NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
549410 | 2lxr | 18692 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H MET 1 1.511 -0.653 0.544 2 HA MET 1 HA MET 1 2.152 -0.158 -2.290 3 HB2 MET 1 2HB MET 1 3.034 2.077 -1.436 4 HB3 MET 1 3HB MET 1 1.288 1.878 -1.475 5 HG2 MET 1 2HG MET 1 2.403 1.045 1.058 6 HG3 MET 1 3HG MET 1 2.822 2.712 0.670 7 HE1 MET 1 3HE MET 1 0.083 4.699 1.614 8 HE2 MET 1 1HE MET 1 1.669 4.496 0.868 9 HE3 MET 1 2HE MET 1 0.220 4.526 -0.137 10 H LYS 2 H LYS 2 3.307 -2.290 -0.990 11 HA LYS 2 HA LYS 2 6.055 -1.345 -0.496 12 HB2 LYS 2 2HB LYS 2 6.303 -3.574 0.732 13 HB3 LYS 2 3HB LYS 2 5.350 -2.326 1.523 14 HG2 LYS 2 2HG LYS 2 3.297 -3.413 0.693 15 HG3 LYS 2 3HG LYS 2 4.290 -4.698 0.001 16 HD2 LYS 2 2HD LYS 2 5.226 -4.735 2.507 17 HD3 LYS 2 3HD LYS 2 3.596 -4.136 2.826 18 HE2 LYS 2 2HE LYS 2 3.443 -6.291 0.964 19 HE3 LYS 2 3HE LYS 2 4.429 -6.796 2.335 20 HZ1 LYS 2 3HZ LYS 2 2.375 -7.289 3.129 21 HZ2 LYS 2 1HZ LYS 2 1.598 -6.071 2.248 22 HZ3 LYS 2 2HZ LYS 2 2.460 -5.682 3.649 23 H ARG 3 H ARG 3 4.787 -1.978 -3.064 24 HA ARG 3 HA ARG 3 6.745 -3.954 -3.962 25 HB2 ARG 3 2HB ARG 3 5.102 -5.129 -5.328 26 HB3 ARG 3 3HB ARG 3 4.652 -5.198 -3.629 27 HG2 ARG 3 2HG ARG 3 3.496 -2.950 -5.118 28 HG3 ARG 3 3HG ARG 3 2.970 -4.549 -5.647 29 HD2 ARG 3 2HD ARG 3 2.612 -4.995 -3.120 30 HD3 ARG 3 3HD ARG 3 2.649 -3.238 -2.974 31 HE ARG 3 HE ARG 3 0.566 -3.154 -3.913 32 HH11 ARG 3 1HH1 ARG 3 1.963 -6.283 -4.529 33 HH12 ARG 3 2HH1 ARG 3 0.509 -6.945 -5.199 34 HH21 ARG 3 1HH2 ARG 3 -1.355 -4.014 -4.794 35 HH22 ARG 3 2HH2 ARG 3 -1.377 -5.654 -5.350 36 H PHE 4 H PHE 4 7.008 -3.938 -6.342 37 HA PHE 4 HA PHE 4 6.192 -1.407 -7.584 38 HB2 PHE 4 2HB PHE 4 8.752 -1.835 -6.627 39 HB3 PHE 4 3HB PHE 4 8.892 -2.227 -8.337 40 HD1 PHE 4 HD2 PHE 4 6.871 0.339 -6.544 41 HD2 PHE 4 HD1 PHE 4 9.935 -0.466 -9.386 42 HE1 PHE 4 HE2 PHE 4 7.001 2.737 -7.078 43 HE2 PHE 4 HE1 PHE 4 10.071 1.931 -9.925 44 HZ PHE 4 HZ PHE 4 8.602 3.536 -8.771 45 H ASP 5 H ASP 5 5.135 -1.864 -9.387 46 HA ASP 5 HA ASP 5 5.436 -4.424 -10.687 47 HB2 ASP 5 2HB ASP 5 3.455 -2.334 -10.603 48 HB3 ASP 5 3HB ASP 5 3.822 -2.747 -12.275 49 H LEU 6 H LEU 6 7.554 -4.367 -11.493 50 HA LEU 6 HA LEU 6 8.369 -2.271 -13.300 51 HB2 LEU 6 2HB LEU 6 9.605 -4.713 -12.148 52 HB3 LEU 6 3HB LEU 6 10.274 -4.085 -13.652 53 HG LEU 6 HG LEU 6 11.611 -3.164 -11.970 54 HD11 LEU 6 1HD1 LEU 6 9.578 -0.989 -12.357 55 HD12 LEU 6 2HD1 LEU 6 10.617 -1.548 -13.667 56 HD13 LEU 6 3HD1 LEU 6 11.330 -0.849 -12.213 57 HD21 LEU 6 3HD2 LEU 6 9.224 -2.178 -10.442 58 HD22 LEU 6 1HD2 LEU 6 10.895 -2.337 -9.903 59 HD23 LEU 6 2HD2 LEU 6 9.910 -3.778 -10.159 60 H ARG 7 H ARG 7 6.364 -4.860 -13.615 61 HA ARG 7 HA ARG 7 7.053 -6.208 -15.906 62 HB2 ARG 7 2HB ARG 7 4.725 -5.887 -14.350 63 HB3 ARG 7 3HB ARG 7 4.251 -5.557 -16.010 64 HG2 ARG 7 2HG ARG 7 5.057 -7.702 -16.726 65 HG3 ARG 7 3HG ARG 7 5.722 -8.028 -15.125 66 HD2 ARG 7 2HD ARG 7 3.676 -9.213 -15.259 67 HD3 ARG 7 3HD ARG 7 3.378 -7.811 -14.231 68 HE ARG 7 HE ARG 7 2.739 -7.356 -16.991 69 HH11 ARG 7 1HH1 ARG 7 1.573 -8.623 -13.966 70 HH12 ARG 7 2HH1 ARG 7 -0.098 -8.401 -14.367 71 HH21 ARG 7 1HH2 ARG 7 0.543 -7.058 -17.531 72 HH22 ARG 7 2HH2 ARG 7 -0.682 -7.511 -16.395 73 HA PRO 8 HA PRO 8 4.965 -2.842 -18.659 74 HB2 PRO 8 2HB PRO 8 4.178 -0.540 -17.455 75 HB3 PRO 8 3HB PRO 8 3.128 -1.955 -17.602 76 HG2 PRO 8 2HG PRO 8 4.755 -1.037 -15.262 77 HG3 PRO 8 3HG PRO 8 3.096 -1.664 -15.295 78 HD2 PRO 8 2HD PRO 8 5.217 -3.190 -14.583 79 HD3 PRO 8 3HD PRO 8 3.794 -3.858 -15.408 80 H LEU 9 H LEU 9 7.359 -2.385 -16.339 81 HA LEU 9 HA LEU 9 8.432 0.055 -17.502 82 HB2 LEU 9 2HB LEU 9 8.705 -1.359 -15.021 83 HB3 LEU 9 3HB LEU 9 10.295 -1.084 -15.729 84 HG LEU 9 HG LEU 9 8.934 1.364 -15.916 85 HD11 LEU 9 1HD1 LEU 9 8.720 1.480 -13.238 86 HD12 LEU 9 2HD1 LEU 9 8.175 -0.173 -13.521 87 HD13 LEU 9 3HD1 LEU 9 7.359 1.172 -14.317 88 HD21 LEU 9 3HD2 LEU 9 10.800 2.158 -14.892 89 HD22 LEU 9 1HD2 LEU 9 11.398 0.556 -15.325 90 HD23 LEU 9 2HD2 LEU 9 10.825 0.870 -13.687 91 H LYS 10 H LYS 10 8.264 -2.675 -18.873 92 HA LYS 10 HA LYS 10 9.581 -4.078 -20.128 93 HB2 LYS 10 2HB LYS 10 10.848 -2.918 -21.786 94 HB3 LYS 10 3HB LYS 10 9.459 -1.912 -21.398 95 HG2 LYS 10 2HG LYS 10 10.813 -0.454 -20.060 96 HG3 LYS 10 3HG LYS 10 12.209 -1.520 -20.239 97 HD2 LYS 10 2HD LYS 10 12.725 -0.037 -21.878 98 HD3 LYS 10 3HD LYS 10 11.671 -1.093 -22.822 99 HE2 LYS 10 2HE LYS 10 9.844 0.389 -22.616 100 HE3 LYS 10 3HE LYS 10 10.640 1.314 -21.344 101 HZ1 LYS 10 3HZ LYS 10 12.386 1.764 -23.174 102 HZ2 LYS 10 1HZ LYS 10 10.937 2.638 -23.185 103 HZ3 LYS 10 2HZ LYS 10 11.147 1.335 -24.242 104 H ALA 11 H ALA 11 12.287 -3.820 -20.906 105 HA ALA 11 HA ALA 11 13.623 -4.422 -18.350 106 HB1 ALA 11 1HB ALA 11 13.426 -5.905 -20.772 107 HB2 ALA 11 2HB ALA 11 15.116 -5.474 -20.509 108 HB3 ALA 11 3HB ALA 11 14.225 -6.350 -19.264 109 H GLY 12 H GLY 12 15.752 -3.709 -18.009 110 HA2 GLY 12 2HA GLY 12 17.746 -2.580 -18.748 111 HA3 GLY 12 3HA GLY 12 16.773 -1.733 -19.941 112 H ILE 13 H ILE 13 14.682 -0.813 -18.406 113 HA ILE 13 HA ILE 13 16.061 1.175 -16.749 114 HB ILE 13 HB ILE 13 13.186 1.382 -17.574 115 HG12 ILE 13 2HG1 ILE 13 15.598 2.131 -19.240 116 HG13 ILE 13 3HG1 ILE 13 14.392 0.911 -19.636 117 HG21 ILE 13 1HG2 ILE 13 14.864 3.760 -17.590 118 HG22 ILE 13 2HG2 ILE 13 13.325 3.464 -16.782 119 HG23 ILE 13 3HG2 ILE 13 14.831 2.949 -16.024 120 HD11 ILE 13 3HD1 ILE 13 13.825 2.755 -20.937 121 HD12 ILE 13 1HD1 ILE 13 12.703 2.818 -19.579 122 HD13 ILE 13 2HD1 ILE 13 14.104 3.889 -19.616 123 H PHE 14 H PHE 14 13.782 -1.420 -16.605 124 HA PHE 14 HA PHE 14 12.381 -0.807 -14.278 125 HB2 PHE 14 2HB PHE 14 11.741 -3.068 -14.208 126 HB3 PHE 14 3HB PHE 14 12.043 -2.762 -15.916 127 HD1 PHE 14 HD1 PHE 14 14.702 -3.118 -16.485 128 HD2 PHE 14 HD2 PHE 14 12.453 -5.105 -13.467 129 HE1 PHE 14 HE1 PHE 14 16.292 -4.995 -16.540 130 HE2 PHE 14 HE2 PHE 14 14.040 -6.984 -13.516 131 HZ PHE 14 HZ PHE 14 15.963 -6.931 -15.054 132 H GLU 15 H GLU 15 15.631 -1.986 -14.725 133 HA GLU 15 HA GLU 15 16.003 -2.708 -11.962 134 HB2 GLU 15 2HB GLU 15 17.260 -3.902 -13.648 135 HB3 GLU 15 3HB GLU 15 17.953 -2.402 -14.249 136 HG2 GLU 15 2HG GLU 15 18.462 -2.777 -11.423 137 HG3 GLU 15 3HG GLU 15 19.073 -4.114 -12.396 138 H ARG 16 H ARG 16 16.078 0.172 -13.752 139 HA ARG 16 HA ARG 16 17.897 1.516 -11.907 140 HB2 ARG 16 2HB ARG 16 16.765 2.115 -14.580 141 HB3 ARG 16 3HB ARG 16 17.061 3.495 -13.531 142 HG2 ARG 16 2HG ARG 16 19.304 3.298 -13.674 143 HG3 ARG 16 3HG ARG 16 19.253 1.535 -13.753 144 HD2 ARG 16 2HD ARG 16 19.644 1.708 -15.936 145 HD3 ARG 16 3HD ARG 16 18.029 2.395 -16.102 146 HE ARG 16 HE ARG 16 19.586 4.518 -15.410 147 HH11 ARG 16 1HH1 ARG 16 19.708 2.117 -17.927 148 HH12 ARG 16 2HH1 ARG 16 20.483 3.165 -19.069 149 HH21 ARG 16 1HH2 ARG 16 20.606 5.907 -16.904 150 HH22 ARG 16 2HH2 ARG 16 20.994 5.320 -18.485 151 H LEU 17 H LEU 17 14.515 1.186 -12.593 152 HA LEU 17 HA LEU 17 13.714 3.501 -11.078 153 HB2 LEU 17 2HB LEU 17 12.465 1.554 -12.802 154 HB3 LEU 17 3HB LEU 17 11.521 1.790 -11.333 155 HG LEU 17 HG LEU 17 10.673 3.241 -13.041 156 HD11 LEU 17 1HD1 LEU 17 12.276 5.121 -11.371 157 HD12 LEU 17 2HD1 LEU 17 11.111 4.047 -10.598 158 HD13 LEU 17 3HD1 LEU 17 10.574 5.191 -11.828 159 HD21 LEU 17 3HD2 LEU 17 11.929 4.243 -14.580 160 HD22 LEU 17 1HD2 LEU 17 13.300 3.349 -13.923 161 HD23 LEU 17 2HD2 LEU 17 12.962 4.985 -13.358 162 H GLU 18 H GLU 18 14.199 0.100 -10.491 163 HA GLU 18 HA GLU 18 12.713 -0.292 -8.187 164 HB2 GLU 18 2HB GLU 18 14.692 -1.698 -9.602 165 HB3 GLU 18 3HB GLU 18 15.287 -1.579 -7.952 166 HG2 GLU 18 2HG GLU 18 13.898 -3.158 -7.276 167 HG3 GLU 18 3HG GLU 18 12.512 -2.290 -7.936 168 H GLU 19 H GLU 19 15.633 1.520 -8.653 169 HA GLU 19 HA GLU 19 16.331 1.647 -5.868 170 HB2 GLU 19 2HB GLU 19 18.119 1.858 -7.436 171 HB3 GLU 19 3HB GLU 19 17.294 3.146 -8.302 172 HG2 GLU 19 2HG GLU 19 17.712 3.804 -5.512 173 HG3 GLU 19 3HG GLU 19 19.221 3.441 -6.349 174 H LEU 20 H LEU 20 14.446 3.553 -8.106 175 HA LEU 20 HA LEU 20 14.289 5.923 -6.576 176 HB2 LEU 20 2HB LEU 20 13.100 4.844 -8.973 177 HB3 LEU 20 3HB LEU 20 11.899 5.696 -8.004 178 HG LEU 20 HG LEU 20 13.912 7.507 -8.011 179 HD11 LEU 20 1HD1 LEU 20 15.338 7.302 -9.701 180 HD12 LEU 20 2HD1 LEU 20 14.038 6.975 -10.847 181 HD13 LEU 20 3HD1 LEU 20 14.740 5.656 -9.910 182 HD21 LEU 20 3HD2 LEU 20 11.491 7.794 -8.569 183 HD22 LEU 20 1HD2 LEU 20 11.867 7.266 -10.210 184 HD23 LEU 20 2HD2 LEU 20 12.594 8.741 -9.570 185 H ILE 21 H ILE 21 12.544 2.901 -6.479 186 HA ILE 21 HA ILE 21 10.540 3.937 -4.651 187 HB ILE 21 HB ILE 21 9.854 2.278 -6.305 188 HG12 ILE 21 2HG1 ILE 21 8.699 0.722 -4.786 189 HG13 ILE 21 3HG1 ILE 21 9.785 1.188 -3.482 190 HG21 ILE 21 1HG2 ILE 21 11.916 1.049 -6.554 191 HG22 ILE 21 2HG2 ILE 21 11.800 0.458 -4.897 192 HG23 ILE 21 3HG2 ILE 21 10.622 -0.061 -6.103 193 HD11 ILE 21 3HD1 ILE 21 8.557 2.964 -2.986 194 HD12 ILE 21 1HD1 ILE 21 8.487 3.482 -4.670 195 HD13 ILE 21 2HD1 ILE 21 7.328 2.299 -4.062 196 H GLU 22 H GLU 22 13.483 2.056 -4.564 197 HA GLU 22 HA GLU 22 13.281 0.857 -2.070 198 HB2 GLU 22 2HB GLU 22 15.514 1.715 -3.820 199 HB3 GLU 22 3HB GLU 22 15.914 1.421 -2.134 200 HG2 GLU 22 2HG GLU 22 14.747 -0.509 -4.115 201 HG3 GLU 22 3HG GLU 22 16.313 -0.590 -3.311 202 H LYS 23 H LYS 23 13.897 4.178 -2.914 203 HA LYS 23 HA LYS 23 14.950 5.040 -0.435 204 HB2 LYS 23 2HB LYS 23 14.053 6.254 -2.918 205 HB3 LYS 23 3HB LYS 23 13.597 7.221 -1.521 206 HG2 LYS 23 2HG LYS 23 15.924 7.257 -0.781 207 HG3 LYS 23 3HG LYS 23 16.383 6.284 -2.181 208 HD2 LYS 23 2HD LYS 23 16.804 8.296 -3.111 209 HD3 LYS 23 3HD LYS 23 15.063 8.301 -3.400 210 HE2 LYS 23 2HE LYS 23 16.095 9.332 -0.802 211 HE3 LYS 23 3HE LYS 23 16.260 10.338 -2.240 212 HZ1 LYS 23 3HZ LYS 23 14.204 11.001 -1.720 213 HZ2 LYS 23 1HZ LYS 23 13.900 9.668 -0.724 214 HZ3 LYS 23 2HZ LYS 23 13.699 9.536 -2.398 215 H GLU 24 H GLU 24 11.672 4.717 -1.675 216 HA GLU 24 HA GLU 24 10.438 6.027 0.552 217 HB2 GLU 24 2HB GLU 24 9.619 5.082 -1.978 218 HB3 GLU 24 3HB GLU 24 8.657 4.212 -0.792 219 HG2 GLU 24 2HG GLU 24 8.782 6.988 -0.097 220 HG3 GLU 24 3HG GLU 24 8.252 6.803 -1.768 221 H MET 25 H MET 25 11.087 2.677 -0.352 222 HA MET 25 HA MET 25 9.619 1.425 1.683 223 HB2 MET 25 2HB MET 25 12.170 0.467 0.374 224 HB3 MET 25 3HB MET 25 11.023 -0.533 1.255 225 HG2 MET 25 2HG MET 25 10.467 0.951 -1.304 226 HG3 MET 25 3HG MET 25 10.769 -0.778 -1.152 227 HE1 MET 25 3HE MET 25 9.618 -2.045 0.714 228 HE2 MET 25 1HE MET 25 8.521 -1.179 1.791 229 HE3 MET 25 2HE MET 25 7.874 -2.258 0.555 230 H GLN 26 H GLN 26 10.158 0.710 3.731 231 HA GLN 26 HA GLN 26 11.857 2.344 5.258 232 HB2 GLN 26 2HB GLN 26 10.092 0.080 5.718 233 HB3 GLN 26 3HB GLN 26 11.522 0.011 6.738 234 HG2 GLN 26 2HG GLN 26 10.681 2.653 6.892 235 HG3 GLN 26 3HG GLN 26 9.196 1.704 6.932 236 HE21 GLN 26 1HE2 GLN 26 10.243 3.257 9.062 237 HE22 GLN 26 2HE2 GLN 26 10.605 2.183 10.365 238 HA PRO 27 HA PRO 27 15.839 0.523 5.022 239 HB2 PRO 27 2HB PRO 27 16.701 0.632 7.594 240 HB3 PRO 27 3HB PRO 27 16.540 2.066 6.573 241 HG2 PRO 27 2HG PRO 27 14.674 1.008 8.661 242 HG3 PRO 27 3HG PRO 27 15.177 2.681 8.354 243 HD2 PRO 27 2HD PRO 27 12.800 1.695 7.510 244 HD3 PRO 27 3HD PRO 27 13.692 2.939 6.610 245 H ASN 28 H ASN 28 13.349 -1.013 6.687 246 HA ASN 28 HA ASN 28 14.796 -3.540 6.618 247 HB2 ASN 28 2HB ASN 28 14.720 -2.267 8.994 248 HB3 ASN 28 3HB ASN 28 13.187 -3.131 9.074 249 HD21 ASN 28 1HD2 ASN 28 13.190 -5.393 9.053 250 HD22 ASN 28 2HD2 ASN 28 14.608 -6.299 9.444 251 H GLU 29 H GLU 29 12.718 -2.458 4.987 252 HA GLU 29 HA GLU 29 10.437 -4.165 5.732 253 HB2 GLU 29 2HB GLU 29 10.617 -1.477 4.628 254 HB3 GLU 29 3HB GLU 29 9.593 -2.523 3.655 255 HG2 GLU 29 2HG GLU 29 8.536 -3.146 5.959 256 HG3 GLU 29 3HG GLU 29 9.242 -1.613 6.468 257 H VAL 30 H VAL 30 9.226 -5.058 3.815 258 HA VAL 30 HA VAL 30 11.164 -6.252 1.978 259 HB VAL 30 HB VAL 30 9.417 -7.577 3.382 260 HG11 VAL 30 1HG1 VAL 30 7.255 -7.775 2.583 261 HG12 VAL 30 2HG1 VAL 30 7.571 -6.050 2.381 262 HG13 VAL 30 3HG1 VAL 30 7.673 -7.136 0.994 263 HG21 VAL 30 3HG2 VAL 30 10.543 -7.981 0.738 264 HG22 VAL 30 1HG2 VAL 30 10.412 -9.101 2.094 265 HG23 VAL 30 2HG2 VAL 30 9.059 -8.903 0.980 266 H ALA 31 H ALA 31 10.970 -6.172 -0.241 267 HA ALA 31 HA ALA 31 8.892 -4.386 -1.321 268 HB1 ALA 31 1HB ALA 31 10.410 -3.206 -2.633 269 HB2 ALA 31 2HB ALA 31 11.249 -3.381 -1.091 270 HB3 ALA 31 3HB ALA 31 11.669 -4.427 -2.447 271 H ILE 32 H ILE 32 7.650 -5.482 -2.680 272 HA ILE 32 HA ILE 32 8.685 -7.862 -4.007 273 HB ILE 32 HB ILE 32 5.916 -6.741 -3.666 274 HG12 ILE 32 2HG1 ILE 32 6.363 -9.553 -3.086 275 HG13 ILE 32 3HG1 ILE 32 7.472 -8.523 -2.187 276 HG21 ILE 32 1HG2 ILE 32 5.464 -9.098 -4.901 277 HG22 ILE 32 2HG2 ILE 32 5.487 -7.541 -5.727 278 HG23 ILE 32 3HG2 ILE 32 6.920 -8.567 -5.743 279 HD11 ILE 32 3HD1 ILE 32 5.860 -7.771 -0.841 280 HD12 ILE 32 1HD1 ILE 32 4.699 -7.604 -2.158 281 HD13 ILE 32 2HD1 ILE 32 4.957 -9.178 -1.404 282 H PHE 33 H PHE 33 9.798 -7.422 -5.811 283 HA PHE 33 HA PHE 33 8.753 -5.396 -7.661 284 HB2 PHE 33 2HB PHE 33 11.462 -6.740 -7.674 285 HB3 PHE 33 3HB PHE 33 10.962 -5.379 -8.672 286 HD1 PHE 33 HD2 PHE 33 9.547 -3.734 -6.650 287 HD2 PHE 33 HD1 PHE 33 13.222 -5.870 -6.428 288 HE1 PHE 33 HE2 PHE 33 10.345 -2.176 -4.922 289 HE2 PHE 33 HE1 PHE 33 14.025 -4.316 -4.698 290 HZ PHE 33 HZ PHE 33 12.586 -2.465 -3.944 291 H MET 34 H MET 34 7.616 -6.072 -9.344 292 HA MET 34 HA MET 34 7.706 -8.868 -10.133 293 HB2 MET 34 2HB MET 34 5.988 -6.683 -11.307 294 HB3 MET 34 3HB MET 34 5.730 -8.420 -11.405 295 HG2 MET 34 2HG MET 34 5.737 -8.072 -8.729 296 HG3 MET 34 3HG MET 34 5.080 -6.526 -9.259 297 HE1 MET 34 3HE MET 34 2.822 -9.740 -8.024 298 HE2 MET 34 1HE MET 34 4.035 -8.599 -7.443 299 HE3 MET 34 2HE MET 34 2.386 -8.053 -7.749 300 H PHE 35 H PHE 35 8.719 -9.634 -11.877 301 HA PHE 35 HA PHE 35 9.634 -7.722 -13.919 302 HB2 PHE 35 2HB PHE 35 11.751 -8.912 -14.096 303 HB3 PHE 35 3HB PHE 35 11.513 -8.357 -12.443 304 HD1 PHE 35 HD1 PHE 35 10.513 -10.066 -10.786 305 HD2 PHE 35 HD2 PHE 35 12.287 -11.122 -14.508 306 HE1 PHE 35 HE1 PHE 35 10.864 -12.358 -9.964 307 HE2 PHE 35 HE2 PHE 35 12.641 -13.416 -13.692 308 HZ PHE 35 HZ PHE 35 11.928 -14.037 -11.418 309 H GLU 36 H GLU 36 9.055 -8.246 -15.922 310 HA GLU 36 HA GLU 36 7.883 -10.877 -16.398 311 HB2 GLU 36 2HB GLU 36 6.796 -9.941 -18.266 312 HB3 GLU 36 3HB GLU 36 6.736 -8.690 -17.032 313 HG2 GLU 36 2HG GLU 36 7.412 -7.395 -18.741 314 HG3 GLU 36 3HG GLU 36 9.002 -7.973 -18.247 315 H VAL 37 H VAL 37 10.675 -8.999 -17.185 316 HA VAL 37 HA VAL 37 11.445 -10.491 -19.504 317 HB VAL 37 HB VAL 37 13.219 -8.799 -17.742 318 HG11 VAL 37 1HG1 VAL 37 14.810 -9.468 -19.144 319 HG12 VAL 37 2HG1 VAL 37 13.639 -10.307 -20.163 320 HG13 VAL 37 3HG1 VAL 37 13.966 -8.593 -20.421 321 HG21 VAL 37 3HG2 VAL 37 12.379 -7.476 -20.137 322 HG22 VAL 37 1HG2 VAL 37 10.964 -7.987 -19.216 323 HG23 VAL 37 2HG2 VAL 37 12.187 -6.967 -18.459 324 H GLY 38 H GLY 38 12.995 -12.096 -19.696 325 HA2 GLY 38 2HA GLY 38 13.174 -13.957 -17.585 326 HA3 GLY 38 3HA GLY 38 14.115 -14.000 -19.069 327 H ASP 39 H ASP 39 14.935 -11.113 -18.139 328 HA ASP 39 HA ASP 39 17.464 -11.861 -17.130 329 HB2 ASP 39 2HB ASP 39 16.032 -9.226 -17.379 330 HB3 ASP 39 3HB ASP 39 17.618 -9.336 -16.621 331 H PHE 40 H PHE 40 17.184 -13.100 -15.273 332 HA PHE 40 HA PHE 40 15.790 -11.962 -12.997 333 HB2 PHE 40 2HB PHE 40 16.100 -14.069 -11.932 334 HB3 PHE 40 3HB PHE 40 15.712 -14.419 -13.613 335 HD1 PHE 40 HD2 PHE 40 18.330 -14.450 -11.058 336 HD2 PHE 40 HD1 PHE 40 17.350 -15.376 -15.095 337 HE1 PHE 40 HE2 PHE 40 20.379 -15.800 -11.243 338 HE2 PHE 40 HE1 PHE 40 19.396 -16.729 -15.286 339 HZ PHE 40 HZ PHE 40 20.915 -16.941 -13.358 340 H SER 41 H SER 41 19.007 -12.233 -14.206 341 HA SER 41 HA SER 41 20.386 -11.918 -11.737 342 HB2 SER 41 2HB SER 41 22.316 -11.924 -12.991 343 HB3 SER 41 3HB SER 41 21.217 -12.677 -14.146 344 HG SER 41 HG SER 41 21.596 -11.061 -15.415 345 H ASN 42 H ASN 42 18.678 -9.771 -13.779 346 HA ASN 42 HA ASN 42 20.070 -7.386 -12.947 347 HB2 ASN 42 2HB ASN 42 17.815 -8.037 -14.759 348 HB3 ASN 42 3HB ASN 42 17.791 -6.434 -14.031 349 HD21 ASN 42 1HD2 ASN 42 19.772 -8.657 -15.909 350 HD22 ASN 42 2HD2 ASN 42 20.674 -7.439 -16.738 351 H ILE 43 H ILE 43 17.360 -9.259 -11.880 352 HA ILE 43 HA ILE 43 15.835 -7.443 -10.481 353 HB ILE 43 HB ILE 43 16.439 -10.330 -10.095 354 HG12 ILE 43 2HG1 ILE 43 14.699 -9.537 -11.666 355 HG13 ILE 43 3HG1 ILE 43 14.028 -10.533 -10.379 356 HG21 ILE 43 1HG2 ILE 43 15.245 -8.542 -8.007 357 HG22 ILE 43 2HG2 ILE 43 14.797 -10.243 -8.119 358 HG23 ILE 43 3HG2 ILE 43 16.477 -9.792 -7.828 359 HD11 ILE 43 3HD1 ILE 43 13.864 -7.553 -10.686 360 HD12 ILE 43 1HD1 ILE 43 12.548 -8.727 -10.687 361 HD13 ILE 43 2HD1 ILE 43 13.433 -8.394 -9.197 362 HA PRO 44 HA PRO 44 18.713 -7.985 -6.631 363 HB2 PRO 44 2HB PRO 44 21.112 -9.187 -7.041 364 HB3 PRO 44 3HB PRO 44 19.652 -10.082 -6.603 365 HG2 PRO 44 2HG PRO 44 20.904 -9.700 -9.295 366 HG3 PRO 44 3HG PRO 44 20.217 -11.169 -8.579 367 HD2 PRO 44 2HD PRO 44 18.866 -9.653 -10.371 368 HD3 PRO 44 3HD PRO 44 18.052 -10.549 -9.072 369 H LYS 45 H LYS 45 20.000 -7.299 -9.793 370 HA LYS 45 HA LYS 45 22.206 -5.714 -9.023 371 HB2 LYS 45 2HB LYS 45 21.494 -6.699 -11.357 372 HB3 LYS 45 3HB LYS 45 20.680 -5.150 -11.534 373 HG2 LYS 45 2HG LYS 45 23.300 -4.629 -10.606 374 HG3 LYS 45 3HG LYS 45 23.419 -5.783 -11.937 375 HD2 LYS 45 2HD LYS 45 21.778 -4.192 -13.149 376 HD3 LYS 45 3HD LYS 45 22.271 -3.014 -11.930 377 HE2 LYS 45 2HE LYS 45 24.665 -4.066 -12.786 378 HE3 LYS 45 3HE LYS 45 23.706 -4.014 -14.264 379 HZ1 LYS 45 3HZ LYS 45 24.714 -1.826 -12.628 380 HZ2 LYS 45 1HZ LYS 45 23.175 -1.615 -13.297 381 HZ3 LYS 45 2HZ LYS 45 24.500 -1.916 -14.304 382 H SER 46 H SER 46 18.800 -5.003 -9.502 383 HA SER 46 HA SER 46 19.011 -2.184 -9.447 384 HB2 SER 46 2HB SER 46 16.539 -3.391 -8.357 385 HB3 SER 46 3HB SER 46 16.743 -2.192 -9.634 386 HG SER 46 HG SER 46 16.075 -4.585 -10.058 387 H ALA 47 H ALA 47 18.090 -4.506 -6.906 388 HA ALA 47 HA ALA 47 17.849 -2.647 -4.826 389 HB1 ALA 47 1HB ALA 47 18.758 -5.479 -4.414 390 HB2 ALA 47 2HB ALA 47 17.760 -4.475 -3.361 391 HB3 ALA 47 3HB ALA 47 17.103 -5.085 -4.879 392 H GLU 48 H GLU 48 20.635 -3.981 -6.352 393 HA GLU 48 HA GLU 48 22.459 -3.529 -4.191 394 HB2 GLU 48 2HB GLU 48 22.775 -5.169 -6.103 395 HB3 GLU 48 3HB GLU 48 23.155 -3.783 -7.115 396 HG2 GLU 48 2HG GLU 48 24.758 -3.516 -4.841 397 HG3 GLU 48 3HG GLU 48 24.830 -5.220 -5.284 398 H PHE 49 H PHE 49 21.237 -1.659 -6.865 399 HA PHE 49 HA PHE 49 23.156 0.313 -7.117 400 HB2 PHE 49 2HB PHE 49 20.548 -0.097 -8.040 401 HB3 PHE 49 3HB PHE 49 20.492 1.453 -7.206 402 HD1 PHE 49 HD2 PHE 49 21.963 3.300 -7.938 403 HD2 PHE 49 HD1 PHE 49 21.667 -0.348 -10.111 404 HE1 PHE 49 HE2 PHE 49 22.962 4.394 -9.903 405 HE2 PHE 49 HE1 PHE 49 22.666 0.740 -12.079 406 HZ PHE 49 HZ PHE 49 23.314 3.114 -11.977 407 H ILE 50 H ILE 50 20.912 -0.246 -4.539 408 HA ILE 50 HA ILE 50 21.062 2.363 -3.383 409 HB ILE 50 HB ILE 50 20.330 -0.195 -1.962 410 HG12 ILE 50 2HG1 ILE 50 19.056 0.152 -4.105 411 HG13 ILE 50 3HG1 ILE 50 18.058 0.124 -2.656 412 HG21 ILE 50 1HG2 ILE 50 20.538 1.470 -0.356 413 HG22 ILE 50 2HG2 ILE 50 19.904 2.719 -1.427 414 HG23 ILE 50 3HG2 ILE 50 18.819 1.506 -0.747 415 HD11 ILE 50 3HD1 ILE 50 17.871 2.522 -2.688 416 HD12 ILE 50 1HD1 ILE 50 18.982 2.622 -4.054 417 HD13 ILE 50 2HD1 ILE 50 17.400 1.869 -4.257 418 H GLN 51 H GLN 51 22.348 -0.771 -2.251 419 HA GLN 51 HA GLN 51 24.865 0.430 -1.540 420 HB2 GLN 51 2HB GLN 51 22.952 0.670 0.370 421 HB3 GLN 51 3HB GLN 51 23.640 -0.891 0.799 422 HG2 GLN 51 2HG GLN 51 25.506 1.354 0.278 423 HG3 GLN 51 3HG GLN 51 24.577 1.373 1.776 424 HE21 GLN 51 1HE2 GLN 51 25.277 0.197 3.433 425 HE22 GLN 51 2HE2 GLN 51 26.552 -0.967 3.365 426 H SER 52 H SER 52 26.453 -1.032 -1.688 427 HA SER 52 HA SER 52 26.088 -3.557 -2.726 428 HB2 SER 52 2HB SER 52 28.250 -2.177 -2.529 429 HB3 SER 52 3HB SER 52 28.422 -2.907 -0.933 430 HG SER 52 HG SER 52 28.246 -4.271 -3.416 431 H LYS 53 H LYS 53 26.060 -2.533 0.613 432 HA LYS 53 HA LYS 53 25.533 -5.318 1.424 433 HB2 LYS 53 2HB LYS 53 26.669 -3.093 3.127 434 HB3 LYS 53 3HB LYS 53 26.412 -4.759 3.628 435 HG2 LYS 53 2HG LYS 53 28.516 -5.139 3.042 436 HG3 LYS 53 3HG LYS 53 27.988 -4.981 1.365 437 HD2 LYS 53 2HD LYS 53 29.462 -3.303 1.226 438 HD3 LYS 53 3HD LYS 53 28.298 -2.366 2.167 439 HE2 LYS 53 2HE LYS 53 30.348 -4.106 3.498 440 HE3 LYS 53 3HE LYS 53 30.734 -2.465 2.984 441 HZ1 LYS 53 3HZ LYS 53 28.549 -1.939 4.302 442 HZ2 LYS 53 1HZ LYS 53 30.033 -2.082 5.101 443 HZ3 LYS 53 2HZ LYS 53 28.939 -3.372 5.112 444 H GLY 54 H GLY 54 23.503 -5.694 2.006 445 HA2 GLY 54 2HA GLY 54 21.908 -4.796 3.851 446 HA3 GLY 54 3HA GLY 54 21.810 -3.416 2.767 447 H HIS 55 H HIS 55 21.604 -4.460 0.315 448 HA HIS 55 HA HIS 55 18.928 -5.448 0.281 449 HB2 HIS 55 2HB HIS 55 19.068 -5.297 -2.100 450 HB3 HIS 55 3HB HIS 55 19.947 -3.918 -1.446 451 HD1 HIS 55 HD1 HIS 55 22.692 -4.579 -1.155 452 HD2 HIS 55 HD2 HIS 55 20.445 -6.470 -4.093 453 HE1 HIS 55 HE1 HIS 55 24.362 -5.455 -2.819 454 H GLU 56 H GLU 56 18.316 -7.485 0.519 455 HA GLU 56 HA GLU 56 19.982 -9.621 -0.596 456 HB2 GLU 56 2HB GLU 56 19.875 -9.082 2.139 457 HB3 GLU 56 3HB GLU 56 18.774 -10.434 1.916 458 HG2 GLU 56 2HG GLU 56 21.346 -10.695 0.531 459 HG3 GLU 56 3HG GLU 56 21.442 -10.663 2.290 460 H LEU 57 H LEU 57 18.774 -10.794 -1.915 461 HA LEU 57 HA LEU 57 15.902 -10.649 -1.837 462 HB2 LEU 57 2HB LEU 57 17.829 -12.165 -3.583 463 HB3 LEU 57 3HB LEU 57 16.078 -12.253 -3.769 464 HG LEU 57 HG LEU 57 16.898 -10.743 -5.410 465 HD11 LEU 57 1HD1 LEU 57 14.876 -10.118 -3.909 466 HD12 LEU 57 2HD1 LEU 57 15.543 -8.918 -5.014 467 HD13 LEU 57 3HD1 LEU 57 15.946 -8.857 -3.298 468 HD21 LEU 57 3HD2 LEU 57 18.988 -10.289 -3.775 469 HD22 LEU 57 1HD2 LEU 57 18.065 -8.808 -3.519 470 HD23 LEU 57 2HD2 LEU 57 18.575 -9.258 -5.146 471 H LEU 58 H LEU 58 14.997 -11.704 -0.156 472 HA LEU 58 HA LEU 58 15.900 -13.990 1.113 473 HB2 LEU 58 2HB LEU 58 13.400 -12.493 0.967 474 HB3 LEU 58 3HB LEU 58 13.167 -14.207 1.303 475 HG LEU 58 HG LEU 58 15.212 -12.889 2.955 476 HD11 LEU 58 1HD1 LEU 58 13.140 -11.278 2.547 477 HD12 LEU 58 2HD1 LEU 58 13.915 -11.437 4.123 478 HD13 LEU 58 3HD1 LEU 58 12.425 -12.314 3.782 479 HD21 LEU 58 3HD2 LEU 58 14.562 -14.426 4.500 480 HD22 LEU 58 1HD2 LEU 58 14.009 -15.256 3.045 481 HD23 LEU 58 2HD2 LEU 58 12.863 -14.347 4.031 482 H ASN 59 H ASN 59 13.130 -13.941 -1.136 483 HA ASN 59 HA ASN 59 13.854 -15.780 -2.973 484 HB2 ASN 59 2HB ASN 59 13.539 -17.060 -0.374 485 HB3 ASN 59 3HB ASN 59 12.497 -17.778 -1.598 486 HD21 ASN 59 1HD2 ASN 59 13.842 -19.664 -1.258 487 HD22 ASN 59 2HD2 ASN 59 15.340 -19.796 -2.109 488 H SER 60 H SER 60 12.277 -15.827 -4.444 489 HA SER 60 HA SER 60 9.580 -16.314 -4.016 490 HB2 SER 60 2HB SER 60 9.278 -14.301 -2.827 491 HB3 SER 60 3HB SER 60 10.327 -13.397 -3.919 492 HG SER 60 HG SER 60 7.816 -14.519 -4.625 493 H LEU 61 H LEU 61 11.980 -14.580 -5.900 494 HA LEU 61 HA LEU 61 10.528 -14.423 -8.314 495 HB2 LEU 61 2HB LEU 61 12.418 -13.555 -9.219 496 HB3 LEU 61 3HB LEU 61 12.802 -13.341 -7.512 497 HG LEU 61 HG LEU 61 13.730 -15.752 -9.043 498 HD11 LEU 61 1HD1 LEU 61 15.041 -14.457 -10.284 499 HD12 LEU 61 2HD1 LEU 61 15.893 -14.030 -8.801 500 HD13 LEU 61 3HD1 LEU 61 14.579 -13.011 -9.386 501 HD21 LEU 61 3HD2 LEU 61 14.841 -14.350 -6.617 502 HD22 LEU 61 1HD2 LEU 61 15.393 -15.876 -7.307 503 HD23 LEU 61 2HD2 LEU 61 13.795 -15.770 -6.568 504 H ARG 62 H ARG 62 10.151 -15.862 -9.888 505 HA ARG 62 HA ARG 62 11.555 -18.449 -9.762 506 HB2 ARG 62 2HB ARG 62 9.121 -18.444 -8.971 507 HB3 ARG 62 3HB ARG 62 8.693 -18.140 -10.650 508 HG2 ARG 62 2HG ARG 62 8.534 -20.395 -10.662 509 HG3 ARG 62 3HG ARG 62 10.256 -20.257 -11.021 510 HD2 ARG 62 2HD ARG 62 10.880 -20.830 -8.857 511 HD3 ARG 62 3HD ARG 62 9.302 -20.415 -8.190 512 HE ARG 62 HE ARG 62 8.949 -22.536 -9.965 513 HH11 ARG 62 1HH1 ARG 62 10.518 -21.886 -6.926 514 HH12 ARG 62 2HH1 ARG 62 10.363 -23.513 -6.350 515 HH21 ARG 62 1HH2 ARG 62 8.739 -24.680 -9.217 516 HH22 ARG 62 2HH2 ARG 62 9.352 -25.101 -7.654 517 H PHE 63 H PHE 63 12.590 -16.501 -11.320 518 HA PHE 63 HA PHE 63 11.738 -16.009 -13.843 519 HB2 PHE 63 2HB PHE 63 13.873 -15.376 -14.296 520 HB3 PHE 63 3HB PHE 63 14.086 -15.636 -12.568 521 HD1 PHE 63 HD2 PHE 63 15.227 -17.627 -11.741 522 HD2 PHE 63 HD1 PHE 63 14.840 -16.858 -15.909 523 HE1 PHE 63 HE2 PHE 63 16.975 -19.294 -12.207 524 HE2 PHE 63 HE1 PHE 63 16.587 -18.525 -16.382 525 HZ PHE 63 HZ PHE 63 17.658 -19.744 -14.530 526 H ASN 64 H ASN 64 10.761 -17.365 -15.200 527 HA ASN 64 HA ASN 64 12.032 -19.331 -16.636 528 HB2 ASN 64 2HB ASN 64 11.132 -20.280 -14.022 529 HB3 ASN 64 3HB ASN 64 10.475 -21.226 -15.355 530 HD21 ASN 64 1HD2 ASN 64 12.607 -21.646 -13.225 531 HD22 ASN 64 2HD2 ASN 64 13.954 -22.266 -14.111 532 H GLN 65 H GLN 65 9.036 -18.250 -15.187 533 HA GLN 65 HA GLN 65 7.653 -18.901 -17.705 534 HB2 GLN 65 2HB GLN 65 7.065 -19.955 -15.206 535 HB3 GLN 65 3HB GLN 65 5.889 -18.662 -15.399 536 HG2 GLN 65 2HG GLN 65 6.255 -21.142 -17.015 537 HG3 GLN 65 3HG GLN 65 4.793 -20.487 -16.279 538 HE21 GLN 65 1HE2 GLN 65 6.739 -20.629 -19.065 539 HE22 GLN 65 2HE2 GLN 65 5.815 -19.554 -20.053 540 H ALA 66 H ALA 66 5.217 -17.607 -16.794 541 HA ALA 66 HA ALA 66 5.490 -15.091 -17.851 542 HB1 ALA 66 1HB ALA 66 3.412 -14.556 -16.397 543 HB2 ALA 66 2HB ALA 66 3.302 -15.811 -17.632 544 HB3 ALA 66 3HB ALA 66 3.509 -16.257 -15.938 545 H ASP 67 H ASP 67 5.055 -12.981 -16.640 546 HA ASP 67 HA ASP 67 7.235 -12.224 -15.169 547 HB2 ASP 67 2HB ASP 67 6.023 -10.417 -15.928 548 HB3 ASP 67 3HB ASP 67 4.478 -11.119 -15.456 549 H TRP 68 H TRP 68 7.943 -12.554 -13.167 550 HA TRP 68 HA TRP 68 6.054 -13.653 -11.192 551 HB2 TRP 68 2HB TRP 68 8.428 -14.745 -12.113 552 HB3 TRP 68 3HB TRP 68 8.885 -14.014 -10.577 553 HD1 TRP 68 HD1 TRP 68 8.495 -15.480 -8.515 554 HE1 TRP 68 HE1 TRP 68 7.101 -17.577 -7.982 555 HE3 TRP 68 HE3 TRP 68 5.981 -15.930 -12.944 556 HZ2 TRP 68 HZ2 TRP 68 5.189 -19.206 -9.270 557 HZ3 TRP 68 HZ3 TRP 68 4.388 -17.786 -13.212 558 HH2 TRP 68 HH2 TRP 68 4.001 -19.389 -11.412 559 H THR 69 H THR 69 7.275 -13.347 -8.869 560 HA THR 69 HA THR 69 7.923 -10.481 -8.653 561 HB THR 69 HB THR 69 6.517 -10.155 -6.825 562 HG1 THR 69 HG1 THR 69 5.461 -12.105 -5.847 563 HG21 THR 69 3HG2 THR 69 5.219 -10.428 -8.886 564 HG22 THR 69 1HG2 THR 69 4.303 -10.966 -7.479 565 HG23 THR 69 2HG2 THR 69 5.048 -12.151 -8.552 566 H ILE 70 H ILE 70 9.338 -9.888 -6.984 567 HA ILE 70 HA ILE 70 10.646 -12.093 -5.546 568 HB ILE 70 HB ILE 70 12.101 -11.616 -7.404 569 HG12 ILE 70 2HG1 ILE 70 14.139 -10.951 -6.208 570 HG13 ILE 70 3HG1 ILE 70 13.165 -10.305 -4.892 571 HG21 ILE 70 1HG2 ILE 70 11.238 -8.918 -6.952 572 HG22 ILE 70 2HG2 ILE 70 12.999 -8.995 -6.973 573 HG23 ILE 70 3HG2 ILE 70 12.074 -9.605 -8.344 574 HD11 ILE 70 3HD1 ILE 70 12.246 -12.643 -4.611 575 HD12 ILE 70 1HD1 ILE 70 13.531 -13.169 -5.698 576 HD13 ILE 70 2HD1 ILE 70 13.935 -12.397 -4.164 577 H VAL 71 H VAL 71 11.072 -11.695 -3.453 578 HA VAL 71 HA VAL 71 10.264 -9.109 -2.376 579 HB VAL 71 HB VAL 71 10.621 -10.295 -0.148 580 HG11 VAL 71 1HG1 VAL 71 8.500 -11.550 -0.346 581 HG12 VAL 71 2HG1 VAL 71 8.412 -9.936 -1.055 582 HG13 VAL 71 3HG1 VAL 71 8.576 -11.350 -2.097 583 HG21 VAL 71 3HG2 VAL 71 11.094 -12.526 -0.032 584 HG22 VAL 71 1HG2 VAL 71 10.415 -12.865 -1.624 585 HG23 VAL 71 2HG2 VAL 71 12.005 -12.116 -1.485 586 H VAL 72 H VAL 72 11.625 -7.630 -1.577 587 HA VAL 72 HA VAL 72 14.454 -8.389 -1.240 588 HB VAL 72 HB VAL 72 13.587 -5.628 -2.053 589 HG11 VAL 72 1HG1 VAL 72 15.828 -5.264 -2.569 590 HG12 VAL 72 2HG1 VAL 72 15.902 -6.229 -1.093 591 HG13 VAL 72 3HG1 VAL 72 16.187 -6.988 -2.660 592 HG21 VAL 72 3HG2 VAL 72 12.876 -6.512 -3.990 593 HG22 VAL 72 1HG2 VAL 72 14.592 -6.711 -4.343 594 HG23 VAL 72 2HG2 VAL 72 13.665 -8.060 -3.686 595 H ARG 73 H ARG 73 15.249 -8.057 0.726 596 HA ARG 73 HA ARG 73 13.711 -6.412 2.602 597 HB2 ARG 73 2HB ARG 73 15.167 -7.557 4.328 598 HB3 ARG 73 3HB ARG 73 14.057 -8.600 3.449 599 HG2 ARG 73 2HG ARG 73 15.715 -9.838 2.639 600 HG3 ARG 73 3HG ARG 73 16.638 -8.417 2.145 601 HD2 ARG 73 2HD ARG 73 18.066 -9.186 3.727 602 HD3 ARG 73 3HD ARG 73 17.003 -8.260 4.786 603 HE ARG 73 HE ARG 73 15.924 -10.798 4.627 604 HH11 ARG 73 1HH1 ARG 73 18.900 -9.347 5.703 605 HH12 ARG 73 2HH1 ARG 73 19.204 -10.552 6.909 606 HH21 ARG 73 1HH2 ARG 73 16.314 -12.392 6.212 607 HH22 ARG 73 2HH2 ARG 73 17.733 -12.285 7.197 608 H LYS 74 H LYS 74 14.420 -4.478 3.202 609 HA LYS 74 HA LYS 74 17.008 -3.550 2.306 610 HB2 LYS 74 2HB LYS 74 14.551 -2.304 3.426 611 HB3 LYS 74 3HB LYS 74 16.068 -1.449 3.673 612 HG2 LYS 74 2HG LYS 74 15.713 -2.363 0.933 613 HG3 LYS 74 3HG LYS 74 14.447 -1.257 1.470 614 HD2 LYS 74 2HD LYS 74 17.405 -0.725 1.734 615 HD3 LYS 74 3HD LYS 74 16.394 -0.120 0.419 616 HE2 LYS 74 2HE LYS 74 15.497 1.492 1.696 617 HE3 LYS 74 3HE LYS 74 15.327 0.424 3.088 618 HZ1 LYS 74 3HZ LYS 74 17.613 0.769 3.647 619 HZ2 LYS 74 1HZ LYS 74 16.885 2.284 3.452 620 HZ3 LYS 74 2HZ LYS 74 17.886 1.665 2.238 621 H LYS 75 H LYS 75 18.526 -2.469 3.728 622 HA LYS 75 HA LYS 75 18.386 -2.749 6.553 623 HB2 LYS 75 2HB LYS 75 19.122 -5.082 5.266 624 HB3 LYS 75 3HB LYS 75 20.668 -4.362 5.697 625 HG2 LYS 75 2HG LYS 75 18.614 -4.410 7.814 626 HG3 LYS 75 3HG LYS 75 19.282 -5.969 7.324 627 HD2 LYS 75 2HD LYS 75 21.563 -5.021 7.666 628 HD3 LYS 75 3HD LYS 75 20.808 -3.564 8.316 629 HE2 LYS 75 2HE LYS 75 21.039 -4.626 10.287 630 HE3 LYS 75 3HE LYS 75 19.571 -5.464 9.787 631 HZ1 LYS 75 3HZ LYS 75 20.690 -7.355 9.864 632 HZ2 LYS 75 1HZ LYS 75 22.115 -6.543 10.282 633 HZ3 LYS 75 2HZ LYS 75 21.736 -6.804 8.654 634 H ALA 76 H ALA 76 20.411 -2.358 3.695 635 HA ALA 76 HA ALA 76 21.494 0.091 4.649 636 HB1 ALA 76 1HB ALA 76 22.977 -1.029 6.018 637 HB2 ALA 76 2HB ALA 76 23.154 -2.381 4.900 638 HB3 ALA 76 3HB ALA 76 23.921 -0.834 4.540 Start of MODEL 2 1 H1 MET 1 H MET 1 0.689 0.705 -0.113 2 HA MET 1 HA MET 1 1.989 -0.209 -1.851 3 HB2 MET 1 2HB MET 1 2.925 2.660 -1.731 4 HB3 MET 1 3HB MET 1 2.792 1.644 -3.161 5 HG2 MET 1 2HG MET 1 0.376 1.608 -2.936 6 HG3 MET 1 3HG MET 1 0.485 2.572 -1.465 7 HE1 MET 1 3HE MET 1 -0.568 3.536 -5.262 8 HE2 MET 1 1HE MET 1 -1.242 2.881 -3.769 9 HE3 MET 1 2HE MET 1 -1.279 4.619 -4.065 10 H LYS 2 H LYS 2 3.529 -1.659 -1.270 11 HA LYS 2 HA LYS 2 6.216 -0.578 -0.768 12 HB2 LYS 2 2HB LYS 2 6.561 -2.666 0.687 13 HB3 LYS 2 3HB LYS 2 5.631 -1.339 1.371 14 HG2 LYS 2 2HG LYS 2 3.554 -2.523 0.763 15 HG3 LYS 2 3HG LYS 2 4.528 -3.876 0.182 16 HD2 LYS 2 2HD LYS 2 5.522 -3.420 2.713 17 HD3 LYS 2 3HD LYS 2 3.791 -3.131 2.901 18 HE2 LYS 2 2HE LYS 2 4.691 -5.543 1.402 19 HE3 LYS 2 3HE LYS 2 4.815 -5.545 3.160 20 HZ1 LYS 2 3HZ LYS 2 2.329 -5.003 1.629 21 HZ2 LYS 2 1HZ LYS 2 2.466 -5.084 3.314 22 HZ3 LYS 2 2HZ LYS 2 2.709 -6.471 2.378 23 H ARG 3 H ARG 3 4.877 -1.554 -3.198 24 HA ARG 3 HA ARG 3 6.879 -3.556 -3.932 25 HB2 ARG 3 2HB ARG 3 5.178 -4.872 -5.163 26 HB3 ARG 3 3HB ARG 3 4.921 -4.881 -3.423 27 HG2 ARG 3 2HG ARG 3 3.492 -2.760 -4.853 28 HG3 ARG 3 3HG ARG 3 3.000 -4.401 -5.274 29 HD2 ARG 3 2HD ARG 3 2.305 -4.883 -3.116 30 HD3 ARG 3 3HD ARG 3 3.301 -3.614 -2.406 31 HE ARG 3 HE ARG 3 1.569 -2.158 -2.698 32 HH11 ARG 3 1HH1 ARG 3 1.071 -4.919 -4.759 33 HH12 ARG 3 2HH1 ARG 3 -0.508 -4.419 -5.267 34 HH21 ARG 3 1HH2 ARG 3 -0.509 -1.488 -3.360 35 HH22 ARG 3 2HH2 ARG 3 -1.405 -2.466 -4.472 36 H PHE 4 H PHE 4 7.092 -3.797 -6.296 37 HA PHE 4 HA PHE 4 6.163 -1.437 -7.783 38 HB2 PHE 4 2HB PHE 4 8.790 -1.811 -6.927 39 HB3 PHE 4 3HB PHE 4 8.809 -2.298 -8.618 40 HD1 PHE 4 HD2 PHE 4 7.035 0.392 -6.734 41 HD2 PHE 4 HD1 PHE 4 9.652 -0.625 -9.934 42 HE1 PHE 4 HE2 PHE 4 7.122 2.756 -7.410 43 HE2 PHE 4 HE1 PHE 4 9.743 1.738 -10.614 44 HZ PHE 4 HZ PHE 4 8.477 3.432 -9.353 45 H ASP 5 H ASP 5 5.040 -2.076 -9.487 46 HA ASP 5 HA ASP 5 5.440 -4.754 -10.569 47 HB2 ASP 5 2HB ASP 5 3.205 -2.993 -10.282 48 HB3 ASP 5 3HB ASP 5 3.412 -3.363 -11.991 49 H LEU 6 H LEU 6 7.259 -4.689 -11.818 50 HA LEU 6 HA LEU 6 7.579 -2.582 -13.799 51 HB2 LEU 6 2HB LEU 6 9.298 -4.882 -12.916 52 HB3 LEU 6 3HB LEU 6 9.696 -3.900 -14.324 53 HG LEU 6 HG LEU 6 10.995 -3.119 -12.484 54 HD11 LEU 6 1HD1 LEU 6 10.646 -0.929 -12.845 55 HD12 LEU 6 2HD1 LEU 6 8.948 -1.012 -12.378 56 HD13 LEU 6 3HD1 LEU 6 9.443 -1.507 -13.997 57 HD21 LEU 6 3HD2 LEU 6 8.469 -2.628 -10.925 58 HD22 LEU 6 1HD2 LEU 6 10.138 -2.517 -10.365 59 HD23 LEU 6 2HD2 LEU 6 9.439 -4.091 -10.746 60 H ARG 7 H ARG 7 5.704 -5.165 -13.717 61 HA ARG 7 HA ARG 7 6.250 -6.787 -15.876 62 HB2 ARG 7 2HB ARG 7 3.997 -6.221 -14.222 63 HB3 ARG 7 3HB ARG 7 3.452 -6.258 -15.894 64 HG2 ARG 7 2HG ARG 7 4.205 -8.477 -16.191 65 HG3 ARG 7 3HG ARG 7 5.115 -8.444 -14.679 66 HD2 ARG 7 2HD ARG 7 3.241 -9.616 -14.045 67 HD3 ARG 7 3HD ARG 7 2.772 -7.969 -13.624 68 HE ARG 7 HE ARG 7 1.971 -8.595 -16.269 69 HH11 ARG 7 1HH1 ARG 7 1.168 -9.195 -12.935 70 HH12 ARG 7 2HH1 ARG 7 -0.511 -9.479 -13.255 71 HH21 ARG 7 1HH2 ARG 7 -0.237 -8.966 -16.703 72 HH22 ARG 7 2HH2 ARG 7 -1.309 -9.349 -15.398 73 HA PRO 8 HA PRO 8 3.894 -3.767 -18.813 74 HB2 PRO 8 2HB PRO 8 3.207 -1.334 -17.824 75 HB3 PRO 8 3HB PRO 8 2.155 -2.750 -17.707 76 HG2 PRO 8 2HG PRO 8 3.981 -1.572 -15.648 77 HG3 PRO 8 3HG PRO 8 2.330 -2.188 -15.458 78 HD2 PRO 8 2HD PRO 8 4.512 -3.633 -14.764 79 HD3 PRO 8 3HD PRO 8 3.024 -4.384 -15.373 80 H LEU 9 H LEU 9 6.448 -2.976 -16.732 81 HA LEU 9 HA LEU 9 7.408 -0.713 -18.263 82 HB2 LEU 9 2HB LEU 9 7.962 -1.914 -15.704 83 HB3 LEU 9 3HB LEU 9 9.457 -1.644 -16.599 84 HG LEU 9 HG LEU 9 7.955 0.731 -16.813 85 HD11 LEU 9 1HD1 LEU 9 6.612 0.580 -15.005 86 HD12 LEU 9 2HD1 LEU 9 8.077 1.075 -14.158 87 HD13 LEU 9 3HD1 LEU 9 7.624 -0.628 -14.214 88 HD21 LEU 9 3HD2 LEU 9 10.511 -0.205 -15.710 89 HD22 LEU 9 1HD2 LEU 9 9.891 1.285 -14.998 90 HD23 LEU 9 2HD2 LEU 9 10.155 1.183 -16.739 91 H LYS 10 H LYS 10 9.555 -0.696 -19.236 92 HA LYS 10 HA LYS 10 10.051 -3.187 -20.679 93 HB2 LYS 10 2HB LYS 10 11.207 -1.885 -22.292 94 HB3 LYS 10 3HB LYS 10 9.767 -0.970 -21.866 95 HG2 LYS 10 2HG LYS 10 11.128 0.415 -20.352 96 HG3 LYS 10 3HG LYS 10 12.564 -0.473 -20.866 97 HD2 LYS 10 2HD LYS 10 12.621 1.407 -22.222 98 HD3 LYS 10 3HD LYS 10 11.829 0.215 -23.256 99 HE2 LYS 10 2HE LYS 10 9.918 1.378 -23.308 100 HE3 LYS 10 3HE LYS 10 9.965 1.700 -21.576 101 HZ1 LYS 10 3HZ LYS 10 10.457 3.782 -22.113 102 HZ2 LYS 10 1HZ LYS 10 10.695 3.395 -23.743 103 HZ3 LYS 10 2HZ LYS 10 11.969 3.238 -22.642 104 H ALA 11 H ALA 11 12.298 -3.857 -21.071 105 HA ALA 11 HA ALA 11 13.738 -4.057 -18.620 106 HB1 ALA 11 1HB ALA 11 15.033 -5.635 -19.664 107 HB2 ALA 11 2HB ALA 11 13.575 -5.705 -20.655 108 HB3 ALA 11 3HB ALA 11 14.983 -4.807 -21.220 109 H GLY 12 H GLY 12 15.791 -3.259 -18.099 110 HA2 GLY 12 2HA GLY 12 17.765 -1.994 -18.598 111 HA3 GLY 12 3HA GLY 12 16.865 -1.157 -19.855 112 H ILE 13 H ILE 13 14.591 -0.404 -18.480 113 HA ILE 13 HA ILE 13 15.708 1.616 -16.674 114 HB ILE 13 HB ILE 13 12.943 1.588 -17.877 115 HG12 ILE 13 2HG1 ILE 13 15.444 2.946 -18.910 116 HG13 ILE 13 3HG1 ILE 13 14.628 1.582 -19.667 117 HG21 ILE 13 1HG2 ILE 13 12.968 3.968 -17.354 118 HG22 ILE 13 2HG2 ILE 13 13.239 3.003 -15.904 119 HG23 ILE 13 3HG2 ILE 13 14.594 3.814 -16.689 120 HD11 ILE 13 3HD1 ILE 13 13.903 3.401 -20.895 121 HD12 ILE 13 1HD1 ILE 13 12.583 3.137 -19.755 122 HD13 ILE 13 2HD1 ILE 13 13.750 4.430 -19.472 123 H PHE 14 H PHE 14 13.592 -1.117 -16.763 124 HA PHE 14 HA PHE 14 12.031 -0.622 -14.488 125 HB2 PHE 14 2HB PHE 14 11.390 -2.873 -14.595 126 HB3 PHE 14 3HB PHE 14 11.809 -2.487 -16.261 127 HD1 PHE 14 HD1 PHE 14 14.453 -2.859 -16.732 128 HD2 PHE 14 HD2 PHE 14 12.101 -4.905 -13.834 129 HE1 PHE 14 HE1 PHE 14 16.047 -4.733 -16.767 130 HE2 PHE 14 HE2 PHE 14 13.692 -6.782 -13.864 131 HZ PHE 14 HZ PHE 14 15.669 -6.697 -15.331 132 H GLU 15 H GLU 15 15.311 -1.737 -14.851 133 HA GLU 15 HA GLU 15 15.560 -2.619 -12.118 134 HB2 GLU 15 2HB GLU 15 16.917 -3.744 -13.732 135 HB3 GLU 15 3HB GLU 15 17.559 -2.225 -14.342 136 HG2 GLU 15 2HG GLU 15 18.056 -2.601 -11.503 137 HG3 GLU 15 3HG GLU 15 18.758 -3.872 -12.503 138 H ARG 16 H ARG 16 16.100 0.303 -13.921 139 HA ARG 16 HA ARG 16 17.722 1.561 -11.909 140 HB2 ARG 16 2HB ARG 16 16.649 2.267 -14.559 141 HB3 ARG 16 3HB ARG 16 16.798 3.617 -13.442 142 HG2 ARG 16 2HG ARG 16 19.058 3.567 -13.463 143 HG3 ARG 16 3HG ARG 16 19.127 1.814 -13.657 144 HD2 ARG 16 2HD ARG 16 19.749 2.309 -15.760 145 HD3 ARG 16 3HD ARG 16 18.021 2.546 -16.017 146 HE ARG 16 HE ARG 16 19.371 4.909 -15.106 147 HH11 ARG 16 1HH1 ARG 16 18.551 2.987 -17.891 148 HH12 ARG 16 2HH1 ARG 16 18.669 4.312 -19.002 149 HH21 ARG 16 1HH2 ARG 16 19.529 6.660 -16.559 150 HH22 ARG 16 2HH2 ARG 16 19.227 6.400 -18.243 151 H LEU 17 H LEU 17 14.333 1.704 -12.915 152 HA LEU 17 HA LEU 17 13.578 3.763 -11.119 153 HB2 LEU 17 2HB LEU 17 12.361 2.243 -13.147 154 HB3 LEU 17 3HB LEU 17 11.407 1.976 -11.690 155 HG LEU 17 HG LEU 17 10.452 3.779 -12.972 156 HD11 LEU 17 1HD1 LEU 17 11.797 5.232 -10.750 157 HD12 LEU 17 2HD1 LEU 17 10.774 3.847 -10.369 158 HD13 LEU 17 3HD1 LEU 17 10.102 5.228 -11.236 159 HD21 LEU 17 3HD2 LEU 17 12.443 5.801 -12.671 160 HD22 LEU 17 1HD2 LEU 17 11.691 5.194 -14.147 161 HD23 LEU 17 2HD2 LEU 17 13.146 4.420 -13.516 162 H GLU 18 H GLU 18 13.982 0.331 -10.796 163 HA GLU 18 HA GLU 18 12.384 -0.211 -8.588 164 HB2 GLU 18 2HB GLU 18 14.142 -1.650 -10.095 165 HB3 GLU 18 3HB GLU 18 15.021 -1.523 -8.577 166 HG2 GLU 18 2HG GLU 18 13.765 -3.089 -7.655 167 HG3 GLU 18 3HG GLU 18 12.291 -2.212 -8.060 168 H GLU 19 H GLU 19 15.456 1.427 -8.801 169 HA GLU 19 HA GLU 19 15.949 1.357 -5.962 170 HB2 GLU 19 2HB GLU 19 17.873 1.416 -7.375 171 HB3 GLU 19 3HB GLU 19 17.269 2.818 -8.247 172 HG2 GLU 19 2HG GLU 19 17.567 3.266 -5.381 173 HG3 GLU 19 3HG GLU 19 19.076 2.869 -6.201 174 H LEU 20 H LEU 20 14.327 3.434 -8.208 175 HA LEU 20 HA LEU 20 14.375 5.843 -6.765 176 HB2 LEU 20 2HB LEU 20 13.091 4.802 -9.089 177 HB3 LEU 20 3HB LEU 20 11.889 5.625 -8.098 178 HG LEU 20 HG LEU 20 13.918 7.450 -8.135 179 HD11 LEU 20 1HD1 LEU 20 14.926 5.791 -9.902 180 HD12 LEU 20 2HD1 LEU 20 15.010 7.536 -10.145 181 HD13 LEU 20 3HD1 LEU 20 13.781 6.588 -10.982 182 HD21 LEU 20 3HD2 LEU 20 11.554 7.122 -9.974 183 HD22 LEU 20 1HD2 LEU 20 12.526 8.590 -9.880 184 HD23 LEU 20 2HD2 LEU 20 11.633 8.033 -8.465 185 H ILE 21 H ILE 21 12.289 3.021 -6.557 186 HA ILE 21 HA ILE 21 10.565 4.286 -4.594 187 HB ILE 21 HB ILE 21 9.580 2.755 -6.240 188 HG12 ILE 21 2HG1 ILE 21 8.283 1.371 -4.653 189 HG13 ILE 21 3HG1 ILE 21 9.462 1.727 -3.396 190 HG21 ILE 21 1HG2 ILE 21 10.007 0.359 -6.134 191 HG22 ILE 21 2HG2 ILE 21 11.488 1.246 -6.492 192 HG23 ILE 21 3HG2 ILE 21 11.207 0.619 -4.868 193 HD11 ILE 21 3HD1 ILE 21 8.719 3.863 -3.115 194 HD12 ILE 21 1HD1 ILE 21 8.129 3.996 -4.771 195 HD13 ILE 21 2HD1 ILE 21 7.218 3.064 -3.582 196 H GLU 22 H GLU 22 13.166 1.936 -4.723 197 HA GLU 22 HA GLU 22 12.946 0.802 -2.195 198 HB2 GLU 22 2HB GLU 22 14.663 0.488 -4.246 199 HB3 GLU 22 3HB GLU 22 15.683 1.412 -3.153 200 HG2 GLU 22 2HG GLU 22 15.889 -0.283 -1.689 201 HG3 GLU 22 3HG GLU 22 14.241 -0.852 -1.948 202 H LYS 23 H LYS 23 13.997 3.963 -3.140 203 HA LYS 23 HA LYS 23 15.461 4.632 -0.810 204 HB2 LYS 23 2HB LYS 23 14.528 5.971 -3.205 205 HB3 LYS 23 3HB LYS 23 14.344 7.001 -1.792 206 HG2 LYS 23 2HG LYS 23 16.784 6.365 -1.277 207 HG3 LYS 23 3HG LYS 23 16.839 5.838 -2.961 208 HD2 LYS 23 2HD LYS 23 15.811 8.203 -3.418 209 HD3 LYS 23 3HD LYS 23 16.496 8.583 -1.836 210 HE2 LYS 23 2HE LYS 23 18.696 7.828 -2.629 211 HE3 LYS 23 3HE LYS 23 18.001 7.488 -4.212 212 HZ1 LYS 23 3HZ LYS 23 18.490 9.573 -4.736 213 HZ2 LYS 23 1HZ LYS 23 18.905 9.962 -3.142 214 HZ3 LYS 23 2HZ LYS 23 17.297 10.084 -3.651 215 H GLU 24 H GLU 24 12.061 4.993 -1.714 216 HA GLU 24 HA GLU 24 11.343 6.400 0.671 217 HB2 GLU 24 2HB GLU 24 10.144 6.012 -1.757 218 HB3 GLU 24 3HB GLU 24 9.210 4.936 -0.727 219 HG2 GLU 24 2HG GLU 24 9.635 7.544 0.477 220 HG3 GLU 24 3HG GLU 24 8.796 7.632 -1.071 221 H MET 25 H MET 25 11.656 3.072 -0.229 222 HA MET 25 HA MET 25 9.969 1.901 1.693 223 HB2 MET 25 2HB MET 25 12.480 0.844 0.385 224 HB3 MET 25 3HB MET 25 11.391 -0.129 1.364 225 HG2 MET 25 2HG MET 25 10.636 1.295 -1.177 226 HG3 MET 25 3HG MET 25 11.021 -0.419 -1.040 227 HE1 MET 25 3HE MET 25 9.633 -2.063 0.592 228 HE2 MET 25 1HE MET 25 9.630 -0.903 1.921 229 HE3 MET 25 2HE MET 25 8.114 -1.612 1.367 230 H GLN 26 H GLN 26 10.374 1.072 3.744 231 HA GLN 26 HA GLN 26 12.106 2.584 5.381 232 HB2 GLN 26 2HB GLN 26 10.129 0.477 5.729 233 HB3 GLN 26 3HB GLN 26 11.487 0.296 6.832 234 HG2 GLN 26 2HG GLN 26 10.930 2.967 7.021 235 HG3 GLN 26 3HG GLN 26 9.331 2.255 6.813 236 HE21 GLN 26 1HE2 GLN 26 10.571 3.548 9.141 237 HE22 GLN 26 2HE2 GLN 26 10.477 2.393 10.422 238 HA PRO 27 HA PRO 27 15.917 0.415 5.336 239 HB2 PRO 27 2HB PRO 27 16.657 0.461 7.948 240 HB3 PRO 27 3HB PRO 27 16.675 1.898 6.919 241 HG2 PRO 27 2HG PRO 27 14.621 1.022 8.913 242 HG3 PRO 27 3HG PRO 27 15.286 2.641 8.629 243 HD2 PRO 27 2HD PRO 27 12.876 1.867 7.668 244 HD3 PRO 27 3HD PRO 27 13.918 3.022 6.813 245 H ASN 28 H ASN 28 13.227 -0.873 6.916 246 HA ASN 28 HA ASN 28 14.461 -3.520 6.938 247 HB2 ASN 28 2HB ASN 28 14.294 -2.214 9.292 248 HB3 ASN 28 3HB ASN 28 12.695 -2.952 9.251 249 HD21 ASN 28 1HD2 ASN 28 12.525 -4.939 9.996 250 HD22 ASN 28 2HD2 ASN 28 13.826 -6.054 10.217 251 H GLU 29 H GLU 29 12.584 -2.240 5.167 252 HA GLU 29 HA GLU 29 10.123 -3.752 5.728 253 HB2 GLU 29 2HB GLU 29 10.626 -1.117 4.633 254 HB3 GLU 29 3HB GLU 29 9.652 -2.084 3.534 255 HG2 GLU 29 2HG GLU 29 8.940 -1.919 6.430 256 HG3 GLU 29 3HG GLU 29 8.492 -0.624 5.321 257 H VAL 30 H VAL 30 9.014 -4.648 3.781 258 HA VAL 30 HA VAL 30 10.988 -6.010 2.104 259 HB VAL 30 HB VAL 30 9.138 -7.226 3.428 260 HG11 VAL 30 1HG1 VAL 30 6.979 -7.320 2.562 261 HG12 VAL 30 2HG1 VAL 30 7.389 -5.607 2.449 262 HG13 VAL 30 3HG1 VAL 30 7.466 -6.630 1.014 263 HG21 VAL 30 3HG2 VAL 30 10.546 -8.382 1.862 264 HG22 VAL 30 1HG2 VAL 30 8.880 -8.904 1.609 265 HG23 VAL 30 2HG2 VAL 30 9.622 -7.752 0.498 266 H ALA 31 H ALA 31 10.897 -6.027 -0.132 267 HA ALA 31 HA ALA 31 9.005 -4.150 -1.383 268 HB1 ALA 31 1HB ALA 31 11.801 -4.397 -2.411 269 HB2 ALA 31 2HB ALA 31 10.649 -3.075 -2.599 270 HB3 ALA 31 3HB ALA 31 11.449 -3.333 -1.049 271 H ILE 32 H ILE 32 7.737 -5.300 -2.680 272 HA ILE 32 HA ILE 32 8.768 -7.713 -3.963 273 HB ILE 32 HB ILE 32 5.982 -6.614 -3.645 274 HG12 ILE 32 2HG1 ILE 32 6.506 -9.374 -2.878 275 HG13 ILE 32 3HG1 ILE 32 7.559 -8.243 -2.034 276 HG21 ILE 32 1HG2 ILE 32 5.599 -7.550 -5.663 277 HG22 ILE 32 2HG2 ILE 32 7.027 -8.581 -5.576 278 HG23 ILE 32 3HG2 ILE 32 5.555 -9.040 -4.721 279 HD11 ILE 32 3HD1 ILE 32 5.022 -8.939 -1.290 280 HD12 ILE 32 1HD1 ILE 32 5.905 -7.515 -0.740 281 HD13 ILE 32 2HD1 ILE 32 4.781 -7.388 -2.093 282 H PHE 33 H PHE 33 9.842 -7.291 -5.795 283 HA PHE 33 HA PHE 33 8.733 -5.312 -7.660 284 HB2 PHE 33 2HB PHE 33 11.468 -6.602 -7.704 285 HB3 PHE 33 3HB PHE 33 10.923 -5.255 -8.698 286 HD1 PHE 33 HD2 PHE 33 9.501 -3.652 -6.628 287 HD2 PHE 33 HD1 PHE 33 13.248 -5.669 -6.524 288 HE1 PHE 33 HE2 PHE 33 10.301 -2.071 -4.922 289 HE2 PHE 33 HE1 PHE 33 14.053 -4.091 -4.816 290 HZ PHE 33 HZ PHE 33 12.580 -2.288 -4.014 291 H MET 34 H MET 34 7.296 -6.272 -8.968 292 HA MET 34 HA MET 34 7.630 -8.992 -9.860 293 HB2 MET 34 2HB MET 34 5.544 -6.891 -10.109 294 HB3 MET 34 3HB MET 34 5.585 -8.128 -11.358 295 HG2 MET 34 2HG MET 34 5.797 -9.522 -8.958 296 HG3 MET 34 3HG MET 34 4.594 -8.269 -8.661 297 HE1 MET 34 3HE MET 34 4.401 -10.292 -12.577 298 HE2 MET 34 1HE MET 34 5.848 -10.088 -11.589 299 HE3 MET 34 2HE MET 34 4.924 -11.588 -11.501 300 H PHE 35 H PHE 35 8.461 -9.683 -11.738 301 HA PHE 35 HA PHE 35 8.953 -7.726 -13.871 302 HB2 PHE 35 2HB PHE 35 11.202 -8.547 -14.219 303 HB3 PHE 35 3HB PHE 35 11.034 -8.040 -12.541 304 HD1 PHE 35 HD1 PHE 35 10.306 -9.971 -10.891 305 HD2 PHE 35 HD2 PHE 35 12.211 -10.560 -14.651 306 HE1 PHE 35 HE1 PHE 35 11.091 -12.180 -10.143 307 HE2 PHE 35 HE2 PHE 35 12.998 -12.770 -13.910 308 HZ PHE 35 HZ PHE 35 12.438 -13.583 -11.654 309 H GLU 36 H GLU 36 8.342 -8.422 -15.817 310 HA GLU 36 HA GLU 36 7.651 -11.262 -16.108 311 HB2 GLU 36 2HB GLU 36 6.193 -10.559 -17.939 312 HB3 GLU 36 3HB GLU 36 5.813 -9.682 -16.464 313 HG2 GLU 36 2HG GLU 36 5.879 -7.859 -17.733 314 HG3 GLU 36 3HG GLU 36 7.632 -8.033 -17.664 315 H VAL 37 H VAL 37 9.994 -9.032 -16.977 316 HA VAL 37 HA VAL 37 10.584 -10.071 -19.599 317 HB VAL 37 HB VAL 37 12.429 -8.400 -17.904 318 HG11 VAL 37 1HG1 VAL 37 13.704 -8.759 -19.713 319 HG12 VAL 37 2HG1 VAL 37 12.336 -9.293 -20.692 320 HG13 VAL 37 3HG1 VAL 37 12.658 -7.571 -20.490 321 HG21 VAL 37 3HG2 VAL 37 11.384 -6.431 -19.032 322 HG22 VAL 37 1HG2 VAL 37 10.104 -7.503 -19.598 323 HG23 VAL 37 2HG2 VAL 37 10.335 -7.241 -17.870 324 H GLY 38 H GLY 38 12.555 -11.157 -20.173 325 HA2 GLY 38 2HA GLY 38 13.175 -13.310 -18.408 326 HA3 GLY 38 3HA GLY 38 13.942 -12.982 -19.955 327 H ASP 39 H ASP 39 14.300 -10.158 -18.501 328 HA ASP 39 HA ASP 39 17.046 -10.581 -17.892 329 HB2 ASP 39 2HB ASP 39 15.171 -8.249 -17.676 330 HB3 ASP 39 3HB ASP 39 16.769 -8.163 -16.940 331 H PHE 40 H PHE 40 16.973 -12.215 -16.272 332 HA PHE 40 HA PHE 40 15.793 -11.541 -13.704 333 HB2 PHE 40 2HB PHE 40 16.274 -13.778 -13.049 334 HB3 PHE 40 3HB PHE 40 15.717 -13.865 -14.717 335 HD1 PHE 40 HD2 PHE 40 18.585 -14.216 -12.479 336 HD2 PHE 40 HD1 PHE 40 17.222 -14.467 -16.504 337 HE1 PHE 40 HE2 PHE 40 20.639 -15.422 -13.097 338 HE2 PHE 40 HE1 PHE 40 19.273 -15.674 -17.127 339 HZ PHE 40 HZ PHE 40 20.986 -16.152 -15.423 340 H SER 41 H SER 41 18.869 -11.492 -15.273 341 HA SER 41 HA SER 41 20.487 -11.493 -12.927 342 HB2 SER 41 2HB SER 41 22.298 -11.182 -14.350 343 HB3 SER 41 3HB SER 41 21.131 -11.944 -15.431 344 HG SER 41 HG SER 41 20.644 -9.936 -16.282 345 H ASN 42 H ASN 42 18.521 -9.151 -14.434 346 HA ASN 42 HA ASN 42 19.961 -6.851 -13.456 347 HB2 ASN 42 2HB ASN 42 17.739 -7.351 -15.242 348 HB3 ASN 42 3HB ASN 42 17.348 -6.065 -14.103 349 HD21 ASN 42 1HD2 ASN 42 18.482 -6.589 -17.069 350 HD22 ASN 42 2HD2 ASN 42 19.515 -5.218 -17.263 351 H ILE 43 H ILE 43 17.393 -8.920 -12.365 352 HA ILE 43 HA ILE 43 16.071 -7.342 -10.529 353 HB ILE 43 HB ILE 43 16.645 -10.255 -10.692 354 HG12 ILE 43 2HG1 ILE 43 14.745 -9.193 -11.879 355 HG13 ILE 43 3HG1 ILE 43 14.217 -10.400 -10.711 356 HG21 ILE 43 1HG2 ILE 43 15.254 -10.484 -8.538 357 HG22 ILE 43 2HG2 ILE 43 16.971 -10.113 -8.394 358 HG23 ILE 43 3HG2 ILE 43 15.774 -8.832 -8.204 359 HD11 ILE 43 3HD1 ILE 43 13.808 -8.511 -9.110 360 HD12 ILE 43 1HD1 ILE 43 14.089 -7.412 -10.459 361 HD13 ILE 43 2HD1 ILE 43 12.751 -8.560 -10.521 362 HA PRO 44 HA PRO 44 19.350 -8.509 -7.173 363 HB2 PRO 44 2HB PRO 44 21.650 -9.666 -8.036 364 HB3 PRO 44 3HB PRO 44 20.221 -10.597 -7.575 365 HG2 PRO 44 2HG PRO 44 21.174 -9.818 -10.304 366 HG3 PRO 44 3HG PRO 44 20.526 -11.372 -9.746 367 HD2 PRO 44 2HD PRO 44 19.032 -9.578 -11.117 368 HD3 PRO 44 3HD PRO 44 18.340 -10.653 -9.885 369 H LYS 45 H LYS 45 20.078 -7.184 -10.254 370 HA LYS 45 HA LYS 45 22.445 -5.760 -9.430 371 HB2 LYS 45 2HB LYS 45 21.499 -6.518 -11.853 372 HB3 LYS 45 3HB LYS 45 20.967 -4.842 -11.820 373 HG2 LYS 45 2HG LYS 45 23.627 -4.826 -10.935 374 HG3 LYS 45 3HG LYS 45 23.573 -5.911 -12.327 375 HD2 LYS 45 2HD LYS 45 22.211 -4.028 -13.453 376 HD3 LYS 45 3HD LYS 45 22.855 -3.003 -12.168 377 HE2 LYS 45 2HE LYS 45 24.813 -4.699 -13.583 378 HE3 LYS 45 3HE LYS 45 24.088 -3.401 -14.530 379 HZ1 LYS 45 3HZ LYS 45 26.118 -3.229 -12.597 380 HZ2 LYS 45 1HZ LYS 45 24.785 -2.343 -12.050 381 HZ3 LYS 45 2HZ LYS 45 25.470 -1.995 -13.556 382 H SER 46 H SER 46 19.020 -5.179 -9.528 383 HA SER 46 HA SER 46 19.168 -2.335 -9.295 384 HB2 SER 46 2HB SER 46 16.731 -3.530 -8.228 385 HB3 SER 46 3HB SER 46 16.940 -2.431 -9.591 386 HG SER 46 HG SER 46 16.354 -4.192 -10.633 387 H ALA 47 H ALA 47 18.411 -4.936 -6.982 388 HA ALA 47 HA ALA 47 18.168 -3.309 -4.714 389 HB1 ALA 47 1HB ALA 47 17.579 -5.813 -5.076 390 HB2 ALA 47 2HB ALA 47 19.227 -6.096 -4.514 391 HB3 ALA 47 3HB ALA 47 18.074 -5.257 -3.477 392 H GLU 48 H GLU 48 20.961 -4.512 -6.389 393 HA GLU 48 HA GLU 48 22.808 -4.092 -4.238 394 HB2 GLU 48 2HB GLU 48 23.121 -5.684 -6.191 395 HB3 GLU 48 3HB GLU 48 23.470 -4.270 -7.176 396 HG2 GLU 48 2HG GLU 48 25.031 -4.336 -4.729 397 HG3 GLU 48 3HG GLU 48 25.290 -5.753 -5.745 398 H PHE 49 H PHE 49 21.455 -2.153 -6.773 399 HA PHE 49 HA PHE 49 23.390 -0.146 -6.977 400 HB2 PHE 49 2HB PHE 49 20.878 -0.618 -8.061 401 HB3 PHE 49 3HB PHE 49 20.665 0.874 -7.150 402 HD1 PHE 49 HD2 PHE 49 22.186 2.815 -7.633 403 HD2 PHE 49 HD1 PHE 49 21.995 -0.635 -10.119 404 HE1 PHE 49 HE2 PHE 49 23.223 4.084 -9.468 405 HE2 PHE 49 HE1 PHE 49 23.032 0.628 -11.958 406 HZ PHE 49 HZ PHE 49 23.647 2.991 -11.634 407 H ILE 50 H ILE 50 21.087 -0.833 -4.493 408 HA ILE 50 HA ILE 50 21.126 1.769 -3.290 409 HB ILE 50 HB ILE 50 20.290 -0.866 -2.073 410 HG12 ILE 50 2HG1 ILE 50 19.035 -0.286 -4.133 411 HG13 ILE 50 3HG1 ILE 50 18.021 -0.255 -2.695 412 HG21 ILE 50 1HG2 ILE 50 18.818 1.158 -0.918 413 HG22 ILE 50 2HG2 ILE 50 20.194 0.328 -0.193 414 HG23 ILE 50 3HG2 ILE 50 20.435 1.849 -1.052 415 HD11 ILE 50 3HD1 ILE 50 17.588 1.610 -4.241 416 HD12 ILE 50 1HD1 ILE 50 18.095 2.145 -2.639 417 HD13 ILE 50 2HD1 ILE 50 19.238 2.175 -3.982 418 H GLN 51 H GLN 51 22.173 -1.330 -1.877 419 HA GLN 51 HA GLN 51 24.671 -0.080 -1.019 420 HB2 GLN 51 2HB GLN 51 22.818 0.101 0.769 421 HB3 GLN 51 3HB GLN 51 23.030 -1.634 0.965 422 HG2 GLN 51 2HG GLN 51 24.327 -0.524 2.625 423 HG3 GLN 51 3HG GLN 51 25.427 -1.235 1.446 424 HE21 GLN 51 1HE2 GLN 51 27.100 0.028 1.121 425 HE22 GLN 51 2HE2 GLN 51 27.075 1.752 1.007 426 H SER 52 H SER 52 26.355 -1.411 -1.232 427 HA SER 52 HA SER 52 26.221 -3.856 -2.500 428 HB2 SER 52 2HB SER 52 28.556 -4.218 -1.667 429 HB3 SER 52 3HB SER 52 28.302 -2.633 -2.397 430 HG SER 52 HG SER 52 28.562 -3.305 0.331 431 H LYS 53 H LYS 53 25.977 -3.127 0.907 432 HA LYS 53 HA LYS 53 25.429 -5.973 1.421 433 HB2 LYS 53 2HB LYS 53 27.296 -4.135 2.798 434 HB3 LYS 53 3HB LYS 53 26.315 -5.158 3.840 435 HG2 LYS 53 2HG LYS 53 27.529 -6.961 3.374 436 HG3 LYS 53 3HG LYS 53 27.490 -6.638 1.639 437 HD2 LYS 53 2HD LYS 53 29.719 -6.354 1.977 438 HD3 LYS 53 3HD LYS 53 29.191 -4.718 2.378 439 HE2 LYS 53 2HE LYS 53 30.209 -4.994 4.340 440 HE3 LYS 53 3HE LYS 53 28.915 -6.117 4.753 441 HZ1 LYS 53 3HZ LYS 53 31.443 -6.898 3.406 442 HZ2 LYS 53 1HZ LYS 53 30.231 -7.938 3.966 443 HZ3 LYS 53 2HZ LYS 53 31.158 -7.050 5.067 444 H GLY 54 H GLY 54 23.357 -6.192 1.935 445 HA2 GLY 54 2HA GLY 54 22.005 -5.375 4.075 446 HA3 GLY 54 3HA GLY 54 21.888 -3.942 3.064 447 H HIS 55 H HIS 55 21.580 -5.088 0.561 448 HA HIS 55 HA HIS 55 18.810 -5.777 0.638 449 HB2 HIS 55 2HB HIS 55 18.951 -5.849 -1.786 450 HB3 HIS 55 3HB HIS 55 19.820 -4.439 -1.188 451 HD1 HIS 55 HD1 HIS 55 22.521 -4.789 -1.044 452 HD2 HIS 55 HD2 HIS 55 20.400 -7.425 -3.455 453 HE1 HIS 55 HE1 HIS 55 24.229 -5.827 -2.570 454 H GLU 56 H GLU 56 18.019 -7.724 1.042 455 HA GLU 56 HA GLU 56 19.476 -10.077 0.050 456 HB2 GLU 56 2HB GLU 56 19.320 -9.403 2.724 457 HB3 GLU 56 3HB GLU 56 18.007 -10.555 2.531 458 HG2 GLU 56 2HG GLU 56 20.547 -11.347 1.294 459 HG3 GLU 56 3HG GLU 56 20.571 -11.222 3.052 460 H LEU 57 H LEU 57 18.242 -11.217 -1.276 461 HA LEU 57 HA LEU 57 15.407 -10.755 -1.436 462 HB2 LEU 57 2HB LEU 57 17.213 -12.663 -2.914 463 HB3 LEU 57 3HB LEU 57 15.504 -12.422 -3.273 464 HG LEU 57 HG LEU 57 16.643 -11.174 -4.892 465 HD11 LEU 57 1HD1 LEU 57 16.326 -8.907 -3.033 466 HD12 LEU 57 2HD1 LEU 57 14.923 -9.958 -3.226 467 HD13 LEU 57 3HD1 LEU 57 15.636 -9.173 -4.635 468 HD21 LEU 57 3HD2 LEU 57 18.663 -10.213 -4.661 469 HD22 LEU 57 1HD2 LEU 57 18.763 -11.210 -3.209 470 HD23 LEU 57 2HD2 LEU 57 18.271 -9.520 -3.087 471 H LEU 58 H LEU 58 14.253 -11.589 0.212 472 HA LEU 58 HA LEU 58 14.798 -13.859 1.699 473 HB2 LEU 58 2HB LEU 58 12.633 -12.020 1.393 474 HB3 LEU 58 3HB LEU 58 11.988 -13.657 1.487 475 HG LEU 58 HG LEU 58 13.949 -13.264 3.547 476 HD11 LEU 58 1HD1 LEU 58 11.651 -11.469 4.045 477 HD12 LEU 58 2HD1 LEU 58 12.938 -10.857 3.006 478 HD13 LEU 58 3HD1 LEU 58 13.307 -11.391 4.646 479 HD21 LEU 58 3HD2 LEU 58 10.973 -13.574 3.842 480 HD22 LEU 58 1HD2 LEU 58 12.246 -14.116 4.934 481 HD23 LEU 58 2HD2 LEU 58 12.026 -14.910 3.375 482 H ASN 59 H ASN 59 12.848 -13.547 -1.246 483 HA ASN 59 HA ASN 59 12.913 -16.484 -1.492 484 HB2 ASN 59 2HB ASN 59 10.636 -15.267 -1.111 485 HB3 ASN 59 3HB ASN 59 10.796 -14.806 -2.803 486 HD21 ASN 59 1HD2 ASN 59 10.079 -16.174 -4.277 487 HD22 ASN 59 2HD2 ASN 59 9.694 -17.837 -4.008 488 H SER 60 H SER 60 14.308 -17.056 -3.016 489 HA SER 60 HA SER 60 15.487 -15.431 -4.908 490 HB2 SER 60 2HB SER 60 16.670 -17.361 -4.869 491 HB3 SER 60 3HB SER 60 15.253 -18.332 -4.474 492 HG SER 60 HG SER 60 15.885 -18.906 -6.517 493 H LEU 61 H LEU 61 14.750 -14.438 -6.654 494 HA LEU 61 HA LEU 61 12.154 -14.538 -7.589 495 HB2 LEU 61 2HB LEU 61 13.012 -13.440 -9.628 496 HB3 LEU 61 3HB LEU 61 13.593 -12.705 -8.135 497 HG LEU 61 HG LEU 61 15.372 -14.726 -9.337 498 HD11 LEU 61 1HD1 LEU 61 15.144 -13.879 -11.409 499 HD12 LEU 61 2HD1 LEU 61 16.164 -12.589 -10.774 500 HD13 LEU 61 3HD1 LEU 61 14.414 -12.380 -10.834 501 HD21 LEU 61 3HD2 LEU 61 15.504 -12.288 -7.711 502 HD22 LEU 61 1HD2 LEU 61 16.807 -12.465 -8.886 503 HD23 LEU 61 2HD2 LEU 61 16.523 -13.728 -7.689 504 H ARG 62 H ARG 62 11.025 -15.851 -8.881 505 HA ARG 62 HA ARG 62 12.382 -18.181 -9.994 506 HB2 ARG 62 2HB ARG 62 10.145 -18.122 -8.594 507 HB3 ARG 62 3HB ARG 62 9.426 -17.788 -10.163 508 HG2 ARG 62 2HG ARG 62 9.348 -19.984 -10.460 509 HG3 ARG 62 3HG ARG 62 11.102 -19.932 -10.648 510 HD2 ARG 62 2HD ARG 62 11.485 -20.619 -8.473 511 HD3 ARG 62 3HD ARG 62 9.900 -20.083 -7.917 512 HE ARG 62 HE ARG 62 9.057 -22.130 -8.484 513 HH11 ARG 62 1HH1 ARG 62 12.122 -21.691 -10.076 514 HH12 ARG 62 2HH1 ARG 62 12.188 -23.313 -10.680 515 HH21 ARG 62 1HH2 ARG 62 9.132 -24.268 -9.274 516 HH22 ARG 62 2HH2 ARG 62 10.487 -24.778 -10.224 517 H PHE 63 H PHE 63 13.340 -16.493 -11.560 518 HA PHE 63 HA PHE 63 11.759 -15.380 -13.604 519 HB2 PHE 63 2HB PHE 63 13.796 -14.896 -14.728 520 HB3 PHE 63 3HB PHE 63 14.154 -14.781 -13.009 521 HD1 PHE 63 HD2 PHE 63 15.233 -16.798 -11.886 522 HD2 PHE 63 HD1 PHE 63 15.033 -16.298 -16.109 523 HE1 PHE 63 HE2 PHE 63 17.071 -18.411 -12.161 524 HE2 PHE 63 HE1 PHE 63 16.869 -17.911 -16.390 525 HZ PHE 63 HZ PHE 63 17.892 -18.969 -14.415 526 H ASN 64 H ASN 64 12.913 -18.581 -13.067 527 HA ASN 64 HA ASN 64 13.045 -19.626 -15.629 528 HB2 ASN 64 2HB ASN 64 12.306 -20.803 -12.970 529 HB3 ASN 64 3HB ASN 64 12.181 -21.782 -14.429 530 HD21 ASN 64 1HD2 ASN 64 13.860 -22.533 -12.437 531 HD22 ASN 64 2HD2 ASN 64 15.502 -22.326 -12.933 532 H GLN 65 H GLN 65 10.280 -18.667 -13.770 533 HA GLN 65 HA GLN 65 8.485 -19.825 -15.791 534 HB2 GLN 65 2HB GLN 65 8.350 -19.808 -12.987 535 HB3 GLN 65 3HB GLN 65 7.119 -18.672 -13.522 536 HG2 GLN 65 2HG GLN 65 5.821 -20.475 -13.695 537 HG3 GLN 65 3HG GLN 65 6.687 -20.759 -15.204 538 HE21 GLN 65 1HE2 GLN 65 6.654 -21.528 -11.769 539 HE22 GLN 65 2HE2 GLN 65 7.422 -23.068 -11.919 540 H ALA 66 H ALA 66 6.273 -18.262 -15.475 541 HA ALA 66 HA ALA 66 6.871 -16.025 -17.083 542 HB1 ALA 66 1HB ALA 66 4.662 -15.941 -17.391 543 HB2 ALA 66 2HB ALA 66 4.591 -17.408 -16.414 544 HB3 ALA 66 3HB ALA 66 4.338 -15.834 -15.660 545 H ASP 67 H ASP 67 5.416 -13.916 -16.132 546 HA ASP 67 HA ASP 67 7.180 -12.440 -14.658 547 HB2 ASP 67 2HB ASP 67 5.330 -10.918 -14.150 548 HB3 ASP 67 3HB ASP 67 5.237 -11.480 -15.817 549 H TRP 68 H TRP 68 8.041 -12.872 -12.742 550 HA TRP 68 HA TRP 68 6.320 -14.029 -10.651 551 HB2 TRP 68 2HB TRP 68 8.671 -15.027 -11.589 552 HB3 TRP 68 3HB TRP 68 9.243 -14.051 -10.238 553 HD1 TRP 68 HD1 TRP 68 9.244 -15.239 -7.972 554 HE1 TRP 68 HE1 TRP 68 8.102 -17.322 -6.981 555 HE3 TRP 68 HE3 TRP 68 6.233 -16.468 -11.917 556 HZ2 TRP 68 HZ2 TRP 68 6.180 -19.233 -7.768 557 HZ3 TRP 68 HZ3 TRP 68 4.773 -18.438 -11.717 558 HH2 TRP 68 HH2 TRP 68 4.749 -19.791 -9.685 559 H THR 69 H THR 69 7.525 -13.490 -8.381 560 HA THR 69 HA THR 69 7.899 -10.568 -8.316 561 HB THR 69 HB THR 69 6.480 -10.280 -6.520 562 HG1 THR 69 HG1 THR 69 6.523 -13.079 -5.986 563 HG21 THR 69 3HG2 THR 69 4.450 -10.980 -7.269 564 HG22 THR 69 1HG2 THR 69 4.971 -12.655 -7.448 565 HG23 THR 69 2HG2 THR 69 5.406 -11.461 -8.671 566 H ILE 70 H ILE 70 9.490 -9.792 -7.010 567 HA ILE 70 HA ILE 70 11.030 -11.778 -5.468 568 HB ILE 70 HB ILE 70 12.330 -11.138 -7.391 569 HG12 ILE 70 2HG1 ILE 70 14.315 -10.213 -6.292 570 HG13 ILE 70 3HG1 ILE 70 13.327 -9.662 -4.944 571 HG21 ILE 70 1HG2 ILE 70 11.105 -8.605 -6.981 572 HG22 ILE 70 2HG2 ILE 70 12.854 -8.391 -6.951 573 HG23 ILE 70 3HG2 ILE 70 12.083 -9.150 -8.343 574 HD11 ILE 70 3HD1 ILE 70 13.020 -12.499 -5.461 575 HD12 ILE 70 1HD1 ILE 70 14.685 -12.043 -5.101 576 HD13 ILE 70 2HD1 ILE 70 13.396 -11.652 -3.961 577 H VAL 71 H VAL 71 11.010 -11.403 -3.361 578 HA VAL 71 HA VAL 71 10.265 -8.769 -2.360 579 HB VAL 71 HB VAL 71 10.234 -9.919 -0.128 580 HG11 VAL 71 1HG1 VAL 71 8.298 -11.569 -1.040 581 HG12 VAL 71 2HG1 VAL 71 8.096 -9.827 -0.839 582 HG13 VAL 71 3HG1 VAL 71 8.485 -10.494 -2.425 583 HG21 VAL 71 3HG2 VAL 71 10.064 -12.598 -1.154 584 HG22 VAL 71 1HG2 VAL 71 11.640 -11.898 -1.527 585 HG23 VAL 71 2HG2 VAL 71 11.075 -11.960 0.142 586 H VAL 72 H VAL 72 11.705 -7.337 -1.672 587 HA VAL 72 HA VAL 72 14.409 -8.286 -0.980 588 HB VAL 72 HB VAL 72 13.713 -5.507 -1.919 589 HG11 VAL 72 1HG1 VAL 72 15.952 -5.066 -1.926 590 HG12 VAL 72 2HG1 VAL 72 15.891 -6.228 -0.600 591 HG13 VAL 72 3HG1 VAL 72 16.396 -6.749 -2.207 592 HG21 VAL 72 3HG2 VAL 72 13.890 -7.949 -3.445 593 HG22 VAL 72 1HG2 VAL 72 13.440 -6.326 -3.969 594 HG23 VAL 72 2HG2 VAL 72 15.137 -6.804 -3.938 595 H ARG 73 H ARG 73 15.052 -8.004 1.049 596 HA ARG 73 HA ARG 73 13.459 -6.269 2.795 597 HB2 ARG 73 2HB ARG 73 14.612 -7.512 4.643 598 HB3 ARG 73 3HB ARG 73 13.606 -8.515 3.606 599 HG2 ARG 73 2HG ARG 73 15.325 -9.802 3.050 600 HG3 ARG 73 3HG ARG 73 16.323 -8.406 2.639 601 HD2 ARG 73 2HD ARG 73 17.379 -8.421 4.624 602 HD3 ARG 73 3HD ARG 73 15.906 -8.804 5.514 603 HE ARG 73 HE ARG 73 16.763 -11.060 4.052 604 HH11 ARG 73 1HH1 ARG 73 17.588 -9.152 6.844 605 HH12 ARG 73 2HH1 ARG 73 18.348 -10.466 7.679 606 HH21 ARG 73 1HH2 ARG 73 17.761 -12.798 5.141 607 HH22 ARG 73 2HH2 ARG 73 18.447 -12.539 6.710 608 H LYS 74 H LYS 74 14.225 -4.315 3.211 609 HA LYS 74 HA LYS 74 16.888 -3.531 2.585 610 HB2 LYS 74 2HB LYS 74 14.465 -2.233 3.689 611 HB3 LYS 74 3HB LYS 74 16.001 -1.481 4.099 612 HG2 LYS 74 2HG LYS 74 16.346 -1.817 1.456 613 HG3 LYS 74 3HG LYS 74 14.592 -1.632 1.518 614 HD2 LYS 74 2HD LYS 74 14.946 0.570 1.563 615 HD3 LYS 74 3HD LYS 74 15.539 0.349 3.211 616 HE2 LYS 74 2HE LYS 74 17.275 0.117 0.759 617 HE3 LYS 74 3HE LYS 74 17.080 1.607 1.681 618 HZ1 LYS 74 3HZ LYS 74 17.706 -0.151 3.606 619 HZ2 LYS 74 1HZ LYS 74 18.832 0.833 2.814 620 HZ3 LYS 74 2HZ LYS 74 18.604 -0.766 2.311 621 H LYS 75 H LYS 75 18.472 -2.681 4.054 622 HA LYS 75 HA LYS 75 18.351 -2.867 6.838 623 HB2 LYS 75 2HB LYS 75 18.622 -5.396 5.606 624 HB3 LYS 75 3HB LYS 75 20.195 -5.001 6.286 625 HG2 LYS 75 2HG LYS 75 18.197 -4.353 8.204 626 HG3 LYS 75 3HG LYS 75 17.903 -5.989 7.608 627 HD2 LYS 75 2HD LYS 75 20.018 -6.736 8.287 628 HD3 LYS 75 3HD LYS 75 20.644 -5.093 8.446 629 HE2 LYS 75 2HE LYS 75 20.297 -5.610 10.648 630 HE3 LYS 75 3HE LYS 75 18.736 -4.897 10.247 631 HZ1 LYS 75 3HZ LYS 75 17.974 -6.793 11.151 632 HZ2 LYS 75 1HZ LYS 75 19.408 -7.648 10.879 633 HZ3 LYS 75 2HZ LYS 75 18.294 -7.445 9.623 634 H ALA 76 H ALA 76 20.826 -3.266 7.674 635 HA ALA 76 HA ALA 76 22.275 -1.074 6.557 636 HB1 ALA 76 1HB ALA 76 23.829 -1.392 8.309 637 HB2 ALA 76 2HB ALA 76 22.244 -1.764 8.987 638 HB3 ALA 76 3HB ALA 76 23.339 -3.071 8.538 Start of MODEL 3 1 H1 MET 1 H MET 1 0.473 0.601 -0.137 2 HA MET 1 HA MET 1 1.687 -0.603 -1.757 3 HB2 MET 1 2HB MET 1 2.684 2.232 -2.072 4 HB3 MET 1 3HB MET 1 2.529 1.022 -3.338 5 HG2 MET 1 2HG MET 1 0.138 1.070 -3.171 6 HG3 MET 1 3HG MET 1 0.218 2.137 -1.771 7 HE1 MET 1 3HE MET 1 0.107 1.484 -5.228 8 HE2 MET 1 1HE MET 1 -0.954 2.868 -5.496 9 HE3 MET 1 2HE MET 1 0.688 2.879 -6.139 10 H LYS 2 H LYS 2 3.230 -2.008 -1.142 11 HA LYS 2 HA LYS 2 5.927 -0.921 -0.666 12 HB2 LYS 2 2HB LYS 2 6.286 -2.972 0.786 13 HB3 LYS 2 3HB LYS 2 5.233 -1.728 1.448 14 HG2 LYS 2 2HG LYS 2 3.277 -3.043 0.700 15 HG3 LYS 2 3HG LYS 2 4.379 -4.315 0.165 16 HD2 LYS 2 2HD LYS 2 5.194 -3.831 2.750 17 HD3 LYS 2 3HD LYS 2 3.440 -3.653 2.846 18 HE2 LYS 2 2HE LYS 2 4.865 -6.017 1.630 19 HE3 LYS 2 3HE LYS 2 4.232 -5.967 3.275 20 HZ1 LYS 2 3HZ LYS 2 2.705 -7.054 1.731 21 HZ2 LYS 2 1HZ LYS 2 2.607 -5.638 0.811 22 HZ3 LYS 2 2HZ LYS 2 2.019 -5.658 2.396 23 H ARG 3 H ARG 3 4.714 -1.790 -3.158 24 HA ARG 3 HA ARG 3 6.683 -3.833 -3.863 25 HB2 ARG 3 2HB ARG 3 5.068 -5.125 -5.139 26 HB3 ARG 3 3HB ARG 3 4.564 -5.026 -3.457 27 HG2 ARG 3 2HG ARG 3 3.473 -2.922 -5.179 28 HG3 ARG 3 3HG ARG 3 2.957 -4.559 -5.588 29 HD2 ARG 3 2HD ARG 3 2.411 -4.845 -3.128 30 HD3 ARG 3 3HD ARG 3 2.634 -3.103 -2.977 31 HE ARG 3 HE ARG 3 0.388 -4.461 -4.116 32 HH11 ARG 3 1HH1 ARG 3 2.263 -1.529 -4.202 33 HH12 ARG 3 2HH1 ARG 3 0.960 -0.559 -4.805 34 HH21 ARG 3 1HH2 ARG 3 -1.335 -3.195 -4.910 35 HH22 ARG 3 2HH2 ARG 3 -1.087 -1.507 -5.206 36 H PHE 4 H PHE 4 6.956 -4.023 -6.245 37 HA PHE 4 HA PHE 4 6.216 -1.562 -7.670 38 HB2 PHE 4 2HB PHE 4 8.783 -2.098 -6.730 39 HB3 PHE 4 3HB PHE 4 8.847 -2.537 -8.434 40 HD1 PHE 4 HD2 PHE 4 7.165 0.189 -6.517 41 HD2 PHE 4 HD1 PHE 4 9.800 -0.876 -9.685 42 HE1 PHE 4 HE2 PHE 4 7.401 2.564 -7.114 43 HE2 PHE 4 HE1 PHE 4 10.041 1.498 -10.287 44 HZ PHE 4 HZ PHE 4 8.840 3.221 -9.002 45 H ASP 5 H ASP 5 5.135 -2.074 -9.443 46 HA ASP 5 HA ASP 5 5.427 -4.731 -10.607 47 HB2 ASP 5 2HB ASP 5 3.289 -2.847 -10.351 48 HB3 ASP 5 3HB ASP 5 3.550 -3.174 -12.062 49 H LEU 6 H LEU 6 7.258 -4.777 -11.817 50 HA LEU 6 HA LEU 6 7.769 -2.621 -13.719 51 HB2 LEU 6 2HB LEU 6 9.383 -4.974 -12.779 52 HB3 LEU 6 3HB LEU 6 9.877 -3.983 -14.149 53 HG LEU 6 HG LEU 6 11.101 -3.251 -12.245 54 HD11 LEU 6 1HD1 LEU 6 9.152 -1.085 -12.116 55 HD12 LEU 6 2HD1 LEU 6 9.545 -1.584 -13.760 56 HD13 LEU 6 3HD1 LEU 6 10.829 -1.075 -12.664 57 HD21 LEU 6 3HD2 LEU 6 8.569 -2.656 -10.754 58 HD22 LEU 6 1HD2 LEU 6 10.218 -2.776 -10.142 59 HD23 LEU 6 2HD2 LEU 6 9.353 -4.232 -10.634 60 H ARG 7 H ARG 7 5.817 -5.139 -13.763 61 HA ARG 7 HA ARG 7 6.421 -6.774 -15.892 62 HB2 ARG 7 2HB ARG 7 4.034 -6.002 -14.450 63 HB3 ARG 7 3HB ARG 7 3.683 -6.245 -16.155 64 HG2 ARG 7 2HG ARG 7 4.274 -8.480 -16.094 65 HG3 ARG 7 3HG ARG 7 5.250 -8.285 -14.637 66 HD2 ARG 7 2HD ARG 7 3.499 -9.041 -13.489 67 HD3 ARG 7 3HD ARG 7 2.698 -7.516 -13.865 68 HE ARG 7 HE ARG 7 2.424 -9.502 -15.924 69 HH11 ARG 7 1HH1 ARG 7 1.122 -8.274 -12.938 70 HH12 ARG 7 2HH1 ARG 7 -0.468 -8.899 -13.222 71 HH21 ARG 7 1HH2 ARG 7 0.335 -10.331 -16.310 72 HH22 ARG 7 2HH2 ARG 7 -0.915 -10.070 -15.140 73 HA PRO 8 HA PRO 8 4.386 -3.657 -18.963 74 HB2 PRO 8 2HB PRO 8 3.742 -1.196 -18.013 75 HB3 PRO 8 3HB PRO 8 2.626 -2.567 -17.967 76 HG2 PRO 8 2HG PRO 8 4.366 -1.467 -15.793 77 HG3 PRO 8 3HG PRO 8 2.681 -2.013 -15.709 78 HD2 PRO 8 2HD PRO 8 4.752 -3.548 -14.882 79 HD3 PRO 8 3HD PRO 8 3.275 -4.236 -15.587 80 H LEU 9 H LEU 9 6.792 -2.888 -16.671 81 HA LEU 9 HA LEU 9 7.955 -0.704 -18.161 82 HB2 LEU 9 2HB LEU 9 8.436 -2.056 -15.599 83 HB3 LEU 9 3HB LEU 9 9.888 -1.477 -16.413 84 HG LEU 9 HG LEU 9 8.140 0.680 -16.514 85 HD11 LEU 9 1HD1 LEU 9 8.145 0.116 -13.651 86 HD12 LEU 9 2HD1 LEU 9 7.093 -0.950 -14.582 87 HD13 LEU 9 3HD1 LEU 9 6.880 0.799 -14.674 88 HD21 LEU 9 3HD2 LEU 9 10.199 1.421 -16.053 89 HD22 LEU 9 1HD2 LEU 9 10.648 -0.069 -15.223 90 HD23 LEU 9 2HD2 LEU 9 9.758 1.186 -14.360 91 H LYS 10 H LYS 10 9.753 -0.762 -19.446 92 HA LYS 10 HA LYS 10 10.399 -3.300 -20.639 93 HB2 LYS 10 2HB LYS 10 11.634 -2.060 -22.247 94 HB3 LYS 10 3HB LYS 10 10.190 -1.119 -21.896 95 HG2 LYS 10 2HG LYS 10 11.509 0.298 -20.378 96 HG3 LYS 10 3HG LYS 10 12.954 -0.621 -20.808 97 HD2 LYS 10 2HD LYS 10 13.065 1.241 -22.202 98 HD3 LYS 10 3HD LYS 10 12.358 -0.001 -23.239 99 HE2 LYS 10 2HE LYS 10 10.103 0.902 -22.625 100 HE3 LYS 10 3HE LYS 10 10.925 2.232 -21.809 101 HZ1 LYS 10 3HZ LYS 10 11.116 3.269 -23.739 102 HZ2 LYS 10 1HZ LYS 10 10.281 2.017 -24.511 103 HZ3 LYS 10 2HZ LYS 10 11.968 1.967 -24.403 104 H ALA 11 H ALA 11 12.649 -4.012 -20.955 105 HA ALA 11 HA ALA 11 14.012 -4.190 -18.461 106 HB1 ALA 11 1HB ALA 11 14.853 -6.013 -19.401 107 HB2 ALA 11 2HB ALA 11 14.016 -5.597 -20.897 108 HB3 ALA 11 3HB ALA 11 15.669 -5.045 -20.628 109 H GLY 12 H GLY 12 16.002 -3.356 -17.844 110 HA2 GLY 12 2HA GLY 12 18.030 -2.141 -18.326 111 HA3 GLY 12 3HA GLY 12 17.167 -1.300 -19.605 112 H ILE 13 H ILE 13 14.849 -0.577 -18.225 113 HA ILE 13 HA ILE 13 15.948 1.480 -16.447 114 HB ILE 13 HB ILE 13 13.177 1.405 -17.633 115 HG12 ILE 13 2HG1 ILE 13 15.656 2.773 -18.703 116 HG13 ILE 13 3HG1 ILE 13 14.846 1.392 -19.437 117 HG21 ILE 13 1HG2 ILE 13 14.272 4.009 -17.148 118 HG22 ILE 13 2HG2 ILE 13 12.820 3.266 -16.480 119 HG23 ILE 13 3HG2 ILE 13 14.376 3.029 -15.685 120 HD11 ILE 13 3HD1 ILE 13 14.186 4.239 -19.533 121 HD12 ILE 13 1HD1 ILE 13 13.834 2.946 -20.680 122 HD13 ILE 13 2HD1 ILE 13 12.808 3.172 -19.262 123 H PHE 14 H PHE 14 13.745 -1.216 -16.541 124 HA PHE 14 HA PHE 14 12.250 -0.723 -14.234 125 HB2 PHE 14 2HB PHE 14 11.579 -2.968 -14.338 126 HB3 PHE 14 3HB PHE 14 11.966 -2.572 -16.009 127 HD1 PHE 14 HD1 PHE 14 14.659 -2.924 -16.449 128 HD2 PHE 14 HD2 PHE 14 12.214 -5.066 -13.702 129 HE1 PHE 14 HE1 PHE 14 16.227 -4.818 -16.535 130 HE2 PHE 14 HE2 PHE 14 13.778 -6.963 -13.783 131 HZ PHE 14 HZ PHE 14 15.789 -6.841 -15.200 132 H GLU 15 H GLU 15 15.529 -1.762 -14.634 133 HA GLU 15 HA GLU 15 15.794 -2.700 -11.908 134 HB2 GLU 15 2HB GLU 15 17.103 -3.835 -13.571 135 HB3 GLU 15 3HB GLU 15 17.788 -2.320 -14.142 136 HG2 GLU 15 2HG GLU 15 18.275 -2.753 -11.316 137 HG3 GLU 15 3HG GLU 15 18.920 -4.049 -12.322 138 H ARG 16 H ARG 16 16.265 0.227 -13.693 139 HA ARG 16 HA ARG 16 17.936 1.458 -11.678 140 HB2 ARG 16 2HB ARG 16 16.956 2.152 -14.367 141 HB3 ARG 16 3HB ARG 16 17.106 3.514 -13.266 142 HG2 ARG 16 2HG ARG 16 19.346 3.467 -13.309 143 HG3 ARG 16 3HG ARG 16 19.411 1.703 -13.293 144 HD2 ARG 16 2HD ARG 16 19.618 1.592 -15.514 145 HD3 ARG 16 3HD ARG 16 18.324 2.762 -15.772 146 HE ARG 16 HE ARG 16 21.108 3.268 -15.897 147 HH11 ARG 16 1HH1 ARG 16 18.097 4.689 -14.877 148 HH12 ARG 16 2HH1 ARG 16 18.643 6.319 -15.095 149 HH21 ARG 16 1HH2 ARG 16 21.837 5.409 -16.188 150 HH22 ARG 16 2HH2 ARG 16 20.770 6.727 -15.842 151 H LEU 17 H LEU 17 14.562 1.473 -12.647 152 HA LEU 17 HA LEU 17 13.786 3.657 -10.990 153 HB2 LEU 17 2HB LEU 17 12.582 1.994 -12.927 154 HB3 LEU 17 3HB LEU 17 11.619 1.851 -11.457 155 HG LEU 17 HG LEU 17 10.705 3.558 -12.913 156 HD11 LEU 17 1HD1 LEU 17 10.350 5.172 -11.299 157 HD12 LEU 17 2HD1 LEU 17 12.004 5.084 -10.696 158 HD13 LEU 17 3HD1 LEU 17 10.865 3.788 -10.334 159 HD21 LEU 17 3HD2 LEU 17 13.252 4.071 -13.669 160 HD22 LEU 17 1HD2 LEU 17 12.955 5.420 -12.572 161 HD23 LEU 17 2HD2 LEU 17 11.893 5.159 -13.956 162 H GLU 18 H GLU 18 14.258 0.263 -10.482 163 HA GLU 18 HA GLU 18 12.650 -0.166 -8.241 164 HB2 GLU 18 2HB GLU 18 14.485 -1.650 -9.691 165 HB3 GLU 18 3HB GLU 18 15.219 -1.539 -8.098 166 HG2 GLU 18 2HG GLU 18 13.886 -3.136 -7.365 167 HG3 GLU 18 3HG GLU 18 12.478 -2.146 -7.742 168 H GLU 19 H GLU 19 15.624 1.565 -8.592 169 HA GLU 19 HA GLU 19 16.252 1.561 -5.775 170 HB2 GLU 19 2HB GLU 19 18.108 1.673 -7.276 171 HB3 GLU 19 3HB GLU 19 17.408 3.035 -8.139 172 HG2 GLU 19 2HG GLU 19 17.797 3.559 -5.304 173 HG3 GLU 19 3HG GLU 19 19.292 3.177 -6.156 174 H LEU 20 H LEU 20 14.520 3.575 -8.020 175 HA LEU 20 HA LEU 20 14.495 5.966 -6.528 176 HB2 LEU 20 2HB LEU 20 13.234 4.916 -8.892 177 HB3 LEU 20 3HB LEU 20 12.069 5.813 -7.920 178 HG LEU 20 HG LEU 20 14.191 7.531 -7.975 179 HD11 LEU 20 1HD1 LEU 20 14.017 6.336 -10.732 180 HD12 LEU 20 2HD1 LEU 20 15.321 5.997 -9.595 181 HD13 LEU 20 3HD1 LEU 20 15.071 7.640 -10.185 182 HD21 LEU 20 3HD2 LEU 20 12.846 8.650 -9.836 183 HD22 LEU 20 1HD2 LEU 20 12.015 8.325 -8.315 184 HD23 LEU 20 2HD2 LEU 20 11.751 7.273 -9.706 185 H ILE 21 H ILE 21 12.579 3.048 -6.363 186 HA ILE 21 HA ILE 21 10.664 4.215 -4.524 187 HB ILE 21 HB ILE 21 9.879 2.553 -6.133 188 HG12 ILE 21 2HG1 ILE 21 8.656 1.108 -4.573 189 HG13 ILE 21 3HG1 ILE 21 9.791 1.515 -3.291 190 HG21 ILE 21 1HG2 ILE 21 11.894 1.227 -6.356 191 HG22 ILE 21 2HG2 ILE 21 11.732 0.660 -4.695 192 HG23 ILE 21 3HG2 ILE 21 10.538 0.193 -5.906 193 HD11 ILE 21 3HD1 ILE 21 8.176 3.617 -4.683 194 HD12 ILE 21 1HD1 ILE 21 7.540 2.704 -3.315 195 HD13 ILE 21 2HD1 ILE 21 8.986 3.697 -3.118 196 H GLU 22 H GLU 22 13.508 2.183 -4.432 197 HA GLU 22 HA GLU 22 13.269 1.082 -1.889 198 HB2 GLU 22 2HB GLU 22 15.310 1.349 -3.867 199 HB3 GLU 22 3HB GLU 22 15.997 1.766 -2.304 200 HG2 GLU 22 2HG GLU 22 16.357 -0.543 -2.608 201 HG3 GLU 22 3HG GLU 22 15.057 -0.389 -1.428 202 H LYS 23 H LYS 23 14.027 4.319 -2.872 203 HA LYS 23 HA LYS 23 15.266 5.216 -0.497 204 HB2 LYS 23 2HB LYS 23 14.164 6.417 -2.932 205 HB3 LYS 23 3HB LYS 23 14.005 7.443 -1.512 206 HG2 LYS 23 2HG LYS 23 16.563 6.703 -1.233 207 HG3 LYS 23 3HG LYS 23 16.416 6.604 -2.990 208 HD2 LYS 23 2HD LYS 23 17.118 8.804 -2.571 209 HD3 LYS 23 3HD LYS 23 15.382 8.936 -2.863 210 HE2 LYS 23 2HE LYS 23 15.456 8.532 -0.171 211 HE3 LYS 23 3HE LYS 23 16.938 9.451 -0.427 212 HZ1 LYS 23 3HZ LYS 23 15.714 11.210 -1.416 213 HZ2 LYS 23 1HZ LYS 23 14.928 10.818 0.030 214 HZ3 LYS 23 2HZ LYS 23 14.287 10.303 -1.447 215 H GLU 24 H GLU 24 11.910 4.920 -1.482 216 HA GLU 24 HA GLU 24 10.908 6.338 0.821 217 HB2 GLU 24 2HB GLU 24 9.873 5.592 -1.672 218 HB3 GLU 24 3HB GLU 24 8.947 4.668 -0.498 219 HG2 GLU 24 2HG GLU 24 9.173 7.327 0.461 220 HG3 GLU 24 3HG GLU 24 8.671 7.389 -1.228 221 H MET 25 H MET 25 11.122 2.964 -0.238 222 HA MET 25 HA MET 25 9.713 1.722 1.782 223 HB2 MET 25 2HB MET 25 12.243 0.762 0.435 224 HB3 MET 25 3HB MET 25 11.145 -0.251 1.362 225 HG2 MET 25 2HG MET 25 10.436 1.239 -1.155 226 HG3 MET 25 3HG MET 25 10.821 -0.478 -1.052 227 HE1 MET 25 3HE MET 25 9.842 -1.911 0.632 228 HE2 MET 25 1HE MET 25 8.560 -1.427 1.742 229 HE3 MET 25 2HE MET 25 8.160 -2.289 0.257 230 H GLN 26 H GLN 26 10.223 0.896 3.809 231 HA GLN 26 HA GLN 26 11.951 2.467 5.397 232 HB2 GLN 26 2HB GLN 26 10.065 0.288 5.799 233 HB3 GLN 26 3HB GLN 26 11.466 0.149 6.852 234 HG2 GLN 26 2HG GLN 26 10.478 1.581 8.216 235 HG3 GLN 26 3HG GLN 26 10.743 2.827 6.997 236 HE21 GLN 26 1HE2 GLN 26 8.888 3.949 7.491 237 HE22 GLN 26 2HE2 GLN 26 7.307 3.353 7.132 238 HA PRO 27 HA PRO 27 15.835 0.439 5.208 239 HB2 PRO 27 2HB PRO 27 16.662 0.498 7.793 240 HB3 PRO 27 3HB PRO 27 16.593 1.940 6.774 241 HG2 PRO 27 2HG PRO 27 14.642 0.979 8.831 242 HG3 PRO 27 3HG PRO 27 15.237 2.623 8.535 243 HD2 PRO 27 2HD PRO 27 12.825 1.766 7.652 244 HD3 PRO 27 3HD PRO 27 13.795 2.963 6.770 245 H ASN 28 H ASN 28 13.246 -0.959 6.855 246 HA ASN 28 HA ASN 28 14.572 -3.559 6.814 247 HB2 ASN 28 2HB ASN 28 14.434 -2.260 9.188 248 HB3 ASN 28 3HB ASN 28 12.887 -3.101 9.203 249 HD21 ASN 28 1HD2 ASN 28 16.253 -3.363 9.592 250 HD22 ASN 28 2HD2 ASN 28 16.325 -5.065 9.880 251 H GLU 29 H GLU 29 12.589 -2.348 5.125 252 HA GLU 29 HA GLU 29 10.202 -3.940 5.782 253 HB2 GLU 29 2HB GLU 29 10.571 -1.284 4.679 254 HB3 GLU 29 3HB GLU 29 9.578 -2.280 3.624 255 HG2 GLU 29 2HG GLU 29 9.001 -2.136 6.551 256 HG3 GLU 29 3HG GLU 29 8.451 -0.864 5.461 257 H VAL 30 H VAL 30 9.061 -4.910 3.914 258 HA VAL 30 HA VAL 30 11.006 -6.155 2.118 259 HB VAL 30 HB VAL 30 9.319 -7.483 3.540 260 HG11 VAL 30 1HG1 VAL 30 7.112 -7.668 2.852 261 HG12 VAL 30 2HG1 VAL 30 7.427 -5.941 2.675 262 HG13 VAL 30 3HG1 VAL 30 7.446 -6.991 1.258 263 HG21 VAL 30 3HG2 VAL 30 8.828 -8.925 1.331 264 HG22 VAL 30 1HG2 VAL 30 10.093 -7.862 0.715 265 HG23 VAL 30 2HG2 VAL 30 10.403 -8.877 2.123 266 H ALA 31 H ALA 31 10.821 -6.136 -0.101 267 HA ALA 31 HA ALA 31 8.715 -4.431 -1.249 268 HB1 ALA 31 1HB ALA 31 11.036 -3.334 -0.981 269 HB2 ALA 31 2HB ALA 31 11.505 -4.365 -2.334 270 HB3 ALA 31 3HB ALA 31 10.203 -3.192 -2.529 271 H ILE 32 H ILE 32 7.555 -5.595 -2.624 272 HA ILE 32 HA ILE 32 8.747 -7.929 -3.914 273 HB ILE 32 HB ILE 32 5.872 -7.013 -3.786 274 HG12 ILE 32 2HG1 ILE 32 6.405 -9.575 -2.602 275 HG13 ILE 32 3HG1 ILE 32 7.500 -8.380 -1.917 276 HG21 ILE 32 1HG2 ILE 32 5.722 -9.587 -4.536 277 HG22 ILE 32 2HG2 ILE 32 5.733 -8.242 -5.675 278 HG23 ILE 32 3HG2 ILE 32 7.222 -9.125 -5.340 279 HD11 ILE 32 3HD1 ILE 32 4.862 -7.292 -2.045 280 HD12 ILE 32 1HD1 ILE 32 4.825 -8.860 -1.239 281 HD13 ILE 32 2HD1 ILE 32 5.885 -7.584 -0.639 282 H PHE 33 H PHE 33 9.758 -7.510 -5.769 283 HA PHE 33 HA PHE 33 8.605 -5.524 -7.600 284 HB2 PHE 33 2HB PHE 33 11.354 -6.772 -7.725 285 HB3 PHE 33 3HB PHE 33 10.776 -5.381 -8.635 286 HD1 PHE 33 HD2 PHE 33 9.348 -3.978 -6.378 287 HD2 PHE 33 HD1 PHE 33 13.184 -5.809 -6.612 288 HE1 PHE 33 HE2 PHE 33 10.168 -2.480 -4.607 289 HE2 PHE 33 HE1 PHE 33 14.009 -4.315 -4.841 290 HZ PHE 33 HZ PHE 33 12.502 -2.646 -3.837 291 H MET 34 H MET 34 7.287 -6.375 -9.067 292 HA MET 34 HA MET 34 7.572 -9.124 -9.922 293 HB2 MET 34 2HB MET 34 5.403 -7.543 -9.571 294 HB3 MET 34 3HB MET 34 5.641 -7.362 -11.304 295 HG2 MET 34 2HG MET 34 5.316 -9.640 -11.705 296 HG3 MET 34 3HG MET 34 5.551 -10.061 -10.010 297 HE1 MET 34 3HE MET 34 2.791 -9.569 -8.131 298 HE2 MET 34 1HE MET 34 4.300 -8.674 -8.310 299 HE3 MET 34 2HE MET 34 2.758 -7.861 -8.573 300 H PHE 35 H PHE 35 8.543 -9.808 -11.721 301 HA PHE 35 HA PHE 35 9.151 -7.842 -13.824 302 HB2 PHE 35 2HB PHE 35 11.355 -8.799 -14.124 303 HB3 PHE 35 3HB PHE 35 11.164 -8.315 -12.442 304 HD1 PHE 35 HD1 PHE 35 10.451 -10.152 -10.782 305 HD2 PHE 35 HD2 PHE 35 12.060 -10.939 -14.643 306 HE1 PHE 35 HE1 PHE 35 11.071 -12.420 -10.058 307 HE2 PHE 35 HE2 PHE 35 12.682 -13.208 -13.925 308 HZ PHE 35 HZ PHE 35 12.187 -13.952 -11.630 309 H GLU 36 H GLU 36 8.492 -8.435 -15.782 310 HA GLU 36 HA GLU 36 7.685 -11.229 -16.188 311 HB2 GLU 36 2HB GLU 36 6.243 -10.429 -17.949 312 HB3 GLU 36 3HB GLU 36 5.963 -9.468 -16.504 313 HG2 GLU 36 2HG GLU 36 6.146 -7.715 -17.861 314 HG3 GLU 36 3HG GLU 36 7.881 -8.011 -17.774 315 H VAL 37 H VAL 37 10.085 -9.000 -17.020 316 HA VAL 37 HA VAL 37 10.686 -10.032 -19.636 317 HB VAL 37 HB VAL 37 12.549 -8.429 -17.894 318 HG11 VAL 37 1HG1 VAL 37 13.849 -8.786 -19.683 319 HG12 VAL 37 2HG1 VAL 37 12.492 -9.302 -20.686 320 HG13 VAL 37 3HG1 VAL 37 12.832 -7.584 -20.475 321 HG21 VAL 37 3HG2 VAL 37 11.408 -6.572 -19.492 322 HG22 VAL 37 1HG2 VAL 37 10.031 -7.631 -19.191 323 HG23 VAL 37 2HG2 VAL 37 10.893 -6.900 -17.838 324 H GLY 38 H GLY 38 12.603 -11.186 -20.215 325 HA2 GLY 38 2HA GLY 38 13.156 -13.381 -18.498 326 HA3 GLY 38 3HA GLY 38 13.971 -13.024 -20.013 327 H ASP 39 H ASP 39 14.393 -10.250 -18.530 328 HA ASP 39 HA ASP 39 17.096 -10.773 -17.831 329 HB2 ASP 39 2HB ASP 39 15.297 -8.376 -17.585 330 HB3 ASP 39 3HB ASP 39 16.913 -8.366 -16.883 331 H PHE 40 H PHE 40 16.972 -12.402 -16.229 332 HA PHE 40 HA PHE 40 15.702 -11.755 -13.697 333 HB2 PHE 40 2HB PHE 40 16.300 -14.012 -13.027 334 HB3 PHE 40 3HB PHE 40 15.562 -14.050 -14.626 335 HD1 PHE 40 HD1 PHE 40 16.887 -14.560 -16.596 336 HD2 PHE 40 HD2 PHE 40 18.619 -14.558 -12.708 337 HE1 PHE 40 HE1 PHE 40 18.840 -15.776 -17.469 338 HE2 PHE 40 HE2 PHE 40 20.575 -15.773 -13.575 339 HZ PHE 40 HZ PHE 40 20.688 -16.383 -15.958 340 H SER 41 H SER 41 18.884 -11.889 -15.117 341 HA SER 41 HA SER 41 20.360 -11.822 -12.690 342 HB2 SER 41 2HB SER 41 22.179 -11.915 -14.034 343 HB3 SER 41 3HB SER 41 21.008 -12.202 -15.321 344 HG SER 41 HG SER 41 21.007 -9.933 -15.694 345 H ASN 42 H ASN 42 18.547 -9.484 -14.367 346 HA ASN 42 HA ASN 42 20.021 -7.199 -13.377 347 HB2 ASN 42 2HB ASN 42 17.782 -7.664 -15.228 348 HB3 ASN 42 3HB ASN 42 17.630 -6.198 -14.264 349 HD21 ASN 42 1HD2 ASN 42 20.020 -5.167 -14.057 350 HD22 ASN 42 2HD2 ASN 42 20.734 -4.847 -15.598 351 H ILE 43 H ILE 43 17.324 -9.150 -12.414 352 HA ILE 43 HA ILE 43 15.888 -7.464 -10.769 353 HB ILE 43 HB ILE 43 16.420 -10.390 -10.743 354 HG12 ILE 43 2HG1 ILE 43 14.646 -9.348 -12.136 355 HG13 ILE 43 3HG1 ILE 43 14.006 -10.506 -10.975 356 HG21 ILE 43 1HG2 ILE 43 15.366 -8.831 -8.412 357 HG22 ILE 43 2HG2 ILE 43 14.848 -10.490 -8.707 358 HG23 ILE 43 3HG2 ILE 43 16.553 -10.134 -8.434 359 HD11 ILE 43 3HD1 ILE 43 14.009 -7.950 -9.754 360 HD12 ILE 43 1HD1 ILE 43 13.284 -7.801 -11.354 361 HD13 ILE 43 2HD1 ILE 43 12.635 -8.963 -10.197 362 HA PRO 44 HA PRO 44 18.863 -8.517 -7.105 363 HB2 PRO 44 2HB PRO 44 21.204 -9.745 -7.724 364 HB3 PRO 44 3HB PRO 44 19.726 -10.633 -7.337 365 HG2 PRO 44 2HG PRO 44 20.910 -9.999 -10.013 366 HG3 PRO 44 3HG PRO 44 20.192 -11.515 -9.438 367 HD2 PRO 44 2HD PRO 44 18.845 -9.767 -11.008 368 HD3 PRO 44 3HD PRO 44 18.038 -10.773 -9.788 369 H LYS 45 H LYS 45 19.935 -7.411 -10.193 370 HA LYS 45 HA LYS 45 22.251 -5.999 -9.291 371 HB2 LYS 45 2HB LYS 45 21.384 -6.761 -11.729 372 HB3 LYS 45 3HB LYS 45 20.858 -5.083 -11.740 373 HG2 LYS 45 2HG LYS 45 23.487 -5.055 -10.771 374 HG3 LYS 45 3HG LYS 45 23.478 -6.171 -12.138 375 HD2 LYS 45 2HD LYS 45 22.154 -4.308 -13.348 376 HD3 LYS 45 3HD LYS 45 22.772 -3.259 -12.069 377 HE2 LYS 45 2HE LYS 45 25.076 -4.196 -12.680 378 HE3 LYS 45 3HE LYS 45 24.304 -4.792 -14.148 379 HZ1 LYS 45 3HZ LYS 45 24.463 -2.787 -15.038 380 HZ2 LYS 45 1HZ LYS 45 25.298 -2.245 -13.669 381 HZ3 LYS 45 2HZ LYS 45 23.616 -2.089 -13.751 382 H SER 46 H SER 46 18.853 -5.296 -9.516 383 HA SER 46 HA SER 46 19.035 -2.470 -9.369 384 HB2 SER 46 2HB SER 46 16.649 -3.718 -8.167 385 HB3 SER 46 3HB SER 46 16.769 -2.514 -9.450 386 HG SER 46 HG SER 46 15.962 -4.614 -10.115 387 H ALA 47 H ALA 47 18.219 -4.889 -6.878 388 HA ALA 47 HA ALA 47 18.141 -3.130 -4.710 389 HB1 ALA 47 1HB ALA 47 17.455 -5.638 -4.918 390 HB2 ALA 47 2HB ALA 47 19.097 -5.933 -4.346 391 HB3 ALA 47 3HB ALA 47 17.977 -4.989 -3.363 392 H GLU 48 H GLU 48 20.823 -4.481 -6.424 393 HA GLU 48 HA GLU 48 22.762 -4.065 -4.352 394 HB2 GLU 48 2HB GLU 48 22.943 -5.726 -6.268 395 HB3 GLU 48 3HB GLU 48 23.315 -4.354 -7.303 396 HG2 GLU 48 2HG GLU 48 24.998 -4.204 -5.031 397 HG3 GLU 48 3HG GLU 48 25.056 -5.855 -5.645 398 H PHE 49 H PHE 49 21.394 -2.166 -6.914 399 HA PHE 49 HA PHE 49 23.375 -0.237 -7.264 400 HB2 PHE 49 2HB PHE 49 20.813 -0.644 -8.221 401 HB3 PHE 49 3HB PHE 49 20.666 0.859 -7.316 402 HD1 PHE 49 HD2 PHE 49 22.220 2.761 -7.877 403 HD2 PHE 49 HD1 PHE 49 21.817 -0.692 -10.332 404 HE1 PHE 49 HE2 PHE 49 23.197 3.996 -9.767 405 HE2 PHE 49 HE1 PHE 49 22.795 0.537 -12.226 406 HZ PHE 49 HZ PHE 49 23.486 2.884 -11.946 407 H ILE 50 H ILE 50 21.235 -0.789 -4.620 408 HA ILE 50 HA ILE 50 21.417 1.852 -3.507 409 HB ILE 50 HB ILE 50 20.568 -0.713 -2.158 410 HG12 ILE 50 2HG1 ILE 50 19.220 -0.167 -4.168 411 HG13 ILE 50 3HG1 ILE 50 18.287 -0.055 -2.679 412 HG21 ILE 50 1HG2 ILE 50 19.247 1.062 -0.784 413 HG22 ILE 50 2HG2 ILE 50 20.943 0.753 -0.418 414 HG23 ILE 50 3HG2 ILE 50 20.490 2.166 -1.370 415 HD11 ILE 50 3HD1 ILE 50 17.830 1.767 -4.276 416 HD12 ILE 50 1HD1 ILE 50 18.423 2.340 -2.717 417 HD13 ILE 50 2HD1 ILE 50 19.505 2.293 -4.110 418 H GLN 51 H GLN 51 22.434 -1.241 -2.061 419 HA GLN 51 HA GLN 51 25.041 -0.103 -1.431 420 HB2 GLN 51 2HB GLN 51 23.221 0.252 0.448 421 HB3 GLN 51 3HB GLN 51 23.580 -1.430 0.811 422 HG2 GLN 51 2HG GLN 51 25.466 -0.891 1.840 423 HG3 GLN 51 3HG GLN 51 25.999 0.105 0.487 424 HE21 GLN 51 1HE2 GLN 51 25.776 2.284 0.587 425 HE22 GLN 51 2HE2 GLN 51 25.189 3.129 1.974 426 H SER 52 H SER 52 26.626 -1.572 -1.567 427 HA SER 52 HA SER 52 26.244 -4.084 -2.656 428 HB2 SER 52 2HB SER 52 28.592 -4.559 -1.904 429 HB3 SER 52 3HB SER 52 28.409 -3.028 -2.759 430 HG SER 52 HG SER 52 29.656 -3.061 -0.696 431 H LYS 53 H LYS 53 26.224 -3.090 0.689 432 HA LYS 53 HA LYS 53 25.596 -5.864 1.459 433 HB2 LYS 53 2HB LYS 53 27.269 -3.809 2.887 434 HB3 LYS 53 3HB LYS 53 26.537 -5.157 3.747 435 HG2 LYS 53 2HG LYS 53 28.494 -6.158 3.292 436 HG3 LYS 53 3HG LYS 53 27.732 -6.481 1.732 437 HD2 LYS 53 2HD LYS 53 29.120 -5.097 0.641 438 HD3 LYS 53 3HD LYS 53 29.019 -3.860 1.896 439 HE2 LYS 53 2HE LYS 53 30.495 -5.530 3.256 440 HE3 LYS 53 3HE LYS 53 30.878 -6.189 1.667 441 HZ1 LYS 53 3HZ LYS 53 31.438 -3.810 1.044 442 HZ2 LYS 53 1HZ LYS 53 32.518 -4.602 2.078 443 HZ3 LYS 53 2HZ LYS 53 31.422 -3.475 2.702 444 H GLY 54 H GLY 54 23.488 -5.964 1.882 445 HA2 GLY 54 2HA GLY 54 22.147 -4.973 3.973 446 HA3 GLY 54 3HA GLY 54 22.061 -3.624 2.850 447 H HIS 55 H HIS 55 21.691 -4.856 0.446 448 HA HIS 55 HA HIS 55 18.931 -5.571 0.596 449 HB2 HIS 55 2HB HIS 55 19.017 -5.701 -1.819 450 HB3 HIS 55 3HB HIS 55 19.919 -4.284 -1.291 451 HD1 HIS 55 HD1 HIS 55 22.628 -4.712 -1.164 452 HD2 HIS 55 HD2 HIS 55 20.390 -7.302 -3.519 453 HE1 HIS 55 HE1 HIS 55 24.279 -5.810 -2.712 454 H GLU 56 H GLU 56 18.162 -7.513 1.064 455 HA GLU 56 HA GLU 56 19.647 -9.881 0.149 456 HB2 GLU 56 2HB GLU 56 19.452 -9.117 2.800 457 HB3 GLU 56 3HB GLU 56 18.166 -10.304 2.630 458 HG2 GLU 56 2HG GLU 56 20.732 -11.084 1.442 459 HG3 GLU 56 3HG GLU 56 20.743 -10.894 3.195 460 H LEU 57 H LEU 57 18.438 -11.080 -1.147 461 HA LEU 57 HA LEU 57 15.585 -10.672 -1.301 462 HB2 LEU 57 2HB LEU 57 17.462 -12.477 -2.814 463 HB3 LEU 57 3HB LEU 57 15.732 -12.365 -3.134 464 HG LEU 57 HG LEU 57 16.770 -11.047 -4.779 465 HD11 LEU 57 1HD1 LEU 57 16.257 -8.776 -2.994 466 HD12 LEU 57 2HD1 LEU 57 14.965 -9.973 -3.066 467 HD13 LEU 57 3HD1 LEU 57 15.528 -9.194 -4.544 468 HD21 LEU 57 3HD2 LEU 57 18.610 -9.705 -4.521 469 HD22 LEU 57 1HD2 LEU 57 18.929 -10.928 -3.290 470 HD23 LEU 57 2HD2 LEU 57 18.261 -9.363 -2.825 471 H LEU 58 H LEU 58 14.492 -11.544 0.374 472 HA LEU 58 HA LEU 58 15.108 -13.792 1.848 473 HB2 LEU 58 2HB LEU 58 12.860 -12.053 1.519 474 HB3 LEU 58 3HB LEU 58 12.297 -13.719 1.637 475 HG LEU 58 HG LEU 58 14.261 -13.061 3.680 476 HD11 LEU 58 1HD1 LEU 58 12.881 -10.873 3.166 477 HD12 LEU 58 2HD1 LEU 58 13.239 -11.370 4.819 478 HD13 LEU 58 3HD1 LEU 58 11.654 -11.705 4.122 479 HD21 LEU 58 3HD2 LEU 58 12.908 -15.056 3.763 480 HD22 LEU 58 1HD2 LEU 58 11.429 -14.096 3.716 481 HD23 LEU 58 2HD2 LEU 58 12.490 -14.011 5.122 482 H ASN 59 H ASN 59 13.198 -13.567 -1.125 483 HA ASN 59 HA ASN 59 13.424 -16.493 -1.385 484 HB2 ASN 59 2HB ASN 59 11.072 -15.410 -0.923 485 HB3 ASN 59 3HB ASN 59 11.144 -15.009 -2.637 486 HD21 ASN 59 1HD2 ASN 59 10.334 -17.336 -0.381 487 HD22 ASN 59 2HD2 ASN 59 10.142 -18.680 -1.449 488 H SER 60 H SER 60 15.059 -16.679 -2.814 489 HA SER 60 HA SER 60 15.876 -14.982 -4.786 490 HB2 SER 60 2HB SER 60 17.283 -16.652 -5.371 491 HB3 SER 60 3HB SER 60 16.576 -17.519 -4.008 492 HG SER 60 HG SER 60 16.593 -18.392 -6.379 493 H LEU 61 H LEU 61 15.045 -14.216 -6.610 494 HA LEU 61 HA LEU 61 12.473 -14.623 -7.482 495 HB2 LEU 61 2HB LEU 61 13.203 -13.660 -9.639 496 HB3 LEU 61 3HB LEU 61 13.746 -12.744 -8.235 497 HG LEU 61 HG LEU 61 15.654 -14.726 -9.314 498 HD11 LEU 61 1HD1 LEU 61 15.104 -14.005 -11.429 499 HD12 LEU 61 2HD1 LEU 61 16.351 -12.844 -10.975 500 HD13 LEU 61 3HD1 LEU 61 14.650 -12.391 -10.879 501 HD21 LEU 61 3HD2 LEU 61 16.917 -13.538 -7.926 502 HD22 LEU 61 1HD2 LEU 61 15.635 -12.348 -7.700 503 HD23 LEU 61 2HD2 LEU 61 16.773 -12.174 -9.037 504 H ARG 62 H ARG 62 11.423 -16.074 -8.711 505 HA ARG 62 HA ARG 62 12.964 -18.372 -9.684 506 HB2 ARG 62 2HB ARG 62 10.768 -18.357 -8.120 507 HB3 ARG 62 3HB ARG 62 10.003 -18.446 -9.701 508 HG2 ARG 62 2HG ARG 62 10.685 -20.561 -10.063 509 HG3 ARG 62 3HG ARG 62 12.234 -20.313 -9.254 510 HD2 ARG 62 2HD ARG 62 11.455 -21.284 -7.417 511 HD3 ARG 62 3HD ARG 62 10.151 -20.101 -7.323 512 HE ARG 62 HE ARG 62 9.521 -22.082 -9.231 513 HH11 ARG 62 1HH1 ARG 62 9.787 -21.600 -5.794 514 HH12 ARG 62 2HH1 ARG 62 8.615 -22.814 -5.401 515 HH21 ARG 62 1HH2 ARG 62 7.976 -23.683 -8.727 516 HH22 ARG 62 2HH2 ARG 62 7.586 -23.998 -7.071 517 H PHE 63 H PHE 63 13.656 -16.989 -11.519 518 HA PHE 63 HA PHE 63 11.701 -16.233 -13.481 519 HB2 PHE 63 2HB PHE 63 13.455 -15.283 -14.665 520 HB3 PHE 63 3HB PHE 63 14.064 -15.212 -13.015 521 HD1 PHE 63 HD2 PHE 63 15.830 -16.726 -12.275 522 HD2 PHE 63 HD1 PHE 63 14.449 -16.719 -16.302 523 HE1 PHE 63 HE2 PHE 63 17.832 -17.981 -12.961 524 HE2 PHE 63 HE1 PHE 63 16.449 -17.975 -16.993 525 HZ PHE 63 HZ PHE 63 18.144 -18.606 -15.322 526 H ASN 64 H ASN 64 10.785 -17.534 -14.912 527 HA ASN 64 HA ASN 64 12.105 -19.364 -16.539 528 HB2 ASN 64 2HB ASN 64 11.317 -20.425 -13.920 529 HB3 ASN 64 3HB ASN 64 10.701 -21.365 -15.276 530 HD21 ASN 64 1HD2 ASN 64 12.869 -21.744 -13.185 531 HD22 ASN 64 2HD2 ASN 64 14.243 -22.250 -14.103 532 H GLN 65 H GLN 65 9.103 -18.608 -14.855 533 HA GLN 65 HA GLN 65 7.642 -19.182 -17.348 534 HB2 GLN 65 2HB GLN 65 7.226 -20.402 -14.942 535 HB3 GLN 65 3HB GLN 65 6.070 -19.079 -14.863 536 HG2 GLN 65 2HG GLN 65 4.723 -19.994 -16.394 537 HG3 GLN 65 3HG GLN 65 6.065 -20.537 -17.400 538 HE21 GLN 65 1HE2 GLN 65 3.697 -21.427 -15.154 539 HE22 GLN 65 2HE2 GLN 65 4.179 -23.071 -14.929 540 H ALA 66 H ALA 66 5.202 -18.014 -16.304 541 HA ALA 66 HA ALA 66 5.298 -15.475 -17.312 542 HB1 ALA 66 1HB ALA 66 3.186 -15.104 -16.387 543 HB2 ALA 66 2HB ALA 66 3.274 -16.857 -16.566 544 HB3 ALA 66 3HB ALA 66 3.520 -16.118 -14.983 545 H ASP 67 H ASP 67 4.995 -13.378 -16.145 546 HA ASP 67 HA ASP 67 7.192 -12.548 -14.804 547 HB2 ASP 67 2HB ASP 67 5.998 -10.602 -14.142 548 HB3 ASP 67 3HB ASP 67 5.267 -11.130 -15.655 549 H TRP 68 H TRP 68 8.077 -12.809 -12.857 550 HA TRP 68 HA TRP 68 6.482 -14.168 -10.794 551 HB2 TRP 68 2HB TRP 68 8.916 -14.876 -11.844 552 HB3 TRP 68 3HB TRP 68 9.385 -14.016 -10.380 553 HD1 TRP 68 HD1 TRP 68 9.495 -15.474 -8.285 554 HE1 TRP 68 HE1 TRP 68 8.499 -17.730 -7.549 555 HE3 TRP 68 HE3 TRP 68 6.552 -16.427 -12.355 556 HZ2 TRP 68 HZ2 TRP 68 6.703 -19.659 -8.561 557 HZ3 TRP 68 HZ3 TRP 68 5.227 -18.500 -12.393 558 HH2 TRP 68 HH2 TRP 68 5.303 -20.082 -10.535 559 H THR 69 H THR 69 7.744 -13.683 -8.524 560 HA THR 69 HA THR 69 7.930 -10.755 -8.279 561 HB THR 69 HB THR 69 6.848 -11.127 -5.957 562 HG1 THR 69 HG1 THR 69 5.218 -12.947 -6.301 563 HG21 THR 69 3HG2 THR 69 5.089 -11.457 -8.386 564 HG22 THR 69 1HG2 THR 69 5.827 -9.930 -7.902 565 HG23 THR 69 2HG2 THR 69 4.656 -10.718 -6.845 566 H ILE 70 H ILE 70 9.484 -9.986 -6.928 567 HA ILE 70 HA ILE 70 11.071 -11.972 -5.437 568 HB ILE 70 HB ILE 70 12.369 -11.321 -7.354 569 HG12 ILE 70 2HG1 ILE 70 14.341 -10.363 -6.255 570 HG13 ILE 70 3HG1 ILE 70 13.343 -9.827 -4.908 571 HG21 ILE 70 1HG2 ILE 70 12.864 -8.569 -6.931 572 HG22 ILE 70 2HG2 ILE 70 12.092 -9.342 -8.314 573 HG23 ILE 70 3HG2 ILE 70 11.116 -8.798 -6.950 574 HD11 ILE 70 3HD1 ILE 70 13.012 -12.647 -5.362 575 HD12 ILE 70 1HD1 ILE 70 14.713 -12.233 -5.143 576 HD13 ILE 70 2HD1 ILE 70 13.531 -11.791 -3.910 577 H VAL 71 H VAL 71 11.131 -11.594 -3.331 578 HA VAL 71 HA VAL 71 10.296 -8.998 -2.306 579 HB VAL 71 HB VAL 71 10.372 -10.136 -0.078 580 HG11 VAL 71 1HG1 VAL 71 8.496 -11.849 -0.796 581 HG12 VAL 71 2HG1 VAL 71 8.231 -10.106 -0.883 582 HG13 VAL 71 3HG1 VAL 71 8.648 -11.010 -2.339 583 HG21 VAL 71 3HG2 VAL 71 11.368 -12.105 0.189 584 HG22 VAL 71 1HG2 VAL 71 10.355 -12.831 -1.059 585 HG23 VAL 71 2HG2 VAL 71 11.870 -12.042 -1.500 586 H VAL 72 H VAL 72 11.651 -7.512 -1.544 587 HA VAL 72 HA VAL 72 14.423 -8.323 -0.945 588 HB VAL 72 HB VAL 72 13.672 -5.561 -1.863 589 HG11 VAL 72 1HG1 VAL 72 15.912 -5.181 -2.053 590 HG12 VAL 72 2HG1 VAL 72 15.937 -6.374 -0.753 591 HG13 VAL 72 3HG1 VAL 72 16.281 -6.867 -2.411 592 HG21 VAL 72 3HG2 VAL 72 13.096 -6.445 -3.840 593 HG22 VAL 72 1HG2 VAL 72 14.824 -6.725 -4.053 594 HG23 VAL 72 2HG2 VAL 72 13.790 -8.018 -3.445 595 H ARG 73 H ARG 73 15.101 -7.946 1.058 596 HA ARG 73 HA ARG 73 13.465 -6.225 2.784 597 HB2 ARG 73 2HB ARG 73 14.635 -7.397 4.654 598 HB3 ARG 73 3HB ARG 73 13.681 -8.461 3.630 599 HG2 ARG 73 2HG ARG 73 15.452 -9.708 3.177 600 HG3 ARG 73 3HG ARG 73 16.371 -8.298 2.647 601 HD2 ARG 73 2HD ARG 73 17.471 -9.463 4.504 602 HD3 ARG 73 3HD ARG 73 17.005 -7.819 4.940 603 HE ARG 73 HE ARG 73 15.544 -8.672 6.491 604 HH11 ARG 73 1HH1 ARG 73 16.618 -11.222 4.378 605 HH12 ARG 73 2HH1 ARG 73 15.915 -12.486 5.331 606 HH21 ARG 73 1HH2 ARG 73 14.614 -10.328 7.755 607 HH22 ARG 73 2HH2 ARG 73 14.774 -11.976 7.252 608 H LYS 74 H LYS 74 14.193 -4.213 2.957 609 HA LYS 74 HA LYS 74 16.797 -3.370 2.321 610 HB2 LYS 74 2HB LYS 74 14.400 -2.144 3.566 611 HB3 LYS 74 3HB LYS 74 15.936 -1.343 3.869 612 HG2 LYS 74 2HG LYS 74 15.389 -2.071 1.065 613 HG3 LYS 74 3HG LYS 74 14.368 -0.810 1.761 614 HD2 LYS 74 2HD LYS 74 17.381 -0.786 1.875 615 HD3 LYS 74 3HD LYS 74 16.439 0.022 0.620 616 HE2 LYS 74 2HE LYS 74 16.038 1.758 1.952 617 HE3 LYS 74 3HE LYS 74 15.440 0.703 3.232 618 HZ1 LYS 74 3HZ LYS 74 18.337 0.978 2.787 619 HZ2 LYS 74 1HZ LYS 74 17.509 0.561 4.201 620 HZ3 LYS 74 2HZ LYS 74 17.504 2.163 3.660 621 H LYS 75 H LYS 75 18.404 -2.429 3.732 622 HA LYS 75 HA LYS 75 18.414 -2.679 6.519 623 HB2 LYS 75 2HB LYS 75 18.763 -5.154 5.239 624 HB3 LYS 75 3HB LYS 75 20.368 -4.673 5.776 625 HG2 LYS 75 2HG LYS 75 18.289 -4.291 7.792 626 HG3 LYS 75 3HG LYS 75 18.511 -5.970 7.295 627 HD2 LYS 75 2HD LYS 75 21.068 -4.727 7.647 628 HD3 LYS 75 3HD LYS 75 20.082 -4.468 9.089 629 HE2 LYS 75 2HE LYS 75 21.148 -6.497 9.507 630 HE3 LYS 75 3HE LYS 75 19.555 -6.978 8.925 631 HZ1 LYS 75 3HZ LYS 75 20.771 -7.012 6.641 632 HZ2 LYS 75 1HZ LYS 75 20.913 -8.326 7.697 633 HZ3 LYS 75 2HZ LYS 75 22.160 -7.188 7.590 634 H ALA 76 H ALA 76 20.873 -2.791 7.307 635 HA ALA 76 HA ALA 76 22.590 -1.356 5.418 636 HB1 ALA 76 1HB ALA 76 22.916 -0.126 7.960 637 HB2 ALA 76 2HB ALA 76 22.392 0.601 6.440 638 HB3 ALA 76 3HB ALA 76 21.203 -0.096 7.541 Start of MODEL 4 1 H1 MET 1 H MET 1 0.686 -3.704 -0.909 2 HA MET 1 HA MET 1 1.383 -1.206 -2.299 3 HB2 MET 1 2HB MET 1 0.146 -1.363 0.198 4 HB3 MET 1 3HB MET 1 1.839 -1.059 0.563 5 HG2 MET 1 2HG MET 1 1.508 1.082 0.147 6 HG3 MET 1 3HG MET 1 1.166 0.677 -1.534 7 HE1 MET 1 3HE MET 1 -0.837 1.605 -2.599 8 HE2 MET 1 1HE MET 1 -2.025 2.542 -1.692 9 HE3 MET 1 2HE MET 1 -0.314 2.957 -1.594 10 H LYS 2 H LYS 2 3.481 -0.384 -0.774 11 HA LYS 2 HA LYS 2 5.765 -0.651 -0.860 12 HB2 LYS 2 2HB LYS 2 6.554 -2.327 0.743 13 HB3 LYS 2 3HB LYS 2 5.169 -1.448 1.375 14 HG2 LYS 2 2HG LYS 2 3.709 -3.307 0.853 15 HG3 LYS 2 3HG LYS 2 5.057 -4.185 0.125 16 HD2 LYS 2 2HD LYS 2 6.208 -4.155 2.315 17 HD3 LYS 2 3HD LYS 2 4.791 -3.372 3.019 18 HE2 LYS 2 2HE LYS 2 4.780 -5.778 3.442 19 HE3 LYS 2 3HE LYS 2 3.420 -5.300 2.427 20 HZ1 LYS 2 3HZ LYS 2 5.576 -5.950 0.764 21 HZ2 LYS 2 1HZ LYS 2 4.090 -6.746 0.913 22 HZ3 LYS 2 2HZ LYS 2 5.395 -7.203 1.886 23 H ARG 3 H ARG 3 4.674 -1.579 -3.231 24 HA ARG 3 HA ARG 3 6.601 -3.669 -3.914 25 HB2 ARG 3 2HB ARG 3 5.020 -5.017 -5.078 26 HB3 ARG 3 3HB ARG 3 4.354 -4.722 -3.478 27 HG2 ARG 3 2HG ARG 3 3.435 -2.663 -5.198 28 HG3 ARG 3 3HG ARG 3 3.183 -4.212 -6.005 29 HD2 ARG 3 2HD ARG 3 2.369 -4.771 -3.465 30 HD3 ARG 3 3HD ARG 3 1.887 -3.083 -3.629 31 HE ARG 3 HE ARG 3 0.945 -4.176 -5.898 32 HH11 ARG 3 1HH1 ARG 3 0.681 -5.113 -2.555 33 HH12 ARG 3 2HH1 ARG 3 -0.871 -5.858 -2.752 34 HH21 ARG 3 1HH2 ARG 3 -1.097 -5.155 -6.169 35 HH22 ARG 3 2HH2 ARG 3 -1.881 -5.883 -4.808 36 H PHE 4 H PHE 4 6.883 -3.878 -6.291 37 HA PHE 4 HA PHE 4 6.177 -1.428 -7.748 38 HB2 PHE 4 2HB PHE 4 8.726 -1.938 -6.759 39 HB3 PHE 4 3HB PHE 4 8.824 -2.415 -8.451 40 HD1 PHE 4 HD2 PHE 4 7.100 0.350 -6.629 41 HD2 PHE 4 HD1 PHE 4 9.797 -0.780 -9.721 42 HE1 PHE 4 HE2 PHE 4 7.342 2.712 -7.276 43 HE2 PHE 4 HE1 PHE 4 10.045 1.580 -10.372 44 HZ PHE 4 HZ PHE 4 8.816 3.329 -9.150 45 H ASP 5 H ASP 5 5.121 -1.964 -9.529 46 HA ASP 5 HA ASP 5 5.440 -4.632 -10.660 47 HB2 ASP 5 2HB ASP 5 3.289 -2.760 -10.448 48 HB3 ASP 5 3HB ASP 5 3.574 -3.093 -12.154 49 H LEU 6 H LEU 6 7.321 -4.645 -11.810 50 HA LEU 6 HA LEU 6 7.851 -2.514 -13.726 51 HB2 LEU 6 2HB LEU 6 9.431 -4.887 -12.776 52 HB3 LEU 6 3HB LEU 6 9.950 -3.893 -14.136 53 HG LEU 6 HG LEU 6 11.159 -3.176 -12.220 54 HD11 LEU 6 1HD1 LEU 6 9.221 -1.003 -12.081 55 HD12 LEU 6 2HD1 LEU 6 9.615 -1.490 -13.729 56 HD13 LEU 6 3HD1 LEU 6 10.899 -0.997 -12.625 57 HD21 LEU 6 3HD2 LEU 6 10.249 -2.686 -10.120 58 HD22 LEU 6 1HD2 LEU 6 9.431 -4.167 -10.618 59 HD23 LEU 6 2HD2 LEU 6 8.603 -2.616 -10.750 60 H ARG 7 H ARG 7 5.883 -5.026 -13.793 61 HA ARG 7 HA ARG 7 6.496 -6.652 -15.926 62 HB2 ARG 7 2HB ARG 7 4.083 -5.848 -14.522 63 HB3 ARG 7 3HB ARG 7 3.772 -6.152 -16.225 64 HG2 ARG 7 2HG ARG 7 4.283 -8.377 -16.066 65 HG3 ARG 7 3HG ARG 7 5.359 -8.143 -14.687 66 HD2 ARG 7 2HD ARG 7 3.679 -8.876 -13.418 67 HD3 ARG 7 3HD ARG 7 2.898 -7.329 -13.737 68 HE ARG 7 HE ARG 7 2.388 -9.269 -15.778 69 HH11 ARG 7 1HH1 ARG 7 1.417 -8.156 -12.626 70 HH12 ARG 7 2HH1 ARG 7 -0.196 -8.773 -12.761 71 HH21 ARG 7 1HH2 ARG 7 0.267 -10.087 -15.968 72 HH22 ARG 7 2HH2 ARG 7 -0.849 -9.872 -14.662 73 HA PRO 8 HA PRO 8 4.493 -3.511 -18.994 74 HB2 PRO 8 2HB PRO 8 3.855 -1.052 -18.035 75 HB3 PRO 8 3HB PRO 8 2.732 -2.417 -18.002 76 HG2 PRO 8 2HG PRO 8 4.466 -1.337 -15.814 77 HG3 PRO 8 3HG PRO 8 2.777 -1.875 -15.742 78 HD2 PRO 8 2HD PRO 8 4.836 -3.425 -14.911 79 HD3 PRO 8 3HD PRO 8 3.360 -4.102 -15.627 80 H LEU 9 H LEU 9 6.897 -2.780 -16.693 81 HA LEU 9 HA LEU 9 8.076 -0.588 -18.161 82 HB2 LEU 9 2HB LEU 9 8.489 -1.916 -15.592 83 HB3 LEU 9 3HB LEU 9 9.988 -1.449 -16.392 84 HG LEU 9 HG LEU 9 8.346 0.804 -16.554 85 HD11 LEU 9 1HD1 LEU 9 7.269 -0.725 -14.553 86 HD12 LEU 9 2HD1 LEU 9 7.129 1.027 -14.696 87 HD13 LEU 9 3HD1 LEU 9 8.386 0.324 -13.678 88 HD21 LEU 9 3HD2 LEU 9 10.786 0.725 -16.242 89 HD22 LEU 9 1HD2 LEU 9 10.542 0.187 -14.580 90 HD23 LEU 9 2HD2 LEU 9 9.996 1.789 -15.077 91 H LYS 10 H LYS 10 9.853 -0.653 -19.464 92 HA LYS 10 HA LYS 10 10.495 -3.183 -20.665 93 HB2 LYS 10 2HB LYS 10 11.752 -1.937 -22.254 94 HB3 LYS 10 3HB LYS 10 10.311 -0.992 -21.905 95 HG2 LYS 10 2HG LYS 10 11.629 0.403 -20.364 96 HG3 LYS 10 3HG LYS 10 13.071 -0.517 -20.798 97 HD2 LYS 10 2HD LYS 10 13.206 1.346 -22.179 98 HD3 LYS 10 3HD LYS 10 12.469 0.132 -23.227 99 HE2 LYS 10 2HE LYS 10 10.236 1.069 -22.587 100 HE3 LYS 10 3HE LYS 10 11.086 2.370 -21.756 101 HZ1 LYS 10 3HZ LYS 10 10.999 1.789 -24.652 102 HZ2 LYS 10 1HZ LYS 10 12.219 2.754 -23.985 103 HZ3 LYS 10 2HZ LYS 10 10.601 3.225 -23.851 104 H ALA 11 H ALA 11 12.739 -3.913 -20.977 105 HA ALA 11 HA ALA 11 14.092 -4.118 -18.477 106 HB1 ALA 11 1HB ALA 11 13.987 -5.662 -20.714 107 HB2 ALA 11 2HB ALA 11 15.590 -4.940 -20.859 108 HB3 ALA 11 3HB ALA 11 15.162 -5.853 -19.412 109 H GLY 12 H GLY 12 16.054 -3.273 -17.828 110 HA2 GLY 12 2HA GLY 12 18.110 -2.093 -18.313 111 HA3 GLY 12 3HA GLY 12 17.258 -1.237 -19.589 112 H ILE 13 H ILE 13 14.942 -0.510 -18.196 113 HA ILE 13 HA ILE 13 16.059 1.535 -16.415 114 HB ILE 13 HB ILE 13 13.287 1.480 -17.603 115 HG12 ILE 13 2HG1 ILE 13 15.776 2.844 -18.654 116 HG13 ILE 13 3HG1 ILE 13 14.955 1.480 -19.404 117 HG21 ILE 13 1HG2 ILE 13 14.886 3.811 -16.569 118 HG22 ILE 13 2HG2 ILE 13 13.179 3.780 -17.007 119 HG23 ILE 13 3HG2 ILE 13 13.740 2.901 -15.585 120 HD11 ILE 13 3HD1 ILE 13 14.480 4.251 -19.747 121 HD12 ILE 13 1HD1 ILE 13 13.690 2.887 -20.538 122 HD13 ILE 13 2HD1 ILE 13 13.043 3.527 -19.026 123 H PHE 14 H PHE 14 13.797 -1.121 -16.527 124 HA PHE 14 HA PHE 14 12.326 -0.633 -14.211 125 HB2 PHE 14 2HB PHE 14 11.634 -2.873 -14.322 126 HB3 PHE 14 3HB PHE 14 12.017 -2.470 -15.992 127 HD1 PHE 14 HD1 PHE 14 14.720 -2.833 -16.426 128 HD2 PHE 14 HD2 PHE 14 12.238 -4.991 -13.725 129 HE1 PHE 14 HE1 PHE 14 16.271 -4.740 -16.531 130 HE2 PHE 14 HE2 PHE 14 13.785 -6.902 -13.824 131 HZ PHE 14 HZ PHE 14 15.805 -6.777 -15.228 132 H GLU 15 H GLU 15 15.596 -1.690 -14.620 133 HA GLU 15 HA GLU 15 15.857 -2.654 -11.903 134 HB2 GLU 15 2HB GLU 15 17.168 -3.789 -13.551 135 HB3 GLU 15 3HB GLU 15 17.836 -2.276 -14.149 136 HG2 GLU 15 2HG GLU 15 18.351 -2.717 -11.318 137 HG3 GLU 15 3HG GLU 15 19.029 -3.968 -12.357 138 H ARG 16 H ARG 16 16.319 0.292 -13.651 139 HA ARG 16 HA ARG 16 17.977 1.492 -11.596 140 HB2 ARG 16 2HB ARG 16 17.057 2.235 -14.308 141 HB3 ARG 16 3HB ARG 16 17.296 3.568 -13.186 142 HG2 ARG 16 2HG ARG 16 19.529 3.370 -13.224 143 HG3 ARG 16 3HG ARG 16 19.476 1.606 -13.254 144 HD2 ARG 16 2HD ARG 16 19.800 1.581 -15.453 145 HD3 ARG 16 3HD ARG 16 18.436 2.668 -15.710 146 HE ARG 16 HE ARG 16 20.623 4.171 -14.813 147 HH11 ARG 16 1HH1 ARG 16 19.610 2.335 -17.592 148 HH12 ARG 16 2HH1 ARG 16 20.547 3.267 -18.712 149 HH21 ARG 16 1HH2 ARG 16 21.861 5.406 -16.279 150 HH22 ARG 16 2HH2 ARG 16 21.827 5.013 -17.964 151 H LEU 17 H LEU 17 14.633 1.425 -12.580 152 HA LEU 17 HA LEU 17 13.830 3.674 -10.992 153 HB2 LEU 17 2HB LEU 17 12.664 1.991 -12.948 154 HB3 LEU 17 3HB LEU 17 11.652 1.908 -11.507 155 HG LEU 17 HG LEU 17 10.811 3.598 -13.012 156 HD11 LEU 17 1HD1 LEU 17 10.357 5.110 -11.398 157 HD12 LEU 17 2HD1 LEU 17 12.054 5.328 -10.969 158 HD13 LEU 17 3HD1 LEU 17 11.167 3.924 -10.374 159 HD21 LEU 17 3HD2 LEU 17 12.043 5.253 -13.991 160 HD22 LEU 17 1HD2 LEU 17 13.270 3.990 -13.888 161 HD23 LEU 17 2HD2 LEU 17 13.238 5.287 -12.694 162 H GLU 18 H GLU 18 14.294 0.291 -10.450 163 HA GLU 18 HA GLU 18 12.605 -0.145 -8.271 164 HB2 GLU 18 2HB GLU 18 14.558 -1.595 -9.629 165 HB3 GLU 18 3HB GLU 18 15.158 -1.499 -7.980 166 HG2 GLU 18 2HG GLU 18 13.779 -3.109 -7.371 167 HG3 GLU 18 3HG GLU 18 12.399 -2.130 -7.866 168 H GLU 19 H GLU 19 15.653 1.521 -8.496 169 HA GLU 19 HA GLU 19 16.111 1.582 -5.654 170 HB2 GLU 19 2HB GLU 19 18.027 1.639 -7.114 171 HB3 GLU 19 3HB GLU 19 17.406 3.055 -7.950 172 HG2 GLU 19 2HG GLU 19 17.671 3.501 -5.100 173 HG3 GLU 19 3HG GLU 19 19.195 3.032 -5.851 174 H LEU 20 H LEU 20 14.606 3.632 -8.049 175 HA LEU 20 HA LEU 20 14.517 6.039 -6.630 176 HB2 LEU 20 2HB LEU 20 13.337 4.931 -8.993 177 HB3 LEU 20 3HB LEU 20 12.112 5.810 -8.079 178 HG LEU 20 HG LEU 20 14.162 7.600 -8.085 179 HD11 LEU 20 1HD1 LEU 20 14.197 6.314 -10.807 180 HD12 LEU 20 2HD1 LEU 20 15.451 6.084 -9.589 181 HD13 LEU 20 3HD1 LEU 20 15.152 7.690 -10.254 182 HD21 LEU 20 3HD2 LEU 20 12.777 8.265 -10.353 183 HD22 LEU 20 1HD2 LEU 20 12.283 8.642 -8.703 184 HD23 LEU 20 2HD2 LEU 20 11.644 7.209 -9.509 185 H ILE 21 H ILE 21 12.502 3.174 -6.451 186 HA ILE 21 HA ILE 21 10.611 4.438 -4.652 187 HB ILE 21 HB ILE 21 9.782 2.794 -6.258 188 HG12 ILE 21 2HG1 ILE 21 8.501 1.385 -4.684 189 HG13 ILE 21 3HG1 ILE 21 9.608 1.837 -3.391 190 HG21 ILE 21 1HG2 ILE 21 11.533 0.841 -4.772 191 HG22 ILE 21 2HG2 ILE 21 10.335 0.409 -5.990 192 HG23 ILE 21 3HG2 ILE 21 11.738 1.379 -6.438 193 HD11 ILE 21 3HD1 ILE 21 8.435 4.124 -4.758 194 HD12 ILE 21 1HD1 ILE 21 7.248 3.076 -3.983 195 HD13 ILE 21 2HD1 ILE 21 8.564 3.769 -3.036 196 H GLU 22 H GLU 22 13.367 2.293 -4.498 197 HA GLU 22 HA GLU 22 13.049 1.217 -1.955 198 HB2 GLU 22 2HB GLU 22 15.286 1.664 -3.806 199 HB3 GLU 22 3HB GLU 22 15.758 1.590 -2.114 200 HG2 GLU 22 2HG GLU 22 14.303 -0.511 -3.697 201 HG3 GLU 22 3HG GLU 22 15.938 -0.596 -3.042 202 H LYS 23 H LYS 23 13.901 4.428 -2.930 203 HA LYS 23 HA LYS 23 15.152 5.309 -0.563 204 HB2 LYS 23 2HB LYS 23 14.185 6.478 -3.022 205 HB3 LYS 23 3HB LYS 23 13.779 7.504 -1.652 206 HG2 LYS 23 2HG LYS 23 15.826 8.344 -1.913 207 HG3 LYS 23 3HG LYS 23 16.381 6.863 -1.129 208 HD2 LYS 23 2HD LYS 23 17.664 6.766 -3.007 209 HD3 LYS 23 3HD LYS 23 16.225 5.951 -3.624 210 HE2 LYS 23 2HE LYS 23 15.893 7.548 -5.136 211 HE3 LYS 23 3HE LYS 23 15.974 8.806 -3.903 212 HZ1 LYS 23 3HZ LYS 23 17.879 8.151 -5.863 213 HZ2 LYS 23 1HZ LYS 23 18.568 7.895 -4.339 214 HZ3 LYS 23 2HZ LYS 23 17.921 9.407 -4.731 215 H GLU 24 H GLU 24 11.766 5.280 -1.589 216 HA GLU 24 HA GLU 24 10.829 6.606 0.774 217 HB2 GLU 24 2HB GLU 24 9.763 5.999 -1.730 218 HB3 GLU 24 3HB GLU 24 8.819 5.031 -0.607 219 HG2 GLU 24 2HG GLU 24 9.111 7.649 0.470 220 HG3 GLU 24 3HG GLU 24 8.566 7.776 -1.202 221 H MET 25 H MET 25 11.491 3.337 -0.141 222 HA MET 25 HA MET 25 9.851 2.049 1.788 223 HB2 MET 25 2HB MET 25 12.341 1.082 0.372 224 HB3 MET 25 3HB MET 25 11.269 0.065 1.326 225 HG2 MET 25 2HG MET 25 10.473 1.582 -1.148 226 HG3 MET 25 3HG MET 25 10.877 -0.132 -1.087 227 HE1 MET 25 3HE MET 25 8.795 -2.070 -0.113 228 HE2 MET 25 1HE MET 25 9.931 -1.393 1.054 229 HE3 MET 25 2HE MET 25 8.206 -1.426 1.420 230 H GLN 26 H GLN 26 10.359 1.226 3.807 231 HA GLN 26 HA GLN 26 12.136 2.739 5.386 232 HB2 GLN 26 2HB GLN 26 10.235 0.572 5.785 233 HB3 GLN 26 3HB GLN 26 11.649 0.407 6.817 234 HG2 GLN 26 2HG GLN 26 10.393 1.692 8.180 235 HG3 GLN 26 3HG GLN 26 11.153 2.979 7.245 236 HE21 GLN 26 1HE2 GLN 26 8.258 1.003 7.529 237 HE22 GLN 26 2HE2 GLN 26 7.186 2.140 6.794 238 HA PRO 27 HA PRO 27 15.996 0.675 5.121 239 HB2 PRO 27 2HB PRO 27 16.851 0.673 7.698 240 HB3 PRO 27 3HB PRO 27 16.785 2.136 6.709 241 HG2 PRO 27 2HG PRO 27 14.846 1.153 8.767 242 HG3 PRO 27 3HG PRO 27 15.455 2.797 8.498 243 HD2 PRO 27 2HD PRO 27 13.025 1.982 7.624 244 HD3 PRO 27 3HD PRO 27 13.998 3.187 6.756 245 H ASN 28 H ASN 28 13.409 -0.733 6.758 246 HA ASN 28 HA ASN 28 14.688 -3.347 6.627 247 HB2 ASN 28 2HB ASN 28 14.651 -2.094 9.040 248 HB3 ASN 28 3HB ASN 28 13.111 -2.947 9.092 249 HD21 ASN 28 1HD2 ASN 28 15.513 -3.374 10.665 250 HD22 ASN 28 2HD2 ASN 28 15.986 -5.013 10.391 251 H GLU 29 H GLU 29 12.682 -2.097 5.027 252 HA GLU 29 HA GLU 29 10.258 -3.583 5.777 253 HB2 GLU 29 2HB GLU 29 10.702 -0.981 4.630 254 HB3 GLU 29 3HB GLU 29 9.728 -1.954 3.538 255 HG2 GLU 29 2HG GLU 29 9.035 -1.794 6.438 256 HG3 GLU 29 3HG GLU 29 8.568 -0.504 5.331 257 H VAL 30 H VAL 30 9.005 -4.477 3.891 258 HA VAL 30 HA VAL 30 10.861 -5.923 2.143 259 HB VAL 30 HB VAL 30 8.294 -6.575 3.400 260 HG11 VAL 30 1HG1 VAL 30 7.666 -8.157 1.556 261 HG12 VAL 30 2HG1 VAL 30 7.407 -6.450 1.193 262 HG13 VAL 30 3HG1 VAL 30 8.802 -7.295 0.520 263 HG21 VAL 30 3HG2 VAL 30 10.104 -7.858 4.095 264 HG22 VAL 30 1HG2 VAL 30 9.293 -8.913 2.938 265 HG23 VAL 30 2HG2 VAL 30 10.740 -8.026 2.459 266 H ALA 31 H ALA 31 10.708 -5.897 -0.061 267 HA ALA 31 HA ALA 31 8.628 -4.198 -1.260 268 HB1 ALA 31 1HB ALA 31 11.444 -4.148 -2.284 269 HB2 ALA 31 2HB ALA 31 10.140 -2.990 -2.553 270 HB3 ALA 31 3HB ALA 31 10.927 -3.081 -0.977 271 H ILE 32 H ILE 32 7.480 -5.407 -2.608 272 HA ILE 32 HA ILE 32 8.702 -7.742 -3.866 273 HB ILE 32 HB ILE 32 5.822 -6.847 -3.730 274 HG12 ILE 32 2HG1 ILE 32 6.578 -9.438 -2.598 275 HG13 ILE 32 3HG1 ILE 32 7.382 -8.082 -1.814 276 HG21 ILE 32 1HG2 ILE 32 7.164 -8.866 -5.381 277 HG22 ILE 32 2HG2 ILE 32 5.742 -9.444 -4.514 278 HG23 ILE 32 3HG2 ILE 32 5.610 -8.065 -5.605 279 HD11 ILE 32 3HD1 ILE 32 5.122 -7.039 -1.528 280 HD12 ILE 32 1HD1 ILE 32 4.430 -8.564 -2.083 281 HD13 ILE 32 2HD1 ILE 32 5.397 -8.518 -0.608 282 H PHE 33 H PHE 33 9.702 -7.364 -5.733 283 HA PHE 33 HA PHE 33 8.555 -5.397 -7.588 284 HB2 PHE 33 2HB PHE 33 11.302 -6.652 -7.704 285 HB3 PHE 33 3HB PHE 33 10.725 -5.262 -8.619 286 HD1 PHE 33 HD2 PHE 33 9.326 -3.802 -6.411 287 HD2 PHE 33 HD1 PHE 33 13.116 -5.733 -6.553 288 HE1 PHE 33 HE2 PHE 33 10.154 -2.298 -4.649 289 HE2 PHE 33 HE1 PHE 33 13.950 -4.234 -4.789 290 HZ PHE 33 HZ PHE 33 12.469 -2.513 -3.836 291 H MET 34 H MET 34 7.311 -6.206 -9.132 292 HA MET 34 HA MET 34 7.562 -8.988 -9.924 293 HB2 MET 34 2HB MET 34 5.398 -7.385 -9.609 294 HB3 MET 34 3HB MET 34 5.648 -7.240 -11.344 295 HG2 MET 34 2HG MET 34 5.317 -9.525 -11.701 296 HG3 MET 34 3HG MET 34 5.533 -9.911 -9.995 297 HE1 MET 34 3HE MET 34 2.795 -9.393 -8.149 298 HE2 MET 34 1HE MET 34 4.273 -8.451 -8.345 299 HE3 MET 34 2HE MET 34 2.703 -7.696 -8.621 300 H PHE 35 H PHE 35 8.553 -9.691 -11.703 301 HA PHE 35 HA PHE 35 9.190 -7.745 -13.817 302 HB2 PHE 35 2HB PHE 35 11.384 -8.735 -14.097 303 HB3 PHE 35 3HB PHE 35 11.188 -8.232 -12.421 304 HD1 PHE 35 HD1 PHE 35 10.453 -10.037 -10.743 305 HD2 PHE 35 HD2 PHE 35 12.051 -10.895 -14.594 306 HE1 PHE 35 HE1 PHE 35 11.039 -12.305 -9.991 307 HE2 PHE 35 HE2 PHE 35 12.639 -13.165 -13.848 308 HZ PHE 35 HZ PHE 35 12.132 -13.873 -11.544 309 H GLU 36 H GLU 36 8.550 -8.342 -15.781 310 HA GLU 36 HA GLU 36 7.707 -11.127 -16.178 311 HB2 GLU 36 2HB GLU 36 6.290 -10.319 -17.955 312 HB3 GLU 36 3HB GLU 36 6.011 -9.345 -16.519 313 HG2 GLU 36 2HG GLU 36 6.176 -7.645 -17.971 314 HG3 GLU 36 3HG GLU 36 7.905 -7.864 -17.709 315 H VAL 37 H VAL 37 10.137 -8.926 -17.009 316 HA VAL 37 HA VAL 37 10.749 -9.971 -19.613 317 HB VAL 37 HB VAL 37 12.621 -8.407 -17.842 318 HG11 VAL 37 1HG1 VAL 37 13.957 -8.728 -19.601 319 HG12 VAL 37 2HG1 VAL 37 12.634 -9.329 -20.602 320 HG13 VAL 37 3HG1 VAL 37 12.915 -7.593 -20.458 321 HG21 VAL 37 3HG2 VAL 37 11.706 -6.382 -18.960 322 HG22 VAL 37 1HG2 VAL 37 10.416 -7.383 -19.626 323 HG23 VAL 37 2HG2 VAL 37 10.559 -7.174 -17.881 324 H GLY 38 H GLY 38 12.564 -11.232 -20.191 325 HA2 GLY 38 2HA GLY 38 13.090 -13.404 -18.445 326 HA3 GLY 38 3HA GLY 38 13.893 -13.095 -19.978 327 H ASP 39 H ASP 39 14.442 -10.313 -18.581 328 HA ASP 39 HA ASP 39 17.127 -10.924 -17.885 329 HB2 ASP 39 2HB ASP 39 15.425 -8.483 -17.913 330 HB3 ASP 39 3HB ASP 39 16.878 -8.446 -16.918 331 H PHE 40 H PHE 40 16.943 -12.493 -16.228 332 HA PHE 40 HA PHE 40 15.716 -11.718 -13.714 333 HB2 PHE 40 2HB PHE 40 16.234 -13.964 -12.970 334 HB3 PHE 40 3HB PHE 40 15.520 -14.042 -14.577 335 HD1 PHE 40 HD1 PHE 40 16.882 -14.621 -16.516 336 HD2 PHE 40 HD2 PHE 40 18.511 -14.595 -12.583 337 HE1 PHE 40 HE1 PHE 40 18.815 -15.918 -17.312 338 HE2 PHE 40 HE2 PHE 40 20.447 -15.892 -13.373 339 HZ PHE 40 HZ PHE 40 20.602 -16.555 -15.740 340 H SER 41 H SER 41 18.855 -11.848 -15.170 341 HA SER 41 HA SER 41 20.388 -11.827 -12.775 342 HB2 SER 41 2HB SER 41 22.211 -11.792 -14.147 343 HB3 SER 41 3HB SER 41 21.016 -12.237 -15.366 344 HG SER 41 HG SER 41 21.261 -10.357 -16.279 345 H ASN 42 H ASN 42 18.560 -9.454 -14.410 346 HA ASN 42 HA ASN 42 20.040 -7.189 -13.395 347 HB2 ASN 42 2HB ASN 42 17.765 -7.624 -15.211 348 HB3 ASN 42 3HB ASN 42 17.641 -6.169 -14.226 349 HD21 ASN 42 1HD2 ASN 42 18.927 -7.528 -16.998 350 HD22 ASN 42 2HD2 ASN 42 20.043 -6.275 -17.409 351 H ILE 43 H ILE 43 17.358 -9.154 -12.420 352 HA ILE 43 HA ILE 43 15.946 -7.500 -10.727 353 HB ILE 43 HB ILE 43 16.491 -10.423 -10.750 354 HG12 ILE 43 2HG1 ILE 43 14.686 -9.375 -12.094 355 HG13 ILE 43 3HG1 ILE 43 14.072 -10.545 -10.931 356 HG21 ILE 43 1HG2 ILE 43 14.961 -10.561 -8.685 357 HG22 ILE 43 2HG2 ILE 43 16.669 -10.200 -8.441 358 HG23 ILE 43 3HG2 ILE 43 15.476 -8.903 -8.377 359 HD11 ILE 43 3HD1 ILE 43 12.705 -9.012 -10.130 360 HD12 ILE 43 1HD1 ILE 43 14.085 -8.014 -9.674 361 HD13 ILE 43 2HD1 ILE 43 13.350 -7.829 -11.267 362 HA PRO 44 HA PRO 44 18.993 -8.585 -7.131 363 HB2 PRO 44 2HB PRO 44 21.334 -9.781 -7.811 364 HB3 PRO 44 3HB PRO 44 19.871 -10.690 -7.413 365 HG2 PRO 44 2HG PRO 44 21.001 -10.002 -10.098 366 HG3 PRO 44 3HG PRO 44 20.307 -11.533 -9.535 367 HD2 PRO 44 2HD PRO 44 18.916 -9.774 -11.052 368 HD3 PRO 44 3HD PRO 44 18.140 -10.806 -9.835 369 H LYS 45 H LYS 45 19.968 -7.396 -10.211 370 HA LYS 45 HA LYS 45 22.298 -5.983 -9.330 371 HB2 LYS 45 2HB LYS 45 21.453 -6.726 -11.757 372 HB3 LYS 45 3HB LYS 45 20.814 -5.088 -11.747 373 HG2 LYS 45 2HG LYS 45 23.458 -4.911 -10.814 374 HG3 LYS 45 3HG LYS 45 23.486 -5.984 -12.215 375 HD2 LYS 45 2HD LYS 45 22.028 -4.176 -13.343 376 HD3 LYS 45 3HD LYS 45 22.592 -3.127 -12.041 377 HE2 LYS 45 2HE LYS 45 24.276 -2.697 -13.477 378 HE3 LYS 45 3HE LYS 45 24.932 -4.203 -12.837 379 HZ1 LYS 45 3HZ LYS 45 24.680 -5.204 -14.793 380 HZ2 LYS 45 1HZ LYS 45 24.425 -3.668 -15.455 381 HZ3 LYS 45 2HZ LYS 45 23.105 -4.624 -15.002 382 H SER 46 H SER 46 18.885 -5.294 -9.540 383 HA SER 46 HA SER 46 19.092 -2.467 -9.279 384 HB2 SER 46 2HB SER 46 16.647 -3.772 -8.250 385 HB3 SER 46 3HB SER 46 16.823 -2.471 -9.428 386 HG SER 46 HG SER 46 16.063 -4.653 -10.165 387 H ALA 47 H ALA 47 18.198 -5.015 -6.951 388 HA ALA 47 HA ALA 47 17.982 -3.399 -4.696 389 HB1 ALA 47 1HB ALA 47 18.757 -5.661 -3.544 390 HB2 ALA 47 2HB ALA 47 17.161 -5.479 -4.273 391 HB3 ALA 47 3HB ALA 47 18.449 -6.291 -5.163 392 H GLU 48 H GLU 48 20.795 -4.585 -6.348 393 HA GLU 48 HA GLU 48 22.631 -4.172 -4.194 394 HB2 GLU 48 2HB GLU 48 22.976 -5.716 -6.172 395 HB3 GLU 48 3HB GLU 48 23.287 -4.280 -7.137 396 HG2 GLU 48 2HG GLU 48 24.948 -3.965 -4.959 397 HG3 GLU 48 3HG GLU 48 25.019 -5.694 -5.295 398 H PHE 49 H PHE 49 21.412 -2.239 -6.847 399 HA PHE 49 HA PHE 49 23.263 -0.199 -6.962 400 HB2 PHE 49 2HB PHE 49 20.733 -0.656 -8.012 401 HB3 PHE 49 3HB PHE 49 20.535 0.820 -7.072 402 HD1 PHE 49 HD2 PHE 49 22.031 2.775 -7.552 403 HD2 PHE 49 HD1 PHE 49 21.831 -0.641 -10.084 404 HE1 PHE 49 HE2 PHE 49 23.037 4.077 -9.381 405 HE2 PHE 49 HE1 PHE 49 22.838 0.655 -11.917 406 HZ PHE 49 HZ PHE 49 23.441 3.017 -11.568 407 H ILE 50 H ILE 50 20.855 -0.846 -4.524 408 HA ILE 50 HA ILE 50 20.908 1.690 -3.258 409 HB ILE 50 HB ILE 50 20.264 -0.964 -1.973 410 HG12 ILE 50 2HG1 ILE 50 18.979 -0.532 -4.081 411 HG13 ILE 50 3HG1 ILE 50 17.975 -0.635 -2.639 412 HG21 ILE 50 1HG2 ILE 50 18.764 0.514 -0.577 413 HG22 ILE 50 2HG2 ILE 50 20.496 0.695 -0.306 414 HG23 ILE 50 3HG2 ILE 50 19.626 1.888 -1.268 415 HD11 ILE 50 3HD1 ILE 50 17.848 1.799 -2.557 416 HD12 ILE 50 1HD1 ILE 50 18.851 1.899 -4.004 417 HD13 ILE 50 2HD1 ILE 50 17.249 1.166 -4.090 418 H GLN 51 H GLN 51 22.169 -1.376 -1.945 419 HA GLN 51 HA GLN 51 24.659 -0.071 -1.208 420 HB2 GLN 51 2HB GLN 51 22.651 -0.044 0.635 421 HB3 GLN 51 3HB GLN 51 23.462 -1.551 1.040 422 HG2 GLN 51 2HG GLN 51 25.193 -0.499 1.956 423 HG3 GLN 51 3HG GLN 51 25.318 0.644 0.620 424 HE21 GLN 51 1HE2 GLN 51 23.005 -0.076 3.220 425 HE22 GLN 51 2HE2 GLN 51 22.808 1.564 3.728 426 H SER 52 H SER 52 26.323 -1.426 -1.421 427 HA SER 52 HA SER 52 26.137 -3.933 -2.531 428 HB2 SER 52 2HB SER 52 28.207 -2.448 -2.267 429 HB3 SER 52 3HB SER 52 28.387 -3.174 -0.670 430 HG SER 52 HG SER 52 28.332 -4.553 -3.152 431 H LYS 53 H LYS 53 26.043 -3.032 0.851 432 HA LYS 53 HA LYS 53 25.472 -5.843 1.523 433 HB2 LYS 53 2HB LYS 53 27.036 -3.827 3.143 434 HB3 LYS 53 3HB LYS 53 26.495 -5.383 3.761 435 HG2 LYS 53 2HG LYS 53 28.415 -6.226 3.048 436 HG3 LYS 53 3HG LYS 53 27.824 -5.996 1.401 437 HD2 LYS 53 2HD LYS 53 29.124 -4.173 1.048 438 HD3 LYS 53 3HD LYS 53 28.987 -3.620 2.719 439 HE2 LYS 53 2HE LYS 53 30.617 -6.017 1.907 440 HE3 LYS 53 3HE LYS 53 31.281 -4.385 1.983 441 HZ1 LYS 53 3HZ LYS 53 31.405 -4.475 4.191 442 HZ2 LYS 53 1HZ LYS 53 31.177 -6.145 4.043 443 HZ3 LYS 53 2HZ LYS 53 29.857 -5.136 4.359 444 H GLY 54 H GLY 54 23.430 -6.061 2.139 445 HA2 GLY 54 2HA GLY 54 22.095 -5.154 4.225 446 HA3 GLY 54 3HA GLY 54 21.988 -3.741 3.185 447 H HIS 55 H HIS 55 21.616 -4.899 0.713 448 HA HIS 55 HA HIS 55 18.845 -5.575 0.846 449 HB2 HIS 55 2HB HIS 55 18.913 -5.613 -1.562 450 HB3 HIS 55 3HB HIS 55 19.879 -4.251 -1.003 451 HD1 HIS 55 HD1 HIS 55 22.573 -4.820 -0.900 452 HD2 HIS 55 HD2 HIS 55 20.197 -7.193 -3.346 453 HE1 HIS 55 HE1 HIS 55 24.159 -5.932 -2.504 454 H GLU 56 H GLU 56 18.041 -7.518 1.249 455 HA GLU 56 HA GLU 56 19.487 -9.880 0.264 456 HB2 GLU 56 2HB GLU 56 19.317 -9.192 2.938 457 HB3 GLU 56 3HB GLU 56 18.015 -10.356 2.739 458 HG2 GLU 56 2HG GLU 56 20.565 -11.132 1.516 459 HG3 GLU 56 3HG GLU 56 20.586 -10.996 3.273 460 H LEU 57 H LEU 57 18.251 -11.014 -1.065 461 HA LEU 57 HA LEU 57 15.422 -10.539 -1.242 462 HB2 LEU 57 2HB LEU 57 17.247 -12.451 -2.687 463 HB3 LEU 57 3HB LEU 57 15.530 -12.270 -3.040 464 HG LEU 57 HG LEU 57 16.648 -11.029 -4.691 465 HD11 LEU 57 1HD1 LEU 57 14.870 -9.841 -3.032 466 HD12 LEU 57 2HD1 LEU 57 15.502 -9.107 -4.505 467 HD13 LEU 57 3HD1 LEU 57 16.218 -8.708 -2.944 468 HD21 LEU 57 3HD2 LEU 57 18.183 -9.337 -2.797 469 HD22 LEU 57 1HD2 LEU 57 18.569 -9.835 -4.444 470 HD23 LEU 57 2HD2 LEU 57 18.777 -10.969 -3.109 471 H LEU 58 H LEU 58 14.257 -11.337 0.419 472 HA LEU 58 HA LEU 58 14.755 -13.563 1.964 473 HB2 LEU 58 2HB LEU 58 12.564 -11.774 1.509 474 HB3 LEU 58 3HB LEU 58 11.957 -13.421 1.671 475 HG LEU 58 HG LEU 58 13.753 -13.115 3.780 476 HD11 LEU 58 1HD1 LEU 58 13.650 -11.047 4.625 477 HD12 LEU 58 2HD1 LEU 58 11.945 -10.861 4.217 478 HD13 LEU 58 3HD1 LEU 58 13.180 -10.564 2.995 479 HD21 LEU 58 3HD2 LEU 58 11.377 -14.181 3.491 480 HD22 LEU 58 1HD2 LEU 58 10.833 -12.635 4.142 481 HD23 LEU 58 2HD2 LEU 58 11.934 -13.647 5.078 482 H ASN 59 H ASN 59 12.959 -13.364 -1.080 483 HA ASN 59 HA ASN 59 13.107 -16.300 -1.257 484 HB2 ASN 59 2HB ASN 59 10.771 -15.138 -0.890 485 HB3 ASN 59 3HB ASN 59 10.900 -14.801 -2.614 486 HD21 ASN 59 1HD2 ASN 59 11.082 -17.419 -0.250 487 HD22 ASN 59 2HD2 ASN 59 10.453 -18.643 -1.295 488 H SER 60 H SER 60 14.750 -16.591 -2.650 489 HA SER 60 HA SER 60 15.681 -14.961 -4.633 490 HB2 SER 60 2HB SER 60 17.100 -16.721 -4.509 491 HB3 SER 60 3HB SER 60 15.815 -17.849 -4.079 492 HG SER 60 HG SER 60 16.515 -16.922 -6.665 493 H LEU 61 H LEU 61 14.908 -14.193 -6.480 494 HA LEU 61 HA LEU 61 12.348 -14.544 -7.410 495 HB2 LEU 61 2HB LEU 61 13.139 -13.610 -9.546 496 HB3 LEU 61 3HB LEU 61 13.713 -12.710 -8.144 497 HG LEU 61 HG LEU 61 15.543 -14.775 -9.202 498 HD11 LEU 61 1HD1 LEU 61 14.587 -12.464 -10.808 499 HD12 LEU 61 2HD1 LEU 61 15.110 -14.066 -11.327 500 HD13 LEU 61 3HD1 LEU 61 16.305 -12.861 -10.847 501 HD21 LEU 61 3HD2 LEU 61 16.849 -13.631 -7.818 502 HD22 LEU 61 1HD2 LEU 61 15.614 -12.391 -7.599 503 HD23 LEU 61 2HD2 LEU 61 16.761 -12.267 -8.933 504 H ARG 62 H ARG 62 11.293 -15.977 -8.659 505 HA ARG 62 HA ARG 62 12.802 -18.322 -9.573 506 HB2 ARG 62 2HB ARG 62 10.590 -18.255 -8.039 507 HB3 ARG 62 3HB ARG 62 9.839 -18.335 -9.627 508 HG2 ARG 62 2HG ARG 62 10.039 -20.545 -9.365 509 HG3 ARG 62 3HG ARG 62 11.719 -20.280 -9.836 510 HD2 ARG 62 2HD ARG 62 12.378 -21.065 -7.868 511 HD3 ARG 62 3HD ARG 62 11.530 -19.742 -7.070 512 HE ARG 62 HE ARG 62 9.881 -21.210 -6.465 513 HH11 ARG 62 1HH1 ARG 62 11.838 -22.652 -8.958 514 HH12 ARG 62 2HH1 ARG 62 11.092 -24.210 -8.824 515 HH21 ARG 62 1HH2 ARG 62 8.891 -23.257 -6.279 516 HH22 ARG 62 2HH2 ARG 62 9.416 -24.553 -7.301 517 H PHE 63 H PHE 63 13.542 -16.952 -11.408 518 HA PHE 63 HA PHE 63 11.630 -16.185 -13.405 519 HB2 PHE 63 2HB PHE 63 13.416 -15.273 -14.568 520 HB3 PHE 63 3HB PHE 63 14.013 -15.213 -12.913 521 HD1 PHE 63 HD2 PHE 63 15.734 -16.771 -12.154 522 HD2 PHE 63 HD1 PHE 63 14.395 -16.727 -16.195 523 HE1 PHE 63 HE2 PHE 63 17.713 -18.071 -12.821 524 HE2 PHE 63 HE1 PHE 63 16.372 -18.028 -16.868 525 HZ PHE 63 HZ PHE 63 18.035 -18.701 -15.180 526 H ASN 64 H ASN 64 10.697 -17.495 -14.817 527 HA ASN 64 HA ASN 64 11.999 -19.353 -16.425 528 HB2 ASN 64 2HB ASN 64 11.194 -20.383 -13.799 529 HB3 ASN 64 3HB ASN 64 10.571 -21.328 -15.148 530 HD21 ASN 64 1HD2 ASN 64 12.409 -21.470 -16.956 531 HD22 ASN 64 2HD2 ASN 64 13.903 -22.093 -16.352 532 H GLN 65 H GLN 65 9.013 -18.504 -14.769 533 HA GLN 65 HA GLN 65 7.545 -19.102 -17.253 534 HB2 GLN 65 2HB GLN 65 7.102 -20.179 -14.723 535 HB3 GLN 65 3HB GLN 65 5.867 -18.938 -14.887 536 HG2 GLN 65 2HG GLN 65 6.294 -21.403 -16.516 537 HG3 GLN 65 3HG GLN 65 4.832 -20.830 -15.714 538 HE21 GLN 65 1HE2 GLN 65 6.630 -20.895 -18.589 539 HE22 GLN 65 2HE2 GLN 65 5.621 -19.854 -19.528 540 H ALA 66 H ALA 66 5.121 -17.886 -16.287 541 HA ALA 66 HA ALA 66 5.272 -15.357 -17.301 542 HB1 ALA 66 1HB ALA 66 3.192 -14.862 -16.137 543 HB2 ALA 66 2HB ALA 66 3.168 -16.500 -16.792 544 HB3 ALA 66 3HB ALA 66 3.447 -16.243 -15.070 545 H ASP 67 H ASP 67 5.002 -13.244 -16.173 546 HA ASP 67 HA ASP 67 7.177 -12.431 -14.799 547 HB2 ASP 67 2HB ASP 67 5.994 -10.470 -14.160 548 HB3 ASP 67 3HB ASP 67 5.278 -10.998 -15.680 549 H TRP 68 H TRP 68 8.038 -12.697 -12.843 550 HA TRP 68 HA TRP 68 6.400 -14.019 -10.789 551 HB2 TRP 68 2HB TRP 68 8.824 -14.786 -11.813 552 HB3 TRP 68 3HB TRP 68 9.306 -13.916 -10.359 553 HD1 TRP 68 HD1 TRP 68 9.381 -15.347 -8.244 554 HE1 TRP 68 HE1 TRP 68 8.339 -17.574 -7.481 555 HE3 TRP 68 HE3 TRP 68 6.431 -16.297 -12.310 556 HZ2 TRP 68 HZ2 TRP 68 6.509 -19.481 -8.473 557 HZ3 TRP 68 HZ3 TRP 68 5.066 -18.344 -12.324 558 HH2 TRP 68 HH2 TRP 68 5.106 -19.902 -10.445 559 H THR 69 H THR 69 7.650 -13.545 -8.509 560 HA THR 69 HA THR 69 7.878 -10.618 -8.279 561 HB THR 69 HB THR 69 6.808 -11.044 -5.923 562 HG1 THR 69 HG1 THR 69 5.101 -12.731 -6.303 563 HG21 THR 69 3HG2 THR 69 4.617 -10.511 -6.819 564 HG22 THR 69 1HG2 THR 69 5.104 -11.076 -8.417 565 HG23 THR 69 2HG2 THR 69 5.856 -9.640 -7.722 566 H ILE 70 H ILE 70 9.413 -9.854 -6.890 567 HA ILE 70 HA ILE 70 10.993 -11.858 -5.417 568 HB ILE 70 HB ILE 70 12.300 -11.185 -7.321 569 HG12 ILE 70 2HG1 ILE 70 14.269 -10.245 -6.201 570 HG13 ILE 70 3HG1 ILE 70 13.266 -9.724 -4.852 571 HG21 ILE 70 1HG2 ILE 70 12.033 -9.193 -8.257 572 HG22 ILE 70 2HG2 ILE 70 11.046 -8.669 -6.893 573 HG23 ILE 70 3HG2 ILE 70 12.794 -8.438 -6.857 574 HD11 ILE 70 3HD1 ILE 70 12.928 -12.536 -5.340 575 HD12 ILE 70 1HD1 ILE 70 14.630 -12.132 -5.116 576 HD13 ILE 70 2HD1 ILE 70 13.450 -11.700 -3.878 577 H VAL 71 H VAL 71 11.048 -11.503 -3.306 578 HA VAL 71 HA VAL 71 10.196 -8.926 -2.253 579 HB VAL 71 HB VAL 71 10.980 -11.259 -0.541 580 HG11 VAL 71 1HG1 VAL 71 10.451 -9.118 0.523 581 HG12 VAL 71 2HG1 VAL 71 8.869 -9.122 -0.258 582 HG13 VAL 71 3HG1 VAL 71 9.267 -10.357 0.938 583 HG21 VAL 71 3HG2 VAL 71 8.508 -10.983 -2.218 584 HG22 VAL 71 1HG2 VAL 71 9.570 -12.379 -2.026 585 HG23 VAL 71 2HG2 VAL 71 8.498 -11.898 -0.711 586 H VAL 72 H VAL 72 11.536 -7.432 -1.478 587 HA VAL 72 HA VAL 72 14.311 -8.223 -0.871 588 HB VAL 72 HB VAL 72 13.533 -5.483 -1.843 589 HG11 VAL 72 1HG1 VAL 72 15.760 -5.041 -1.947 590 HG12 VAL 72 2HG1 VAL 72 15.793 -6.247 -0.660 591 HG13 VAL 72 3HG1 VAL 72 16.189 -6.711 -2.315 592 HG21 VAL 72 3HG2 VAL 72 13.073 -6.378 -3.838 593 HG22 VAL 72 1HG2 VAL 72 14.800 -6.715 -3.959 594 HG23 VAL 72 2HG2 VAL 72 13.698 -7.958 -3.365 595 H ARG 73 H ARG 73 14.977 -7.819 1.132 596 HA ARG 73 HA ARG 73 13.334 -6.061 2.818 597 HB2 ARG 73 2HB ARG 73 14.440 -7.245 4.720 598 HB3 ARG 73 3HB ARG 73 13.475 -8.293 3.690 599 HG2 ARG 73 2HG ARG 73 15.218 -9.594 3.286 600 HG3 ARG 73 3HG ARG 73 16.182 -8.217 2.748 601 HD2 ARG 73 2HD ARG 73 17.267 -8.057 4.708 602 HD3 ARG 73 3HD ARG 73 15.809 -8.370 5.649 603 HE ARG 73 HE ARG 73 16.667 -10.742 4.387 604 HH11 ARG 73 1HH1 ARG 73 17.517 -8.581 6.980 605 HH12 ARG 73 2HH1 ARG 73 18.303 -9.807 7.919 606 HH21 ARG 73 1HH2 ARG 73 17.698 -12.366 5.614 607 HH22 ARG 73 2HH2 ARG 73 18.406 -11.959 7.140 608 H LYS 74 H LYS 74 14.112 -4.064 2.957 609 HA LYS 74 HA LYS 74 16.689 -3.232 2.327 610 HB2 LYS 74 2HB LYS 74 14.380 -2.046 3.764 611 HB3 LYS 74 3HB LYS 74 15.943 -1.279 4.015 612 HG2 LYS 74 2HG LYS 74 15.203 -1.862 1.218 613 HG3 LYS 74 3HG LYS 74 14.271 -0.608 2.040 614 HD2 LYS 74 2HD LYS 74 17.255 -0.584 2.204 615 HD3 LYS 74 3HD LYS 74 16.455 0.013 0.748 616 HE2 LYS 74 2HE LYS 74 15.048 1.175 2.841 617 HE3 LYS 74 3HE LYS 74 16.733 1.248 3.355 618 HZ1 LYS 74 3HZ LYS 74 15.723 3.132 1.901 619 HZ2 LYS 74 1HZ LYS 74 16.037 2.068 0.623 620 HZ3 LYS 74 2HZ LYS 74 17.302 2.597 1.613 621 H LYS 75 H LYS 75 18.419 -2.472 3.654 622 HA LYS 75 HA LYS 75 18.588 -2.776 6.425 623 HB2 LYS 75 2HB LYS 75 18.742 -5.250 5.043 624 HB3 LYS 75 3HB LYS 75 20.357 -4.883 5.633 625 HG2 LYS 75 2HG LYS 75 18.385 -4.368 7.668 626 HG3 LYS 75 3HG LYS 75 18.253 -6.019 7.058 627 HD2 LYS 75 2HD LYS 75 20.928 -4.877 7.769 628 HD3 LYS 75 3HD LYS 75 19.867 -5.513 9.028 629 HE2 LYS 75 2HE LYS 75 19.829 -7.447 7.031 630 HE3 LYS 75 3HE LYS 75 21.509 -6.919 7.102 631 HZ1 LYS 75 3HZ LYS 75 21.126 -8.742 8.618 632 HZ2 LYS 75 1HZ LYS 75 19.888 -7.888 9.394 633 HZ3 LYS 75 2HZ LYS 75 21.485 -7.339 9.494 634 H ALA 76 H ALA 76 21.069 -3.065 7.065 635 HA ALA 76 HA ALA 76 22.790 -1.779 5.081 636 HB1 ALA 76 1HB ALA 76 21.710 -0.483 7.455 637 HB2 ALA 76 2HB ALA 76 23.470 -0.411 7.363 638 HB3 ALA 76 3HB ALA 76 22.491 0.216 6.037 Start of MODEL 5 1 H1 MET 1 H MET 1 1.727 -0.849 0.791 2 HA MET 1 HA MET 1 2.088 -0.064 -1.813 3 HB2 MET 1 2HB MET 1 2.389 2.280 0.073 4 HB3 MET 1 3HB MET 1 2.904 2.263 -1.608 5 HG2 MET 1 2HG MET 1 0.130 1.488 -1.312 6 HG3 MET 1 3HG MET 1 0.455 3.083 -0.639 7 HE1 MET 1 3HE MET 1 -0.901 4.672 -2.630 8 HE2 MET 1 1HE MET 1 -1.194 3.750 -4.105 9 HE3 MET 1 2HE MET 1 -1.547 3.034 -2.533 10 H LYS 2 H LYS 2 3.611 -1.724 -1.533 11 HA LYS 2 HA LYS 2 6.217 -0.785 -0.697 12 HB2 LYS 2 2HB LYS 2 6.567 -2.892 0.697 13 HB3 LYS 2 3HB LYS 2 5.586 -1.622 1.415 14 HG2 LYS 2 2HG LYS 2 3.557 -2.853 0.690 15 HG3 LYS 2 3HG LYS 2 4.602 -4.161 0.131 16 HD2 LYS 2 2HD LYS 2 5.552 -3.992 2.585 17 HD3 LYS 2 3HD LYS 2 3.969 -3.281 2.907 18 HE2 LYS 2 2HE LYS 2 2.943 -5.288 1.823 19 HE3 LYS 2 3HE LYS 2 4.554 -6.001 1.745 20 HZ1 LYS 2 3HZ LYS 2 3.862 -5.032 4.360 21 HZ2 LYS 2 1HZ LYS 2 4.492 -6.532 3.894 22 HZ3 LYS 2 2HZ LYS 2 2.826 -6.252 3.813 23 H ARG 3 H ARG 3 4.889 -1.638 -3.166 24 HA ARG 3 HA ARG 3 6.856 -3.648 -3.968 25 HB2 ARG 3 2HB ARG 3 5.140 -4.876 -5.267 26 HB3 ARG 3 3HB ARG 3 4.865 -4.951 -3.531 27 HG2 ARG 3 2HG ARG 3 3.496 -2.742 -4.885 28 HG3 ARG 3 3HG ARG 3 2.974 -4.354 -5.379 29 HD2 ARG 3 2HD ARG 3 3.257 -4.280 -2.535 30 HD3 ARG 3 3HD ARG 3 2.259 -2.922 -3.055 31 HE ARG 3 HE ARG 3 1.473 -5.371 -4.289 32 HH11 ARG 3 1HH1 ARG 3 1.227 -3.493 -1.368 33 HH12 ARG 3 2HH1 ARG 3 -0.282 -4.196 -0.888 34 HH21 ARG 3 1HH2 ARG 3 -0.514 -6.304 -3.668 35 HH22 ARG 3 2HH2 ARG 3 -1.271 -5.796 -2.196 36 H PHE 4 H PHE 4 7.033 -3.816 -6.360 37 HA PHE 4 HA PHE 4 6.176 -1.375 -7.748 38 HB2 PHE 4 2HB PHE 4 8.788 -1.807 -6.878 39 HB3 PHE 4 3HB PHE 4 8.824 -2.235 -8.586 40 HD1 PHE 4 HD2 PHE 4 7.056 0.406 -6.628 41 HD2 PHE 4 HD1 PHE 4 9.698 -0.526 -9.833 42 HE1 PHE 4 HE2 PHE 4 7.176 2.791 -7.218 43 HE2 PHE 4 HE1 PHE 4 9.823 1.858 -10.428 44 HZ PHE 4 HZ PHE 4 8.560 3.520 -9.121 45 H ASP 5 H ASP 5 5.086 -1.917 -9.506 46 HA ASP 5 HA ASP 5 5.411 -4.568 -10.663 47 HB2 ASP 5 2HB ASP 5 3.259 -2.709 -10.409 48 HB3 ASP 5 3HB ASP 5 3.524 -3.015 -12.124 49 H LEU 6 H LEU 6 7.154 -4.694 -11.957 50 HA LEU 6 HA LEU 6 7.659 -2.533 -13.872 51 HB2 LEU 6 2HB LEU 6 9.327 -4.791 -12.817 52 HB3 LEU 6 3HB LEU 6 9.792 -3.908 -14.270 53 HG LEU 6 HG LEU 6 11.018 -3.029 -12.412 54 HD11 LEU 6 1HD1 LEU 6 10.666 -0.802 -12.799 55 HD12 LEU 6 2HD1 LEU 6 8.910 -0.953 -12.736 56 HD13 LEU 6 3HD1 LEU 6 9.792 -1.502 -14.162 57 HD21 LEU 6 3HD2 LEU 6 9.164 -3.820 -10.768 58 HD22 LEU 6 1HD2 LEU 6 8.511 -2.201 -11.013 59 HD23 LEU 6 2HD2 LEU 6 10.140 -2.405 -10.370 60 H ARG 7 H ARG 7 5.772 -5.099 -13.843 61 HA ARG 7 HA ARG 7 6.412 -6.783 -15.919 62 HB2 ARG 7 2HB ARG 7 4.036 -6.064 -14.473 63 HB3 ARG 7 3HB ARG 7 3.649 -6.251 -16.178 64 HG2 ARG 7 2HG ARG 7 4.304 -8.488 -16.206 65 HG3 ARG 7 3HG ARG 7 5.225 -8.331 -14.709 66 HD2 ARG 7 2HD ARG 7 3.446 -9.094 -13.616 67 HD3 ARG 7 3HD ARG 7 2.608 -7.605 -14.052 68 HE ARG 7 HE ARG 7 2.403 -9.366 -16.205 69 HH11 ARG 7 1HH1 ARG 7 1.330 -9.112 -12.903 70 HH12 ARG 7 2HH1 ARG 7 -0.116 -10.029 -13.165 71 HH21 ARG 7 1HH2 ARG 7 0.502 -10.575 -16.563 72 HH22 ARG 7 2HH2 ARG 7 -0.586 -10.862 -15.247 73 HA PRO 8 HA PRO 8 4.333 -3.800 -19.094 74 HB2 PRO 8 2HB PRO 8 3.647 -1.322 -18.224 75 HB3 PRO 8 3HB PRO 8 2.553 -2.708 -18.137 76 HG2 PRO 8 2HG PRO 8 4.269 -1.512 -15.995 77 HG3 PRO 8 3HG PRO 8 2.593 -2.082 -15.898 78 HD2 PRO 8 2HD PRO 8 4.686 -3.557 -15.018 79 HD3 PRO 8 3HD PRO 8 3.222 -4.291 -15.703 80 H LEU 9 H LEU 9 6.758 -2.996 -16.864 81 HA LEU 9 HA LEU 9 7.881 -0.820 -18.414 82 HB2 LEU 9 2HB LEU 9 8.275 -1.978 -15.777 83 HB3 LEU 9 3HB LEU 9 9.797 -1.614 -16.587 84 HG LEU 9 HG LEU 9 8.210 0.667 -16.922 85 HD11 LEU 9 1HD1 LEU 9 7.134 -0.699 -14.789 86 HD12 LEU 9 2HD1 LEU 9 6.988 1.031 -15.096 87 HD13 LEU 9 3HD1 LEU 9 8.254 0.429 -14.025 88 HD21 LEU 9 3HD2 LEU 9 10.754 0.109 -16.293 89 HD22 LEU 9 1HD2 LEU 9 10.160 0.591 -14.704 90 HD23 LEU 9 2HD2 LEU 9 10.031 1.702 -16.067 91 H LYS 10 H LYS 10 9.659 -0.911 -19.714 92 HA LYS 10 HA LYS 10 10.348 -3.478 -20.801 93 HB2 LYS 10 2HB LYS 10 11.582 -2.285 -22.441 94 HB3 LYS 10 3HB LYS 10 10.138 -1.331 -22.123 95 HG2 LYS 10 2HG LYS 10 11.454 0.130 -20.647 96 HG3 LYS 10 3HG LYS 10 12.898 -0.805 -21.038 97 HD2 LYS 10 2HD LYS 10 13.020 1.014 -22.489 98 HD3 LYS 10 3HD LYS 10 12.322 -0.261 -23.491 99 HE2 LYS 10 2HE LYS 10 10.210 0.692 -23.454 100 HE3 LYS 10 3HE LYS 10 10.539 1.609 -21.984 101 HZ1 LYS 10 3HZ LYS 10 11.869 3.130 -23.179 102 HZ2 LYS 10 1HZ LYS 10 10.455 2.935 -24.087 103 HZ3 LYS 10 2HZ LYS 10 11.882 2.164 -24.567 104 H ALA 11 H ALA 11 12.607 -4.182 -21.079 105 HA ALA 11 HA ALA 11 13.949 -4.271 -18.567 106 HB1 ALA 11 1HB ALA 11 13.859 -5.959 -20.636 107 HB2 ALA 11 2HB ALA 11 15.386 -5.152 -20.996 108 HB3 ALA 11 3HB ALA 11 15.163 -5.967 -19.449 109 H GLY 12 H GLY 12 15.951 -3.426 -17.978 110 HA2 GLY 12 2HA GLY 12 17.970 -2.214 -18.483 111 HA3 GLY 12 3HA GLY 12 17.113 -1.421 -19.797 112 H ILE 13 H ILE 13 14.788 -0.645 -18.474 113 HA ILE 13 HA ILE 13 15.867 1.466 -16.750 114 HB ILE 13 HB ILE 13 13.114 1.360 -17.973 115 HG12 ILE 13 2HG1 ILE 13 15.614 2.679 -19.053 116 HG13 ILE 13 3HG1 ILE 13 14.804 1.282 -19.753 117 HG21 ILE 13 1HG2 ILE 13 14.163 3.982 -17.585 118 HG22 ILE 13 2HG2 ILE 13 12.751 3.232 -16.842 119 HG23 ILE 13 3HG2 ILE 13 14.335 3.068 -16.086 120 HD11 ILE 13 3HD1 ILE 13 14.110 3.075 -21.059 121 HD12 ILE 13 1HD1 ILE 13 12.763 2.802 -19.955 122 HD13 ILE 13 2HD1 ILE 13 13.889 4.128 -19.662 123 H PHE 14 H PHE 14 13.679 -1.237 -16.779 124 HA PHE 14 HA PHE 14 12.134 -0.667 -14.525 125 HB2 PHE 14 2HB PHE 14 11.488 -2.923 -14.548 126 HB3 PHE 14 3HB PHE 14 11.903 -2.590 -16.227 127 HD1 PHE 14 HD1 PHE 14 14.611 -2.925 -16.598 128 HD2 PHE 14 HD2 PHE 14 12.130 -4.990 -13.823 129 HE1 PHE 14 HE1 PHE 14 16.201 -4.803 -16.579 130 HE2 PHE 14 HE2 PHE 14 13.716 -6.870 -13.799 131 HZ PHE 14 HZ PHE 14 15.755 -6.779 -15.177 132 H GLU 15 H GLU 15 15.425 -1.722 -14.817 133 HA GLU 15 HA GLU 15 15.649 -2.549 -12.058 134 HB2 GLU 15 2HB GLU 15 17.022 -3.696 -13.663 135 HB3 GLU 15 3HB GLU 15 17.692 -2.181 -14.251 136 HG2 GLU 15 2HG GLU 15 18.111 -2.535 -11.405 137 HG3 GLU 15 3HG GLU 15 18.805 -3.846 -12.357 138 H ARG 16 H ARG 16 16.076 0.343 -13.903 139 HA ARG 16 HA ARG 16 17.709 1.670 -11.931 140 HB2 ARG 16 2HB ARG 16 16.709 2.244 -14.618 141 HB3 ARG 16 3HB ARG 16 16.680 3.647 -13.558 142 HG2 ARG 16 2HG ARG 16 18.887 3.892 -13.661 143 HG3 ARG 16 3HG ARG 16 19.172 2.175 -13.366 144 HD2 ARG 16 2HD ARG 16 19.373 1.702 -15.560 145 HD3 ARG 16 3HD ARG 16 18.096 2.826 -16.023 146 HE ARG 16 HE ARG 16 20.481 4.157 -15.175 147 HH11 ARG 16 1HH1 ARG 16 18.930 2.572 -17.859 148 HH12 ARG 16 2HH1 ARG 16 19.846 3.423 -19.059 149 HH21 ARG 16 1HH2 ARG 16 21.693 5.283 -16.746 150 HH22 ARG 16 2HH2 ARG 16 21.418 4.964 -18.425 151 H LEU 17 H LEU 17 14.314 1.586 -12.853 152 HA LEU 17 HA LEU 17 13.515 3.728 -11.144 153 HB2 LEU 17 2HB LEU 17 12.332 2.129 -13.132 154 HB3 LEU 17 3HB LEU 17 11.386 1.877 -11.666 155 HG LEU 17 HG LEU 17 10.375 3.621 -12.971 156 HD11 LEU 17 1HD1 LEU 17 9.887 4.816 -11.159 157 HD12 LEU 17 2HD1 LEU 17 11.537 5.424 -11.020 158 HD13 LEU 17 3HD1 LEU 17 11.110 3.863 -10.318 159 HD21 LEU 17 3HD2 LEU 17 11.457 5.433 -13.880 160 HD22 LEU 17 1HD2 LEU 17 12.701 4.192 -14.023 161 HD23 LEU 17 2HD2 LEU 17 12.778 5.370 -12.712 162 H GLU 18 H GLU 18 13.998 0.313 -10.742 163 HA GLU 18 HA GLU 18 12.419 -0.195 -8.505 164 HB2 GLU 18 2HB GLU 18 14.220 -1.633 -10.002 165 HB3 GLU 18 3HB GLU 18 15.041 -1.507 -8.452 166 HG2 GLU 18 2HG GLU 18 13.775 -3.112 -7.620 167 HG3 GLU 18 3HG GLU 18 12.320 -2.185 -7.981 168 H GLU 19 H GLU 19 15.460 1.479 -8.799 169 HA GLU 19 HA GLU 19 16.013 1.462 -5.972 170 HB2 GLU 19 2HB GLU 19 17.912 1.542 -7.403 171 HB3 GLU 19 3HB GLU 19 17.256 2.895 -8.315 172 HG2 GLU 19 2HG GLU 19 17.545 3.511 -5.498 173 HG3 GLU 19 3HG GLU 19 19.069 3.031 -6.242 174 H LEU 20 H LEU 20 14.444 3.574 -8.267 175 HA LEU 20 HA LEU 20 14.430 5.957 -6.810 176 HB2 LEU 20 2HB LEU 20 13.123 4.884 -9.126 177 HB3 LEU 20 3HB LEU 20 11.960 5.772 -8.144 178 HG LEU 20 HG LEU 20 14.023 7.537 -8.234 179 HD11 LEU 20 1HD1 LEU 20 13.920 6.584 -11.052 180 HD12 LEU 20 2HD1 LEU 20 15.023 5.795 -9.925 181 HD13 LEU 20 3HD1 LEU 20 15.158 7.528 -10.221 182 HD21 LEU 20 3HD2 LEU 20 11.542 7.794 -8.733 183 HD22 LEU 20 1HD2 LEU 20 11.947 7.392 -10.401 184 HD23 LEU 20 2HD2 LEU 20 12.649 8.822 -9.643 185 H ILE 21 H ILE 21 12.429 3.093 -6.557 186 HA ILE 21 HA ILE 21 10.682 4.363 -4.599 187 HB ILE 21 HB ILE 21 9.668 2.879 -6.269 188 HG12 ILE 21 2HG1 ILE 21 8.409 1.420 -4.672 189 HG13 ILE 21 3HG1 ILE 21 9.562 1.868 -3.420 190 HG21 ILE 21 1HG2 ILE 21 10.068 0.480 -6.225 191 HG22 ILE 21 2HG2 ILE 21 11.564 1.353 -6.555 192 HG23 ILE 21 3HG2 ILE 21 11.267 0.689 -4.949 193 HD11 ILE 21 3HD1 ILE 21 8.596 3.852 -3.076 194 HD12 ILE 21 1HD1 ILE 21 8.332 4.137 -4.796 195 HD13 ILE 21 2HD1 ILE 21 7.210 3.124 -3.887 196 H GLU 22 H GLU 22 13.238 1.964 -4.788 197 HA GLU 22 HA GLU 22 13.016 0.797 -2.276 198 HB2 GLU 22 2HB GLU 22 14.661 0.375 -4.306 199 HB3 GLU 22 3HB GLU 22 15.730 1.401 -3.360 200 HG2 GLU 22 2HG GLU 22 15.978 -0.140 -1.702 201 HG3 GLU 22 3HG GLU 22 14.396 -0.863 -1.984 202 H LYS 23 H LYS 23 14.165 3.941 -3.190 203 HA LYS 23 HA LYS 23 15.657 4.550 -0.872 204 HB2 LYS 23 2HB LYS 23 14.656 5.966 -3.209 205 HB3 LYS 23 3HB LYS 23 14.591 6.961 -1.760 206 HG2 LYS 23 2HG LYS 23 16.682 7.439 -2.603 207 HG3 LYS 23 3HG LYS 23 17.034 6.187 -1.409 208 HD2 LYS 23 2HD LYS 23 16.804 4.539 -3.367 209 HD3 LYS 23 3HD LYS 23 16.942 5.962 -4.402 210 HE2 LYS 23 2HE LYS 23 18.990 6.133 -2.462 211 HE3 LYS 23 3HE LYS 23 19.002 4.484 -3.086 212 HZ1 LYS 23 3HZ LYS 23 20.226 6.543 -4.269 213 HZ2 LYS 23 1HZ LYS 23 18.748 6.556 -5.092 214 HZ3 LYS 23 2HZ LYS 23 19.703 5.160 -5.091 215 H GLU 24 H GLU 24 12.241 4.898 -1.679 216 HA GLU 24 HA GLU 24 11.586 6.301 0.733 217 HB2 GLU 24 2HB GLU 24 10.318 5.856 -1.688 218 HB3 GLU 24 3HB GLU 24 9.374 4.900 -0.554 219 HG2 GLU 24 2HG GLU 24 9.999 7.569 0.430 220 HG3 GLU 24 3HG GLU 24 9.055 7.570 -1.059 221 H MET 25 H MET 25 11.862 2.983 -0.215 222 HA MET 25 HA MET 25 10.216 1.794 1.730 223 HB2 MET 25 2HB MET 25 12.715 0.716 0.413 224 HB3 MET 25 3HB MET 25 11.559 -0.245 1.325 225 HG2 MET 25 2HG MET 25 10.965 1.272 -1.205 226 HG3 MET 25 3HG MET 25 11.243 -0.464 -1.085 227 HE1 MET 25 3HE MET 25 10.051 -1.818 0.720 228 HE2 MET 25 1HE MET 25 9.255 -0.821 1.938 229 HE3 MET 25 2HE MET 25 8.291 -1.811 0.843 230 H GLN 26 H GLN 26 10.640 0.982 3.772 231 HA GLN 26 HA GLN 26 12.439 2.452 5.373 232 HB2 GLN 26 2HB GLN 26 10.424 0.388 5.761 233 HB3 GLN 26 3HB GLN 26 11.799 0.179 6.837 234 HG2 GLN 26 2HG GLN 26 10.472 1.528 8.106 235 HG3 GLN 26 3HG GLN 26 11.456 2.734 7.278 236 HE21 GLN 26 1HE2 GLN 26 8.409 2.001 8.178 237 HE22 GLN 26 2HE2 GLN 26 7.522 2.902 7.002 238 HA PRO 27 HA PRO 27 16.198 0.198 5.259 239 HB2 PRO 27 2HB PRO 27 16.982 0.212 7.858 240 HB3 PRO 27 3HB PRO 27 17.016 1.654 6.837 241 HG2 PRO 27 2HG PRO 27 14.976 0.812 8.860 242 HG3 PRO 27 3HG PRO 27 15.672 2.418 8.574 243 HD2 PRO 27 2HD PRO 27 13.230 1.704 7.650 244 HD3 PRO 27 3HD PRO 27 14.283 2.840 6.784 245 H ASN 28 H ASN 28 13.507 -1.039 6.877 246 HA ASN 28 HA ASN 28 14.680 -3.713 6.860 247 HB2 ASN 28 2HB ASN 28 14.581 -2.412 9.226 248 HB3 ASN 28 3HB ASN 28 12.973 -3.132 9.211 249 HD21 ASN 28 1HD2 ASN 28 13.369 -4.564 10.847 250 HD22 ASN 28 2HD2 ASN 28 14.439 -5.911 10.687 251 H GLU 29 H GLU 29 12.793 -2.370 5.140 252 HA GLU 29 HA GLU 29 10.303 -3.811 5.748 253 HB2 GLU 29 2HB GLU 29 10.868 -1.204 4.633 254 HB3 GLU 29 3HB GLU 29 9.874 -2.148 3.532 255 HG2 GLU 29 2HG GLU 29 8.461 -2.635 5.661 256 HG3 GLU 29 3HG GLU 29 9.265 -1.198 6.290 257 H VAL 30 H VAL 30 9.111 -4.559 3.720 258 HA VAL 30 HA VAL 30 11.020 -6.055 2.066 259 HB VAL 30 HB VAL 30 9.197 -7.240 3.405 260 HG11 VAL 30 1HG1 VAL 30 6.981 -7.222 2.661 261 HG12 VAL 30 2HG1 VAL 30 7.456 -5.522 2.630 262 HG13 VAL 30 3HG1 VAL 30 7.404 -6.453 1.132 263 HG21 VAL 30 3HG2 VAL 30 8.719 -8.821 1.523 264 HG22 VAL 30 1HG2 VAL 30 9.496 -7.668 0.437 265 HG23 VAL 30 2HG2 VAL 30 10.425 -8.424 1.732 266 H ALA 31 H ALA 31 10.873 -6.101 -0.173 267 HA ALA 31 HA ALA 31 9.025 -4.175 -1.411 268 HB1 ALA 31 1HB ALA 31 10.682 -3.142 -2.659 269 HB2 ALA 31 2HB ALA 31 11.460 -3.365 -1.092 270 HB3 ALA 31 3HB ALA 31 11.826 -4.463 -2.423 271 H ILE 32 H ILE 32 7.736 -5.309 -2.700 272 HA ILE 32 HA ILE 32 8.729 -7.736 -3.987 273 HB ILE 32 HB ILE 32 5.931 -6.608 -3.845 274 HG12 ILE 32 2HG1 ILE 32 6.322 -9.171 -2.587 275 HG13 ILE 32 3HG1 ILE 32 7.463 -8.001 -1.932 276 HG21 ILE 32 1HG2 ILE 32 5.648 -7.890 -5.672 277 HG22 ILE 32 2HG2 ILE 32 7.114 -8.822 -5.373 278 HG23 ILE 32 3HG2 ILE 32 5.629 -9.212 -4.506 279 HD11 ILE 32 3HD1 ILE 32 5.873 -7.126 -0.678 280 HD12 ILE 32 1HD1 ILE 32 4.894 -6.786 -2.105 281 HD13 ILE 32 2HD1 ILE 32 4.749 -8.341 -1.285 282 H PHE 33 H PHE 33 9.807 -7.319 -5.819 283 HA PHE 33 HA PHE 33 8.707 -5.337 -7.685 284 HB2 PHE 33 2HB PHE 33 11.437 -6.637 -7.727 285 HB3 PHE 33 3HB PHE 33 10.897 -5.291 -8.725 286 HD1 PHE 33 HD2 PHE 33 9.486 -3.667 -6.672 287 HD2 PHE 33 HD1 PHE 33 13.214 -5.716 -6.537 288 HE1 PHE 33 HE2 PHE 33 10.291 -2.083 -4.970 289 HE2 PHE 33 HE1 PHE 33 14.025 -4.135 -4.834 290 HZ PHE 33 HZ PHE 33 12.563 -2.315 -4.050 291 H MET 34 H MET 34 7.329 -6.229 -9.081 292 HA MET 34 HA MET 34 7.582 -8.977 -9.918 293 HB2 MET 34 2HB MET 34 5.432 -7.438 -9.568 294 HB3 MET 34 3HB MET 34 5.697 -7.118 -11.277 295 HG2 MET 34 2HG MET 34 5.484 -9.433 -11.816 296 HG3 MET 34 3HG MET 34 5.452 -9.877 -10.111 297 HE1 MET 34 3HE MET 34 3.120 -9.731 -8.585 298 HE2 MET 34 1HE MET 34 3.786 -8.099 -8.649 299 HE3 MET 34 2HE MET 34 2.065 -8.360 -8.931 300 H PHE 35 H PHE 35 8.500 -9.722 -11.727 301 HA PHE 35 HA PHE 35 9.155 -7.812 -13.864 302 HB2 PHE 35 2HB PHE 35 11.363 -8.764 -14.121 303 HB3 PHE 35 3HB PHE 35 11.160 -8.245 -12.451 304 HD1 PHE 35 HD1 PHE 35 10.414 -10.061 -10.767 305 HD2 PHE 35 HD2 PHE 35 12.107 -10.901 -14.580 306 HE1 PHE 35 HE1 PHE 35 11.037 -12.311 -9.990 307 HE2 PHE 35 HE2 PHE 35 12.732 -13.153 -13.810 308 HZ PHE 35 HZ PHE 35 12.196 -13.861 -11.513 309 H GLU 36 H GLU 36 8.494 -8.466 -15.801 310 HA GLU 36 HA GLU 36 7.677 -11.265 -16.122 311 HB2 GLU 36 2HB GLU 36 6.303 -10.499 -17.972 312 HB3 GLU 36 3HB GLU 36 5.968 -9.538 -16.539 313 HG2 GLU 36 2HG GLU 36 6.179 -7.792 -17.905 314 HG3 GLU 36 3HG GLU 36 7.912 -8.063 -17.733 315 H VAL 37 H VAL 37 10.115 -9.095 -17.006 316 HA VAL 37 HA VAL 37 10.749 -10.259 -19.560 317 HB VAL 37 HB VAL 37 12.594 -8.567 -17.884 318 HG11 VAL 37 1HG1 VAL 37 13.903 -9.028 -19.646 319 HG12 VAL 37 2HG1 VAL 37 12.546 -9.565 -20.638 320 HG13 VAL 37 3HG1 VAL 37 12.907 -7.844 -20.493 321 HG21 VAL 37 3HG2 VAL 37 10.216 -7.757 -19.520 322 HG22 VAL 37 1HG2 VAL 37 10.686 -7.233 -17.903 323 HG23 VAL 37 2HG2 VAL 37 11.587 -6.668 -19.309 324 H GLY 38 H GLY 38 12.709 -11.410 -20.043 325 HA2 GLY 38 2HA GLY 38 13.230 -13.512 -18.190 326 HA3 GLY 38 3HA GLY 38 14.051 -13.253 -19.723 327 H ASP 39 H ASP 39 14.439 -10.390 -18.368 328 HA ASP 39 HA ASP 39 17.152 -10.853 -17.657 329 HB2 ASP 39 2HB ASP 39 15.334 -8.519 -17.797 330 HB3 ASP 39 3HB ASP 39 16.697 -8.371 -16.691 331 H PHE 40 H PHE 40 17.018 -12.421 -15.985 332 HA PHE 40 HA PHE 40 15.765 -11.651 -13.478 333 HB2 PHE 40 2HB PHE 40 16.195 -13.868 -12.738 334 HB3 PHE 40 3HB PHE 40 15.705 -14.008 -14.423 335 HD1 PHE 40 HD2 PHE 40 18.481 -14.296 -12.063 336 HD2 PHE 40 HD1 PHE 40 17.270 -14.691 -16.124 337 HE1 PHE 40 HE2 PHE 40 20.547 -15.538 -12.555 338 HE2 PHE 40 HE1 PHE 40 19.333 -15.935 -16.622 339 HZ PHE 40 HZ PHE 40 20.976 -16.358 -14.837 340 H SER 41 H SER 41 18.877 -11.641 -14.957 341 HA SER 41 HA SER 41 20.413 -11.571 -12.545 342 HB2 SER 41 2HB SER 41 22.211 -11.655 -13.918 343 HB3 SER 41 3HB SER 41 21.024 -11.991 -15.178 344 HG SER 41 HG SER 41 22.358 -9.592 -14.578 345 H ASN 42 H ASN 42 18.510 -9.304 -14.205 346 HA ASN 42 HA ASN 42 19.966 -6.976 -13.272 347 HB2 ASN 42 2HB ASN 42 17.834 -7.513 -15.183 348 HB3 ASN 42 3HB ASN 42 17.484 -6.109 -14.178 349 HD21 ASN 42 1HD2 ASN 42 17.960 -4.363 -15.292 350 HD22 ASN 42 2HD2 ASN 42 19.403 -4.101 -16.205 351 H ILE 43 H ILE 43 17.271 -8.937 -12.302 352 HA ILE 43 HA ILE 43 15.822 -7.248 -10.677 353 HB ILE 43 HB ILE 43 16.372 -10.169 -10.622 354 HG12 ILE 43 2HG1 ILE 43 14.593 -9.154 -12.025 355 HG13 ILE 43 3HG1 ILE 43 13.958 -10.301 -10.851 356 HG21 ILE 43 1HG2 ILE 43 16.504 -9.893 -8.315 357 HG22 ILE 43 2HG2 ILE 43 15.308 -8.597 -8.305 358 HG23 ILE 43 3HG2 ILE 43 14.801 -10.263 -8.585 359 HD11 ILE 43 3HD1 ILE 43 13.231 -7.598 -11.261 360 HD12 ILE 43 1HD1 ILE 43 12.574 -8.754 -10.103 361 HD13 ILE 43 2HD1 ILE 43 13.943 -7.737 -9.653 362 HA PRO 44 HA PRO 44 18.795 -8.243 -6.994 363 HB2 PRO 44 2HB PRO 44 21.150 -9.452 -7.596 364 HB3 PRO 44 3HB PRO 44 19.680 -10.353 -7.207 365 HG2 PRO 44 2HG PRO 44 20.866 -9.726 -9.884 366 HG3 PRO 44 3HG PRO 44 20.161 -11.245 -9.300 367 HD2 PRO 44 2HD PRO 44 18.801 -9.524 -10.887 368 HD3 PRO 44 3HD PRO 44 18.001 -10.529 -9.662 369 H LYS 45 H LYS 45 19.853 -7.141 -10.084 370 HA LYS 45 HA LYS 45 22.152 -5.696 -9.180 371 HB2 LYS 45 2HB LYS 45 21.382 -6.512 -11.606 372 HB3 LYS 45 3HB LYS 45 20.732 -4.879 -11.663 373 HG2 LYS 45 2HG LYS 45 23.349 -4.659 -10.661 374 HG3 LYS 45 3HG LYS 45 23.420 -5.768 -12.033 375 HD2 LYS 45 2HD LYS 45 21.986 -4.002 -13.249 376 HD3 LYS 45 3HD LYS 45 22.501 -2.914 -11.958 377 HE2 LYS 45 2HE LYS 45 24.566 -2.716 -12.801 378 HE3 LYS 45 3HE LYS 45 24.693 -4.444 -13.128 379 HZ1 LYS 45 3HZ LYS 45 24.581 -2.636 -15.044 380 HZ2 LYS 45 1HZ LYS 45 22.921 -2.904 -14.856 381 HZ3 LYS 45 2HZ LYS 45 23.949 -4.194 -15.233 382 H SER 46 H SER 46 18.746 -5.016 -9.518 383 HA SER 46 HA SER 46 18.910 -2.192 -9.364 384 HB2 SER 46 2HB SER 46 16.484 -3.393 -8.227 385 HB3 SER 46 3HB SER 46 16.661 -2.265 -9.570 386 HG SER 46 HG SER 46 16.206 -4.881 -9.666 387 H ALA 47 H ALA 47 18.074 -4.626 -6.896 388 HA ALA 47 HA ALA 47 17.884 -2.871 -4.732 389 HB1 ALA 47 1HB ALA 47 17.286 -5.406 -4.967 390 HB2 ALA 47 2HB ALA 47 18.913 -5.640 -4.326 391 HB3 ALA 47 3HB ALA 47 17.720 -4.733 -3.396 392 H GLU 48 H GLU 48 20.650 -4.135 -6.374 393 HA GLU 48 HA GLU 48 22.521 -3.686 -4.252 394 HB2 GLU 48 2HB GLU 48 22.811 -5.308 -6.181 395 HB3 GLU 48 3HB GLU 48 23.146 -3.911 -7.194 396 HG2 GLU 48 2HG GLU 48 24.862 -3.484 -5.143 397 HG3 GLU 48 3HG GLU 48 24.827 -5.245 -5.200 398 H PHE 49 H PHE 49 21.149 -1.781 -6.803 399 HA PHE 49 HA PHE 49 23.077 0.215 -7.074 400 HB2 PHE 49 2HB PHE 49 20.516 -0.250 -8.060 401 HB3 PHE 49 3HB PHE 49 20.368 1.268 -7.181 402 HD1 PHE 49 HD2 PHE 49 21.856 3.179 -7.788 403 HD2 PHE 49 HD1 PHE 49 21.608 -0.360 -10.139 404 HE1 PHE 49 HE2 PHE 49 22.849 4.379 -9.693 405 HE2 PHE 49 HE1 PHE 49 22.602 0.833 -12.047 406 HZ PHE 49 HZ PHE 49 23.223 3.206 -11.826 407 H ILE 50 H ILE 50 20.913 -0.464 -4.485 408 HA ILE 50 HA ILE 50 20.985 2.164 -3.320 409 HB ILE 50 HB ILE 50 20.173 -0.448 -2.039 410 HG12 ILE 50 2HG1 ILE 50 18.870 0.104 -4.085 411 HG13 ILE 50 3HG1 ILE 50 17.893 0.136 -2.621 412 HG21 ILE 50 1HG2 ILE 50 20.670 1.292 -0.417 413 HG22 ILE 50 2HG2 ILE 50 19.603 2.410 -1.265 414 HG23 ILE 50 3HG2 ILE 50 18.936 0.981 -0.475 415 HD11 ILE 50 3HD1 ILE 50 17.893 2.517 -2.592 416 HD12 ILE 50 1HD1 ILE 50 19.071 2.586 -3.902 417 HD13 ILE 50 2HD1 ILE 50 17.441 1.988 -4.212 418 H GLN 51 H GLN 51 22.050 -0.933 -1.915 419 HA GLN 51 HA GLN 51 24.605 0.267 -1.187 420 HB2 GLN 51 2HB GLN 51 22.567 0.307 0.642 421 HB3 GLN 51 3HB GLN 51 23.378 -1.202 1.041 422 HG2 GLN 51 2HG GLN 51 25.264 -0.165 1.762 423 HG3 GLN 51 3HG GLN 51 25.071 1.197 0.660 424 HE21 GLN 51 1HE2 GLN 51 25.685 1.251 3.475 425 HE22 GLN 51 2HE2 GLN 51 24.422 2.144 4.243 426 H SER 52 H SER 52 26.241 -1.149 -1.307 427 HA SER 52 HA SER 52 25.964 -3.642 -2.476 428 HB2 SER 52 2HB SER 52 28.307 -4.063 -1.669 429 HB3 SER 52 3HB SER 52 28.097 -2.523 -2.502 430 HG SER 52 HG SER 52 29.305 -2.378 -0.520 431 H LYS 53 H LYS 53 25.820 -2.735 0.889 432 HA LYS 53 HA LYS 53 25.303 -5.553 1.580 433 HB2 LYS 53 2HB LYS 53 27.003 -3.513 2.891 434 HB3 LYS 53 3HB LYS 53 26.031 -4.514 3.963 435 HG2 LYS 53 2HG LYS 53 27.479 -6.173 3.775 436 HG3 LYS 53 3HG LYS 53 27.281 -6.186 2.021 437 HD2 LYS 53 2HD LYS 53 29.184 -5.022 1.669 438 HD3 LYS 53 3HD LYS 53 28.949 -4.007 3.094 439 HE2 LYS 53 2HE LYS 53 29.470 -6.258 4.361 440 HE3 LYS 53 3HE LYS 53 30.269 -6.666 2.843 441 HZ1 LYS 53 3HZ LYS 53 31.619 -4.688 3.045 442 HZ2 LYS 53 1HZ LYS 53 31.786 -5.639 4.435 443 HZ3 LYS 53 2HZ LYS 53 30.827 -4.246 4.473 444 H GLY 54 H GLY 54 23.202 -5.813 1.954 445 HA2 GLY 54 2HA GLY 54 21.699 -4.958 3.971 446 HA3 GLY 54 3HA GLY 54 21.597 -3.570 2.898 447 H HIS 55 H HIS 55 21.395 -4.693 0.434 448 HA HIS 55 HA HIS 55 18.679 -5.572 0.422 449 HB2 HIS 55 2HB HIS 55 18.864 -5.556 -1.984 450 HB3 HIS 55 3HB HIS 55 19.688 -4.134 -1.351 451 HD1 HIS 55 HD1 HIS 55 22.415 -4.512 -1.102 452 HD2 HIS 55 HD2 HIS 55 20.354 -6.962 -3.750 453 HE1 HIS 55 HE1 HIS 55 24.161 -5.449 -2.650 454 H GLU 56 H GLU 56 18.002 -7.577 0.749 455 HA GLU 56 HA GLU 56 19.572 -9.807 -0.318 456 HB2 GLU 56 2HB GLU 56 19.316 -9.176 2.461 457 HB3 GLU 56 3HB GLU 56 18.456 -10.676 2.144 458 HG2 GLU 56 2HG GLU 56 21.111 -10.497 0.914 459 HG3 GLU 56 3HG GLU 56 21.102 -10.494 2.677 460 H LEU 57 H LEU 57 18.330 -11.116 -1.477 461 HA LEU 57 HA LEU 57 15.503 -10.762 -1.598 462 HB2 LEU 57 2HB LEU 57 17.287 -12.869 -2.807 463 HB3 LEU 57 3HB LEU 57 15.578 -12.663 -3.184 464 HG LEU 57 HG LEU 57 16.637 -11.639 -4.971 465 HD11 LEU 57 1HD1 LEU 57 16.553 -9.178 -3.321 466 HD12 LEU 57 2HD1 LEU 57 15.076 -10.134 -3.442 467 HD13 LEU 57 3HD1 LEU 57 15.845 -9.511 -4.901 468 HD21 LEU 57 3HD2 LEU 57 18.752 -10.932 -4.969 469 HD22 LEU 57 1HD2 LEU 57 18.840 -11.544 -3.316 470 HD23 LEU 57 2HD2 LEU 57 18.474 -9.843 -3.609 471 H LEU 58 H LEU 58 14.021 -11.644 -0.329 472 HA LEU 58 HA LEU 58 14.518 -13.328 1.803 473 HB2 LEU 58 2HB LEU 58 12.331 -12.005 0.794 474 HB3 LEU 58 3HB LEU 58 11.865 -13.698 0.644 475 HG LEU 58 HG LEU 58 12.908 -13.374 3.244 476 HD11 LEU 58 1HD1 LEU 58 12.012 -11.502 4.156 477 HD12 LEU 58 2HD1 LEU 58 10.676 -11.444 3.006 478 HD13 LEU 58 3HD1 LEU 58 12.278 -10.889 2.523 479 HD21 LEU 58 3HD2 LEU 58 10.359 -13.655 3.741 480 HD22 LEU 58 1HD2 LEU 58 11.267 -14.964 2.984 481 HD23 LEU 58 2HD2 LEU 58 10.250 -13.912 1.999 482 H ASN 59 H ASN 59 12.958 -14.264 -1.270 483 HA ASN 59 HA ASN 59 14.144 -16.936 -0.956 484 HB2 ASN 59 2HB ASN 59 11.581 -16.647 -0.390 485 HB3 ASN 59 3HB ASN 59 11.410 -16.678 -2.142 486 HD21 ASN 59 1HD2 ASN 59 12.253 -18.482 0.691 487 HD22 ASN 59 2HD2 ASN 59 12.280 -20.039 -0.056 488 H SER 60 H SER 60 15.361 -15.077 -2.484 489 HA SER 60 HA SER 60 16.030 -14.500 -4.595 490 HB2 SER 60 2HB SER 60 16.777 -16.315 -5.810 491 HB3 SER 60 3HB SER 60 16.497 -17.082 -4.247 492 HG SER 60 HG SER 60 14.690 -18.013 -5.008 493 H LEU 61 H LEU 61 15.285 -15.358 -7.119 494 HA LEU 61 HA LEU 61 12.451 -14.569 -7.277 495 HB2 LEU 61 2HB LEU 61 13.141 -13.512 -9.500 496 HB3 LEU 61 3HB LEU 61 13.565 -12.668 -8.012 497 HG LEU 61 HG LEU 61 15.636 -14.472 -9.082 498 HD11 LEU 61 1HD1 LEU 61 14.565 -13.383 -11.107 499 HD12 LEU 61 2HD1 LEU 61 16.296 -13.122 -10.890 500 HD13 LEU 61 3HD1 LEU 61 15.153 -11.849 -10.464 501 HD21 LEU 61 3HD2 LEU 61 15.388 -11.971 -7.560 502 HD22 LEU 61 1HD2 LEU 61 16.759 -12.042 -8.668 503 HD23 LEU 61 2HD2 LEU 61 16.567 -13.276 -7.422 504 H ARG 62 H ARG 62 11.166 -15.762 -8.565 505 HA ARG 62 HA ARG 62 12.347 -18.109 -9.828 506 HB2 ARG 62 2HB ARG 62 10.186 -17.954 -8.291 507 HB3 ARG 62 3HB ARG 62 9.408 -17.615 -9.831 508 HG2 ARG 62 2HG ARG 62 9.196 -19.847 -9.913 509 HG3 ARG 62 3HG ARG 62 10.858 -19.781 -10.502 510 HD2 ARG 62 2HD ARG 62 11.591 -20.892 -8.723 511 HD3 ARG 62 3HD ARG 62 10.825 -19.737 -7.632 512 HE ARG 62 HE ARG 62 9.133 -21.236 -7.299 513 HH11 ARG 62 1HH1 ARG 62 10.893 -22.137 -10.164 514 HH12 ARG 62 2HH1 ARG 62 10.051 -23.638 -10.367 515 HH21 ARG 62 1HH2 ARG 62 8.018 -23.209 -7.555 516 HH22 ARG 62 2HH2 ARG 62 8.415 -24.246 -8.883 517 H PHE 63 H PHE 63 13.323 -16.753 -11.529 518 HA PHE 63 HA PHE 63 11.621 -15.448 -13.429 519 HB2 PHE 63 2HB PHE 63 13.619 -15.006 -14.673 520 HB3 PHE 63 3HB PHE 63 14.013 -14.812 -12.968 521 HD1 PHE 63 HD2 PHE 63 15.195 -16.704 -11.786 522 HD2 PHE 63 HD1 PHE 63 14.791 -16.512 -16.018 523 HE1 PHE 63 HE2 PHE 63 17.047 -18.305 -12.031 524 HE2 PHE 63 HE1 PHE 63 16.642 -18.114 -16.271 525 HZ PHE 63 HZ PHE 63 17.773 -19.011 -14.276 526 H ASN 64 H ASN 64 12.703 -16.236 -15.867 527 HA ASN 64 HA ASN 64 12.603 -17.821 -17.512 528 HB2 ASN 64 2HB ASN 64 13.222 -19.335 -15.233 529 HB3 ASN 64 3HB ASN 64 11.860 -20.163 -15.983 530 HD21 ASN 64 1HD2 ASN 64 14.724 -18.432 -17.172 531 HD22 ASN 64 2HD2 ASN 64 15.253 -19.690 -18.231 532 H GLN 65 H GLN 65 10.236 -18.524 -14.940 533 HA GLN 65 HA GLN 65 8.193 -19.181 -16.864 534 HB2 GLN 65 2HB GLN 65 8.568 -19.423 -13.993 535 HB3 GLN 65 3HB GLN 65 6.955 -18.845 -14.392 536 HG2 GLN 65 2HG GLN 65 6.379 -20.949 -14.746 537 HG3 GLN 65 3HG GLN 65 7.418 -20.930 -16.170 538 HE21 GLN 65 1HE2 GLN 65 7.366 -21.593 -12.712 539 HE22 GLN 65 2HE2 GLN 65 8.640 -22.760 -12.731 540 H ALA 66 H ALA 66 5.905 -18.108 -15.964 541 HA ALA 66 HA ALA 66 5.734 -15.636 -17.164 542 HB1 ALA 66 1HB ALA 66 3.644 -15.393 -15.611 543 HB2 ALA 66 2HB ALA 66 3.687 -16.636 -16.862 544 HB3 ALA 66 3HB ALA 66 4.021 -17.062 -15.183 545 H ASP 67 H ASP 67 5.031 -13.559 -16.066 546 HA ASP 67 HA ASP 67 7.084 -12.408 -14.673 547 HB2 ASP 67 2HB ASP 67 5.592 -10.585 -14.147 548 HB3 ASP 67 3HB ASP 67 5.191 -11.190 -15.752 549 H TRP 68 H TRP 68 7.924 -12.797 -12.745 550 HA TRP 68 HA TRP 68 6.187 -13.902 -10.643 551 HB2 TRP 68 2HB TRP 68 8.477 -14.972 -11.584 552 HB3 TRP 68 3HB TRP 68 9.131 -13.959 -10.301 553 HD1 TRP 68 HD1 TRP 68 9.223 -15.069 -7.999 554 HE1 TRP 68 HE1 TRP 68 8.073 -17.078 -6.872 555 HE3 TRP 68 HE3 TRP 68 5.973 -16.346 -11.734 556 HZ2 TRP 68 HZ2 TRP 68 6.057 -18.955 -7.485 557 HZ3 TRP 68 HZ3 TRP 68 4.468 -18.261 -11.384 558 HH2 TRP 68 HH2 TRP 68 4.511 -19.538 -9.304 559 H THR 69 H THR 69 7.409 -13.393 -8.374 560 HA THR 69 HA THR 69 7.873 -10.486 -8.295 561 HB THR 69 HB THR 69 6.727 -10.775 -5.915 562 HG1 THR 69 HG1 THR 69 6.098 -12.863 -5.937 563 HG21 THR 69 3HG2 THR 69 4.815 -9.745 -6.789 564 HG22 THR 69 1HG2 THR 69 4.924 -10.624 -8.313 565 HG23 THR 69 2HG2 THR 69 6.077 -9.340 -7.951 566 H ILE 70 H ILE 70 9.509 -9.805 -7.015 567 HA ILE 70 HA ILE 70 10.881 -11.846 -5.389 568 HB ILE 70 HB ILE 70 12.307 -11.344 -7.225 569 HG12 ILE 70 2HG1 ILE 70 14.261 -10.415 -6.120 570 HG13 ILE 70 3HG1 ILE 70 13.247 -9.651 -4.900 571 HG21 ILE 70 1HG2 ILE 70 11.188 -8.688 -6.936 572 HG22 ILE 70 2HG2 ILE 70 12.941 -8.650 -7.120 573 HG23 ILE 70 3HG2 ILE 70 11.943 -9.448 -8.336 574 HD11 ILE 70 3HD1 ILE 70 14.429 -12.203 -4.842 575 HD12 ILE 70 1HD1 ILE 70 13.368 -11.461 -3.645 576 HD13 ILE 70 2HD1 ILE 70 12.684 -12.439 -4.943 577 H VAL 71 H VAL 71 10.869 -11.447 -3.287 578 HA VAL 71 HA VAL 71 10.221 -8.769 -2.328 579 HB VAL 71 HB VAL 71 10.196 -9.975 -0.063 580 HG11 VAL 71 1HG1 VAL 71 7.993 -11.250 -0.931 581 HG12 VAL 71 2HG1 VAL 71 8.074 -9.505 -0.681 582 HG13 VAL 71 3HG1 VAL 71 8.282 -10.176 -2.299 583 HG21 VAL 71 3HG2 VAL 71 9.811 -12.480 -1.631 584 HG22 VAL 71 1HG2 VAL 71 11.449 -11.968 -1.226 585 HG23 VAL 71 2HG2 VAL 71 10.276 -12.267 0.057 586 H VAL 72 H VAL 72 11.774 -7.401 -1.781 587 HA VAL 72 HA VAL 72 14.390 -8.478 -0.966 588 HB VAL 72 HB VAL 72 13.854 -5.681 -1.954 589 HG11 VAL 72 1HG1 VAL 72 16.103 -5.347 -1.901 590 HG12 VAL 72 2HG1 VAL 72 15.979 -6.531 -0.598 591 HG13 VAL 72 3HG1 VAL 72 16.475 -7.042 -2.212 592 HG21 VAL 72 3HG2 VAL 72 15.207 -6.975 -3.968 593 HG22 VAL 72 1HG2 VAL 72 14.032 -8.180 -3.440 594 HG23 VAL 72 2HG2 VAL 72 13.486 -6.588 -3.965 595 H ARG 73 H ARG 73 15.009 -8.206 1.072 596 HA ARG 73 HA ARG 73 13.477 -6.375 2.771 597 HB2 ARG 73 2HB ARG 73 14.694 -7.645 4.630 598 HB3 ARG 73 3HB ARG 73 13.484 -8.530 3.710 599 HG2 ARG 73 2HG ARG 73 14.998 -9.933 2.804 600 HG3 ARG 73 3HG ARG 73 16.249 -8.692 2.703 601 HD2 ARG 73 2HD ARG 73 16.967 -10.305 4.302 602 HD3 ARG 73 3HD ARG 73 16.492 -8.856 5.187 603 HE ARG 73 HE ARG 73 14.341 -10.707 4.974 604 HH11 ARG 73 1HH1 ARG 73 17.288 -10.047 6.705 605 HH12 ARG 73 2HH1 ARG 73 16.797 -10.901 8.130 606 HH21 ARG 73 1HH2 ARG 73 13.682 -11.835 6.844 607 HH22 ARG 73 2HH2 ARG 73 14.746 -11.919 8.207 608 H LYS 74 H LYS 74 14.317 -4.427 3.064 609 HA LYS 74 HA LYS 74 16.983 -3.730 2.462 610 HB2 LYS 74 2HB LYS 74 14.669 -2.364 3.757 611 HB3 LYS 74 3HB LYS 74 16.264 -1.650 3.950 612 HG2 LYS 74 2HG LYS 74 15.855 -2.340 1.205 613 HG3 LYS 74 3HG LYS 74 14.496 -1.376 1.788 614 HD2 LYS 74 2HD LYS 74 17.156 -0.421 2.609 615 HD3 LYS 74 3HD LYS 74 16.831 -0.340 0.876 616 HE2 LYS 74 2HE LYS 74 15.600 1.481 1.186 617 HE3 LYS 74 3HE LYS 74 14.525 0.583 2.256 618 HZ1 LYS 74 3HZ LYS 74 16.330 2.616 2.921 619 HZ2 LYS 74 1HZ LYS 74 16.855 1.195 3.674 620 HZ3 LYS 74 2HZ LYS 74 15.287 1.766 3.946 621 H LYS 75 H LYS 75 18.632 -2.951 3.900 622 HA LYS 75 HA LYS 75 18.582 -3.182 6.683 623 HB2 LYS 75 2HB LYS 75 18.743 -5.696 5.402 624 HB3 LYS 75 3HB LYS 75 20.345 -5.360 6.047 625 HG2 LYS 75 2HG LYS 75 18.345 -4.706 7.996 626 HG3 LYS 75 3HG LYS 75 18.119 -6.358 7.416 627 HD2 LYS 75 2HD LYS 75 20.888 -5.512 8.054 628 HD3 LYS 75 3HD LYS 75 19.783 -5.745 9.411 629 HE2 LYS 75 2HE LYS 75 19.268 -7.967 7.958 630 HE3 LYS 75 3HE LYS 75 20.967 -7.711 7.563 631 HZ1 LYS 75 3HZ LYS 75 21.567 -8.438 9.555 632 HZ2 LYS 75 1HZ LYS 75 19.964 -8.906 9.825 633 HZ3 LYS 75 2HZ LYS 75 20.501 -7.391 10.348 634 H ALA 76 H ALA 76 21.066 -3.670 7.442 635 HA ALA 76 HA ALA 76 22.873 -2.281 5.597 636 HB1 ALA 76 1HB ALA 76 22.552 -0.405 6.791 637 HB2 ALA 76 2HB ALA 76 21.892 -1.274 8.176 638 HB3 ALA 76 3HB ALA 76 23.638 -1.174 7.949 Start of MODEL 6 1 H1 MET 1 H MET 1 0.429 -0.303 -0.571 2 HA MET 1 HA MET 1 1.975 0.218 -2.643 3 HB2 MET 1 2HB MET 1 0.811 1.806 -0.767 4 HB3 MET 1 3HB MET 1 2.510 2.170 -0.497 5 HG2 MET 1 2HG MET 1 2.791 3.058 -2.616 6 HG3 MET 1 3HG MET 1 1.371 2.234 -3.257 7 HE1 MET 1 3HE MET 1 2.783 4.902 -0.991 8 HE2 MET 1 1HE MET 1 2.545 5.779 -2.502 9 HE3 MET 1 2HE MET 1 1.607 6.214 -1.074 10 H LYS 2 H LYS 2 3.295 -1.836 -1.057 11 HA LYS 2 HA LYS 2 5.964 -0.612 -0.800 12 HB2 LYS 2 2HB LYS 2 6.437 -2.621 0.708 13 HB3 LYS 2 3HB LYS 2 5.403 -1.357 1.359 14 HG2 LYS 2 2HG LYS 2 3.428 -2.707 0.785 15 HG3 LYS 2 3HG LYS 2 4.496 -3.986 0.203 16 HD2 LYS 2 2HD LYS 2 5.547 -3.922 2.533 17 HD3 LYS 2 3HD LYS 2 4.135 -2.976 3.011 18 HE2 LYS 2 2HE LYS 2 3.115 -4.923 3.382 19 HE3 LYS 2 3HE LYS 2 3.058 -5.115 1.630 20 HZ1 LYS 2 3HZ LYS 2 4.081 -7.044 2.274 21 HZ2 LYS 2 1HZ LYS 2 4.898 -6.329 3.571 22 HZ3 LYS 2 2HZ LYS 2 5.433 -6.069 1.988 23 H ARG 3 H ARG 3 4.741 -1.642 -3.226 24 HA ARG 3 HA ARG 3 6.795 -3.615 -3.894 25 HB2 ARG 3 2HB ARG 3 5.159 -4.973 -5.155 26 HB3 ARG 3 3HB ARG 3 4.831 -4.958 -3.427 27 HG2 ARG 3 2HG ARG 3 3.438 -2.896 -4.994 28 HG3 ARG 3 3HG ARG 3 2.966 -4.564 -5.328 29 HD2 ARG 3 2HD ARG 3 3.150 -4.348 -2.536 30 HD3 ARG 3 3HD ARG 3 2.311 -2.897 -3.082 31 HE ARG 3 HE ARG 3 1.189 -5.113 -4.373 32 HH11 ARG 3 1HH1 ARG 3 1.436 -3.737 -1.184 33 HH12 ARG 3 2HH1 ARG 3 -0.071 -4.398 -0.640 34 HH21 ARG 3 1HH2 ARG 3 -0.796 -5.989 -3.668 35 HH22 ARG 3 2HH2 ARG 3 -1.339 -5.679 -2.054 36 H PHE 4 H PHE 4 7.138 -3.827 -6.223 37 HA PHE 4 HA PHE 4 6.223 -1.476 -7.739 38 HB2 PHE 4 2HB PHE 4 8.827 -1.892 -6.845 39 HB3 PHE 4 3HB PHE 4 8.867 -2.392 -8.532 40 HD1 PHE 4 HD2 PHE 4 7.099 0.341 -6.706 41 HD2 PHE 4 HD1 PHE 4 9.772 -0.742 -9.837 42 HE1 PHE 4 HE2 PHE 4 7.241 2.699 -7.397 43 HE2 PHE 4 HE1 PHE 4 9.919 1.614 -10.532 44 HZ PHE 4 HZ PHE 4 8.651 3.337 -9.312 45 H ASP 5 H ASP 5 5.116 -2.087 -9.463 46 HA ASP 5 HA ASP 5 5.476 -4.771 -10.545 47 HB2 ASP 5 2HB ASP 5 3.273 -2.966 -10.287 48 HB3 ASP 5 3HB ASP 5 3.499 -3.333 -11.994 49 H LEU 6 H LEU 6 7.320 -4.735 -11.761 50 HA LEU 6 HA LEU 6 7.705 -2.635 -13.739 51 HB2 LEU 6 2HB LEU 6 9.379 -4.967 -12.845 52 HB3 LEU 6 3HB LEU 6 9.817 -3.957 -14.221 53 HG LEU 6 HG LEU 6 11.085 -3.216 -12.352 54 HD11 LEU 6 1HD1 LEU 6 9.448 -1.564 -13.795 55 HD12 LEU 6 2HD1 LEU 6 10.754 -1.040 -12.733 56 HD13 LEU 6 3HD1 LEU 6 9.097 -1.092 -12.132 57 HD21 LEU 6 3HD2 LEU 6 8.532 -2.816 -10.808 58 HD22 LEU 6 1HD2 LEU 6 10.189 -2.659 -10.225 59 HD23 LEU 6 2HD2 LEU 6 9.551 -4.248 -10.649 60 H ARG 7 H ARG 7 5.778 -5.169 -13.693 61 HA ARG 7 HA ARG 7 6.328 -6.830 -15.815 62 HB2 ARG 7 2HB ARG 7 4.039 -6.151 -14.251 63 HB3 ARG 7 3HB ARG 7 3.555 -6.201 -15.941 64 HG2 ARG 7 2HG ARG 7 4.210 -8.450 -16.170 65 HG3 ARG 7 3HG ARG 7 5.104 -8.423 -14.649 66 HD2 ARG 7 2HD ARG 7 3.178 -9.517 -14.025 67 HD3 ARG 7 3HD ARG 7 2.779 -7.849 -13.619 68 HE ARG 7 HE ARG 7 1.966 -8.459 -16.264 69 HH11 ARG 7 1HH1 ARG 7 1.118 -8.997 -12.930 70 HH12 ARG 7 2HH1 ARG 7 -0.570 -9.208 -13.258 71 HH21 ARG 7 1HH2 ARG 7 -0.254 -8.736 -16.708 72 HH22 ARG 7 2HH2 ARG 7 -1.349 -9.061 -15.407 73 HA PRO 8 HA PRO 8 4.192 -3.770 -18.874 74 HB2 PRO 8 2HB PRO 8 3.555 -1.300 -17.943 75 HB3 PRO 8 3HB PRO 8 2.451 -2.677 -17.847 76 HG2 PRO 8 2HG PRO 8 4.241 -1.535 -15.737 77 HG3 PRO 8 3HG PRO 8 2.562 -2.090 -15.600 78 HD2 PRO 8 2HD PRO 8 4.666 -3.600 -14.807 79 HD3 PRO 8 3HD PRO 8 3.175 -4.308 -15.461 80 H LEU 9 H LEU 9 6.661 -2.968 -16.668 81 HA LEU 9 HA LEU 9 7.764 -0.787 -18.207 82 HB2 LEU 9 2HB LEU 9 8.313 -2.105 -15.648 83 HB3 LEU 9 3HB LEU 9 9.754 -1.570 -16.511 84 HG LEU 9 HG LEU 9 8.054 0.622 -16.605 85 HD11 LEU 9 1HD1 LEU 9 8.104 0.137 -13.736 86 HD12 LEU 9 2HD1 LEU 9 7.036 -0.964 -14.605 87 HD13 LEU 9 3HD1 LEU 9 6.816 0.779 -14.757 88 HD21 LEU 9 3HD2 LEU 9 10.137 1.324 -16.198 89 HD22 LEU 9 1HD2 LEU 9 10.572 -0.164 -15.356 90 HD23 LEU 9 2HD2 LEU 9 9.729 1.124 -14.494 91 H LYS 10 H LYS 10 9.781 -0.827 -19.290 92 HA LYS 10 HA LYS 10 10.314 -3.369 -20.594 93 HB2 LYS 10 2HB LYS 10 11.532 -2.129 -22.212 94 HB3 LYS 10 3HB LYS 10 10.099 -1.179 -21.840 95 HG2 LYS 10 2HG LYS 10 11.445 0.225 -20.336 96 HG3 LYS 10 3HG LYS 10 12.878 -0.705 -20.780 97 HD2 LYS 10 2HD LYS 10 12.993 1.156 -22.174 98 HD3 LYS 10 3HD LYS 10 12.262 -0.076 -23.205 99 HE2 LYS 10 2HE LYS 10 10.044 0.838 -22.712 100 HE3 LYS 10 3HE LYS 10 10.780 2.070 -21.687 101 HZ1 LYS 10 3HZ LYS 10 11.414 3.275 -23.452 102 HZ2 LYS 10 1HZ LYS 10 10.213 2.414 -24.275 103 HZ3 LYS 10 2HZ LYS 10 11.828 1.924 -24.382 104 H ALA 11 H ALA 11 12.559 -4.085 -20.930 105 HA ALA 11 HA ALA 11 13.945 -4.257 -18.444 106 HB1 ALA 11 1HB ALA 11 13.836 -5.789 -20.724 107 HB2 ALA 11 2HB ALA 11 15.465 -5.113 -20.775 108 HB3 ALA 11 3HB ALA 11 14.935 -6.032 -19.366 109 H GLY 12 H GLY 12 15.976 -3.458 -17.880 110 HA2 GLY 12 2HA GLY 12 17.997 -2.257 -18.391 111 HA3 GLY 12 3HA GLY 12 17.128 -1.424 -19.672 112 H ILE 13 H ILE 13 14.846 -0.621 -18.321 113 HA ILE 13 HA ILE 13 15.982 1.416 -16.543 114 HB ILE 13 HB ILE 13 13.225 1.412 -17.762 115 HG12 ILE 13 2HG1 ILE 13 15.749 2.709 -18.814 116 HG13 ILE 13 3HG1 ILE 13 14.924 1.335 -19.541 117 HG21 ILE 13 1HG2 ILE 13 13.279 3.794 -17.282 118 HG22 ILE 13 2HG2 ILE 13 13.557 2.861 -15.812 119 HG23 ILE 13 3HG2 ILE 13 14.911 3.641 -16.630 120 HD11 ILE 13 3HD1 ILE 13 14.409 3.371 -20.733 121 HD12 ILE 13 1HD1 ILE 13 12.963 2.744 -19.943 122 HD13 ILE 13 2HD1 ILE 13 13.823 4.119 -19.247 123 H PHE 14 H PHE 14 13.754 -1.246 -16.629 124 HA PHE 14 HA PHE 14 12.216 -0.693 -14.360 125 HB2 PHE 14 2HB PHE 14 11.514 -2.929 -14.444 126 HB3 PHE 14 3HB PHE 14 11.943 -2.567 -16.113 127 HD1 PHE 14 HD1 PHE 14 14.615 -2.984 -16.526 128 HD2 PHE 14 HD2 PHE 14 12.130 -5.005 -13.723 129 HE1 PHE 14 HE1 PHE 14 16.158 -4.902 -16.545 130 HE2 PHE 14 HE2 PHE 14 13.668 -6.924 -13.737 131 HZ PHE 14 HZ PHE 14 15.686 -6.874 -15.149 132 H GLU 15 H GLU 15 15.480 -1.827 -14.689 133 HA GLU 15 HA GLU 15 15.689 -2.721 -11.951 134 HB2 GLU 15 2HB GLU 15 17.032 -3.884 -13.549 135 HB3 GLU 15 3HB GLU 15 17.710 -2.383 -14.164 136 HG2 GLU 15 2HG GLU 15 18.181 -2.746 -11.321 137 HG3 GLU 15 3HG GLU 15 18.858 -4.044 -12.302 138 H ARG 16 H ARG 16 16.277 0.181 -13.765 139 HA ARG 16 HA ARG 16 17.906 1.418 -11.734 140 HB2 ARG 16 2HB ARG 16 16.940 2.103 -14.427 141 HB3 ARG 16 3HB ARG 16 17.067 3.472 -13.329 142 HG2 ARG 16 2HG ARG 16 19.326 3.385 -13.256 143 HG3 ARG 16 3HG ARG 16 19.374 1.629 -13.428 144 HD2 ARG 16 2HD ARG 16 19.923 1.927 -15.562 145 HD3 ARG 16 3HD ARG 16 18.305 2.576 -15.826 146 HE ARG 16 HE ARG 16 19.213 4.668 -15.992 147 HH11 ARG 16 1HH1 ARG 16 21.536 2.536 -14.518 148 HH12 ARG 16 2HH1 ARG 16 22.822 3.697 -14.557 149 HH21 ARG 16 1HH2 ARG 16 20.897 6.206 -16.049 150 HH22 ARG 16 2HH2 ARG 16 22.457 5.784 -15.427 151 H LEU 17 H LEU 17 14.539 1.536 -12.772 152 HA LEU 17 HA LEU 17 13.778 3.684 -11.075 153 HB2 LEU 17 2HB LEU 17 12.563 2.042 -13.037 154 HB3 LEU 17 3HB LEU 17 11.577 1.945 -11.580 155 HG LEU 17 HG LEU 17 10.772 3.670 -13.115 156 HD11 LEU 17 1HD1 LEU 17 11.747 5.452 -11.053 157 HD12 LEU 17 2HD1 LEU 17 11.202 3.912 -10.390 158 HD13 LEU 17 3HD1 LEU 17 10.109 4.884 -11.375 159 HD21 LEU 17 3HD2 LEU 17 13.071 4.174 -14.035 160 HD22 LEU 17 1HD2 LEU 17 13.339 5.149 -12.590 161 HD23 LEU 17 2HD2 LEU 17 12.045 5.571 -13.712 162 H GLU 18 H GLU 18 14.240 0.295 -10.591 163 HA GLU 18 HA GLU 18 12.580 -0.209 -8.419 164 HB2 GLU 18 2HB GLU 18 14.568 -1.588 -9.782 165 HB3 GLU 18 3HB GLU 18 15.192 -1.468 -8.143 166 HG2 GLU 18 2HG GLU 18 13.901 -3.152 -7.540 167 HG3 GLU 18 3HG GLU 18 12.475 -2.199 -7.944 168 H GLU 19 H GLU 19 15.617 1.507 -8.591 169 HA GLU 19 HA GLU 19 16.028 1.572 -5.748 170 HB2 GLU 19 2HB GLU 19 17.957 1.691 -7.189 171 HB3 GLU 19 3HB GLU 19 17.309 3.102 -8.015 172 HG2 GLU 19 2HG GLU 19 17.532 3.524 -5.159 173 HG3 GLU 19 3HG GLU 19 19.076 3.095 -5.893 174 H LEU 20 H LEU 20 14.407 3.539 -8.110 175 HA LEU 20 HA LEU 20 14.272 5.965 -6.716 176 HB2 LEU 20 2HB LEU 20 13.095 4.797 -9.048 177 HB3 LEU 20 3HB LEU 20 11.849 5.626 -8.118 178 HG LEU 20 HG LEU 20 13.931 7.450 -8.206 179 HD11 LEU 20 1HD1 LEU 20 14.780 7.562 -10.369 180 HD12 LEU 20 2HD1 LEU 20 13.576 6.441 -11.005 181 HD13 LEU 20 3HD1 LEU 20 14.879 5.846 -9.976 182 HD21 LEU 20 3HD2 LEU 20 12.439 8.763 -9.482 183 HD22 LEU 20 1HD2 LEU 20 11.432 7.741 -8.456 184 HD23 LEU 20 2HD2 LEU 20 11.646 7.340 -10.160 185 H ILE 21 H ILE 21 12.357 3.034 -6.480 186 HA ILE 21 HA ILE 21 10.469 4.249 -4.643 187 HB ILE 21 HB ILE 21 9.631 2.591 -6.216 188 HG12 ILE 21 2HG1 ILE 21 8.446 1.135 -4.626 189 HG13 ILE 21 3HG1 ILE 21 9.604 1.560 -3.370 190 HG21 ILE 21 1HG2 ILE 21 10.276 0.212 -5.975 191 HG22 ILE 21 2HG2 ILE 21 11.600 1.240 -6.520 192 HG23 ILE 21 3HG2 ILE 21 11.535 0.702 -4.842 193 HD11 ILE 21 3HD1 ILE 21 8.718 3.641 -3.068 194 HD12 ILE 21 1HD1 ILE 21 8.099 3.739 -4.716 195 HD13 ILE 21 2HD1 ILE 21 7.273 2.737 -3.522 196 H GLU 22 H GLU 22 13.296 2.201 -4.548 197 HA GLU 22 HA GLU 22 13.060 1.112 -1.998 198 HB2 GLU 22 2HB GLU 22 15.240 1.613 -3.902 199 HB3 GLU 22 3HB GLU 22 15.755 1.564 -2.222 200 HG2 GLU 22 2HG GLU 22 14.325 -0.588 -3.758 201 HG3 GLU 22 3HG GLU 22 15.975 -0.622 -3.138 202 H LYS 23 H LYS 23 13.802 4.344 -2.996 203 HA LYS 23 HA LYS 23 15.079 5.262 -0.656 204 HB2 LYS 23 2HB LYS 23 14.029 6.401 -3.096 205 HB3 LYS 23 3HB LYS 23 13.637 7.421 -1.719 206 HG2 LYS 23 2HG LYS 23 16.423 6.414 -2.064 207 HG3 LYS 23 3HG LYS 23 15.854 7.783 -3.021 208 HD2 LYS 23 2HD LYS 23 15.385 9.056 -1.061 209 HD3 LYS 23 3HD LYS 23 15.641 7.655 -0.018 210 HE2 LYS 23 2HE LYS 23 17.913 8.346 -1.747 211 HE3 LYS 23 3HE LYS 23 17.506 9.563 -0.539 212 HZ1 LYS 23 3HZ LYS 23 18.820 7.081 -0.190 213 HZ2 LYS 23 1HZ LYS 23 17.421 7.127 0.761 214 HZ3 LYS 23 2HZ LYS 23 18.596 8.333 0.926 215 H GLU 24 H GLU 24 11.677 5.126 -1.611 216 HA GLU 24 HA GLU 24 10.740 6.455 0.746 217 HB2 GLU 24 2HB GLU 24 9.641 5.669 -1.724 218 HB3 GLU 24 3HB GLU 24 8.729 4.805 -0.495 219 HG2 GLU 24 2HG GLU 24 9.112 7.559 0.255 220 HG3 GLU 24 3HG GLU 24 8.362 7.429 -1.335 221 H MET 25 H MET 25 11.062 3.097 -0.293 222 HA MET 25 HA MET 25 9.663 1.834 1.746 223 HB2 MET 25 2HB MET 25 12.180 0.894 0.358 224 HB3 MET 25 3HB MET 25 11.089 -0.126 1.287 225 HG2 MET 25 2HG MET 25 10.370 1.373 -1.221 226 HG3 MET 25 3HG MET 25 10.741 -0.346 -1.120 227 HE1 MET 25 3HE MET 25 9.786 -1.655 0.776 228 HE2 MET 25 1HE MET 25 8.253 -1.355 1.596 229 HE3 MET 25 2HE MET 25 8.274 -2.195 0.045 230 H GLN 26 H GLN 26 10.215 1.034 3.766 231 HA GLN 26 HA GLN 26 11.952 2.618 5.320 232 HB2 GLN 26 2HB GLN 26 10.128 0.391 5.750 233 HB3 GLN 26 3HB GLN 26 11.555 0.282 6.771 234 HG2 GLN 26 2HG GLN 26 10.623 1.722 8.159 235 HG3 GLN 26 3HG GLN 26 10.713 2.951 6.899 236 HE21 GLN 26 1HE2 GLN 26 8.895 2.957 5.335 237 HE22 GLN 26 2HE2 GLN 26 7.311 2.631 5.942 238 HA PRO 27 HA PRO 27 15.878 0.685 5.036 239 HB2 PRO 27 2HB PRO 27 16.755 0.738 7.605 240 HB3 PRO 27 3HB PRO 27 16.631 2.188 6.602 241 HG2 PRO 27 2HG PRO 27 14.746 1.161 8.688 242 HG3 PRO 27 3HG PRO 27 15.296 2.822 8.397 243 HD2 PRO 27 2HD PRO 27 12.887 1.916 7.554 244 HD3 PRO 27 3HD PRO 27 13.810 3.144 6.664 245 H ASN 28 H ASN 28 13.358 -0.789 6.726 246 HA ASN 28 HA ASN 28 14.736 -3.359 6.620 247 HB2 ASN 28 2HB ASN 28 14.659 -2.095 9.010 248 HB3 ASN 28 3HB ASN 28 13.121 -2.950 9.068 249 HD21 ASN 28 1HD2 ASN 28 16.118 -3.170 10.108 250 HD22 ASN 28 2HD2 ASN 28 16.362 -4.881 10.079 251 H GLU 29 H GLU 29 12.683 -2.185 5.001 252 HA GLU 29 HA GLU 29 10.335 -3.800 5.730 253 HB2 GLU 29 2HB GLU 29 10.646 -1.156 4.608 254 HB3 GLU 29 3HB GLU 29 9.680 -2.167 3.543 255 HG2 GLU 29 2HG GLU 29 8.420 -2.772 5.751 256 HG3 GLU 29 3HG GLU 29 9.116 -1.256 6.320 257 H VAL 30 H VAL 30 9.116 -4.684 3.800 258 HA VAL 30 HA VAL 30 11.042 -6.018 2.038 259 HB VAL 30 HB VAL 30 8.470 -6.782 3.231 260 HG11 VAL 30 1HG1 VAL 30 7.958 -8.359 1.341 261 HG12 VAL 30 2HG1 VAL 30 7.632 -6.656 1.009 262 HG13 VAL 30 3HG1 VAL 30 9.079 -7.423 0.353 263 HG21 VAL 30 3HG2 VAL 30 11.023 -7.736 3.240 264 HG22 VAL 30 1HG2 VAL 30 9.599 -8.658 3.722 265 HG23 VAL 30 2HG2 VAL 30 10.241 -8.817 2.087 266 H ALA 31 H ALA 31 10.937 -5.913 -0.160 267 HA ALA 31 HA ALA 31 8.846 -4.197 -1.327 268 HB1 ALA 31 1HB ALA 31 11.614 -4.224 -2.452 269 HB2 ALA 31 2HB ALA 31 10.362 -2.988 -2.582 270 HB3 ALA 31 3HB ALA 31 11.233 -3.204 -1.064 271 H ILE 32 H ILE 32 7.630 -5.392 -2.629 272 HA ILE 32 HA ILE 32 8.741 -7.759 -3.913 273 HB ILE 32 HB ILE 32 5.939 -6.711 -3.605 274 HG12 ILE 32 2HG1 ILE 32 6.560 -9.503 -2.969 275 HG13 ILE 32 3HG1 ILE 32 7.499 -8.347 -2.029 276 HG21 ILE 32 1HG2 ILE 32 7.004 -8.603 -5.609 277 HG22 ILE 32 2HG2 ILE 32 5.512 -9.070 -4.794 278 HG23 ILE 32 3HG2 ILE 32 5.594 -7.548 -5.680 279 HD11 ILE 32 3HD1 ILE 32 5.372 -7.244 -1.382 280 HD12 ILE 32 1HD1 ILE 32 4.504 -8.543 -2.201 281 HD13 ILE 32 2HD1 ILE 32 5.528 -8.905 -0.811 282 H PHE 33 H PHE 33 9.818 -7.370 -5.743 283 HA PHE 33 HA PHE 33 8.765 -5.373 -7.618 284 HB2 PHE 33 2HB PHE 33 11.462 -6.743 -7.618 285 HB3 PHE 33 3HB PHE 33 10.965 -5.418 -8.665 286 HD1 PHE 33 HD2 PHE 33 9.526 -3.766 -6.596 287 HD2 PHE 33 HD1 PHE 33 13.287 -5.757 -6.523 288 HE1 PHE 33 HE2 PHE 33 10.347 -2.147 -4.935 289 HE2 PHE 33 HE1 PHE 33 14.114 -4.142 -4.861 290 HZ PHE 33 HZ PHE 33 12.643 -2.333 -4.066 291 H MET 34 H MET 34 7.301 -6.289 -8.927 292 HA MET 34 HA MET 34 7.545 -9.018 -9.816 293 HB2 MET 34 2HB MET 34 5.537 -6.848 -10.064 294 HB3 MET 34 3HB MET 34 5.547 -8.060 -11.338 295 HG2 MET 34 2HG MET 34 5.692 -9.482 -8.934 296 HG3 MET 34 3HG MET 34 4.494 -8.216 -8.677 297 HE1 MET 34 3HE MET 34 4.396 -10.200 -12.609 298 HE2 MET 34 1HE MET 34 5.817 -10.024 -11.579 299 HE3 MET 34 2HE MET 34 4.879 -11.517 -11.539 300 H PHE 35 H PHE 35 8.410 -9.737 -11.662 301 HA PHE 35 HA PHE 35 8.989 -7.801 -13.797 302 HB2 PHE 35 2HB PHE 35 11.198 -8.720 -14.125 303 HB3 PHE 35 3HB PHE 35 11.037 -8.237 -12.439 304 HD1 PHE 35 HD1 PHE 35 10.338 -10.102 -10.779 305 HD2 PHE 35 HD2 PHE 35 11.971 -10.830 -14.642 306 HE1 PHE 35 HE1 PHE 35 11.006 -12.361 -10.067 307 HE2 PHE 35 HE2 PHE 35 12.640 -13.090 -13.936 308 HZ PHE 35 HZ PHE 35 12.157 -13.859 -11.647 309 H GLU 36 H GLU 36 8.448 -8.470 -15.782 310 HA GLU 36 HA GLU 36 7.559 -11.254 -16.081 311 HB2 GLU 36 2HB GLU 36 6.205 -10.468 -17.950 312 HB3 GLU 36 3HB GLU 36 5.854 -9.538 -16.500 313 HG2 GLU 36 2HG GLU 36 6.005 -7.824 -17.957 314 HG3 GLU 36 3HG GLU 36 7.714 -7.954 -17.546 315 H VAL 37 H VAL 37 10.013 -9.104 -16.976 316 HA VAL 37 HA VAL 37 10.631 -10.257 -19.534 317 HB VAL 37 HB VAL 37 12.510 -8.629 -17.833 318 HG11 VAL 37 1HG1 VAL 37 13.822 -9.048 -19.595 319 HG12 VAL 37 2HG1 VAL 37 12.473 -9.622 -20.577 320 HG13 VAL 37 3HG1 VAL 37 12.807 -7.894 -20.459 321 HG21 VAL 37 3HG2 VAL 37 10.283 -7.664 -19.622 322 HG22 VAL 37 1HG2 VAL 37 10.461 -7.385 -17.890 323 HG23 VAL 37 2HG2 VAL 37 11.589 -6.642 -19.023 324 H GLY 38 H GLY 38 12.510 -11.491 -20.042 325 HA2 GLY 38 2HA GLY 38 13.017 -13.590 -18.177 326 HA3 GLY 38 3HA GLY 38 13.792 -13.381 -19.741 327 H ASP 39 H ASP 39 14.312 -10.514 -18.419 328 HA ASP 39 HA ASP 39 17.037 -11.037 -17.827 329 HB2 ASP 39 2HB ASP 39 15.263 -8.671 -17.871 330 HB3 ASP 39 3HB ASP 39 16.659 -8.557 -16.804 331 H PHE 40 H PHE 40 17.028 -12.589 -16.163 332 HA PHE 40 HA PHE 40 15.861 -11.873 -13.599 333 HB2 PHE 40 2HB PHE 40 16.359 -14.089 -12.904 334 HB3 PHE 40 3HB PHE 40 15.813 -14.221 -14.573 335 HD1 PHE 40 HD2 PHE 40 18.668 -14.491 -12.309 336 HD2 PHE 40 HD1 PHE 40 17.339 -14.838 -16.338 337 HE1 PHE 40 HE2 PHE 40 20.741 -15.684 -12.887 338 HE2 PHE 40 HE1 PHE 40 19.409 -16.033 -16.922 339 HZ PHE 40 HZ PHE 40 21.114 -16.456 -15.195 340 H SER 41 H SER 41 18.898 -11.748 -15.207 341 HA SER 41 HA SER 41 20.539 -11.691 -12.862 342 HB2 SER 41 2HB SER 41 21.893 -12.260 -14.602 343 HB3 SER 41 3HB SER 41 20.935 -11.358 -15.776 344 HG SER 41 HG SER 41 22.502 -9.966 -15.654 345 H ASN 42 H ASN 42 18.521 -9.437 -14.410 346 HA ASN 42 HA ASN 42 19.953 -7.101 -13.451 347 HB2 ASN 42 2HB ASN 42 17.793 -7.630 -15.343 348 HB3 ASN 42 3HB ASN 42 17.465 -6.238 -14.315 349 HD21 ASN 42 1HD2 ASN 42 18.047 -6.392 -17.177 350 HD22 ASN 42 2HD2 ASN 42 19.425 -5.382 -17.433 351 H ILE 43 H ILE 43 17.334 -9.151 -12.485 352 HA ILE 43 HA ILE 43 15.847 -7.533 -10.821 353 HB ILE 43 HB ILE 43 16.492 -10.435 -10.815 354 HG12 ILE 43 2HG1 ILE 43 14.667 -9.464 -12.187 355 HG13 ILE 43 3HG1 ILE 43 14.078 -10.641 -11.018 356 HG21 ILE 43 1HG2 ILE 43 15.400 -8.932 -8.465 357 HG22 ILE 43 2HG2 ILE 43 14.944 -10.609 -8.766 358 HG23 ILE 43 3HG2 ILE 43 16.637 -10.189 -8.506 359 HD11 ILE 43 3HD1 ILE 43 12.649 -9.144 -10.257 360 HD12 ILE 43 1HD1 ILE 43 13.992 -8.104 -9.782 361 HD13 ILE 43 2HD1 ILE 43 13.280 -7.947 -11.388 362 HA PRO 44 HA PRO 44 18.889 -8.486 -7.184 363 HB2 PRO 44 2HB PRO 44 21.274 -9.613 -7.827 364 HB3 PRO 44 3HB PRO 44 19.836 -10.564 -7.436 365 HG2 PRO 44 2HG PRO 44 20.973 -9.864 -10.116 366 HG3 PRO 44 3HG PRO 44 20.322 -11.412 -9.546 367 HD2 PRO 44 2HD PRO 44 18.893 -9.712 -11.095 368 HD3 PRO 44 3HD PRO 44 18.137 -10.757 -9.875 369 H LYS 45 H LYS 45 19.943 -7.357 -10.282 370 HA LYS 45 HA LYS 45 22.197 -5.858 -9.405 371 HB2 LYS 45 2HB LYS 45 21.331 -6.607 -11.829 372 HB3 LYS 45 3HB LYS 45 20.681 -4.973 -11.802 373 HG2 LYS 45 2HG LYS 45 23.326 -4.767 -10.897 374 HG3 LYS 45 3HG LYS 45 23.362 -5.856 -12.286 375 HD2 LYS 45 2HD LYS 45 21.871 -4.073 -13.422 376 HD3 LYS 45 3HD LYS 45 22.449 -3.005 -12.140 377 HE2 LYS 45 2HE LYS 45 24.225 -4.562 -14.016 378 HE3 LYS 45 3HE LYS 45 23.785 -2.868 -14.227 379 HZ1 LYS 45 3HZ LYS 45 24.745 -2.574 -11.895 380 HZ2 LYS 45 1HZ LYS 45 25.835 -2.797 -13.170 381 HZ3 LYS 45 2HZ LYS 45 25.474 -4.083 -12.132 382 H SER 46 H SER 46 18.770 -5.244 -9.573 383 HA SER 46 HA SER 46 18.897 -2.418 -9.327 384 HB2 SER 46 2HB SER 46 16.523 -3.737 -8.188 385 HB3 SER 46 3HB SER 46 16.637 -2.506 -9.447 386 HG SER 46 HG SER 46 15.866 -4.568 -10.197 387 H ALA 47 H ALA 47 18.162 -4.965 -6.944 388 HA ALA 47 HA ALA 47 18.000 -3.305 -4.703 389 HB1 ALA 47 1HB ALA 47 19.079 -6.075 -4.451 390 HB2 ALA 47 2HB ALA 47 17.911 -5.226 -3.438 391 HB3 ALA 47 3HB ALA 47 17.428 -5.833 -5.022 392 H GLU 48 H GLU 48 20.744 -4.473 -6.457 393 HA GLU 48 HA GLU 48 22.666 -4.094 -4.375 394 HB2 GLU 48 2HB GLU 48 22.934 -5.593 -6.400 395 HB3 GLU 48 3HB GLU 48 23.200 -4.134 -7.344 396 HG2 GLU 48 2HG GLU 48 24.897 -4.107 -5.042 397 HG3 GLU 48 3HG GLU 48 25.085 -5.632 -5.906 398 H PHE 49 H PHE 49 21.382 -2.124 -6.982 399 HA PHE 49 HA PHE 49 23.219 -0.068 -7.072 400 HB2 PHE 49 2HB PHE 49 20.687 -0.531 -8.122 401 HB3 PHE 49 3HB PHE 49 20.487 0.935 -7.168 402 HD1 PHE 49 HD2 PHE 49 21.983 2.897 -7.632 403 HD2 PHE 49 HD1 PHE 49 21.771 -0.491 -10.199 404 HE1 PHE 49 HE2 PHE 49 22.979 4.219 -9.453 405 HE2 PHE 49 HE1 PHE 49 22.768 0.825 -12.024 406 HZ PHE 49 HZ PHE 49 23.372 3.183 -11.653 407 H ILE 50 H ILE 50 20.843 -0.786 -4.630 408 HA ILE 50 HA ILE 50 20.876 1.740 -3.331 409 HB ILE 50 HB ILE 50 20.237 -0.929 -2.076 410 HG12 ILE 50 2HG1 ILE 50 18.965 -0.506 -4.192 411 HG13 ILE 50 3HG1 ILE 50 17.949 -0.611 -2.759 412 HG21 ILE 50 1HG2 ILE 50 19.675 1.923 -1.347 413 HG22 ILE 50 2HG2 ILE 50 18.662 0.609 -0.750 414 HG23 ILE 50 3HG2 ILE 50 20.382 0.643 -0.361 415 HD11 ILE 50 3HD1 ILE 50 17.816 1.826 -2.681 416 HD12 ILE 50 1HD1 ILE 50 18.823 1.923 -4.125 417 HD13 ILE 50 2HD1 ILE 50 17.223 1.184 -4.212 418 H GLN 51 H GLN 51 22.196 -1.361 -2.156 419 HA GLN 51 HA GLN 51 24.651 -0.042 -1.344 420 HB2 GLN 51 2HB GLN 51 22.685 -0.056 0.498 421 HB3 GLN 51 3HB GLN 51 23.398 -1.631 0.820 422 HG2 GLN 51 2HG GLN 51 25.148 -0.736 1.846 423 HG3 GLN 51 3HG GLN 51 25.412 0.428 0.549 424 HE21 GLN 51 1HE2 GLN 51 25.336 0.522 3.597 425 HE22 GLN 51 2HE2 GLN 51 24.340 1.892 3.937 426 H SER 52 H SER 52 26.343 -1.361 -1.584 427 HA SER 52 HA SER 52 26.195 -3.827 -2.803 428 HB2 SER 52 2HB SER 52 28.556 -4.159 -2.016 429 HB3 SER 52 3HB SER 52 28.269 -2.598 -2.785 430 HG SER 52 HG SER 52 28.099 -1.691 -0.690 431 H LYS 53 H LYS 53 26.026 -3.047 0.596 432 HA LYS 53 HA LYS 53 25.516 -5.889 1.167 433 HB2 LYS 53 2HB LYS 53 27.428 -4.034 2.447 434 HB3 LYS 53 3HB LYS 53 26.470 -5.014 3.549 435 HG2 LYS 53 2HG LYS 53 27.971 -6.618 3.254 436 HG3 LYS 53 3HG LYS 53 27.332 -6.808 1.620 437 HD2 LYS 53 2HD LYS 53 29.105 -5.776 0.667 438 HD3 LYS 53 3HD LYS 53 29.283 -4.627 1.994 439 HE2 LYS 53 2HE LYS 53 29.890 -7.414 2.688 440 HE3 LYS 53 3HE LYS 53 30.971 -6.702 1.492 441 HZ1 LYS 53 3HZ LYS 53 30.692 -6.113 4.308 442 HZ2 LYS 53 1HZ LYS 53 30.816 -4.747 3.318 443 HZ3 LYS 53 2HZ LYS 53 32.029 -5.925 3.290 444 H GLY 54 H GLY 54 23.469 -6.121 1.768 445 HA2 GLY 54 2HA GLY 54 22.173 -5.284 3.925 446 HA3 GLY 54 3HA GLY 54 22.027 -3.856 2.911 447 H HIS 55 H HIS 55 21.655 -5.029 0.423 448 HA HIS 55 HA HIS 55 18.886 -5.706 0.577 449 HB2 HIS 55 2HB HIS 55 18.964 -5.805 -1.847 450 HB3 HIS 55 3HB HIS 55 19.858 -4.394 -1.290 451 HD1 HIS 55 HD1 HIS 55 22.560 -4.766 -1.209 452 HD2 HIS 55 HD2 HIS 55 20.356 -7.408 -3.538 453 HE1 HIS 55 HE1 HIS 55 24.220 -5.834 -2.768 454 H GLU 56 H GLU 56 18.095 -7.645 1.022 455 HA GLU 56 HA GLU 56 19.522 -10.015 0.027 456 HB2 GLU 56 2HB GLU 56 19.411 -9.305 2.698 457 HB3 GLU 56 3HB GLU 56 18.102 -10.468 2.538 458 HG2 GLU 56 2HG GLU 56 20.623 -11.261 1.266 459 HG3 GLU 56 3HG GLU 56 20.683 -11.110 3.021 460 H LEU 57 H LEU 57 18.258 -11.163 -1.263 461 HA LEU 57 HA LEU 57 15.430 -10.685 -1.396 462 HB2 LEU 57 2HB LEU 57 17.231 -12.622 -2.837 463 HB3 LEU 57 3HB LEU 57 15.505 -12.462 -3.159 464 HG LEU 57 HG LEU 57 16.592 -11.252 -4.857 465 HD11 LEU 57 1HD1 LEU 57 14.742 -10.094 -3.386 466 HD12 LEU 57 2HD1 LEU 57 15.558 -9.222 -4.683 467 HD13 LEU 57 3HD1 LEU 57 16.060 -8.983 -3.009 468 HD21 LEU 57 3HD2 LEU 57 18.109 -9.459 -3.057 469 HD22 LEU 57 1HD2 LEU 57 18.510 -10.060 -4.666 470 HD23 LEU 57 2HD2 LEU 57 18.725 -11.100 -3.258 471 H LEU 58 H LEU 58 14.210 -11.478 0.207 472 HA LEU 58 HA LEU 58 14.725 -13.629 1.851 473 HB2 LEU 58 2HB LEU 58 12.551 -11.878 1.339 474 HB3 LEU 58 3HB LEU 58 11.917 -13.521 1.404 475 HG LEU 58 HG LEU 58 13.735 -12.765 3.601 476 HD11 LEU 58 1HD1 LEU 58 10.964 -11.792 3.927 477 HD12 LEU 58 2HD1 LEU 58 12.044 -10.800 2.948 478 HD13 LEU 58 3HD1 LEU 58 12.472 -11.187 4.614 479 HD21 LEU 58 3HD2 LEU 58 11.043 -13.832 4.099 480 HD22 LEU 58 1HD2 LEU 58 12.612 -14.371 4.700 481 HD23 LEU 58 2HD2 LEU 58 12.075 -14.845 3.088 482 H ASN 59 H ASN 59 12.877 -13.599 -1.183 483 HA ASN 59 HA ASN 59 13.181 -16.528 -1.284 484 HB2 ASN 59 2HB ASN 59 10.799 -15.481 -0.925 485 HB3 ASN 59 3HB ASN 59 10.897 -15.154 -2.653 486 HD21 ASN 59 1HD2 ASN 59 9.961 -17.348 -0.366 487 HD22 ASN 59 2HD2 ASN 59 9.868 -18.761 -1.356 488 H SER 60 H SER 60 14.460 -17.143 -2.885 489 HA SER 60 HA SER 60 15.593 -15.527 -4.802 490 HB2 SER 60 2HB SER 60 16.691 -17.401 -5.406 491 HB3 SER 60 3HB SER 60 15.800 -18.190 -4.105 492 HG SER 60 HG SER 60 15.703 -18.789 -6.632 493 H LEU 61 H LEU 61 14.828 -14.513 -6.525 494 HA LEU 61 HA LEU 61 12.199 -14.582 -7.386 495 HB2 LEU 61 2HB LEU 61 13.056 -13.493 -9.466 496 HB3 LEU 61 3HB LEU 61 13.554 -12.727 -7.958 497 HG LEU 61 HG LEU 61 15.454 -14.686 -9.072 498 HD11 LEU 61 1HD1 LEU 61 16.081 -12.358 -10.453 499 HD12 LEU 61 2HD1 LEU 61 14.355 -12.592 -10.728 500 HD13 LEU 61 3HD1 LEU 61 15.494 -13.874 -11.138 501 HD21 LEU 61 3HD2 LEU 61 15.454 -12.136 -7.569 502 HD22 LEU 61 1HD2 LEU 61 16.851 -12.462 -8.595 503 HD23 LEU 61 2HD2 LEU 61 16.406 -13.601 -7.324 504 H ARG 62 H ARG 62 11.039 -15.957 -8.560 505 HA ARG 62 HA ARG 62 12.355 -18.247 -9.770 506 HB2 ARG 62 2HB ARG 62 10.136 -18.177 -8.346 507 HB3 ARG 62 3HB ARG 62 9.401 -17.809 -9.901 508 HG2 ARG 62 2HG ARG 62 9.556 -19.920 -10.588 509 HG3 ARG 62 3HG ARG 62 11.226 -20.065 -10.036 510 HD2 ARG 62 2HD ARG 62 10.601 -20.764 -7.918 511 HD3 ARG 62 3HD ARG 62 8.991 -20.056 -8.051 512 HE ARG 62 HE ARG 62 8.257 -21.983 -9.061 513 HH11 ARG 62 1HH1 ARG 62 11.737 -21.978 -8.954 514 HH12 ARG 62 2HH1 ARG 62 11.885 -23.626 -9.470 515 HH21 ARG 62 1HH2 ARG 62 8.439 -24.153 -9.740 516 HH22 ARG 62 2HH2 ARG 62 10.008 -24.861 -9.917 517 H PHE 63 H PHE 63 13.364 -16.763 -11.398 518 HA PHE 63 HA PHE 63 11.757 -15.550 -13.406 519 HB2 PHE 63 2HB PHE 63 13.807 -15.127 -14.569 520 HB3 PHE 63 3HB PHE 63 14.130 -14.918 -12.851 521 HD1 PHE 63 HD2 PHE 63 15.255 -16.801 -11.602 522 HD2 PHE 63 HD1 PHE 63 15.029 -16.651 -15.849 523 HE1 PHE 63 HE2 PHE 63 17.110 -18.411 -11.754 524 HE2 PHE 63 HE1 PHE 63 16.883 -18.261 -16.009 525 HZ PHE 63 HZ PHE 63 17.927 -19.142 -13.959 526 H ASN 64 H ASN 64 12.894 -16.348 -15.796 527 HA ASN 64 HA ASN 64 12.842 -17.936 -17.438 528 HB2 ASN 64 2HB ASN 64 13.436 -19.436 -15.137 529 HB3 ASN 64 3HB ASN 64 12.117 -20.292 -15.930 530 HD21 ASN 64 1HD2 ASN 64 12.924 -21.897 -17.062 531 HD22 ASN 64 2HD2 ASN 64 14.308 -21.822 -18.092 532 H GLN 65 H GLN 65 10.443 -18.665 -14.905 533 HA GLN 65 HA GLN 65 8.447 -19.398 -16.841 534 HB2 GLN 65 2HB GLN 65 8.790 -19.592 -13.984 535 HB3 GLN 65 3HB GLN 65 7.200 -18.942 -14.363 536 HG2 GLN 65 2HG GLN 65 8.154 -21.353 -15.823 537 HG3 GLN 65 3HG GLN 65 7.595 -21.519 -14.159 538 HE21 GLN 65 1HE2 GLN 65 6.491 -22.457 -16.757 539 HE22 GLN 65 2HE2 GLN 65 4.862 -21.880 -16.785 540 H ALA 66 H ALA 66 6.128 -18.310 -15.940 541 HA ALA 66 HA ALA 66 5.978 -15.869 -17.257 542 HB1 ALA 66 1HB ALA 66 3.765 -15.918 -16.783 543 HB2 ALA 66 2HB ALA 66 4.145 -17.580 -16.329 544 HB3 ALA 66 3HB ALA 66 4.023 -16.333 -15.088 545 H ASP 67 H ASP 67 5.134 -13.802 -16.192 546 HA ASP 67 HA ASP 67 7.096 -12.554 -14.763 547 HB2 ASP 67 2HB ASP 67 5.407 -10.861 -14.136 548 HB3 ASP 67 3HB ASP 67 5.283 -11.327 -15.830 549 H TRP 68 H TRP 68 7.925 -12.880 -12.819 550 HA TRP 68 HA TRP 68 6.200 -14.029 -10.726 551 HB2 TRP 68 2HB TRP 68 8.519 -15.071 -11.674 552 HB3 TRP 68 3HB TRP 68 9.130 -14.091 -10.344 553 HD1 TRP 68 HD1 TRP 68 9.135 -15.243 -8.058 554 HE1 TRP 68 HE1 TRP 68 7.978 -17.299 -7.028 555 HE3 TRP 68 HE3 TRP 68 6.069 -16.488 -11.956 556 HZ2 TRP 68 HZ2 TRP 68 6.026 -19.198 -7.770 557 HZ3 TRP 68 HZ3 TRP 68 4.588 -18.438 -11.715 558 HH2 TRP 68 HH2 TRP 68 4.569 -19.764 -9.665 559 H THR 69 H THR 69 7.413 -13.512 -8.459 560 HA THR 69 HA THR 69 7.840 -10.597 -8.390 561 HB THR 69 HB THR 69 6.407 -10.278 -6.620 562 HG1 THR 69 HG1 THR 69 5.710 -12.171 -5.313 563 HG21 THR 69 3HG2 THR 69 5.310 -11.459 -8.733 564 HG22 THR 69 1HG2 THR 69 4.362 -11.031 -7.309 565 HG23 THR 69 2HG2 THR 69 4.924 -12.688 -7.528 566 H ILE 70 H ILE 70 9.362 -9.827 -6.959 567 HA ILE 70 HA ILE 70 10.862 -11.838 -5.418 568 HB ILE 70 HB ILE 70 12.202 -11.345 -7.350 569 HG12 ILE 70 2HG1 ILE 70 14.217 -10.443 -6.285 570 HG13 ILE 70 3HG1 ILE 70 13.244 -9.786 -4.973 571 HG21 ILE 70 1HG2 ILE 70 12.874 -8.632 -7.108 572 HG22 ILE 70 2HG2 ILE 70 11.962 -9.406 -8.403 573 HG23 ILE 70 3HG2 ILE 70 11.115 -8.713 -7.020 574 HD11 ILE 70 3HD1 ILE 70 14.500 -12.241 -5.031 575 HD12 ILE 70 1HD1 ILE 70 13.268 -11.716 -3.884 576 HD13 ILE 70 2HD1 ILE 70 12.804 -12.622 -5.325 577 H VAL 71 H VAL 71 10.948 -11.371 -3.329 578 HA VAL 71 HA VAL 71 10.253 -8.690 -2.423 579 HB VAL 71 HB VAL 71 10.186 -9.701 -0.165 580 HG11 VAL 71 1HG1 VAL 71 8.412 -11.592 -1.112 581 HG12 VAL 71 2HG1 VAL 71 8.053 -9.894 -0.793 582 HG13 VAL 71 3HG1 VAL 71 8.497 -10.412 -2.420 583 HG21 VAL 71 3HG2 VAL 71 11.879 -11.426 -0.485 584 HG22 VAL 71 1HG2 VAL 71 10.363 -12.132 0.073 585 HG23 VAL 71 2HG2 VAL 71 10.826 -12.264 -1.623 586 H VAL 72 H VAL 72 11.631 -7.291 -1.492 587 HA VAL 72 HA VAL 72 14.376 -8.221 -0.949 588 HB VAL 72 HB VAL 72 13.693 -5.457 -1.937 589 HG11 VAL 72 1HG1 VAL 72 15.934 -5.047 -1.990 590 HG12 VAL 72 2HG1 VAL 72 15.895 -6.204 -0.658 591 HG13 VAL 72 3HG1 VAL 72 16.350 -6.736 -2.277 592 HG21 VAL 72 3HG2 VAL 72 13.341 -6.329 -3.957 593 HG22 VAL 72 1HG2 VAL 72 15.042 -6.792 -3.969 594 HG23 VAL 72 2HG2 VAL 72 13.820 -7.938 -3.418 595 H ARG 73 H ARG 73 15.043 -7.900 1.066 596 HA ARG 73 HA ARG 73 13.489 -6.106 2.788 597 HB2 ARG 73 2HB ARG 73 14.705 -7.316 4.645 598 HB3 ARG 73 3HB ARG 73 13.607 -8.301 3.688 599 HG2 ARG 73 2HG ARG 73 15.242 -9.651 3.009 600 HG3 ARG 73 3HG ARG 73 16.319 -8.302 2.642 601 HD2 ARG 73 2HD ARG 73 17.434 -9.417 4.346 602 HD3 ARG 73 3HD ARG 73 16.597 -8.119 5.198 603 HE ARG 73 HE ARG 73 15.041 -10.504 5.112 604 HH11 ARG 73 1HH1 ARG 73 17.708 -8.965 6.737 605 HH12 ARG 73 2HH1 ARG 73 17.497 -9.857 8.207 606 HH21 ARG 73 1HH2 ARG 73 14.753 -11.685 7.042 607 HH22 ARG 73 2HH2 ARG 73 15.817 -11.405 8.379 608 H LYS 74 H LYS 74 14.281 -4.121 2.976 609 HA LYS 74 HA LYS 74 16.913 -3.364 2.327 610 HB2 LYS 74 2HB LYS 74 14.527 -2.068 3.471 611 HB3 LYS 74 3HB LYS 74 16.057 -1.336 3.938 612 HG2 LYS 74 2HG LYS 74 16.557 -1.439 1.378 613 HG3 LYS 74 3HG LYS 74 14.800 -1.548 1.245 614 HD2 LYS 74 2HD LYS 74 14.651 0.653 1.512 615 HD3 LYS 74 3HD LYS 74 15.399 0.507 3.105 616 HE2 LYS 74 2HE LYS 74 16.964 0.652 0.536 617 HE3 LYS 74 3HE LYS 74 16.553 2.067 1.503 618 HZ1 LYS 74 3HZ LYS 74 18.806 0.758 1.824 619 HZ2 LYS 74 1HZ LYS 74 17.849 -0.162 2.873 620 HZ3 LYS 74 2HZ LYS 74 18.015 1.503 3.121 621 H LYS 75 H LYS 75 18.547 -2.470 3.737 622 HA LYS 75 HA LYS 75 18.525 -2.763 6.535 623 HB2 LYS 75 2HB LYS 75 18.887 -5.198 5.208 624 HB3 LYS 75 3HB LYS 75 20.502 -4.717 5.712 625 HG2 LYS 75 2HG LYS 75 18.331 -4.514 7.717 626 HG3 LYS 75 3HG LYS 75 18.885 -6.128 7.266 627 HD2 LYS 75 2HD LYS 75 20.924 -5.841 8.223 628 HD3 LYS 75 3HD LYS 75 20.980 -4.118 7.842 629 HE2 LYS 75 2HE LYS 75 20.758 -4.083 10.136 630 HE3 LYS 75 3HE LYS 75 19.080 -3.947 9.614 631 HZ1 LYS 75 3HZ LYS 75 19.174 -5.561 11.329 632 HZ2 LYS 75 1HZ LYS 75 20.464 -6.378 10.599 633 HZ3 LYS 75 2HZ LYS 75 18.932 -6.405 9.883 634 H ALA 76 H ALA 76 20.424 -2.698 3.575 635 HA ALA 76 HA ALA 76 22.373 -1.659 3.014 636 HB1 ALA 76 1HB ALA 76 20.799 0.185 4.555 637 HB2 ALA 76 2HB ALA 76 22.519 0.496 4.794 638 HB3 ALA 76 3HB ALA 76 21.841 0.491 3.165 Start of MODEL 7 1 H1 MET 1 H MET 1 0.492 -3.722 -0.731 2 HA MET 1 HA MET 1 1.510 -1.423 -2.218 3 HB2 MET 1 2HB MET 1 1.505 -1.863 0.770 4 HB3 MET 1 3HB MET 1 1.785 -0.348 -0.079 5 HG2 MET 1 2HG MET 1 -0.799 -1.889 -0.097 6 HG3 MET 1 3HG MET 1 -0.453 -0.493 0.920 7 HE1 MET 1 3HE MET 1 -2.841 -0.909 -0.751 8 HE2 MET 1 1HE MET 1 -2.881 0.832 -0.465 9 HE3 MET 1 2HE MET 1 -3.043 0.204 -2.105 10 H LYS 2 H LYS 2 3.624 -0.622 -0.704 11 HA LYS 2 HA LYS 2 5.910 -0.841 -0.847 12 HB2 LYS 2 2HB LYS 2 6.764 -2.559 0.672 13 HB3 LYS 2 3HB LYS 2 5.368 -1.745 1.365 14 HG2 LYS 2 2HG LYS 2 3.949 -3.621 0.774 15 HG3 LYS 2 3HG LYS 2 5.316 -4.432 0.005 16 HD2 LYS 2 2HD LYS 2 6.480 -4.356 2.232 17 HD3 LYS 2 3HD LYS 2 4.959 -3.794 2.929 18 HE2 LYS 2 2HE LYS 2 3.916 -5.873 1.871 19 HE3 LYS 2 3HE LYS 2 5.569 -6.440 1.644 20 HZ1 LYS 2 3HZ LYS 2 5.567 -5.693 4.229 21 HZ2 LYS 2 1HZ LYS 2 5.315 -7.275 3.685 22 HZ3 LYS 2 2HZ LYS 2 3.993 -6.286 4.052 23 H ARG 3 H ARG 3 4.781 -1.696 -3.231 24 HA ARG 3 HA ARG 3 6.736 -3.711 -4.042 25 HB2 ARG 3 2HB ARG 3 5.159 -5.050 -5.220 26 HB3 ARG 3 3HB ARG 3 4.522 -4.831 -3.596 27 HG2 ARG 3 2HG ARG 3 3.522 -2.731 -5.218 28 HG3 ARG 3 3HG ARG 3 3.284 -4.255 -6.075 29 HD2 ARG 3 2HD ARG 3 2.540 -4.923 -3.541 30 HD3 ARG 3 3HD ARG 3 2.019 -3.242 -3.632 31 HE ARG 3 HE ARG 3 0.364 -3.875 -5.077 32 HH11 ARG 3 1HH1 ARG 3 2.742 -6.411 -4.894 33 HH12 ARG 3 2HH1 ARG 3 1.807 -7.533 -5.827 34 HH21 ARG 3 1HH2 ARG 3 -0.876 -5.343 -6.306 35 HH22 ARG 3 2HH2 ARG 3 -0.250 -6.924 -6.630 36 H PHE 4 H PHE 4 6.954 -3.824 -6.436 37 HA PHE 4 HA PHE 4 6.157 -1.337 -7.777 38 HB2 PHE 4 2HB PHE 4 8.743 -1.818 -6.865 39 HB3 PHE 4 3HB PHE 4 8.812 -2.212 -8.579 40 HD1 PHE 4 HD2 PHE 4 7.045 0.412 -6.598 41 HD2 PHE 4 HD1 PHE 4 9.721 -0.490 -9.783 42 HE1 PHE 4 HE2 PHE 4 7.205 2.807 -7.137 43 HE2 PHE 4 HE1 PHE 4 9.886 1.904 -10.326 44 HZ PHE 4 HZ PHE 4 8.627 3.556 -9.004 45 H ASP 5 H ASP 5 5.081 -1.833 -9.558 46 HA ASP 5 HA ASP 5 5.381 -4.455 -10.770 47 HB2 ASP 5 2HB ASP 5 3.275 -2.554 -10.534 48 HB3 ASP 5 3HB ASP 5 3.592 -2.794 -12.250 49 H LEU 6 H LEU 6 7.134 -4.632 -12.036 50 HA LEU 6 HA LEU 6 7.756 -2.453 -13.902 51 HB2 LEU 6 2HB LEU 6 9.361 -4.730 -12.790 52 HB3 LEU 6 3HB LEU 6 9.886 -3.853 -14.226 53 HG LEU 6 HG LEU 6 11.054 -2.993 -12.318 54 HD11 LEU 6 1HD1 LEU 6 9.969 -1.451 -14.122 55 HD12 LEU 6 2HD1 LEU 6 10.735 -0.750 -12.697 56 HD13 LEU 6 3HD1 LEU 6 8.979 -0.899 -12.770 57 HD21 LEU 6 3HD2 LEU 6 9.092 -3.741 -10.762 58 HD22 LEU 6 1HD2 LEU 6 8.522 -2.092 -11.022 59 HD23 LEU 6 2HD2 LEU 6 10.112 -2.374 -10.312 60 H ARG 7 H ARG 7 5.849 -5.012 -13.941 61 HA ARG 7 HA ARG 7 6.545 -6.692 -16.000 62 HB2 ARG 7 2HB ARG 7 4.099 -5.907 -14.671 63 HB3 ARG 7 3HB ARG 7 3.813 -6.196 -16.382 64 HG2 ARG 7 2HG ARG 7 4.412 -8.423 -16.243 65 HG3 ARG 7 3HG ARG 7 5.345 -8.184 -14.764 66 HD2 ARG 7 2HD ARG 7 3.501 -9.160 -13.860 67 HD3 ARG 7 3HD ARG 7 2.960 -7.482 -13.833 68 HE ARG 7 HE ARG 7 2.217 -8.626 -16.280 69 HH11 ARG 7 1HH1 ARG 7 1.464 -8.862 -12.889 70 HH12 ARG 7 2HH1 ARG 7 -0.171 -9.371 -13.154 71 HH21 ARG 7 1HH2 ARG 7 0.066 -9.297 -16.642 72 HH22 ARG 7 2HH2 ARG 7 -0.964 -9.619 -15.289 73 HA PRO 8 HA PRO 8 4.601 -3.685 -19.236 74 HB2 PRO 8 2HB PRO 8 3.902 -1.204 -18.383 75 HB3 PRO 8 3HB PRO 8 2.796 -2.582 -18.339 76 HG2 PRO 8 2HG PRO 8 4.445 -1.404 -16.135 77 HG3 PRO 8 3HG PRO 8 2.762 -1.962 -16.097 78 HD2 PRO 8 2HD PRO 8 4.813 -3.455 -15.150 79 HD3 PRO 8 3HD PRO 8 3.368 -4.176 -15.888 80 H LEU 9 H LEU 9 6.953 -2.907 -16.922 81 HA LEU 9 HA LEU 9 8.139 -0.718 -18.394 82 HB2 LEU 9 2HB LEU 9 8.359 -1.827 -15.770 83 HB3 LEU 9 3HB LEU 9 9.961 -1.756 -16.502 84 HG LEU 9 HG LEU 9 8.761 0.740 -16.993 85 HD11 LEU 9 1HD1 LEU 9 8.620 1.180 -14.333 86 HD12 LEU 9 2HD1 LEU 9 7.929 -0.439 -14.432 87 HD13 LEU 9 3HD1 LEU 9 7.220 0.880 -15.363 88 HD21 LEU 9 3HD2 LEU 9 10.640 0.469 -14.735 89 HD22 LEU 9 1HD2 LEU 9 10.716 1.502 -16.162 90 HD23 LEU 9 2HD2 LEU 9 11.176 -0.197 -16.279 91 H LYS 10 H LYS 10 10.063 -0.770 -19.537 92 HA LYS 10 HA LYS 10 10.720 -3.335 -20.708 93 HB2 LYS 10 2HB LYS 10 11.965 -2.112 -22.326 94 HB3 LYS 10 3HB LYS 10 10.491 -1.200 -22.033 95 HG2 LYS 10 2HG LYS 10 11.731 0.304 -20.543 96 HG3 LYS 10 3HG LYS 10 13.209 -0.599 -20.884 97 HD2 LYS 10 2HD LYS 10 13.308 1.237 -22.332 98 HD3 LYS 10 3HD LYS 10 12.730 -0.085 -23.349 99 HE2 LYS 10 2HE LYS 10 10.414 1.005 -22.306 100 HE3 LYS 10 3HE LYS 10 11.432 2.411 -22.611 101 HZ1 LYS 10 3HZ LYS 10 10.180 0.595 -24.486 102 HZ2 LYS 10 1HZ LYS 10 11.776 1.012 -24.862 103 HZ3 LYS 10 2HZ LYS 10 10.608 2.221 -24.673 104 H ALA 11 H ALA 11 13.000 -3.993 -20.981 105 HA ALA 11 HA ALA 11 14.313 -4.132 -18.467 106 HB1 ALA 11 1HB ALA 11 15.845 -4.833 -20.892 107 HB2 ALA 11 2HB ALA 11 15.588 -5.746 -19.404 108 HB3 ALA 11 3HB ALA 11 14.331 -5.702 -20.641 109 H GLY 12 H GLY 12 16.195 -3.179 -17.747 110 HA2 GLY 12 2HA GLY 12 18.197 -1.884 -18.143 111 HA3 GLY 12 3HA GLY 12 17.356 -1.077 -19.458 112 H ILE 13 H ILE 13 14.957 -0.440 -18.204 113 HA ILE 13 HA ILE 13 15.880 1.660 -16.382 114 HB ILE 13 HB ILE 13 13.152 1.439 -17.645 115 HG12 ILE 13 2HG1 ILE 13 15.594 2.900 -18.676 116 HG13 ILE 13 3HG1 ILE 13 14.856 1.480 -19.411 117 HG21 ILE 13 1HG2 ILE 13 12.686 3.396 -16.672 118 HG22 ILE 13 2HG2 ILE 13 14.076 3.066 -15.640 119 HG23 ILE 13 3HG2 ILE 13 14.264 4.073 -17.075 120 HD11 ILE 13 3HD1 ILE 13 13.837 4.286 -19.294 121 HD12 ILE 13 1HD1 ILE 13 14.063 3.235 -20.692 122 HD13 ILE 13 2HD1 ILE 13 12.740 2.932 -19.565 123 H PHE 14 H PHE 14 13.818 -1.145 -16.538 124 HA PHE 14 HA PHE 14 12.241 -0.715 -14.267 125 HB2 PHE 14 2HB PHE 14 11.648 -2.979 -14.405 126 HB3 PHE 14 3HB PHE 14 12.070 -2.562 -16.063 127 HD1 PHE 14 HD1 PHE 14 14.833 -2.781 -16.346 128 HD2 PHE 14 HD2 PHE 14 12.288 -5.097 -13.841 129 HE1 PHE 14 HE1 PHE 14 16.466 -4.621 -16.394 130 HE2 PHE 14 HE2 PHE 14 13.917 -6.940 -13.884 131 HZ PHE 14 HZ PHE 14 16.009 -6.704 -15.161 132 H GLU 15 H GLU 15 15.573 -1.523 -14.582 133 HA GLU 15 HA GLU 15 15.807 -2.507 -11.860 134 HB2 GLU 15 2HB GLU 15 17.208 -3.597 -13.458 135 HB3 GLU 15 3HB GLU 15 17.813 -2.064 -14.069 136 HG2 GLU 15 2HG GLU 15 18.305 -2.400 -11.229 137 HG3 GLU 15 3HG GLU 15 19.032 -3.677 -12.203 138 H ARG 16 H ARG 16 16.312 0.426 -13.662 139 HA ARG 16 HA ARG 16 17.875 1.722 -11.628 140 HB2 ARG 16 2HB ARG 16 16.840 2.390 -14.298 141 HB3 ARG 16 3HB ARG 16 16.904 3.750 -13.185 142 HG2 ARG 16 2HG ARG 16 19.164 3.792 -13.146 143 HG3 ARG 16 3HG ARG 16 19.309 2.042 -13.324 144 HD2 ARG 16 2HD ARG 16 19.854 2.410 -15.451 145 HD3 ARG 16 3HD ARG 16 18.175 2.880 -15.711 146 HE ARG 16 HE ARG 16 19.848 5.011 -14.745 147 HH11 ARG 16 1HH1 ARG 16 18.693 3.317 -17.558 148 HH12 ARG 16 2HH1 ARG 16 18.968 4.648 -18.633 149 HH21 ARG 16 1HH2 ARG 16 20.215 6.770 -16.150 150 HH22 ARG 16 2HH2 ARG 16 19.834 6.611 -17.831 151 H LEU 17 H LEU 17 14.502 1.846 -12.710 152 HA LEU 17 HA LEU 17 13.687 3.864 -10.900 153 HB2 LEU 17 2HB LEU 17 12.503 2.241 -12.923 154 HB3 LEU 17 3HB LEU 17 11.499 2.164 -11.477 155 HG LEU 17 HG LEU 17 10.707 3.896 -12.976 156 HD11 LEU 17 1HD1 LEU 17 11.872 5.640 -10.945 157 HD12 LEU 17 2HD1 LEU 17 11.152 4.169 -10.294 158 HD13 LEU 17 3HD1 LEU 17 10.184 5.259 -11.286 159 HD21 LEU 17 3HD2 LEU 17 12.995 4.300 -13.986 160 HD22 LEU 17 1HD2 LEU 17 13.325 5.322 -12.586 161 HD23 LEU 17 2HD2 LEU 17 12.008 5.732 -13.685 162 H GLU 18 H GLU 18 14.185 0.456 -10.586 163 HA GLU 18 HA GLU 18 12.526 -0.139 -8.423 164 HB2 GLU 18 2HB GLU 18 14.410 -1.505 -9.904 165 HB3 GLU 18 3HB GLU 18 15.139 -1.449 -8.306 166 HG2 GLU 18 2HG GLU 18 13.786 -3.028 -7.555 167 HG3 GLU 18 3HG GLU 18 12.361 -2.156 -8.117 168 H GLU 19 H GLU 19 15.555 1.572 -8.567 169 HA GLU 19 HA GLU 19 16.008 1.467 -5.719 170 HB2 GLU 19 2HB GLU 19 17.956 1.572 -7.095 171 HB3 GLU 19 3HB GLU 19 17.345 2.972 -7.964 172 HG2 GLU 19 2HG GLU 19 17.606 3.368 -5.078 173 HG3 GLU 19 3HG GLU 19 19.125 3.055 -5.915 174 H LEU 20 H LEU 20 14.351 3.511 -7.953 175 HA LEU 20 HA LEU 20 14.347 5.917 -6.490 176 HB2 LEU 20 2HB LEU 20 13.090 4.861 -8.836 177 HB3 LEU 20 3HB LEU 20 11.892 5.704 -7.857 178 HG LEU 20 HG LEU 20 13.917 7.517 -7.886 179 HD11 LEU 20 1HD1 LEU 20 14.388 7.575 -10.459 180 HD12 LEU 20 2HD1 LEU 20 14.129 5.835 -10.337 181 HD13 LEU 20 3HD1 LEU 20 15.397 6.606 -9.384 182 HD21 LEU 20 3HD2 LEU 20 12.030 7.543 -10.180 183 HD22 LEU 20 1HD2 LEU 20 12.447 8.823 -9.041 184 HD23 LEU 20 2HD2 LEU 20 11.356 7.527 -8.550 185 H ILE 21 H ILE 21 12.353 3.036 -6.314 186 HA ILE 21 HA ILE 21 10.538 4.246 -4.398 187 HB ILE 21 HB ILE 21 9.660 2.657 -6.056 188 HG12 ILE 21 2HG1 ILE 21 8.369 1.252 -4.485 189 HG13 ILE 21 3HG1 ILE 21 9.499 1.665 -3.200 190 HG21 ILE 21 1HG2 ILE 21 10.173 0.278 -5.891 191 HG22 ILE 21 2HG2 ILE 21 11.625 1.216 -6.234 192 HG23 ILE 21 3HG2 ILE 21 11.332 0.610 -4.605 193 HD11 ILE 21 3HD1 ILE 21 7.185 2.929 -3.574 194 HD12 ILE 21 1HD1 ILE 21 8.611 3.715 -2.898 195 HD13 ILE 21 2HD1 ILE 21 8.217 3.920 -4.605 196 H GLU 22 H GLU 22 13.236 2.005 -4.450 197 HA GLU 22 HA GLU 22 12.978 0.955 -1.863 198 HB2 GLU 22 2HB GLU 22 14.771 0.685 -3.973 199 HB3 GLU 22 3HB GLU 22 15.746 1.341 -2.665 200 HG2 GLU 22 2HG GLU 22 15.761 -0.593 -1.578 201 HG3 GLU 22 3HG GLU 22 14.019 -0.796 -1.756 202 H LYS 23 H LYS 23 14.104 4.027 -2.996 203 HA LYS 23 HA LYS 23 15.577 4.761 -0.671 204 HB2 LYS 23 2HB LYS 23 14.688 6.056 -3.157 205 HB3 LYS 23 3HB LYS 23 14.806 7.142 -1.779 206 HG2 LYS 23 2HG LYS 23 17.087 5.318 -2.264 207 HG3 LYS 23 3HG LYS 23 16.852 6.651 -3.396 208 HD2 LYS 23 2HD LYS 23 17.648 8.125 -1.927 209 HD3 LYS 23 3HD LYS 23 16.549 7.550 -0.671 210 HE2 LYS 23 2HE LYS 23 18.502 6.988 0.332 211 HE3 LYS 23 3HE LYS 23 18.303 5.537 -0.648 212 HZ1 LYS 23 3HZ LYS 23 20.437 6.124 -1.156 213 HZ2 LYS 23 1HZ LYS 23 20.152 7.785 -1.012 214 HZ3 LYS 23 2HZ LYS 23 19.616 6.951 -2.382 215 H GLU 24 H GLU 24 12.222 5.006 -1.640 216 HA GLU 24 HA GLU 24 11.501 6.745 0.544 217 HB2 GLU 24 2HB GLU 24 10.343 6.089 -1.881 218 HB3 GLU 24 3HB GLU 24 9.313 5.274 -0.713 219 HG2 GLU 24 2HG GLU 24 9.812 7.880 0.265 220 HG3 GLU 24 3HG GLU 24 9.367 8.018 -1.435 221 H MET 25 H MET 25 11.348 3.304 -0.179 222 HA MET 25 HA MET 25 9.718 2.503 1.957 223 HB2 MET 25 2HB MET 25 11.823 1.103 0.333 224 HB3 MET 25 3HB MET 25 11.028 0.287 1.672 225 HG2 MET 25 2HG MET 25 9.212 1.599 -0.217 226 HG3 MET 25 3HG MET 25 10.157 0.273 -0.891 227 HE1 MET 25 3HE MET 25 9.092 0.225 2.998 228 HE2 MET 25 1HE MET 25 8.087 1.389 2.134 229 HE3 MET 25 2HE MET 25 7.375 -0.100 2.756 230 H GLN 26 H GLN 26 10.334 1.388 3.924 231 HA GLN 26 HA GLN 26 12.189 2.854 5.462 232 HB2 GLN 26 2HB GLN 26 10.256 0.754 5.896 233 HB3 GLN 26 3HB GLN 26 11.734 0.421 6.788 234 HG2 GLN 26 2HG GLN 26 10.699 1.673 8.348 235 HG3 GLN 26 3HG GLN 26 11.440 2.987 7.435 236 HE21 GLN 26 1HE2 GLN 26 10.086 3.913 5.685 237 HE22 GLN 26 2HE2 GLN 26 8.392 4.078 5.980 238 HA PRO 27 HA PRO 27 16.022 0.801 4.888 239 HB2 PRO 27 2HB PRO 27 17.065 0.833 7.394 240 HB3 PRO 27 3HB PRO 27 16.925 2.284 6.393 241 HG2 PRO 27 2HG PRO 27 15.146 1.327 8.602 242 HG3 PRO 27 3HG PRO 27 15.730 2.967 8.267 243 HD2 PRO 27 2HD PRO 27 13.243 2.140 7.587 244 HD3 PRO 27 3HD PRO 27 14.147 3.333 6.633 245 H ASN 28 H ASN 28 13.545 -0.607 6.649 246 HA ASN 28 HA ASN 28 14.876 -3.203 6.548 247 HB2 ASN 28 2HB ASN 28 14.818 -1.912 8.930 248 HB3 ASN 28 3HB ASN 28 13.277 -2.762 8.997 249 HD21 ASN 28 1HD2 ASN 28 13.771 -5.099 7.781 250 HD22 ASN 28 2HD2 ASN 28 14.978 -5.992 8.636 251 H GLU 29 H GLU 29 12.851 -2.028 4.913 252 HA GLU 29 HA GLU 29 10.465 -3.571 5.673 253 HB2 GLU 29 2HB GLU 29 10.864 -0.984 4.394 254 HB3 GLU 29 3HB GLU 29 9.781 -2.020 3.476 255 HG2 GLU 29 2HG GLU 29 9.401 -1.617 6.415 256 HG3 GLU 29 3HG GLU 29 8.788 -0.449 5.246 257 H VAL 30 H VAL 30 9.218 -4.424 3.719 258 HA VAL 30 HA VAL 30 11.125 -5.849 1.998 259 HB VAL 30 HB VAL 30 8.562 -6.570 3.240 260 HG11 VAL 30 1HG1 VAL 30 8.026 -8.195 1.400 261 HG12 VAL 30 2HG1 VAL 30 7.707 -6.502 1.021 262 HG13 VAL 30 3HG1 VAL 30 9.144 -7.295 0.376 263 HG21 VAL 30 3HG2 VAL 30 10.268 -8.672 2.157 264 HG22 VAL 30 1HG2 VAL 30 11.132 -7.539 3.197 265 HG23 VAL 30 2HG2 VAL 30 9.719 -8.399 3.810 266 H ALA 31 H ALA 31 10.980 -5.812 -0.203 267 HA ALA 31 HA ALA 31 8.864 -4.146 -1.392 268 HB1 ALA 31 1HB ALA 31 11.139 -3.005 -1.153 269 HB2 ALA 31 2HB ALA 31 11.684 -4.107 -2.418 270 HB3 ALA 31 3HB ALA 31 10.373 -2.973 -2.741 271 H ILE 32 H ILE 32 7.725 -5.276 -2.810 272 HA ILE 32 HA ILE 32 8.931 -7.640 -4.055 273 HB ILE 32 HB ILE 32 6.040 -6.790 -3.857 274 HG12 ILE 32 2HG1 ILE 32 6.830 -9.351 -2.703 275 HG13 ILE 32 3HG1 ILE 32 7.675 -7.993 -1.967 276 HG21 ILE 32 1HG2 ILE 32 5.824 -8.034 -5.716 277 HG22 ILE 32 2HG2 ILE 32 7.388 -8.816 -5.497 278 HG23 ILE 32 3HG2 ILE 32 5.982 -9.394 -4.604 279 HD11 ILE 32 3HD1 ILE 32 5.657 -6.991 -1.278 280 HD12 ILE 32 1HD1 ILE 32 4.692 -8.068 -2.287 281 HD13 ILE 32 2HD1 ILE 32 5.527 -8.702 -0.868 282 H PHE 33 H PHE 33 9.827 -7.308 -5.976 283 HA PHE 33 HA PHE 33 8.604 -5.341 -7.789 284 HB2 PHE 33 2HB PHE 33 11.376 -6.515 -8.019 285 HB3 PHE 33 3HB PHE 33 10.733 -5.101 -8.848 286 HD1 PHE 33 HD2 PHE 33 9.444 -3.656 -6.642 287 HD2 PHE 33 HD1 PHE 33 13.163 -5.722 -6.781 288 HE1 PHE 33 HE2 PHE 33 10.309 -2.212 -4.848 289 HE2 PHE 33 HE1 PHE 33 14.033 -4.282 -4.986 290 HZ PHE 33 HZ PHE 33 12.607 -2.524 -4.018 291 H MET 34 H MET 34 7.380 -6.167 -9.339 292 HA MET 34 HA MET 34 7.635 -8.953 -10.096 293 HB2 MET 34 2HB MET 34 5.469 -7.397 -9.806 294 HB3 MET 34 3HB MET 34 5.750 -7.159 -11.525 295 HG2 MET 34 2HG MET 34 5.535 -9.485 -11.965 296 HG3 MET 34 3HG MET 34 5.527 -9.867 -10.244 297 HE1 MET 34 3HE MET 34 2.553 -9.266 -8.770 298 HE2 MET 34 1HE MET 34 4.094 -8.407 -8.762 299 HE3 MET 34 2HE MET 34 2.620 -7.570 -9.251 300 H PHE 35 H PHE 35 8.616 -9.698 -11.868 301 HA PHE 35 HA PHE 35 9.324 -7.780 -13.986 302 HB2 PHE 35 2HB PHE 35 11.485 -8.875 -14.251 303 HB3 PHE 35 3HB PHE 35 11.301 -8.301 -12.597 304 HD1 PHE 35 HD1 PHE 35 10.566 -9.989 -10.834 305 HD2 PHE 35 HD2 PHE 35 12.001 -11.099 -14.685 306 HE1 PHE 35 HE1 PHE 35 11.064 -12.248 -9.994 307 HE2 PHE 35 HE2 PHE 35 12.501 -13.359 -13.851 308 HZ PHE 35 HZ PHE 35 12.032 -13.936 -11.503 309 H GLU 36 H GLU 36 8.631 -8.353 -15.935 310 HA GLU 36 HA GLU 36 7.962 -11.185 -16.400 311 HB2 GLU 36 2HB GLU 36 6.191 -10.477 -17.869 312 HB3 GLU 36 3HB GLU 36 6.006 -9.648 -16.330 313 HG2 GLU 36 2HG GLU 36 5.689 -7.875 -17.681 314 HG3 GLU 36 3HG GLU 36 7.449 -7.812 -17.611 315 H VAL 37 H VAL 37 10.242 -9.000 -17.084 316 HA VAL 37 HA VAL 37 10.489 -9.534 -19.935 317 HB VAL 37 HB VAL 37 12.447 -8.026 -18.208 318 HG11 VAL 37 1HG1 VAL 37 13.543 -8.218 -20.179 319 HG12 VAL 37 2HG1 VAL 37 12.062 -8.475 -21.104 320 HG13 VAL 37 3HG1 VAL 37 12.524 -6.845 -20.612 321 HG21 VAL 37 3HG2 VAL 37 10.488 -6.836 -17.802 322 HG22 VAL 37 1HG2 VAL 37 11.188 -5.997 -19.186 323 HG23 VAL 37 2HG2 VAL 37 9.857 -7.129 -19.423 324 H GLY 38 H GLY 38 12.513 -10.351 -20.835 325 HA2 GLY 38 2HA GLY 38 13.294 -12.788 -19.634 326 HA3 GLY 38 3HA GLY 38 14.058 -12.039 -21.028 327 H ASP 39 H ASP 39 14.318 -9.622 -19.023 328 HA ASP 39 HA ASP 39 17.015 -10.324 -18.243 329 HB2 ASP 39 2HB ASP 39 15.401 -7.797 -18.256 330 HB3 ASP 39 3HB ASP 39 16.883 -7.884 -17.308 331 H PHE 40 H PHE 40 16.439 -11.966 -16.688 332 HA PHE 40 HA PHE 40 15.150 -11.040 -14.239 333 HB2 PHE 40 2HB PHE 40 16.033 -13.703 -13.924 334 HB3 PHE 40 3HB PHE 40 14.387 -13.141 -14.199 335 HD1 PHE 40 HD1 PHE 40 17.457 -14.328 -15.867 336 HD2 PHE 40 HD2 PHE 40 13.302 -13.494 -16.262 337 HE1 PHE 40 HE1 PHE 40 17.439 -15.470 -18.047 338 HE2 PHE 40 HE2 PHE 40 13.277 -14.635 -18.442 339 HZ PHE 40 HZ PHE 40 15.347 -15.625 -19.337 340 H SER 41 H SER 41 18.269 -11.523 -15.530 341 HA SER 41 HA SER 41 19.636 -12.039 -13.069 342 HB2 SER 41 2HB SER 41 21.546 -12.165 -14.335 343 HB3 SER 41 3HB SER 41 20.357 -12.400 -15.616 344 HG SER 41 HG SER 41 21.042 -10.624 -16.479 345 H ASN 42 H ASN 42 18.352 -9.254 -14.559 346 HA ASN 42 HA ASN 42 20.149 -7.370 -13.320 347 HB2 ASN 42 2HB ASN 42 17.924 -7.273 -15.221 348 HB3 ASN 42 3HB ASN 42 17.920 -5.930 -14.081 349 HD21 ASN 42 1HD2 ASN 42 19.965 -4.738 -13.859 350 HD22 ASN 42 2HD2 ASN 42 20.941 -4.522 -15.268 351 H ILE 43 H ILE 43 17.194 -8.965 -12.508 352 HA ILE 43 HA ILE 43 15.950 -7.291 -10.742 353 HB ILE 43 HB ILE 43 16.267 -10.248 -10.840 354 HG12 ILE 43 2HG1 ILE 43 14.569 -9.036 -12.183 355 HG13 ILE 43 3HG1 ILE 43 13.846 -10.175 -11.052 356 HG21 ILE 43 1HG2 ILE 43 15.324 -8.710 -8.446 357 HG22 ILE 43 2HG2 ILE 43 14.707 -10.323 -8.800 358 HG23 ILE 43 3HG2 ILE 43 16.431 -10.081 -8.521 359 HD11 ILE 43 3HD1 ILE 43 13.385 -7.382 -11.330 360 HD12 ILE 43 1HD1 ILE 43 12.577 -8.545 -10.279 361 HD13 ILE 43 2HD1 ILE 43 14.024 -7.705 -9.719 362 HA PRO 44 HA PRO 44 18.878 -8.720 -7.167 363 HB2 PRO 44 2HB PRO 44 21.122 -10.075 -7.873 364 HB3 PRO 44 3HB PRO 44 19.590 -10.877 -7.508 365 HG2 PRO 44 2HG PRO 44 20.788 -10.201 -10.167 366 HG3 PRO 44 3HG PRO 44 19.972 -11.689 -9.654 367 HD2 PRO 44 2HD PRO 44 18.734 -9.781 -11.123 368 HD3 PRO 44 3HD PRO 44 17.871 -10.785 -9.940 369 H LYS 45 H LYS 45 19.908 -7.467 -10.186 370 HA LYS 45 HA LYS 45 22.345 -6.268 -9.234 371 HB2 LYS 45 2HB LYS 45 21.461 -6.907 -11.704 372 HB3 LYS 45 3HB LYS 45 21.044 -5.198 -11.670 373 HG2 LYS 45 2HG LYS 45 23.663 -5.395 -10.670 374 HG3 LYS 45 3HG LYS 45 23.586 -6.432 -12.095 375 HD2 LYS 45 2HD LYS 45 22.423 -4.432 -13.225 376 HD3 LYS 45 3HD LYS 45 23.055 -3.487 -11.876 377 HE2 LYS 45 2HE LYS 45 25.118 -5.163 -12.961 378 HE3 LYS 45 3HE LYS 45 24.379 -4.209 -14.246 379 HZ1 LYS 45 3HZ LYS 45 25.718 -2.586 -13.561 380 HZ2 LYS 45 1HZ LYS 45 26.095 -3.369 -12.110 381 HZ3 LYS 45 2HZ LYS 45 24.698 -2.424 -12.222 382 H SER 46 H SER 46 18.996 -5.388 -9.418 383 HA SER 46 HA SER 46 19.364 -2.569 -9.175 384 HB2 SER 46 2HB SER 46 16.842 -3.654 -8.128 385 HB3 SER 46 3HB SER 46 17.117 -2.464 -9.401 386 HG SER 46 HG SER 46 16.383 -4.948 -9.712 387 H ALA 47 H ALA 47 18.351 -5.078 -6.854 388 HA ALA 47 HA ALA 47 18.190 -3.478 -4.590 389 HB1 ALA 47 1HB ALA 47 19.143 -6.331 -4.562 390 HB2 ALA 47 2HB ALA 47 18.247 -5.468 -3.311 391 HB3 ALA 47 3HB ALA 47 17.460 -5.880 -4.834 392 H GLU 48 H GLU 48 20.975 -4.705 -6.257 393 HA GLU 48 HA GLU 48 22.811 -4.289 -4.088 394 HB2 GLU 48 2HB GLU 48 23.108 -5.931 -6.007 395 HB3 GLU 48 3HB GLU 48 23.505 -4.544 -7.012 396 HG2 GLU 48 2HG GLU 48 25.199 -4.104 -4.996 397 HG3 GLU 48 3HG GLU 48 25.072 -5.859 -4.885 398 H PHE 49 H PHE 49 21.508 -2.385 -6.672 399 HA PHE 49 HA PHE 49 23.480 -0.419 -6.915 400 HB2 PHE 49 2HB PHE 49 20.958 -0.868 -7.990 401 HB3 PHE 49 3HB PHE 49 20.777 0.651 -7.118 402 HD1 PHE 49 HD2 PHE 49 22.305 2.557 -7.662 403 HD2 PHE 49 HD1 PHE 49 22.111 -0.973 -10.033 404 HE1 PHE 49 HE2 PHE 49 23.370 3.755 -9.528 405 HE2 PHE 49 HE1 PHE 49 23.177 0.220 -11.903 406 HZ PHE 49 HZ PHE 49 23.807 2.588 -11.652 407 H ILE 50 H ILE 50 21.089 -0.964 -4.457 408 HA ILE 50 HA ILE 50 21.170 1.642 -3.305 409 HB ILE 50 HB ILE 50 20.371 -0.955 -1.986 410 HG12 ILE 50 2HG1 ILE 50 19.119 -0.464 -4.087 411 HG13 ILE 50 3HG1 ILE 50 18.102 -0.449 -2.650 412 HG21 ILE 50 1HG2 ILE 50 18.860 1.093 -0.927 413 HG22 ILE 50 2HG2 ILE 50 20.253 0.327 -0.165 414 HG23 ILE 50 3HG2 ILE 50 20.462 1.810 -1.096 415 HD11 ILE 50 3HD1 ILE 50 17.800 1.392 -4.414 416 HD12 ILE 50 1HD1 ILE 50 17.838 1.849 -2.712 417 HD13 ILE 50 2HD1 ILE 50 19.265 2.086 -3.721 418 H GLN 51 H GLN 51 22.650 -1.464 -2.381 419 HA GLN 51 HA GLN 51 25.046 -0.233 -1.491 420 HB2 GLN 51 2HB GLN 51 23.210 0.179 0.359 421 HB3 GLN 51 3HB GLN 51 23.577 -1.486 0.790 422 HG2 GLN 51 2HG GLN 51 24.943 -0.187 2.165 423 HG3 GLN 51 3HG GLN 51 26.008 -0.769 0.887 424 HE21 GLN 51 1HE2 GLN 51 26.674 0.682 -0.738 425 HE22 GLN 51 2HE2 GLN 51 26.643 2.390 -0.480 426 H SER 52 H SER 52 26.660 -1.691 -1.477 427 HA SER 52 HA SER 52 26.365 -4.223 -2.527 428 HB2 SER 52 2HB SER 52 28.658 -4.674 -1.595 429 HB3 SER 52 3HB SER 52 28.529 -3.170 -2.507 430 HG SER 52 HG SER 52 29.124 -2.159 -0.777 431 H LYS 53 H LYS 53 26.090 -3.172 0.786 432 HA LYS 53 HA LYS 53 25.338 -5.915 1.540 433 HB2 LYS 53 2HB LYS 53 26.293 -5.351 3.836 434 HB3 LYS 53 3HB LYS 53 27.453 -5.667 2.552 435 HG2 LYS 53 2HG LYS 53 28.241 -3.555 2.556 436 HG3 LYS 53 3HG LYS 53 26.664 -2.850 2.919 437 HD2 LYS 53 2HD LYS 53 27.466 -2.519 4.981 438 HD3 LYS 53 3HD LYS 53 27.256 -4.257 5.209 439 HE2 LYS 53 2HE LYS 53 29.453 -4.075 5.785 440 HE3 LYS 53 3HE LYS 53 29.637 -4.319 4.049 441 HZ1 LYS 53 3HZ LYS 53 30.758 -2.309 5.383 442 HZ2 LYS 53 1HZ LYS 53 29.315 -1.565 4.905 443 HZ3 LYS 53 2HZ LYS 53 30.352 -2.224 3.743 444 H GLY 54 H GLY 54 23.309 -6.006 2.231 445 HA2 GLY 54 2HA GLY 54 21.960 -4.940 4.183 446 HA3 GLY 54 3HA GLY 54 22.021 -3.527 3.140 447 H HIS 55 H HIS 55 21.929 -5.717 0.885 448 HA HIS 55 HA HIS 55 18.989 -5.881 0.877 449 HB2 HIS 55 2HB HIS 55 19.088 -5.863 -1.544 450 HB3 HIS 55 3HB HIS 55 19.993 -4.488 -0.918 451 HD1 HIS 55 HD1 HIS 55 22.711 -5.016 -0.739 452 HD2 HIS 55 HD2 HIS 55 20.456 -7.279 -3.395 453 HE1 HIS 55 HE1 HIS 55 24.365 -5.999 -2.357 454 H GLU 56 H GLU 56 18.191 -7.837 1.219 455 HA GLU 56 HA GLU 56 19.633 -10.161 0.141 456 HB2 GLU 56 2HB GLU 56 19.488 -9.572 2.838 457 HB3 GLU 56 3HB GLU 56 18.178 -10.722 2.611 458 HG2 GLU 56 2HG GLU 56 20.712 -11.467 1.337 459 HG3 GLU 56 3HG GLU 56 20.749 -11.395 3.097 460 H LEU 57 H LEU 57 18.388 -11.245 -1.221 461 HA LEU 57 HA LEU 57 15.569 -10.755 -1.394 462 HB2 LEU 57 2HB LEU 57 17.399 -12.658 -2.841 463 HB3 LEU 57 3HB LEU 57 15.677 -12.510 -3.189 464 HG LEU 57 HG LEU 57 16.789 -11.256 -4.844 465 HD11 LEU 57 1HD1 LEU 57 16.201 -9.002 -3.013 466 HD12 LEU 57 2HD1 LEU 57 14.902 -10.149 -3.337 467 HD13 LEU 57 3HD1 LEU 57 15.670 -9.288 -4.670 468 HD21 LEU 57 3HD2 LEU 57 18.875 -11.090 -3.173 469 HD22 LEU 57 1HD2 LEU 57 18.229 -9.460 -2.990 470 HD23 LEU 57 2HD2 LEU 57 18.688 -10.052 -4.587 471 H LEU 58 H LEU 58 14.354 -11.554 0.222 472 HA LEU 58 HA LEU 58 14.797 -13.755 1.803 473 HB2 LEU 58 2HB LEU 58 12.608 -12.003 1.228 474 HB3 LEU 58 3HB LEU 58 12.012 -13.655 1.372 475 HG LEU 58 HG LEU 58 13.831 -12.817 3.521 476 HD11 LEU 58 1HD1 LEU 58 12.532 -11.228 4.542 477 HD12 LEU 58 2HD1 LEU 58 11.070 -11.708 3.680 478 HD13 LEU 58 3HD1 LEU 58 12.322 -10.786 2.847 479 HD21 LEU 58 3HD2 LEU 58 12.808 -14.869 3.856 480 HD22 LEU 58 1HD2 LEU 58 11.259 -14.317 3.218 481 HD23 LEU 58 2HD2 LEU 58 11.800 -13.777 4.808 482 H ASN 59 H ASN 59 13.153 -13.629 -1.329 483 HA ASN 59 HA ASN 59 13.445 -16.549 -1.505 484 HB2 ASN 59 2HB ASN 59 11.027 -15.504 -1.072 485 HB3 ASN 59 3HB ASN 59 11.086 -15.292 -2.819 486 HD21 ASN 59 1HD2 ASN 59 9.721 -16.805 -3.520 487 HD22 ASN 59 2HD2 ASN 59 9.862 -18.496 -3.192 488 H SER 60 H SER 60 14.878 -16.894 -3.066 489 HA SER 60 HA SER 60 15.760 -15.164 -4.996 490 HB2 SER 60 2HB SER 60 17.134 -16.962 -5.053 491 HB3 SER 60 3HB SER 60 15.844 -18.079 -4.608 492 HG SER 60 HG SER 60 16.906 -17.716 -6.990 493 H LEU 61 H LEU 61 14.886 -14.253 -6.727 494 HA LEU 61 HA LEU 61 12.285 -14.470 -7.540 495 HB2 LEU 61 2HB LEU 61 12.908 -13.360 -9.570 496 HB3 LEU 61 3HB LEU 61 13.863 -12.708 -8.240 497 HG LEU 61 HG LEU 61 14.930 -14.792 -10.130 498 HD11 LEU 61 1HD1 LEU 61 16.031 -12.220 -10.633 499 HD12 LEU 61 2HD1 LEU 61 14.275 -12.113 -10.756 500 HD13 LEU 61 3HD1 LEU 61 15.157 -13.284 -11.735 501 HD21 LEU 61 3HD2 LEU 61 16.063 -13.024 -8.003 502 HD22 LEU 61 1HD2 LEU 61 17.080 -13.567 -9.338 503 HD23 LEU 61 2HD2 LEU 61 16.311 -14.749 -8.279 504 H ARG 62 H ARG 62 11.095 -15.905 -8.618 505 HA ARG 62 HA ARG 62 12.391 -18.290 -9.663 506 HB2 ARG 62 2HB ARG 62 10.185 -18.074 -8.197 507 HB3 ARG 62 3HB ARG 62 9.437 -17.910 -9.780 508 HG2 ARG 62 2HG ARG 62 9.294 -20.155 -9.581 509 HG3 ARG 62 3HG ARG 62 10.922 -20.068 -10.257 510 HD2 ARG 62 2HD ARG 62 11.787 -20.979 -8.425 511 HD3 ARG 62 3HD ARG 62 11.028 -19.755 -7.409 512 HE ARG 62 HE ARG 62 9.425 -21.281 -6.840 513 HH11 ARG 62 1HH1 ARG 62 11.065 -22.381 -9.707 514 HH12 ARG 62 2HH1 ARG 62 10.279 -23.924 -9.723 515 HH21 ARG 62 1HH2 ARG 62 8.383 -23.310 -6.850 516 HH22 ARG 62 2HH2 ARG 62 8.753 -24.451 -8.098 517 H PHE 63 H PHE 63 13.204 -16.452 -11.304 518 HA PHE 63 HA PHE 63 11.577 -15.570 -13.375 519 HB2 PHE 63 2HB PHE 63 13.565 -15.134 -14.598 520 HB3 PHE 63 3HB PHE 63 13.992 -14.929 -12.902 521 HD1 PHE 63 HD2 PHE 63 14.936 -17.097 -11.741 522 HD2 PHE 63 HD1 PHE 63 14.947 -16.383 -15.937 523 HE1 PHE 63 HE2 PHE 63 16.771 -18.714 -12.008 524 HE2 PHE 63 HE1 PHE 63 16.781 -18.000 -16.211 525 HZ PHE 63 HZ PHE 63 17.696 -19.167 -14.245 526 H ASN 64 H ASN 64 12.687 -18.733 -12.666 527 HA ASN 64 HA ASN 64 12.850 -19.986 -15.104 528 HB2 ASN 64 2HB ASN 64 11.769 -20.938 -12.459 529 HB3 ASN 64 3HB ASN 64 11.849 -22.004 -13.859 530 HD21 ASN 64 1HD2 ASN 64 13.319 -23.355 -12.825 531 HD22 ASN 64 2HD2 ASN 64 14.974 -22.910 -12.607 532 H GLN 65 H GLN 65 10.042 -18.701 -13.531 533 HA GLN 65 HA GLN 65 8.323 -19.871 -15.614 534 HB2 GLN 65 2HB GLN 65 7.992 -19.769 -12.835 535 HB3 GLN 65 3HB GLN 65 6.879 -18.566 -13.473 536 HG2 GLN 65 2HG GLN 65 6.576 -20.811 -15.109 537 HG3 GLN 65 3HG GLN 65 6.669 -21.427 -13.460 538 HE21 GLN 65 1HE2 GLN 65 4.780 -21.626 -12.521 539 HE22 GLN 65 2HE2 GLN 65 3.391 -20.635 -12.789 540 H ALA 66 H ALA 66 6.178 -18.178 -15.484 541 HA ALA 66 HA ALA 66 7.022 -16.023 -17.109 542 HB1 ALA 66 1HB ALA 66 4.773 -15.497 -17.361 543 HB2 ALA 66 2HB ALA 66 4.746 -17.232 -17.044 544 HB3 ALA 66 3HB ALA 66 4.351 -16.094 -15.756 545 H ASP 67 H ASP 67 5.545 -13.842 -16.315 546 HA ASP 67 HA ASP 67 7.210 -12.332 -14.811 547 HB2 ASP 67 2HB ASP 67 5.348 -10.831 -14.359 548 HB3 ASP 67 3HB ASP 67 5.221 -11.463 -15.999 549 H TRP 68 H TRP 68 8.098 -12.831 -12.915 550 HA TRP 68 HA TRP 68 6.370 -13.931 -10.800 551 HB2 TRP 68 2HB TRP 68 8.695 -14.977 -11.749 552 HB3 TRP 68 3HB TRP 68 9.295 -14.003 -10.410 553 HD1 TRP 68 HD1 TRP 68 9.234 -15.125 -8.105 554 HE1 TRP 68 HE1 TRP 68 8.085 -17.198 -7.101 555 HE3 TRP 68 HE3 TRP 68 6.311 -16.442 -12.087 556 HZ2 TRP 68 HZ2 TRP 68 6.191 -19.136 -7.893 557 HZ3 TRP 68 HZ3 TRP 68 4.859 -18.419 -11.882 558 HH2 TRP 68 HH2 TRP 68 4.803 -19.737 -9.828 559 H THR 69 H THR 69 7.604 -13.398 -8.543 560 HA THR 69 HA THR 69 8.061 -10.488 -8.502 561 HB THR 69 HB THR 69 6.963 -10.809 -6.082 562 HG1 THR 69 HG1 THR 69 5.002 -12.195 -6.669 563 HG21 THR 69 3HG2 THR 69 5.090 -10.572 -8.407 564 HG22 THR 69 1HG2 THR 69 6.319 -9.339 -8.131 565 HG23 THR 69 2HG2 THR 69 5.108 -9.670 -6.892 566 H ILE 70 H ILE 70 9.616 -9.741 -7.116 567 HA ILE 70 HA ILE 70 11.067 -11.768 -5.544 568 HB ILE 70 HB ILE 70 12.408 -11.198 -7.476 569 HG12 ILE 70 2HG1 ILE 70 14.435 -10.476 -6.359 570 HG13 ILE 70 3HG1 ILE 70 13.502 -9.762 -5.049 571 HG21 ILE 70 1HG2 ILE 70 11.289 -8.641 -7.134 572 HG22 ILE 70 2HG2 ILE 70 13.030 -8.459 -6.927 573 HG23 ILE 70 3HG2 ILE 70 12.388 -9.181 -8.403 574 HD11 ILE 70 3HD1 ILE 70 12.938 -12.588 -5.459 575 HD12 ILE 70 1HD1 ILE 70 14.619 -12.254 -5.045 576 HD13 ILE 70 2HD1 ILE 70 13.323 -11.706 -3.981 577 H VAL 71 H VAL 71 11.096 -11.350 -3.445 578 HA VAL 71 HA VAL 71 10.387 -8.689 -2.492 579 HB VAL 71 HB VAL 71 10.292 -9.757 -0.255 580 HG11 VAL 71 1HG1 VAL 71 8.488 -11.575 -1.198 581 HG12 VAL 71 2HG1 VAL 71 8.171 -9.853 -0.976 582 HG13 VAL 71 3HG1 VAL 71 8.638 -10.468 -2.562 583 HG21 VAL 71 3HG2 VAL 71 11.968 -11.490 -0.593 584 HG22 VAL 71 1HG2 VAL 71 10.433 -12.203 -0.095 585 HG23 VAL 71 2HG2 VAL 71 10.934 -12.278 -1.785 586 H VAL 72 H VAL 72 11.767 -7.294 -1.581 587 HA VAL 72 HA VAL 72 14.493 -8.241 -0.975 588 HB VAL 72 HB VAL 72 13.790 -5.487 -1.990 589 HG11 VAL 72 1HG1 VAL 72 16.040 -5.011 -1.984 590 HG12 VAL 72 2HG1 VAL 72 15.910 -6.037 -0.554 591 HG13 VAL 72 3HG1 VAL 72 16.510 -6.708 -2.072 592 HG21 VAL 72 3HG2 VAL 72 13.697 -6.317 -4.049 593 HG22 VAL 72 1HG2 VAL 72 15.351 -6.901 -3.869 594 HG23 VAL 72 2HG2 VAL 72 13.996 -7.942 -3.434 595 H ARG 73 H ARG 73 15.117 -7.953 1.058 596 HA ARG 73 HA ARG 73 13.550 -6.152 2.765 597 HB2 ARG 73 2HB ARG 73 14.675 -7.420 4.639 598 HB3 ARG 73 3HB ARG 73 13.580 -8.363 3.637 599 HG2 ARG 73 2HG ARG 73 15.191 -9.783 3.094 600 HG3 ARG 73 3HG ARG 73 16.259 -8.471 2.593 601 HD2 ARG 73 2HD ARG 73 17.152 -9.900 4.442 602 HD3 ARG 73 3HD ARG 73 17.066 -8.179 4.816 603 HE ARG 73 HE ARG 73 14.751 -9.655 5.658 604 HH11 ARG 73 1HH1 ARG 73 17.975 -8.660 6.514 605 HH12 ARG 73 2HH1 ARG 73 17.707 -8.802 8.219 606 HH21 ARG 73 1HH2 ARG 73 14.385 -9.846 7.902 607 HH22 ARG 73 2HH2 ARG 73 15.665 -9.478 9.008 608 H LYS 74 H LYS 74 14.397 -4.184 2.936 609 HA LYS 74 HA LYS 74 17.101 -3.546 2.435 610 HB2 LYS 74 2HB LYS 74 14.689 -2.120 3.345 611 HB3 LYS 74 3HB LYS 74 16.207 -1.426 3.899 612 HG2 LYS 74 2HG LYS 74 16.985 -1.301 1.577 613 HG3 LYS 74 3HG LYS 74 15.441 -1.963 1.036 614 HD2 LYS 74 2HD LYS 74 15.269 0.388 2.805 615 HD3 LYS 74 3HD LYS 74 15.980 0.681 1.216 616 HE2 LYS 74 2HE LYS 74 13.469 0.980 1.407 617 HE3 LYS 74 3HE LYS 74 14.041 -0.056 0.100 618 HZ1 LYS 74 3HZ LYS 74 13.593 -1.981 1.563 619 HZ2 LYS 74 1HZ LYS 74 12.200 -1.106 1.168 620 HZ3 LYS 74 2HZ LYS 74 12.902 -0.933 2.697 621 H LYS 75 H LYS 75 18.633 -2.605 3.953 622 HA LYS 75 HA LYS 75 18.341 -2.947 6.760 623 HB2 LYS 75 2HB LYS 75 18.994 -5.286 5.411 624 HB3 LYS 75 3HB LYS 75 20.544 -4.693 5.994 625 HG2 LYS 75 2HG LYS 75 18.388 -4.621 7.978 626 HG3 LYS 75 3HG LYS 75 18.835 -6.236 7.424 627 HD2 LYS 75 2HD LYS 75 21.163 -5.803 7.992 628 HD3 LYS 75 3HD LYS 75 20.750 -4.162 8.494 629 HE2 LYS 75 2HE LYS 75 20.600 -5.082 10.541 630 HE3 LYS 75 3HE LYS 75 19.011 -5.605 9.986 631 HZ1 LYS 75 3HZ LYS 75 20.179 -7.456 10.932 632 HZ2 LYS 75 1HZ LYS 75 21.514 -7.200 9.925 633 HZ3 LYS 75 2HZ LYS 75 20.041 -7.703 9.264 634 H ALA 76 H ALA 76 20.525 -2.636 4.010 635 HA ALA 76 HA ALA 76 21.777 -0.338 5.182 636 HB1 ALA 76 1HB ALA 76 24.109 -1.416 4.931 637 HB2 ALA 76 2HB ALA 76 23.161 -1.767 6.377 638 HB3 ALA 76 3HB ALA 76 23.242 -2.946 5.068 Start of MODEL 8 1 H1 MET 1 H MET 1 1.927 -1.264 -2.234 2 HA MET 1 HA MET 1 2.412 1.292 -2.635 3 HB2 MET 1 2HB MET 1 2.671 2.381 -0.385 4 HB3 MET 1 3HB MET 1 1.008 2.074 -0.868 5 HG2 MET 1 2HG MET 1 0.637 0.746 0.874 6 HG3 MET 1 3HG MET 1 2.151 -0.125 0.640 7 HE1 MET 1 3HE MET 1 0.376 1.961 3.374 8 HE2 MET 1 1HE MET 1 0.844 0.265 3.251 9 HE3 MET 1 2HE MET 1 1.670 1.327 4.391 10 H LYS 2 H LYS 2 3.223 -1.461 -0.709 11 HA LYS 2 HA LYS 2 6.030 -0.640 -0.542 12 HB2 LYS 2 2HB LYS 2 6.266 -2.673 0.901 13 HB3 LYS 2 3HB LYS 2 5.157 -1.462 1.531 14 HG2 LYS 2 2HG LYS 2 3.261 -2.766 0.728 15 HG3 LYS 2 3HG LYS 2 4.367 -3.976 0.071 16 HD2 LYS 2 2HD LYS 2 5.263 -3.931 2.581 17 HD3 LYS 2 3HD LYS 2 3.601 -3.420 2.884 18 HE2 LYS 2 2HE LYS 2 2.984 -5.440 1.370 19 HE3 LYS 2 3HE LYS 2 4.617 -5.992 1.741 20 HZ1 LYS 2 3HZ LYS 2 2.687 -6.739 3.237 21 HZ2 LYS 2 1HZ LYS 2 2.787 -5.189 3.907 22 HZ3 LYS 2 2HZ LYS 2 4.122 -6.225 3.971 23 H ARG 3 H ARG 3 4.687 -1.460 -3.049 24 HA ARG 3 HA ARG 3 6.622 -3.511 -3.820 25 HB2 ARG 3 2HB ARG 3 4.977 -4.823 -5.008 26 HB3 ARG 3 3HB ARG 3 4.486 -4.673 -3.326 27 HG2 ARG 3 2HG ARG 3 3.386 -2.578 -5.020 28 HG3 ARG 3 3HG ARG 3 2.907 -4.202 -5.518 29 HD2 ARG 3 2HD ARG 3 2.091 -4.678 -3.287 30 HD3 ARG 3 3HD ARG 3 2.654 -3.106 -2.720 31 HE ARG 3 HE ARG 3 0.766 -2.164 -3.596 32 HH11 ARG 3 1HH1 ARG 3 1.218 -5.311 -5.015 33 HH12 ARG 3 2HH1 ARG 3 -0.303 -5.299 -5.845 34 HH21 ARG 3 1HH2 ARG 3 -1.239 -2.137 -4.683 35 HH22 ARG 3 2HH2 ARG 3 -1.700 -3.493 -5.656 36 H PHE 4 H PHE 4 6.808 -3.704 -6.210 37 HA PHE 4 HA PHE 4 6.002 -1.260 -7.624 38 HB2 PHE 4 2HB PHE 4 8.595 -1.714 -6.731 39 HB3 PHE 4 3HB PHE 4 8.643 -2.187 -8.426 40 HD1 PHE 4 HD2 PHE 4 6.887 0.532 -6.568 41 HD2 PHE 4 HD1 PHE 4 9.571 -0.524 -9.697 42 HE1 PHE 4 HE2 PHE 4 7.054 2.899 -7.218 43 HE2 PHE 4 HE1 PHE 4 9.743 1.842 -10.352 44 HZ PHE 4 HZ PHE 4 8.483 3.557 -9.113 45 H ASP 5 H ASP 5 4.922 -1.789 -9.392 46 HA ASP 5 HA ASP 5 5.188 -4.459 -10.516 47 HB2 ASP 5 2HB ASP 5 3.088 -2.539 -10.310 48 HB3 ASP 5 3HB ASP 5 3.369 -2.862 -12.019 49 H LEU 6 H LEU 6 6.947 -4.649 -11.781 50 HA LEU 6 HA LEU 6 7.540 -2.529 -13.716 51 HB2 LEU 6 2HB LEU 6 9.129 -4.816 -12.603 52 HB3 LEU 6 3HB LEU 6 9.639 -3.971 -14.063 53 HG LEU 6 HG LEU 6 10.864 -3.096 -12.203 54 HD11 LEU 6 1HD1 LEU 6 8.840 -0.953 -12.561 55 HD12 LEU 6 2HD1 LEU 6 9.668 -1.566 -13.992 56 HD13 LEU 6 3HD1 LEU 6 10.600 -0.880 -12.662 57 HD21 LEU 6 3HD2 LEU 6 8.780 -3.759 -10.651 58 HD22 LEU 6 1HD2 LEU 6 8.496 -2.025 -10.801 59 HD23 LEU 6 2HD2 LEU 6 10.029 -2.615 -10.158 60 H ARG 7 H ARG 7 5.595 -5.062 -13.673 61 HA ARG 7 HA ARG 7 6.223 -6.775 -15.729 62 HB2 ARG 7 2HB ARG 7 3.849 -6.003 -14.307 63 HB3 ARG 7 3HB ARG 7 3.472 -6.205 -16.013 64 HG2 ARG 7 2HG ARG 7 4.072 -8.450 -16.009 65 HG3 ARG 7 3HG ARG 7 5.014 -8.293 -14.524 66 HD2 ARG 7 2HD ARG 7 3.241 -8.949 -13.362 67 HD3 ARG 7 3HD ARG 7 2.377 -7.513 -13.907 68 HE ARG 7 HE ARG 7 2.033 -10.207 -14.850 69 HH11 ARG 7 1HH1 ARG 7 1.652 -6.832 -15.614 70 HH12 ARG 7 2HH1 ARG 7 0.401 -7.104 -16.782 71 HH21 ARG 7 1HH2 ARG 7 0.387 -10.578 -16.385 72 HH22 ARG 7 2HH2 ARG 7 -0.318 -9.235 -17.219 73 HA PRO 8 HA PRO 8 4.214 -3.786 -18.943 74 HB2 PRO 8 2HB PRO 8 3.566 -1.288 -18.098 75 HB3 PRO 8 3HB PRO 8 2.448 -2.654 -18.006 76 HG2 PRO 8 2HG PRO 8 4.172 -1.469 -15.865 77 HG3 PRO 8 3HG PRO 8 2.486 -2.009 -15.772 78 HD2 PRO 8 2HD PRO 8 4.548 -3.512 -14.867 79 HD3 PRO 8 3HD PRO 8 3.075 -4.227 -15.555 80 H LEU 9 H LEU 9 6.644 -3.012 -16.710 81 HA LEU 9 HA LEU 9 7.812 -0.868 -18.273 82 HB2 LEU 9 2HB LEU 9 8.177 -2.013 -15.623 83 HB3 LEU 9 3HB LEU 9 9.705 -1.667 -16.430 84 HG LEU 9 HG LEU 9 8.143 0.627 -16.786 85 HD11 LEU 9 1HD1 LEU 9 7.018 -0.709 -14.670 86 HD12 LEU 9 2HD1 LEU 9 6.924 1.028 -14.961 87 HD13 LEU 9 3HD1 LEU 9 8.160 0.380 -13.883 88 HD21 LEU 9 3HD2 LEU 9 9.963 1.651 -15.910 89 HD22 LEU 9 1HD2 LEU 9 10.675 0.054 -16.140 90 HD23 LEU 9 2HD2 LEU 9 10.078 0.532 -14.550 91 H LYS 10 H LYS 10 9.465 -1.040 -19.679 92 HA LYS 10 HA LYS 10 10.142 -3.602 -20.717 93 HB2 LYS 10 2HB LYS 10 11.465 -2.434 -22.319 94 HB3 LYS 10 3HB LYS 10 10.028 -1.459 -22.037 95 HG2 LYS 10 2HG LYS 10 11.347 -0.048 -20.486 96 HG3 LYS 10 3HG LYS 10 12.782 -0.981 -20.918 97 HD2 LYS 10 2HD LYS 10 13.016 0.705 -22.423 98 HD3 LYS 10 3HD LYS 10 11.957 -0.340 -23.373 99 HE2 LYS 10 2HE LYS 10 10.016 0.943 -22.416 100 HE3 LYS 10 3HE LYS 10 11.188 2.072 -21.740 101 HZ1 LYS 10 3HZ LYS 10 11.979 2.537 -23.973 102 HZ2 LYS 10 1HZ LYS 10 10.321 2.851 -23.855 103 HZ3 LYS 10 2HZ LYS 10 10.863 1.446 -24.625 104 H ALA 11 H ALA 11 12.346 -4.430 -20.944 105 HA ALA 11 HA ALA 11 13.665 -4.566 -18.426 106 HB1 ALA 11 1HB ALA 11 14.641 -5.562 -21.100 107 HB2 ALA 11 2HB ALA 11 15.208 -6.073 -19.509 108 HB3 ALA 11 3HB ALA 11 13.563 -6.450 -20.022 109 H GLY 12 H GLY 12 15.728 -3.846 -17.842 110 HA2 GLY 12 2HA GLY 12 17.786 -2.709 -18.284 111 HA3 GLY 12 3HA GLY 12 17.015 -1.917 -19.650 112 H ILE 13 H ILE 13 14.673 -1.020 -18.405 113 HA ILE 13 HA ILE 13 15.790 1.133 -16.763 114 HB ILE 13 HB ILE 13 13.037 0.989 -17.992 115 HG12 ILE 13 2HG1 ILE 13 15.512 2.368 -19.055 116 HG13 ILE 13 3HG1 ILE 13 14.815 0.893 -19.716 117 HG21 ILE 13 1HG2 ILE 13 14.631 3.292 -16.872 118 HG22 ILE 13 2HG2 ILE 13 13.053 3.420 -17.648 119 HG23 ILE 13 3HG2 ILE 13 13.219 2.538 -16.130 120 HD11 ILE 13 3HD1 ILE 13 12.677 2.566 -19.754 121 HD12 ILE 13 1HD1 ILE 13 14.009 3.679 -20.063 122 HD13 ILE 13 2HD1 ILE 13 13.766 2.282 -21.111 123 H PHE 14 H PHE 14 13.624 -1.571 -16.627 124 HA PHE 14 HA PHE 14 12.097 -0.867 -14.384 125 HB2 PHE 14 2HB PHE 14 11.402 -3.104 -14.313 126 HB3 PHE 14 3HB PHE 14 11.811 -2.854 -16.008 127 HD1 PHE 14 HD1 PHE 14 14.436 -3.327 -16.480 128 HD2 PHE 14 HD2 PHE 14 12.078 -5.087 -13.405 129 HE1 PHE 14 HE1 PHE 14 15.985 -5.236 -16.390 130 HE2 PHE 14 HE2 PHE 14 13.624 -6.998 -13.308 131 HZ PHE 14 HZ PHE 14 15.581 -7.075 -14.802 132 H GLU 15 H GLU 15 15.341 -2.108 -14.688 133 HA GLU 15 HA GLU 15 15.597 -2.781 -11.898 134 HB2 GLU 15 2HB GLU 15 16.909 -4.055 -13.439 135 HB3 GLU 15 3HB GLU 15 17.586 -2.601 -14.159 136 HG2 GLU 15 2HG GLU 15 18.086 -2.821 -11.296 137 HG3 GLU 15 3HG GLU 15 18.777 -4.139 -12.240 138 H ARG 16 H ARG 16 15.986 0.028 -13.841 139 HA ARG 16 HA ARG 16 17.748 1.387 -11.998 140 HB2 ARG 16 2HB ARG 16 16.592 1.919 -14.648 141 HB3 ARG 16 3HB ARG 16 16.742 3.343 -13.627 142 HG2 ARG 16 2HG ARG 16 19.001 3.333 -13.703 143 HG3 ARG 16 3HG ARG 16 19.100 1.572 -13.775 144 HD2 ARG 16 2HD ARG 16 19.453 1.715 -15.962 145 HD3 ARG 16 3HD ARG 16 17.841 2.406 -16.150 146 HE ARG 16 HE ARG 16 19.813 4.337 -15.375 147 HH11 ARG 16 1HH1 ARG 16 18.397 2.639 -18.064 148 HH12 ARG 16 2HH1 ARG 16 18.816 3.857 -19.222 149 HH21 ARG 16 1HH2 ARG 16 20.372 5.947 -16.891 150 HH22 ARG 16 2HH2 ARG 16 19.941 5.738 -18.554 151 H LEU 17 H LEU 17 14.325 1.518 -12.897 152 HA LEU 17 HA LEU 17 13.665 3.666 -11.162 153 HB2 LEU 17 2HB LEU 17 12.329 1.981 -13.042 154 HB3 LEU 17 3HB LEU 17 11.391 2.036 -11.552 155 HG LEU 17 HG LEU 17 10.591 3.711 -13.095 156 HD11 LEU 17 1HD1 LEU 17 10.749 4.165 -10.607 157 HD12 LEU 17 2HD1 LEU 17 10.583 5.574 -11.655 158 HD13 LEU 17 3HD1 LEU 17 12.158 5.160 -10.979 159 HD21 LEU 17 3HD2 LEU 17 12.965 3.889 -14.163 160 HD22 LEU 17 1HD2 LEU 17 13.189 5.176 -12.979 161 HD23 LEU 17 2HD2 LEU 17 11.887 5.286 -14.164 162 H GLU 18 H GLU 18 13.951 0.224 -10.745 163 HA GLU 18 HA GLU 18 12.415 -0.178 -8.465 164 HB2 GLU 18 2HB GLU 18 14.075 -1.731 -9.988 165 HB3 GLU 18 3HB GLU 18 14.980 -1.615 -8.485 166 HG2 GLU 18 2HG GLU 18 13.632 -3.046 -7.464 167 HG3 GLU 18 3HG GLU 18 12.194 -2.170 -7.985 168 H GLU 19 H GLU 19 15.522 1.346 -8.845 169 HA GLU 19 HA GLU 19 16.156 1.314 -6.036 170 HB2 GLU 19 2HB GLU 19 18.013 1.319 -7.524 171 HB3 GLU 19 3HB GLU 19 17.382 2.695 -8.418 172 HG2 GLU 19 2HG GLU 19 17.830 3.232 -5.583 173 HG3 GLU 19 3HG GLU 19 19.289 2.809 -6.477 174 H LEU 20 H LEU 20 14.467 3.398 -8.227 175 HA LEU 20 HA LEU 20 14.622 5.793 -6.722 176 HB2 LEU 20 2HB LEU 20 13.338 4.866 -9.112 177 HB3 LEU 20 3HB LEU 20 12.184 5.765 -8.129 178 HG LEU 20 HG LEU 20 14.325 7.441 -8.094 179 HD11 LEU 20 1HD1 LEU 20 15.443 5.854 -9.727 180 HD12 LEU 20 2HD1 LEU 20 15.365 7.551 -10.199 181 HD13 LEU 20 3HD1 LEU 20 14.244 6.387 -10.906 182 HD21 LEU 20 3HD2 LEU 20 13.090 8.717 -9.822 183 HD22 LEU 20 1HD2 LEU 20 12.056 8.118 -8.525 184 HD23 LEU 20 2HD2 LEU 20 12.068 7.303 -10.089 185 H ILE 21 H ILE 21 12.489 3.015 -6.631 186 HA ILE 21 HA ILE 21 10.704 4.282 -4.720 187 HB ILE 21 HB ILE 21 9.757 2.793 -6.426 188 HG12 ILE 21 2HG1 ILE 21 8.415 1.359 -4.883 189 HG13 ILE 21 3HG1 ILE 21 9.524 1.783 -3.583 190 HG21 ILE 21 1HG2 ILE 21 11.296 0.609 -5.028 191 HG22 ILE 21 2HG2 ILE 21 10.142 0.389 -6.342 192 HG23 ILE 21 3HG2 ILE 21 11.651 1.256 -6.630 193 HD11 ILE 21 3HD1 ILE 21 8.375 4.072 -5.001 194 HD12 ILE 21 1HD1 ILE 21 7.211 3.075 -4.129 195 HD13 ILE 21 2HD1 ILE 21 8.580 3.786 -3.273 196 H GLU 22 H GLU 22 13.269 1.890 -4.792 197 HA GLU 22 HA GLU 22 12.941 0.718 -2.295 198 HB2 GLU 22 2HB GLU 22 14.749 0.453 -4.296 199 HB3 GLU 22 3HB GLU 22 15.726 1.292 -3.099 200 HG2 GLU 22 2HG GLU 22 15.983 -0.552 -1.905 201 HG3 GLU 22 3HG GLU 22 14.246 -0.851 -1.879 202 H LYS 23 H LYS 23 14.067 3.881 -3.143 203 HA LYS 23 HA LYS 23 15.469 4.502 -0.770 204 HB2 LYS 23 2HB LYS 23 14.469 5.940 -3.114 205 HB3 LYS 23 3HB LYS 23 14.440 6.908 -1.646 206 HG2 LYS 23 2HG LYS 23 16.934 5.525 -1.813 207 HG3 LYS 23 3HG LYS 23 16.625 6.374 -3.329 208 HD2 LYS 23 2HD LYS 23 16.305 8.454 -2.152 209 HD3 LYS 23 3HD LYS 23 16.439 7.635 -0.594 210 HE2 LYS 23 2HE LYS 23 18.663 7.506 -2.598 211 HE3 LYS 23 3HE LYS 23 18.492 8.898 -1.529 212 HZ1 LYS 23 3HZ LYS 23 19.720 7.670 -0.141 213 HZ2 LYS 23 1HZ LYS 23 19.379 6.215 -0.935 214 HZ3 LYS 23 2HZ LYS 23 18.280 6.844 0.187 215 H GLU 24 H GLU 24 12.075 4.705 -1.671 216 HA GLU 24 HA GLU 24 11.273 6.154 0.658 217 HB2 GLU 24 2HB GLU 24 10.093 5.559 -1.746 218 HB3 GLU 24 3HB GLU 24 9.227 4.500 -0.642 219 HG2 GLU 24 2HG GLU 24 9.320 6.950 0.663 220 HG3 GLU 24 3HG GLU 24 9.000 7.347 -1.024 221 H MET 25 H MET 25 11.290 2.744 -0.279 222 HA MET 25 HA MET 25 9.873 1.640 1.817 223 HB2 MET 25 2HB MET 25 12.338 0.493 0.495 224 HB3 MET 25 3HB MET 25 11.149 -0.417 1.417 225 HG2 MET 25 2HG MET 25 10.652 1.040 -1.169 226 HG3 MET 25 3HG MET 25 10.818 -0.702 -0.967 227 HE1 MET 25 3HE MET 25 9.125 -2.084 0.722 228 HE2 MET 25 1HE MET 25 9.271 -0.829 1.952 229 HE3 MET 25 2HE MET 25 7.676 -1.353 1.414 230 H GLN 26 H GLN 26 10.350 0.958 3.881 231 HA GLN 26 HA GLN 26 12.150 2.476 5.387 232 HB2 GLN 26 2HB GLN 26 10.285 0.296 5.862 233 HB3 GLN 26 3HB GLN 26 11.714 0.169 6.878 234 HG2 GLN 26 2HG GLN 26 10.485 1.479 8.234 235 HG3 GLN 26 3HG GLN 26 11.181 2.755 7.238 236 HE21 GLN 26 1HE2 GLN 26 9.862 4.039 6.110 237 HE22 GLN 26 2HE2 GLN 26 8.152 3.835 5.979 238 HA PRO 27 HA PRO 27 16.040 0.468 5.145 239 HB2 PRO 27 2HB PRO 27 16.910 0.525 7.716 240 HB3 PRO 27 3HB PRO 27 16.815 1.970 6.701 241 HG2 PRO 27 2HG PRO 27 14.905 0.993 8.788 242 HG3 PRO 27 3HG PRO 27 15.485 2.641 8.487 243 HD2 PRO 27 2HD PRO 27 13.064 1.773 7.642 244 HD3 PRO 27 3HD PRO 27 14.012 2.977 6.746 245 H ASN 28 H ASN 28 13.477 -0.963 6.775 246 HA ASN 28 HA ASN 28 14.787 -3.556 6.682 247 HB2 ASN 28 2HB ASN 28 14.797 -2.275 9.079 248 HB3 ASN 28 3HB ASN 28 13.265 -3.138 9.179 249 HD21 ASN 28 1HD2 ASN 28 13.843 -5.435 7.808 250 HD22 ASN 28 2HD2 ASN 28 15.043 -6.335 8.665 251 H GLU 29 H GLU 29 12.754 -2.392 5.088 252 HA GLU 29 HA GLU 29 10.382 -3.936 5.901 253 HB2 GLU 29 2HB GLU 29 10.709 -1.283 4.774 254 HB3 GLU 29 3HB GLU 29 9.641 -2.270 3.787 255 HG2 GLU 29 2HG GLU 29 8.538 -2.830 6.097 256 HG3 GLU 29 3HG GLU 29 9.299 -1.316 6.583 257 H VAL 30 H VAL 30 9.081 -4.774 4.011 258 HA VAL 30 HA VAL 30 10.911 -6.127 2.171 259 HB VAL 30 HB VAL 30 8.384 -6.836 3.448 260 HG11 VAL 30 1HG1 VAL 30 7.605 -8.242 1.538 261 HG12 VAL 30 2HG1 VAL 30 7.412 -6.506 1.286 262 HG13 VAL 30 3HG1 VAL 30 8.735 -7.370 0.503 263 HG21 VAL 30 3HG2 VAL 30 9.362 -9.145 2.626 264 HG22 VAL 30 1HG2 VAL 30 10.813 -8.175 2.373 265 HG23 VAL 30 2HG2 VAL 30 10.085 -8.272 3.977 266 H ALA 31 H ALA 31 10.709 -6.048 -0.038 267 HA ALA 31 HA ALA 31 8.663 -4.245 -1.142 268 HB1 ALA 31 1HB ALA 31 10.985 -3.192 -0.858 269 HB2 ALA 31 2HB ALA 31 11.471 -4.236 -2.194 270 HB3 ALA 31 3HB ALA 31 10.194 -3.043 -2.427 271 H ILE 32 H ILE 32 7.475 -5.331 -2.555 272 HA ILE 32 HA ILE 32 8.612 -7.662 -3.908 273 HB ILE 32 HB ILE 32 5.775 -6.714 -3.549 274 HG12 ILE 32 2HG1 ILE 32 6.648 -9.462 -2.874 275 HG13 ILE 32 3HG1 ILE 32 7.325 -8.175 -1.882 276 HG21 ILE 32 1HG2 ILE 32 5.494 -9.137 -4.706 277 HG22 ILE 32 2HG2 ILE 32 5.409 -7.609 -5.581 278 HG23 ILE 32 3HG2 ILE 32 6.911 -8.533 -5.563 279 HD11 ILE 32 3HD1 ILE 32 4.432 -8.003 -2.309 280 HD12 ILE 32 1HD1 ILE 32 4.973 -9.417 -1.406 281 HD13 ILE 32 2HD1 ILE 32 5.383 -7.798 -0.838 282 H PHE 33 H PHE 33 9.534 -7.290 -5.809 283 HA PHE 33 HA PHE 33 8.367 -5.241 -7.570 284 HB2 PHE 33 2HB PHE 33 11.152 -6.405 -7.722 285 HB3 PHE 33 3HB PHE 33 10.530 -5.015 -8.606 286 HD1 PHE 33 HD2 PHE 33 9.101 -3.614 -6.402 287 HD2 PHE 33 HD1 PHE 33 12.920 -5.489 -6.513 288 HE1 PHE 33 HE2 PHE 33 9.880 -2.125 -4.606 289 HE2 PHE 33 HE1 PHE 33 13.705 -4.003 -4.716 290 HZ PHE 33 HZ PHE 33 12.185 -2.318 -3.761 291 H MET 34 H MET 34 6.947 -6.247 -8.868 292 HA MET 34 HA MET 34 7.423 -8.911 -9.864 293 HB2 MET 34 2HB MET 34 5.175 -7.168 -9.584 294 HB3 MET 34 3HB MET 34 5.286 -7.672 -11.265 295 HG2 MET 34 2HG MET 34 5.344 -10.018 -10.535 296 HG3 MET 34 3HG MET 34 5.164 -9.483 -8.866 297 HE1 MET 34 3HE MET 34 2.026 -8.557 -8.106 298 HE2 MET 34 1HE MET 34 3.548 -7.695 -8.334 299 HE3 MET 34 2HE MET 34 2.131 -7.246 -9.282 300 H PHE 35 H PHE 35 8.254 -9.477 -11.781 301 HA PHE 35 HA PHE 35 8.513 -7.445 -13.879 302 HB2 PHE 35 2HB PHE 35 10.829 -7.981 -14.277 303 HB3 PHE 35 3HB PHE 35 10.645 -7.560 -12.577 304 HD1 PHE 35 HD1 PHE 35 10.029 -9.719 -11.069 305 HD2 PHE 35 HD2 PHE 35 12.199 -9.752 -14.731 306 HE1 PHE 35 HE1 PHE 35 11.076 -11.850 -10.426 307 HE2 PHE 35 HE2 PHE 35 13.249 -11.883 -14.094 308 HZ PHE 35 HZ PHE 35 12.687 -12.936 -11.940 309 H GLU 36 H GLU 36 7.984 -8.181 -15.838 310 HA GLU 36 HA GLU 36 7.685 -11.091 -16.172 311 HB2 GLU 36 2HB GLU 36 5.927 -10.661 -17.746 312 HB3 GLU 36 3HB GLU 36 5.598 -9.724 -16.296 313 HG2 GLU 36 2HG GLU 36 5.400 -7.924 -17.558 314 HG3 GLU 36 3HG GLU 36 7.112 -8.055 -17.958 315 H VAL 37 H VAL 37 9.876 -8.882 -16.813 316 HA VAL 37 HA VAL 37 10.695 -10.179 -19.301 317 HB VAL 37 HB VAL 37 11.135 -7.245 -19.197 318 HG11 VAL 37 1HG1 VAL 37 11.680 -7.562 -21.332 319 HG12 VAL 37 2HG1 VAL 37 11.534 -9.295 -21.032 320 HG13 VAL 37 3HG1 VAL 37 10.159 -8.391 -21.666 321 HG21 VAL 37 3HG2 VAL 37 8.901 -6.942 -20.370 322 HG22 VAL 37 1HG2 VAL 37 8.462 -8.519 -19.715 323 HG23 VAL 37 2HG2 VAL 37 8.849 -7.188 -18.625 324 H GLY 38 H GLY 38 12.843 -8.229 -19.685 325 HA2 GLY 38 2HA GLY 38 15.056 -8.027 -19.107 326 HA3 GLY 38 3HA GLY 38 14.460 -7.839 -17.464 327 H ASP 39 H ASP 39 16.743 -8.925 -17.354 328 HA ASP 39 HA ASP 39 16.491 -11.840 -17.540 329 HB2 ASP 39 2HB ASP 39 18.567 -10.155 -18.224 330 HB3 ASP 39 3HB ASP 39 19.076 -10.786 -16.660 331 H PHE 40 H PHE 40 17.825 -12.976 -15.707 332 HA PHE 40 HA PHE 40 16.498 -12.286 -13.241 333 HB2 PHE 40 2HB PHE 40 17.305 -14.376 -12.404 334 HB3 PHE 40 3HB PHE 40 16.807 -14.647 -14.071 335 HD1 PHE 40 HD2 PHE 40 19.668 -14.355 -11.797 336 HD2 PHE 40 HD1 PHE 40 18.400 -15.203 -15.771 337 HE1 PHE 40 HE2 PHE 40 21.891 -15.278 -12.306 338 HE2 PHE 40 HE1 PHE 40 20.620 -16.128 -16.286 339 HZ PHE 40 HZ PHE 40 22.370 -16.165 -14.553 340 H SER 41 H SER 41 19.650 -11.918 -14.634 341 HA SER 41 HA SER 41 21.017 -11.433 -12.159 342 HB2 SER 41 2HB SER 41 22.933 -11.219 -13.426 343 HB3 SER 41 3HB SER 41 21.942 -12.172 -14.530 344 HG SER 41 HG SER 41 23.050 -10.139 -15.310 345 H ASN 42 H ASN 42 18.815 -9.664 -13.907 346 HA ASN 42 HA ASN 42 19.975 -7.059 -13.309 347 HB2 ASN 42 2HB ASN 42 17.800 -8.069 -15.037 348 HB3 ASN 42 3HB ASN 42 17.517 -6.491 -14.308 349 HD21 ASN 42 1HD2 ASN 42 18.042 -4.914 -15.619 350 HD22 ASN 42 2HD2 ASN 42 19.379 -4.893 -16.712 351 H ILE 43 H ILE 43 17.567 -9.251 -12.113 352 HA ILE 43 HA ILE 43 15.938 -7.540 -10.645 353 HB ILE 43 HB ILE 43 16.683 -10.411 -10.390 354 HG12 ILE 43 2HG1 ILE 43 14.881 -9.627 -11.905 355 HG13 ILE 43 3HG1 ILE 43 14.289 -10.725 -10.664 356 HG21 ILE 43 1HG2 ILE 43 16.722 -9.996 -8.110 357 HG22 ILE 43 2HG2 ILE 43 15.477 -8.751 -8.213 358 HG23 ILE 43 3HG2 ILE 43 15.042 -10.451 -8.392 359 HD11 ILE 43 3HD1 ILE 43 14.052 -8.122 -9.625 360 HD12 ILE 43 1HD1 ILE 43 13.441 -8.078 -11.279 361 HD13 ILE 43 2HD1 ILE 43 12.766 -9.223 -10.119 362 HA PRO 44 HA PRO 44 18.936 -8.119 -6.893 363 HB2 PRO 44 2HB PRO 44 21.373 -9.196 -7.414 364 HB3 PRO 44 3HB PRO 44 19.965 -10.172 -6.980 365 HG2 PRO 44 2HG PRO 44 21.128 -9.621 -9.683 366 HG3 PRO 44 3HG PRO 44 20.524 -11.148 -9.016 367 HD2 PRO 44 2HD PRO 44 19.063 -9.618 -10.706 368 HD3 PRO 44 3HD PRO 44 18.322 -10.603 -9.429 369 H LYS 45 H LYS 45 20.174 -7.287 -10.053 370 HA LYS 45 HA LYS 45 22.318 -5.644 -9.290 371 HB2 LYS 45 2HB LYS 45 21.346 -6.495 -11.663 372 HB3 LYS 45 3HB LYS 45 20.760 -4.837 -11.675 373 HG2 LYS 45 2HG LYS 45 23.442 -4.716 -10.851 374 HG3 LYS 45 3HG LYS 45 23.384 -5.835 -12.215 375 HD2 LYS 45 2HD LYS 45 21.941 -4.021 -13.351 376 HD3 LYS 45 3HD LYS 45 22.583 -2.947 -12.106 377 HE2 LYS 45 2HE LYS 45 24.059 -2.668 -13.885 378 HE3 LYS 45 3HE LYS 45 24.888 -3.820 -12.838 379 HZ1 LYS 45 3HZ LYS 45 25.089 -4.695 -14.975 380 HZ2 LYS 45 1HZ LYS 45 23.487 -4.341 -15.388 381 HZ3 LYS 45 2HZ LYS 45 23.823 -5.586 -14.294 382 H SER 46 H SER 46 18.890 -5.121 -9.283 383 HA SER 46 HA SER 46 19.016 -2.261 -9.148 384 HB2 SER 46 2HB SER 46 16.602 -3.457 -8.024 385 HB3 SER 46 3HB SER 46 16.783 -2.377 -9.406 386 HG SER 46 HG SER 46 16.273 -4.120 -10.480 387 H ALA 47 H ALA 47 18.308 -4.814 -6.766 388 HA ALA 47 HA ALA 47 18.089 -3.128 -4.535 389 HB1 ALA 47 1HB ALA 47 17.467 -5.623 -4.811 390 HB2 ALA 47 2HB ALA 47 19.131 -5.924 -4.307 391 HB3 ALA 47 3HB ALA 47 18.030 -5.050 -3.241 392 H GLU 48 H GLU 48 20.851 -4.323 -6.243 393 HA GLU 48 HA GLU 48 22.740 -3.918 -4.129 394 HB2 GLU 48 2HB GLU 48 23.025 -5.476 -6.111 395 HB3 GLU 48 3HB GLU 48 23.334 -4.045 -7.084 396 HG2 GLU 48 2HG GLU 48 24.937 -4.313 -4.626 397 HG3 GLU 48 3HG GLU 48 25.258 -5.486 -5.903 398 H PHE 49 H PHE 49 21.435 -1.985 -6.731 399 HA PHE 49 HA PHE 49 23.320 0.047 -6.880 400 HB2 PHE 49 2HB PHE 49 20.747 -0.419 -7.898 401 HB3 PHE 49 3HB PHE 49 20.640 1.121 -7.052 402 HD1 PHE 49 HD2 PHE 49 22.181 2.976 -7.691 403 HD2 PHE 49 HD1 PHE 49 21.857 -0.609 -9.963 404 HE1 PHE 49 HE2 PHE 49 23.223 4.104 -9.613 405 HE2 PHE 49 HE1 PHE 49 22.899 0.514 -11.889 406 HZ PHE 49 HZ PHE 49 23.582 2.874 -11.716 407 H ILE 50 H ILE 50 21.006 -0.659 -4.404 408 HA ILE 50 HA ILE 50 21.076 1.932 -3.174 409 HB ILE 50 HB ILE 50 20.177 -0.696 -1.989 410 HG12 ILE 50 2HG1 ILE 50 18.967 -0.078 -4.070 411 HG13 ILE 50 3HG1 ILE 50 17.931 -0.061 -2.648 412 HG21 ILE 50 1HG2 ILE 50 18.706 1.219 -0.775 413 HG22 ILE 50 2HG2 ILE 50 20.204 0.558 -0.121 414 HG23 ILE 50 3HG2 ILE 50 20.228 2.077 -1.015 415 HD11 ILE 50 3HD1 ILE 50 18.110 2.366 -2.543 416 HD12 ILE 50 1HD1 ILE 50 19.157 2.352 -3.962 417 HD13 ILE 50 2HD1 ILE 50 17.477 1.830 -4.100 418 H GLN 51 H GLN 51 22.700 -1.160 -2.667 419 HA GLN 51 HA GLN 51 25.000 -0.021 -1.554 420 HB2 GLN 51 2HB GLN 51 23.040 0.101 0.297 421 HB3 GLN 51 3HB GLN 51 23.673 -1.504 0.637 422 HG2 GLN 51 2HG GLN 51 25.246 -0.555 1.862 423 HG3 GLN 51 3HG GLN 51 25.917 0.131 0.383 424 HE21 GLN 51 1HE2 GLN 51 24.866 0.856 3.395 425 HE22 GLN 51 2HE2 GLN 51 24.470 2.523 3.178 426 H SER 52 H SER 52 26.626 -1.461 -1.653 427 HA SER 52 HA SER 52 26.358 -3.901 -2.909 428 HB2 SER 52 2HB SER 52 28.651 -4.407 -2.007 429 HB3 SER 52 3HB SER 52 28.512 -2.834 -2.793 430 HG SER 52 HG SER 52 28.705 -1.845 -0.896 431 H LYS 53 H LYS 53 26.060 -3.126 0.477 432 HA LYS 53 HA LYS 53 25.281 -5.913 0.995 433 HB2 LYS 53 2HB LYS 53 27.636 -5.020 1.889 434 HB3 LYS 53 3HB LYS 53 26.618 -4.408 3.186 435 HG2 LYS 53 2HG LYS 53 26.310 -6.439 4.062 436 HG3 LYS 53 3HG LYS 53 26.085 -7.193 2.482 437 HD2 LYS 53 2HD LYS 53 28.055 -8.175 3.077 438 HD3 LYS 53 3HD LYS 53 28.691 -6.720 2.307 439 HE2 LYS 53 2HE LYS 53 28.082 -6.235 5.083 440 HE3 LYS 53 3HE LYS 53 29.169 -7.612 4.912 441 HZ1 LYS 53 3HZ LYS 53 29.609 -4.801 4.217 442 HZ2 LYS 53 1HZ LYS 53 30.382 -5.982 3.285 443 HZ3 LYS 53 2HZ LYS 53 30.657 -5.906 4.952 444 H GLY 54 H GLY 54 23.394 -6.133 2.040 445 HA2 GLY 54 2HA GLY 54 22.109 -5.159 4.018 446 HA3 GLY 54 3HA GLY 54 22.143 -3.673 3.081 447 H HIS 55 H HIS 55 21.915 -5.726 0.693 448 HA HIS 55 HA HIS 55 18.974 -5.789 0.780 449 HB2 HIS 55 2HB HIS 55 19.032 -5.749 -1.663 450 HB3 HIS 55 3HB HIS 55 19.930 -4.385 -1.004 451 HD1 HIS 55 HD1 HIS 55 22.628 -4.756 -0.962 452 HD2 HIS 55 HD2 HIS 55 20.424 -7.245 -3.453 453 HE1 HIS 55 HE1 HIS 55 24.286 -5.717 -2.590 454 H GLU 56 H GLU 56 18.116 -7.721 1.116 455 HA GLU 56 HA GLU 56 19.451 -10.076 -0.040 456 HB2 GLU 56 2HB GLU 56 19.371 -9.582 2.638 457 HB3 GLU 56 3HB GLU 56 17.906 -10.531 2.427 458 HG2 GLU 56 2HG GLU 56 20.288 -11.614 1.100 459 HG3 GLU 56 3HG GLU 56 20.362 -11.569 2.861 460 H LEU 57 H LEU 57 18.192 -11.137 -1.410 461 HA LEU 57 HA LEU 57 15.399 -10.497 -1.645 462 HB2 LEU 57 2HB LEU 57 17.165 -12.453 -3.103 463 HB3 LEU 57 3HB LEU 57 15.465 -12.190 -3.489 464 HG LEU 57 HG LEU 57 16.663 -10.951 -5.079 465 HD11 LEU 57 1HD1 LEU 57 15.701 -8.911 -4.836 466 HD12 LEU 57 2HD1 LEU 57 16.259 -8.719 -3.174 467 HD13 LEU 57 3HD1 LEU 57 14.870 -9.748 -3.524 468 HD21 LEU 57 3HD2 LEU 57 18.777 -11.050 -3.519 469 HD22 LEU 57 1HD2 LEU 57 18.247 -9.428 -3.070 470 HD23 LEU 57 2HD2 LEU 57 18.616 -9.801 -4.755 471 H LEU 58 H LEU 58 14.046 -11.311 -0.172 472 HA LEU 58 HA LEU 58 14.439 -13.671 1.294 473 HB2 LEU 58 2HB LEU 58 12.591 -11.577 1.247 474 HB3 LEU 58 3HB LEU 58 11.643 -13.037 0.974 475 HG LEU 58 HG LEU 58 13.572 -13.045 3.234 476 HD11 LEU 58 1HD1 LEU 58 10.906 -11.949 3.847 477 HD12 LEU 58 2HD1 LEU 58 12.030 -10.853 3.046 478 HD13 LEU 58 3HD1 LEU 58 12.474 -11.606 4.577 479 HD21 LEU 58 3HD2 LEU 58 10.790 -13.961 3.512 480 HD22 LEU 58 1HD2 LEU 58 12.299 -14.742 3.984 481 HD23 LEU 58 2HD2 LEU 58 11.754 -14.817 2.308 482 H ASN 59 H ASN 59 12.173 -13.051 -1.392 483 HA ASN 59 HA ASN 59 11.910 -15.944 -1.774 484 HB2 ASN 59 2HB ASN 59 9.913 -14.279 -1.606 485 HB3 ASN 59 3HB ASN 59 10.317 -13.888 -3.275 486 HD21 ASN 59 1HD2 ASN 59 9.489 -15.111 -4.819 487 HD22 ASN 59 2HD2 ASN 59 8.735 -16.649 -4.590 488 H SER 60 H SER 60 13.495 -16.711 -3.033 489 HA SER 60 HA SER 60 14.999 -15.363 -4.909 490 HB2 SER 60 2HB SER 60 15.979 -17.383 -4.631 491 HB3 SER 60 3HB SER 60 14.446 -18.181 -4.283 492 HG SER 60 HG SER 60 15.849 -18.237 -6.533 493 H LEU 61 H LEU 61 14.408 -14.329 -6.686 494 HA LEU 61 HA LEU 61 11.932 -14.386 -7.896 495 HB2 LEU 61 2HB LEU 61 13.043 -13.370 -9.860 496 HB3 LEU 61 3HB LEU 61 13.467 -12.606 -8.330 497 HG LEU 61 HG LEU 61 15.318 -14.701 -9.276 498 HD11 LEU 61 1HD1 LEU 61 14.457 -12.669 -11.069 499 HD12 LEU 61 2HD1 LEU 61 15.724 -13.875 -11.290 500 HD13 LEU 61 3HD1 LEU 61 16.111 -12.313 -10.569 501 HD21 LEU 61 3HD2 LEU 61 16.340 -13.708 -7.552 502 HD22 LEU 61 1HD2 LEU 61 15.314 -12.276 -7.647 503 HD23 LEU 61 2HD2 LEU 61 16.723 -12.423 -8.699 504 H ARG 62 H ARG 62 10.922 -15.644 -9.347 505 HA ARG 62 HA ARG 62 12.291 -18.073 -10.211 506 HB2 ARG 62 2HB ARG 62 9.908 -17.895 -9.120 507 HB3 ARG 62 3HB ARG 62 9.403 -17.517 -10.761 508 HG2 ARG 62 2HG ARG 62 9.088 -19.797 -10.651 509 HG3 ARG 62 3HG ARG 62 10.683 -19.672 -11.396 510 HD2 ARG 62 2HD ARG 62 11.775 -20.207 -9.367 511 HD3 ARG 62 3HD ARG 62 10.297 -19.987 -8.431 512 HE ARG 62 HE ARG 62 9.663 -22.121 -8.984 513 HH11 ARG 62 1HH1 ARG 62 12.303 -21.132 -11.027 514 HH12 ARG 62 2HH1 ARG 62 12.538 -22.707 -11.709 515 HH21 ARG 62 1HH2 ARG 62 9.962 -24.200 -9.874 516 HH22 ARG 62 2HH2 ARG 62 11.205 -24.451 -11.053 517 H PHE 63 H PHE 63 13.497 -16.353 -11.636 518 HA PHE 63 HA PHE 63 12.344 -15.193 -13.871 519 HB2 PHE 63 2HB PHE 63 14.522 -14.976 -14.750 520 HB3 PHE 63 3HB PHE 63 14.744 -14.975 -13.003 521 HD1 PHE 63 HD2 PHE 63 15.051 -17.463 -12.016 522 HD2 PHE 63 HD1 PHE 63 16.009 -16.210 -15.969 523 HE1 PHE 63 HE2 PHE 63 16.643 -19.328 -12.217 524 HE2 PHE 63 HE1 PHE 63 17.602 -18.073 -16.177 525 HZ PHE 63 HZ PHE 63 17.921 -19.635 -14.300 526 H ASN 64 H ASN 64 13.267 -18.518 -13.305 527 HA ASN 64 HA ASN 64 13.247 -19.464 -15.938 528 HB2 ASN 64 2HB ASN 64 12.878 -20.700 -13.248 529 HB3 ASN 64 3HB ASN 64 12.436 -21.652 -14.662 530 HD21 ASN 64 1HD2 ASN 64 14.469 -22.375 -12.917 531 HD22 ASN 64 2HD2 ASN 64 15.978 -22.288 -13.754 532 H GLN 65 H GLN 65 10.687 -18.393 -13.941 533 HA GLN 65 HA GLN 65 8.694 -19.658 -15.696 534 HB2 GLN 65 2HB GLN 65 8.806 -19.443 -12.907 535 HB3 GLN 65 3HB GLN 65 7.574 -18.291 -13.405 536 HG2 GLN 65 2HG GLN 65 6.164 -19.998 -13.442 537 HG3 GLN 65 3HG GLN 65 7.002 -20.543 -14.894 538 HE21 GLN 65 1HE2 GLN 65 8.857 -21.983 -14.559 539 HE22 GLN 65 2HE2 GLN 65 8.794 -23.118 -13.258 540 H ALA 66 H ALA 66 6.554 -18.006 -15.300 541 HA ALA 66 HA ALA 66 7.214 -15.803 -17.019 542 HB1 ALA 66 1HB ALA 66 5.068 -17.216 -17.024 543 HB2 ALA 66 2HB ALA 66 4.552 -16.182 -15.692 544 HB3 ALA 66 3HB ALA 66 4.920 -15.475 -17.266 545 H ASP 67 H ASP 67 5.480 -13.816 -16.160 546 HA ASP 67 HA ASP 67 6.993 -12.175 -14.620 547 HB2 ASP 67 2HB ASP 67 4.999 -10.872 -14.160 548 HB3 ASP 67 3HB ASP 67 4.919 -11.499 -15.804 549 H TRP 68 H TRP 68 7.941 -12.697 -12.752 550 HA TRP 68 HA TRP 68 6.296 -13.948 -10.655 551 HB2 TRP 68 2HB TRP 68 8.657 -14.856 -11.651 552 HB3 TRP 68 3HB TRP 68 9.225 -13.884 -10.296 553 HD1 TRP 68 HD1 TRP 68 9.318 -15.115 -8.056 554 HE1 TRP 68 HE1 TRP 68 8.257 -17.245 -7.075 555 HE3 TRP 68 HE3 TRP 68 6.245 -16.356 -11.948 556 HZ2 TRP 68 HZ2 TRP 68 6.368 -19.194 -7.850 557 HZ3 TRP 68 HZ3 TRP 68 4.843 -18.369 -11.748 558 HH2 TRP 68 HH2 TRP 68 4.906 -19.757 -9.741 559 H THR 69 H THR 69 7.563 -13.415 -8.401 560 HA THR 69 HA THR 69 7.834 -10.483 -8.286 561 HB THR 69 HB THR 69 6.420 -10.263 -6.488 562 HG1 THR 69 HG1 THR 69 6.873 -11.585 -4.896 563 HG21 THR 69 3HG2 THR 69 4.402 -11.115 -7.144 564 HG22 THR 69 1HG2 THR 69 5.046 -12.735 -7.407 565 HG23 THR 69 2HG2 THR 69 5.340 -11.466 -8.596 566 H ILE 70 H ILE 70 9.470 -9.699 -7.065 567 HA ILE 70 HA ILE 70 11.098 -11.666 -5.591 568 HB ILE 70 HB ILE 70 12.290 -10.850 -7.543 569 HG12 ILE 70 2HG1 ILE 70 14.290 -9.909 -6.407 570 HG13 ILE 70 3HG1 ILE 70 13.320 -9.658 -4.959 571 HG21 ILE 70 1HG2 ILE 70 10.992 -8.438 -6.982 572 HG22 ILE 70 2HG2 ILE 70 12.711 -8.117 -6.759 573 HG23 ILE 70 3HG2 ILE 70 12.127 -8.765 -8.292 574 HD11 ILE 70 3HD1 ILE 70 14.843 -11.833 -5.424 575 HD12 ILE 70 1HD1 ILE 70 13.436 -11.813 -4.362 576 HD13 ILE 70 2HD1 ILE 70 13.281 -12.391 -6.021 577 H VAL 71 H VAL 71 11.102 -11.384 -3.470 578 HA VAL 71 HA VAL 71 10.251 -8.840 -2.337 579 HB VAL 71 HB VAL 71 11.022 -11.223 -0.691 580 HG11 VAL 71 1HG1 VAL 71 10.454 -9.056 0.372 581 HG12 VAL 71 2HG1 VAL 71 8.847 -9.163 -0.349 582 HG13 VAL 71 3HG1 VAL 71 9.367 -10.366 0.831 583 HG21 VAL 71 3HG2 VAL 71 8.434 -10.871 -2.200 584 HG22 VAL 71 1HG2 VAL 71 9.615 -12.165 -2.403 585 HG23 VAL 71 2HG2 VAL 71 8.690 -12.041 -0.906 586 H VAL 72 H VAL 72 11.641 -7.348 -1.680 587 HA VAL 72 HA VAL 72 14.399 -8.174 -1.046 588 HB VAL 72 HB VAL 72 13.597 -5.405 -1.914 589 HG11 VAL 72 1HG1 VAL 72 15.816 -4.926 -1.982 590 HG12 VAL 72 2HG1 VAL 72 15.864 -6.185 -0.747 591 HG13 VAL 72 3HG1 VAL 72 16.271 -6.572 -2.419 592 HG21 VAL 72 3HG2 VAL 72 14.888 -6.541 -4.066 593 HG22 VAL 72 1HG2 VAL 72 13.811 -7.825 -3.517 594 HG23 VAL 72 2HG2 VAL 72 13.154 -6.243 -3.938 595 H ARG 73 H ARG 73 15.065 -7.871 0.972 596 HA ARG 73 HA ARG 73 13.445 -6.172 2.738 597 HB2 ARG 73 2HB ARG 73 14.577 -7.439 4.581 598 HB3 ARG 73 3HB ARG 73 13.567 -8.425 3.532 599 HG2 ARG 73 2HG ARG 73 15.275 -9.763 3.112 600 HG3 ARG 73 3HG ARG 73 16.212 -8.406 2.483 601 HD2 ARG 73 2HD ARG 73 17.564 -9.116 4.200 602 HD3 ARG 73 3HD ARG 73 16.598 -7.887 5.017 603 HE ARG 73 HE ARG 73 15.281 -10.319 5.316 604 HH11 ARG 73 1HH1 ARG 73 18.288 -8.846 6.268 605 HH12 ARG 73 2HH1 ARG 73 18.429 -9.768 7.728 606 HH21 ARG 73 1HH2 ARG 73 15.454 -11.540 7.235 607 HH22 ARG 73 2HH2 ARG 73 16.817 -11.301 8.276 608 H LYS 74 H LYS 74 14.237 -4.183 2.935 609 HA LYS 74 HA LYS 74 16.872 -3.407 2.375 610 HB2 LYS 74 2HB LYS 74 14.490 -2.148 3.599 611 HB3 LYS 74 3HB LYS 74 16.037 -1.413 3.998 612 HG2 LYS 74 2HG LYS 74 16.359 -1.590 1.367 613 HG3 LYS 74 3HG LYS 74 14.596 -1.525 1.416 614 HD2 LYS 74 2HD LYS 74 14.712 0.680 1.669 615 HD3 LYS 74 3HD LYS 74 15.543 0.439 3.208 616 HE2 LYS 74 2HE LYS 74 17.206 0.144 0.794 617 HE3 LYS 74 3HE LYS 74 16.598 1.769 1.107 618 HZ1 LYS 74 3HZ LYS 74 18.629 0.284 2.485 619 HZ2 LYS 74 1HZ LYS 74 17.479 0.944 3.536 620 HZ3 LYS 74 2HZ LYS 74 18.329 1.949 2.474 621 H LYS 75 H LYS 75 18.477 -2.533 3.844 622 HA LYS 75 HA LYS 75 18.400 -3.014 6.634 623 HB2 LYS 75 2HB LYS 75 18.945 -5.300 5.134 624 HB3 LYS 75 3HB LYS 75 20.524 -4.748 5.675 625 HG2 LYS 75 2HG LYS 75 18.380 -4.824 7.707 626 HG3 LYS 75 3HG LYS 75 18.976 -6.376 7.111 627 HD2 LYS 75 2HD LYS 75 21.307 -5.053 7.527 628 HD3 LYS 75 3HD LYS 75 20.297 -4.358 8.797 629 HE2 LYS 75 2HE LYS 75 20.195 -7.296 8.463 630 HE3 LYS 75 3HE LYS 75 21.691 -6.623 9.107 631 HZ1 LYS 75 3HZ LYS 75 19.294 -5.566 10.315 632 HZ2 LYS 75 1HZ LYS 75 20.719 -6.117 11.040 633 HZ3 LYS 75 2HZ LYS 75 19.524 -7.221 10.578 634 H ALA 76 H ALA 76 20.352 -2.579 3.738 635 HA ALA 76 HA ALA 76 22.744 -1.726 4.803 636 HB1 ALA 76 1HB ALA 76 23.267 -1.159 2.698 637 HB2 ALA 76 2HB ALA 76 21.705 -1.872 2.294 638 HB3 ALA 76 3HB ALA 76 21.847 -0.129 2.516 Start of MODEL 9 1 H1 MET 1 H MET 1 1.658 -0.362 -0.197 2 HA MET 1 HA MET 1 2.535 0.787 -2.211 3 HB2 MET 1 2HB MET 1 2.952 3.032 -0.229 4 HB3 MET 1 3HB MET 1 3.417 3.045 -1.925 5 HG2 MET 1 2HG MET 1 1.424 3.791 -2.509 6 HG3 MET 1 3HG MET 1 0.643 2.419 -1.725 7 HE1 MET 1 3HE MET 1 -0.329 3.160 1.489 8 HE2 MET 1 1HE MET 1 -1.536 3.732 0.337 9 HE3 MET 1 2HE MET 1 -0.553 2.318 -0.045 10 H LYS 2 H LYS 2 3.836 -1.083 -1.714 11 HA LYS 2 HA LYS 2 6.492 -0.326 -0.837 12 HB2 LYS 2 2HB LYS 2 6.640 -2.335 0.680 13 HB3 LYS 2 3HB LYS 2 5.639 -1.017 1.276 14 HG2 LYS 2 2HG LYS 2 3.633 -2.205 0.578 15 HG3 LYS 2 3HG LYS 2 4.625 -3.520 -0.057 16 HD2 LYS 2 2HD LYS 2 5.538 -3.855 2.234 17 HD3 LYS 2 3HD LYS 2 4.399 -2.641 2.820 18 HE2 LYS 2 2HE LYS 2 2.560 -4.059 1.855 19 HE3 LYS 2 3HE LYS 2 3.771 -5.306 1.564 20 HZ1 LYS 2 3HZ LYS 2 3.940 -4.378 4.231 21 HZ2 LYS 2 1HZ LYS 2 3.630 -5.943 3.666 22 HZ3 LYS 2 2HZ LYS 2 2.353 -4.858 3.894 23 H ARG 3 H ARG 3 5.080 -1.240 -3.292 24 HA ARG 3 HA ARG 3 6.973 -3.353 -3.989 25 HB2 ARG 3 2HB ARG 3 5.280 -4.707 -5.077 26 HB3 ARG 3 3HB ARG 3 4.862 -4.487 -3.383 27 HG2 ARG 3 2HG ARG 3 3.702 -2.476 -5.157 28 HG3 ARG 3 3HG ARG 3 3.170 -4.126 -5.486 29 HD2 ARG 3 2HD ARG 3 2.677 -4.341 -3.028 30 HD3 ARG 3 3HD ARG 3 2.977 -2.609 -2.892 31 HE ARG 3 HE ARG 3 0.942 -2.209 -3.873 32 HH11 ARG 3 1HH1 ARG 3 1.798 -5.555 -4.308 33 HH12 ARG 3 2HH1 ARG 3 0.247 -6.006 -4.933 34 HH21 ARG 3 1HH2 ARG 3 -1.105 -2.791 -4.694 35 HH22 ARG 3 2HH2 ARG 3 -1.404 -4.433 -5.153 36 H PHE 4 H PHE 4 7.080 -3.691 -6.374 37 HA PHE 4 HA PHE 4 6.219 -1.357 -7.923 38 HB2 PHE 4 2HB PHE 4 8.858 -1.724 -7.034 39 HB3 PHE 4 3HB PHE 4 8.868 -2.175 -8.736 40 HD1 PHE 4 HD2 PHE 4 7.018 0.449 -6.840 41 HD2 PHE 4 HD1 PHE 4 9.763 -0.455 -9.964 42 HE1 PHE 4 HE2 PHE 4 7.084 2.827 -7.464 43 HE2 PHE 4 HE1 PHE 4 9.835 1.922 -10.593 44 HZ PHE 4 HZ PHE 4 8.494 3.567 -9.344 45 H ASP 5 H ASP 5 5.100 -2.087 -9.592 46 HA ASP 5 HA ASP 5 5.541 -4.788 -10.583 47 HB2 ASP 5 2HB ASP 5 3.299 -3.032 -10.396 48 HB3 ASP 5 3HB ASP 5 3.544 -3.432 -12.094 49 H LEU 6 H LEU 6 7.430 -4.714 -11.751 50 HA LEU 6 HA LEU 6 7.803 -2.696 -13.798 51 HB2 LEU 6 2HB LEU 6 9.449 -5.009 -12.821 52 HB3 LEU 6 3HB LEU 6 9.893 -4.093 -14.260 53 HG LEU 6 HG LEU 6 11.188 -3.278 -12.431 54 HD11 LEU 6 1HD1 LEU 6 9.073 -1.187 -12.594 55 HD12 LEU 6 2HD1 LEU 6 9.915 -1.674 -14.065 56 HD13 LEU 6 3HD1 LEU 6 10.827 -1.031 -12.699 57 HD21 LEU 6 3HD2 LEU 6 10.268 -2.499 -10.365 58 HD22 LEU 6 1HD2 LEU 6 9.657 -4.128 -10.654 59 HD23 LEU 6 2HD2 LEU 6 8.620 -2.732 -10.949 60 H ARG 7 H ARG 7 5.886 -5.260 -13.688 61 HA ARG 7 HA ARG 7 6.422 -6.930 -15.804 62 HB2 ARG 7 2HB ARG 7 4.140 -6.247 -14.224 63 HB3 ARG 7 3HB ARG 7 3.644 -6.345 -15.908 64 HG2 ARG 7 2HG ARG 7 4.175 -8.584 -16.075 65 HG3 ARG 7 3HG ARG 7 5.300 -8.523 -14.716 66 HD2 ARG 7 2HD ARG 7 3.667 -9.326 -13.439 67 HD3 ARG 7 3HD ARG 7 2.840 -7.783 -13.643 68 HE ARG 7 HE ARG 7 2.179 -10.293 -14.899 69 HH11 ARG 7 1HH1 ARG 7 1.858 -6.829 -15.016 70 HH12 ARG 7 2HH1 ARG 7 0.408 -6.865 -15.964 71 HH21 ARG 7 1HH2 ARG 7 0.270 -10.354 -16.147 72 HH22 ARG 7 2HH2 ARG 7 -0.495 -8.870 -16.606 73 HA PRO 8 HA PRO 8 4.213 -3.922 -18.864 74 HB2 PRO 8 2HB PRO 8 3.559 -1.452 -17.947 75 HB3 PRO 8 3HB PRO 8 2.472 -2.841 -17.825 76 HG2 PRO 8 2HG PRO 8 4.275 -1.658 -15.748 77 HG3 PRO 8 3HG PRO 8 2.605 -2.232 -15.584 78 HD2 PRO 8 2HD PRO 8 4.736 -3.709 -14.804 79 HD3 PRO 8 3HD PRO 8 3.246 -4.441 -15.433 80 H LEU 9 H LEU 9 6.716 -3.105 -16.716 81 HA LEU 9 HA LEU 9 7.769 -0.909 -18.270 82 HB2 LEU 9 2HB LEU 9 8.291 -2.140 -15.698 83 HB3 LEU 9 3HB LEU 9 9.779 -1.797 -16.578 84 HG LEU 9 HG LEU 9 8.255 0.535 -16.783 85 HD11 LEU 9 1HD1 LEU 9 7.117 0.893 -14.901 86 HD12 LEU 9 2HD1 LEU 9 8.398 0.217 -13.896 87 HD13 LEU 9 3HD1 LEU 9 7.212 -0.850 -14.647 88 HD21 LEU 9 3HD2 LEU 9 10.284 0.341 -14.643 89 HD22 LEU 9 1HD2 LEU 9 10.137 1.492 -15.971 90 HD23 LEU 9 2HD2 LEU 9 10.801 -0.115 -16.267 91 H LYS 10 H LYS 10 9.948 -0.957 -19.185 92 HA LYS 10 HA LYS 10 10.429 -3.500 -20.554 93 HB2 LYS 10 2HB LYS 10 11.582 -2.263 -22.220 94 HB3 LYS 10 3HB LYS 10 10.138 -1.336 -21.835 95 HG2 LYS 10 2HG LYS 10 11.477 0.131 -20.396 96 HG3 LYS 10 3HG LYS 10 12.923 -0.784 -20.830 97 HD2 LYS 10 2HD LYS 10 12.961 1.076 -22.253 98 HD3 LYS 10 3HD LYS 10 12.321 -0.229 -23.256 99 HE2 LYS 10 2HE LYS 10 10.127 0.992 -21.954 100 HE3 LYS 10 3HE LYS 10 11.135 2.284 -22.602 101 HZ1 LYS 10 3HZ LYS 10 10.187 -0.041 -24.185 102 HZ2 LYS 10 1HZ LYS 10 11.003 1.321 -24.769 103 HZ3 LYS 10 2HZ LYS 10 9.429 1.471 -24.170 104 H ALA 11 H ALA 11 12.705 -4.133 -20.942 105 HA ALA 11 HA ALA 11 14.126 -4.284 -18.483 106 HB1 ALA 11 1HB ALA 11 14.161 -5.625 -20.975 107 HB2 ALA 11 2HB ALA 11 15.799 -5.054 -20.651 108 HB3 ALA 11 3HB ALA 11 14.972 -6.077 -19.475 109 H GLY 12 H GLY 12 16.109 -3.395 -17.901 110 HA2 GLY 12 2HA GLY 12 18.065 -2.084 -18.363 111 HA3 GLY 12 3HA GLY 12 17.180 -1.289 -19.657 112 H ILE 13 H ILE 13 14.851 -0.568 -18.379 113 HA ILE 13 HA ILE 13 15.853 1.500 -16.560 114 HB ILE 13 HB ILE 13 13.119 1.385 -17.823 115 HG12 ILE 13 2HG1 ILE 13 15.615 2.748 -18.858 116 HG13 ILE 13 3HG1 ILE 13 14.822 1.358 -19.591 117 HG21 ILE 13 1HG2 ILE 13 12.723 3.299 -16.762 118 HG22 ILE 13 2HG2 ILE 13 14.204 3.016 -15.849 119 HG23 ILE 13 3HG2 ILE 13 14.247 3.993 -17.316 120 HD11 ILE 13 3HD1 ILE 13 14.023 3.060 -20.885 121 HD12 ILE 13 1HD1 ILE 13 12.757 2.957 -19.661 122 HD13 ILE 13 2HD1 ILE 13 13.993 4.211 -19.549 123 H PHE 14 H PHE 14 13.799 -1.285 -16.681 124 HA PHE 14 HA PHE 14 12.170 -0.803 -14.452 125 HB2 PHE 14 2HB PHE 14 11.578 -3.068 -14.556 126 HB3 PHE 14 3HB PHE 14 12.034 -2.688 -16.213 127 HD1 PHE 14 HD1 PHE 14 14.721 -2.988 -16.573 128 HD2 PHE 14 HD2 PHE 14 12.286 -5.100 -13.794 129 HE1 PHE 14 HE1 PHE 14 16.353 -4.828 -16.547 130 HE2 PHE 14 HE2 PHE 14 13.915 -6.943 -13.762 131 HZ PHE 14 HZ PHE 14 15.952 -6.809 -15.139 132 H GLU 15 H GLU 15 15.490 -1.788 -14.714 133 HA GLU 15 HA GLU 15 15.681 -2.658 -11.965 134 HB2 GLU 15 2HB GLU 15 17.103 -3.780 -13.520 135 HB3 GLU 15 3HB GLU 15 17.724 -2.260 -14.148 136 HG2 GLU 15 2HG GLU 15 18.178 -2.519 -11.302 137 HG3 GLU 15 3HG GLU 15 18.887 -3.851 -12.212 138 H ARG 16 H ARG 16 16.279 0.237 -13.815 139 HA ARG 16 HA ARG 16 17.794 1.555 -11.764 140 HB2 ARG 16 2HB ARG 16 16.789 2.212 -14.460 141 HB3 ARG 16 3HB ARG 16 16.921 3.576 -13.358 142 HG2 ARG 16 2HG ARG 16 19.182 3.511 -13.325 143 HG3 ARG 16 3HG ARG 16 19.244 1.756 -13.501 144 HD2 ARG 16 2HD ARG 16 19.862 2.164 -15.611 145 HD3 ARG 16 3HD ARG 16 18.164 2.550 -15.888 146 HE ARG 16 HE ARG 16 19.655 4.798 -14.945 147 HH11 ARG 16 1HH1 ARG 16 18.875 2.915 -17.767 148 HH12 ARG 16 2HH1 ARG 16 19.160 4.217 -18.874 149 HH21 ARG 16 1HH2 ARG 16 20.032 6.520 -16.392 150 HH22 ARG 16 2HH2 ARG 16 19.819 6.267 -18.091 151 H LEU 17 H LEU 17 14.443 1.647 -12.900 152 HA LEU 17 HA LEU 17 13.595 3.728 -11.179 153 HB2 LEU 17 2HB LEU 17 12.463 2.099 -13.188 154 HB3 LEU 17 3HB LEU 17 11.459 1.916 -11.751 155 HG LEU 17 HG LEU 17 10.556 3.645 -13.170 156 HD11 LEU 17 1HD1 LEU 17 10.205 5.260 -11.548 157 HD12 LEU 17 2HD1 LEU 17 11.850 5.139 -10.925 158 HD13 LEU 17 3HD1 LEU 17 10.686 3.855 -10.596 159 HD21 LEU 17 3HD2 LEU 17 12.914 4.160 -14.123 160 HD22 LEU 17 1HD2 LEU 17 13.009 5.313 -12.792 161 HD23 LEU 17 2HD2 LEU 17 11.728 5.460 -13.996 162 H GLU 18 H GLU 18 14.096 0.333 -10.729 163 HA GLU 18 HA GLU 18 12.422 -0.172 -8.554 164 HB2 GLU 18 2HB GLU 18 14.265 -1.620 -9.978 165 HB3 GLU 18 3HB GLU 18 15.047 -1.477 -8.410 166 HG2 GLU 18 2HG GLU 18 13.741 -3.041 -7.558 167 HG3 GLU 18 3HG GLU 18 12.293 -2.164 -8.051 168 H GLU 19 H GLU 19 15.393 1.598 -8.762 169 HA GLU 19 HA GLU 19 15.871 1.569 -5.909 170 HB2 GLU 19 2HB GLU 19 17.803 1.639 -7.338 171 HB3 GLU 19 3HB GLU 19 17.189 3.052 -8.185 172 HG2 GLU 19 2HG GLU 19 17.440 3.480 -5.323 173 HG3 GLU 19 3HG GLU 19 18.968 3.055 -6.092 174 H LEU 20 H LEU 20 14.185 3.515 -8.206 175 HA LEU 20 HA LEU 20 14.167 5.974 -6.837 176 HB2 LEU 20 2HB LEU 20 12.934 4.833 -9.141 177 HB3 LEU 20 3HB LEU 20 11.697 5.643 -8.181 178 HG LEU 20 HG LEU 20 13.695 7.518 -8.261 179 HD11 LEU 20 1HD1 LEU 20 14.575 5.763 -10.102 180 HD12 LEU 20 2HD1 LEU 20 14.858 7.501 -10.189 181 HD13 LEU 20 3HD1 LEU 20 13.539 6.776 -11.107 182 HD21 LEU 20 3HD2 LEU 20 11.315 7.920 -8.573 183 HD22 LEU 20 1HD2 LEU 20 11.382 7.165 -10.165 184 HD23 LEU 20 2HD2 LEU 20 12.249 8.672 -9.867 185 H ILE 21 H ILE 21 12.152 3.103 -6.573 186 HA ILE 21 HA ILE 21 10.372 4.367 -4.664 187 HB ILE 21 HB ILE 21 9.523 2.706 -6.305 188 HG12 ILE 21 2HG1 ILE 21 8.162 1.418 -4.667 189 HG13 ILE 21 3HG1 ILE 21 9.233 1.969 -3.384 190 HG21 ILE 21 1HG2 ILE 21 10.274 0.589 -6.469 191 HG22 ILE 21 2HG2 ILE 21 11.720 1.254 -5.709 192 HG23 ILE 21 3HG2 ILE 21 10.510 0.426 -4.729 193 HD11 ILE 21 3HD1 ILE 21 8.175 4.156 -4.971 194 HD12 ILE 21 1HD1 ILE 21 6.916 3.189 -4.203 195 HD13 ILE 21 2HD1 ILE 21 8.187 3.921 -3.223 196 H GLU 22 H GLU 22 13.101 2.180 -4.679 197 HA GLU 22 HA GLU 22 12.902 1.074 -2.139 198 HB2 GLU 22 2HB GLU 22 15.039 1.515 -4.100 199 HB3 GLU 22 3HB GLU 22 15.607 1.438 -2.438 200 HG2 GLU 22 2HG GLU 22 14.074 -0.655 -3.952 201 HG3 GLU 22 3HG GLU 22 15.728 -0.749 -3.349 202 H LYS 23 H LYS 23 13.784 4.285 -3.116 203 HA LYS 23 HA LYS 23 15.130 5.107 -0.778 204 HB2 LYS 23 2HB LYS 23 14.039 6.357 -3.175 205 HB3 LYS 23 3HB LYS 23 13.866 7.377 -1.752 206 HG2 LYS 23 2HG LYS 23 16.507 6.128 -2.106 207 HG3 LYS 23 3HG LYS 23 16.053 7.330 -3.316 208 HD2 LYS 23 2HD LYS 23 15.912 9.037 -1.753 209 HD3 LYS 23 3HD LYS 23 15.690 7.919 -0.405 210 HE2 LYS 23 2HE LYS 23 18.135 7.168 -1.243 211 HE3 LYS 23 3HE LYS 23 18.166 8.869 -1.705 212 HZ1 LYS 23 3HZ LYS 23 18.350 9.496 0.408 213 HZ2 LYS 23 1HZ LYS 23 18.713 7.883 0.767 214 HZ3 LYS 23 2HZ LYS 23 17.128 8.451 0.934 215 H GLU 24 H GLU 24 11.726 4.991 -1.652 216 HA GLU 24 HA GLU 24 10.894 6.371 0.748 217 HB2 GLU 24 2HB GLU 24 9.738 5.850 -1.747 218 HB3 GLU 24 3HB GLU 24 8.782 4.921 -0.601 219 HG2 GLU 24 2HG GLU 24 9.119 7.402 0.606 220 HG3 GLU 24 3HG GLU 24 8.819 7.759 -1.094 221 H MET 25 H MET 25 11.950 3.301 0.094 222 HA MET 25 HA MET 25 10.135 1.883 1.845 223 HB2 MET 25 2HB MET 25 12.692 1.007 0.493 224 HB3 MET 25 3HB MET 25 11.635 -0.050 1.418 225 HG2 MET 25 2HG MET 25 10.876 1.432 -1.089 226 HG3 MET 25 3HG MET 25 11.286 -0.279 -0.984 227 HE1 MET 25 3HE MET 25 9.891 -1.965 0.640 228 HE2 MET 25 1HE MET 25 9.857 -0.799 1.963 229 HE3 MET 25 2HE MET 25 8.357 -1.529 1.393 230 H GLN 26 H GLN 26 10.695 0.939 3.835 231 HA GLN 26 HA GLN 26 12.410 2.538 5.458 232 HB2 GLN 26 2HB GLN 26 10.440 0.433 5.851 233 HB3 GLN 26 3HB GLN 26 11.823 0.251 6.923 234 HG2 GLN 26 2HG GLN 26 11.116 1.893 8.224 235 HG3 GLN 26 3HG GLN 26 10.965 2.991 6.853 236 HE21 GLN 26 1HE2 GLN 26 9.299 2.049 9.332 237 HE22 GLN 26 2HE2 GLN 26 7.704 1.936 8.679 238 HA PRO 27 HA PRO 27 16.217 0.364 5.347 239 HB2 PRO 27 2HB PRO 27 16.992 0.371 7.949 240 HB3 PRO 27 3HB PRO 27 16.998 1.823 6.941 241 HG2 PRO 27 2HG PRO 27 14.970 0.921 8.950 242 HG3 PRO 27 3HG PRO 27 15.633 2.543 8.680 243 HD2 PRO 27 2HD PRO 27 13.209 1.785 7.741 244 HD3 PRO 27 3HD PRO 27 14.241 2.951 6.888 245 H ASN 28 H ASN 28 13.540 -0.954 6.906 246 HA ASN 28 HA ASN 28 14.756 -3.602 6.860 247 HB2 ASN 28 2HB ASN 28 14.635 -2.303 9.255 248 HB3 ASN 28 3HB ASN 28 13.091 -3.149 9.250 249 HD21 ASN 28 1HD2 ASN 28 13.062 -5.400 9.233 250 HD22 ASN 28 2HD2 ASN 28 14.453 -6.334 9.658 251 H GLU 29 H GLU 29 12.849 -2.324 5.163 252 HA GLU 29 HA GLU 29 10.389 -3.808 5.809 253 HB2 GLU 29 2HB GLU 29 10.871 -1.157 4.723 254 HB3 GLU 29 3HB GLU 29 9.816 -2.102 3.682 255 HG2 GLU 29 2HG GLU 29 9.307 -1.911 6.623 256 HG3 GLU 29 3HG GLU 29 8.766 -0.649 5.517 257 H VAL 30 H VAL 30 9.189 -4.633 3.873 258 HA VAL 30 HA VAL 30 11.080 -5.997 2.107 259 HB VAL 30 HB VAL 30 9.475 -7.400 3.309 260 HG11 VAL 30 1HG1 VAL 30 7.429 -5.731 1.865 261 HG12 VAL 30 2HG1 VAL 30 7.061 -7.292 2.602 262 HG13 VAL 30 3HG1 VAL 30 7.619 -5.951 3.604 263 HG21 VAL 30 3HG2 VAL 30 10.298 -8.041 1.054 264 HG22 VAL 30 1HG2 VAL 30 8.717 -8.718 1.444 265 HG23 VAL 30 2HG2 VAL 30 8.840 -7.331 0.361 266 H ALA 31 H ALA 31 10.897 -5.989 -0.133 267 HA ALA 31 HA ALA 31 9.022 -4.040 -1.290 268 HB1 ALA 31 1HB ALA 31 11.683 -4.230 -2.555 269 HB2 ALA 31 2HB ALA 31 10.626 -2.835 -2.331 270 HB3 ALA 31 3HB ALA 31 11.612 -3.419 -0.990 271 H ILE 32 H ILE 32 7.708 -5.177 -2.557 272 HA ILE 32 HA ILE 32 8.644 -7.590 -3.880 273 HB ILE 32 HB ILE 32 5.993 -6.393 -3.307 274 HG12 ILE 32 2HG1 ILE 32 6.308 -9.302 -3.524 275 HG13 ILE 32 3HG1 ILE 32 7.434 -8.554 -2.397 276 HG21 ILE 32 1HG2 ILE 32 5.184 -8.263 -5.042 277 HG22 ILE 32 2HG2 ILE 32 5.398 -6.570 -5.483 278 HG23 ILE 32 3HG2 ILE 32 6.663 -7.743 -5.849 279 HD11 ILE 32 3HD1 ILE 32 5.374 -7.402 -1.410 280 HD12 ILE 32 1HD1 ILE 32 4.445 -8.599 -2.312 281 HD13 ILE 32 2HD1 ILE 32 5.603 -9.120 -1.088 282 H PHE 33 H PHE 33 9.614 -7.440 -5.784 283 HA PHE 33 HA PHE 33 8.714 -5.355 -7.662 284 HB2 PHE 33 2HB PHE 33 11.437 -6.663 -7.486 285 HB3 PHE 33 3HB PHE 33 10.965 -5.418 -8.638 286 HD1 PHE 33 HD2 PHE 33 9.392 -3.665 -6.774 287 HD2 PHE 33 HD1 PHE 33 13.169 -5.579 -6.342 288 HE1 PHE 33 HE2 PHE 33 10.086 -1.926 -5.178 289 HE2 PHE 33 HE1 PHE 33 13.869 -3.843 -4.745 290 HZ PHE 33 HZ PHE 33 12.328 -2.013 -4.161 291 H MET 34 H MET 34 7.306 -6.337 -8.991 292 HA MET 34 HA MET 34 7.668 -9.068 -9.841 293 HB2 MET 34 2HB MET 34 5.597 -6.958 -10.247 294 HB3 MET 34 3HB MET 34 5.657 -8.297 -11.384 295 HG2 MET 34 2HG MET 34 5.808 -9.379 -8.775 296 HG3 MET 34 3HG MET 34 4.496 -8.204 -8.799 297 HE1 MET 34 3HE MET 34 4.874 -10.795 -12.348 298 HE2 MET 34 1HE MET 34 6.187 -10.325 -11.269 299 HE3 MET 34 2HE MET 34 5.366 -11.868 -11.037 300 H PHE 35 H PHE 35 8.557 -9.777 -11.684 301 HA PHE 35 HA PHE 35 9.185 -7.807 -13.778 302 HB2 PHE 35 2HB PHE 35 11.363 -8.825 -14.116 303 HB3 PHE 35 3HB PHE 35 11.207 -8.320 -12.436 304 HD1 PHE 35 HD1 PHE 35 10.526 -10.105 -10.733 305 HD2 PHE 35 HD2 PHE 35 11.959 -11.005 -14.638 306 HE1 PHE 35 HE1 PHE 35 11.103 -12.380 -9.993 307 HE2 PHE 35 HE2 PHE 35 12.537 -13.281 -13.906 308 HZ PHE 35 HZ PHE 35 12.109 -13.972 -11.581 309 H GLU 36 H GLU 36 8.748 -8.422 -15.819 310 HA GLU 36 HA GLU 36 7.985 -11.235 -16.260 311 HB2 GLU 36 2HB GLU 36 6.221 -10.540 -17.722 312 HB3 GLU 36 3HB GLU 36 6.047 -9.651 -16.215 313 HG2 GLU 36 2HG GLU 36 5.720 -7.966 -17.701 314 HG3 GLU 36 3HG GLU 36 7.468 -7.849 -17.499 315 H VAL 37 H VAL 37 10.146 -8.855 -17.027 316 HA VAL 37 HA VAL 37 10.465 -9.434 -19.833 317 HB VAL 37 HB VAL 37 12.435 -7.995 -18.062 318 HG11 VAL 37 1HG1 VAL 37 13.550 -8.166 -20.023 319 HG12 VAL 37 2HG1 VAL 37 12.076 -8.387 -20.968 320 HG13 VAL 37 3HG1 VAL 37 12.555 -6.772 -20.444 321 HG21 VAL 37 3HG2 VAL 37 11.245 -5.918 -18.943 322 HG22 VAL 37 1HG2 VAL 37 9.908 -6.997 -19.342 323 HG23 VAL 37 2HG2 VAL 37 10.435 -6.827 -17.668 324 H GLY 38 H GLY 38 12.461 -10.281 -20.750 325 HA2 GLY 38 2HA GLY 38 13.207 -12.746 -19.579 326 HA3 GLY 38 3HA GLY 38 13.967 -12.000 -20.977 327 H ASP 39 H ASP 39 14.286 -9.607 -18.945 328 HA ASP 39 HA ASP 39 16.984 -10.358 -18.209 329 HB2 ASP 39 2HB ASP 39 16.181 -8.067 -19.133 330 HB3 ASP 39 3HB ASP 39 15.678 -7.754 -17.474 331 H PHE 40 H PHE 40 16.466 -11.989 -16.649 332 HA PHE 40 HA PHE 40 15.173 -11.102 -14.190 333 HB2 PHE 40 2HB PHE 40 16.111 -13.742 -13.881 334 HB3 PHE 40 3HB PHE 40 14.454 -13.219 -14.166 335 HD1 PHE 40 HD1 PHE 40 17.571 -14.293 -15.835 336 HD2 PHE 40 HD2 PHE 40 13.382 -13.638 -16.215 337 HE1 PHE 40 HE1 PHE 40 17.593 -15.434 -18.015 338 HE2 PHE 40 HE2 PHE 40 13.398 -14.778 -18.395 339 HZ PHE 40 HZ PHE 40 15.505 -15.679 -19.298 340 H SER 41 H SER 41 18.298 -11.529 -15.497 341 HA SER 41 HA SER 41 19.683 -12.010 -13.040 342 HB2 SER 41 2HB SER 41 21.589 -12.111 -14.313 343 HB3 SER 41 3HB SER 41 20.399 -12.364 -15.590 344 HG SER 41 HG SER 41 21.944 -10.742 -16.118 345 H ASN 42 H ASN 42 18.342 -9.254 -14.533 346 HA ASN 42 HA ASN 42 20.111 -7.332 -13.312 347 HB2 ASN 42 2HB ASN 42 17.937 -7.295 -15.243 348 HB3 ASN 42 3HB ASN 42 17.790 -5.988 -14.072 349 HD21 ASN 42 1HD2 ASN 42 18.495 -4.222 -15.036 350 HD22 ASN 42 2HD2 ASN 42 19.986 -4.065 -15.896 351 H ILE 43 H ILE 43 17.192 -8.979 -12.475 352 HA ILE 43 HA ILE 43 15.928 -7.322 -10.707 353 HB ILE 43 HB ILE 43 16.300 -10.273 -10.796 354 HG12 ILE 43 2HG1 ILE 43 14.570 -9.096 -12.132 355 HG13 ILE 43 3HG1 ILE 43 13.878 -10.248 -10.995 356 HG21 ILE 43 1HG2 ILE 43 15.338 -8.745 -8.403 357 HG22 ILE 43 2HG2 ILE 43 14.758 -10.374 -8.746 358 HG23 ILE 43 3HG2 ILE 43 16.477 -10.089 -8.478 359 HD11 ILE 43 3HD1 ILE 43 14.026 -7.756 -9.680 360 HD12 ILE 43 1HD1 ILE 43 13.340 -7.476 -11.280 361 HD13 ILE 43 2HD1 ILE 43 12.592 -8.646 -10.191 362 HA PRO 44 HA PRO 44 18.907 -8.681 -7.147 363 HB2 PRO 44 2HB PRO 44 21.173 -9.993 -7.864 364 HB3 PRO 44 3HB PRO 44 19.660 -10.825 -7.487 365 HG2 PRO 44 2HG PRO 44 20.826 -10.132 -10.155 366 HG3 PRO 44 3HG PRO 44 20.044 -11.635 -9.633 367 HD2 PRO 44 2HD PRO 44 18.758 -9.757 -11.099 368 HD3 PRO 44 3HD PRO 44 17.923 -10.775 -9.907 369 H LYS 45 H LYS 45 19.895 -7.420 -10.178 370 HA LYS 45 HA LYS 45 22.307 -6.162 -9.234 371 HB2 LYS 45 2HB LYS 45 21.445 -6.847 -11.700 372 HB3 LYS 45 3HB LYS 45 20.989 -5.149 -11.686 373 HG2 LYS 45 2HG LYS 45 23.611 -5.283 -10.676 374 HG3 LYS 45 3HG LYS 45 23.557 -6.325 -12.099 375 HD2 LYS 45 2HD LYS 45 22.349 -4.350 -13.231 376 HD3 LYS 45 3HD LYS 45 22.969 -3.390 -11.885 377 HE2 LYS 45 2HE LYS 45 24.731 -3.108 -13.269 378 HE3 LYS 45 3HE LYS 45 25.218 -4.669 -12.610 379 HZ1 LYS 45 3HZ LYS 45 25.098 -5.538 -14.627 380 HZ2 LYS 45 1HZ LYS 45 24.695 -4.024 -15.267 381 HZ3 LYS 45 2HZ LYS 45 23.475 -5.087 -14.775 382 H SER 46 H SER 46 18.940 -5.365 -9.421 383 HA SER 46 HA SER 46 19.236 -2.535 -9.220 384 HB2 SER 46 2HB SER 46 16.749 -3.659 -8.141 385 HB3 SER 46 3HB SER 46 16.988 -2.495 -9.444 386 HG SER 46 HG SER 46 16.291 -4.204 -10.533 387 H ALA 47 H ALA 47 18.240 -5.010 -6.852 388 HA ALA 47 HA ALA 47 18.056 -3.402 -4.614 389 HB1 ALA 47 1HB ALA 47 18.090 -5.346 -3.331 390 HB2 ALA 47 2HB ALA 47 17.500 -5.894 -4.901 391 HB3 ALA 47 3HB ALA 47 19.179 -6.175 -4.443 392 H GLU 48 H GLU 48 20.897 -4.614 -6.228 393 HA GLU 48 HA GLU 48 22.727 -4.110 -4.102 394 HB2 GLU 48 2HB GLU 48 23.133 -5.678 -6.021 395 HB3 GLU 48 3HB GLU 48 23.335 -4.272 -7.056 396 HG2 GLU 48 2HG GLU 48 25.071 -3.685 -5.071 397 HG3 GLU 48 3HG GLU 48 25.159 -5.445 -5.080 398 H PHE 49 H PHE 49 21.562 -2.258 -6.857 399 HA PHE 49 HA PHE 49 23.364 -0.169 -6.899 400 HB2 PHE 49 2HB PHE 49 20.902 -0.722 -8.087 401 HB3 PHE 49 3HB PHE 49 20.643 0.793 -7.229 402 HD1 PHE 49 HD2 PHE 49 22.130 2.742 -7.721 403 HD2 PHE 49 HD1 PHE 49 22.148 -0.802 -10.077 404 HE1 PHE 49 HE2 PHE 49 23.236 3.965 -9.546 405 HE2 PHE 49 HE1 PHE 49 23.255 0.415 -11.906 406 HZ PHE 49 HZ PHE 49 23.800 2.803 -11.642 407 H ILE 50 H ILE 50 20.773 -0.804 -4.641 408 HA ILE 50 HA ILE 50 20.668 1.749 -3.434 409 HB ILE 50 HB ILE 50 20.040 -0.900 -2.129 410 HG12 ILE 50 2HG1 ILE 50 18.874 -0.524 -4.325 411 HG13 ILE 50 3HG1 ILE 50 17.794 -0.673 -2.943 412 HG21 ILE 50 1HG2 ILE 50 18.302 0.789 -1.044 413 HG22 ILE 50 2HG2 ILE 50 19.919 0.551 -0.383 414 HG23 ILE 50 3HG2 ILE 50 19.584 1.941 -1.416 415 HD11 ILE 50 3HD1 ILE 50 18.623 1.884 -4.294 416 HD12 ILE 50 1HD1 ILE 50 17.051 1.092 -4.405 417 HD13 ILE 50 2HD1 ILE 50 17.590 1.771 -2.869 418 H GLN 51 H GLN 51 22.411 -1.220 -2.539 419 HA GLN 51 HA GLN 51 24.644 0.185 -1.528 420 HB2 GLN 51 2HB GLN 51 22.559 0.198 0.260 421 HB3 GLN 51 3HB GLN 51 23.478 -1.211 0.772 422 HG2 GLN 51 2HG GLN 51 24.426 1.631 0.571 423 HG3 GLN 51 3HG GLN 51 24.260 0.641 2.020 424 HE21 GLN 51 1HE2 GLN 51 26.392 1.818 -0.206 425 HE22 GLN 51 2HE2 GLN 51 27.696 0.711 0.037 426 H SER 52 H SER 52 26.360 -1.137 -1.535 427 HA SER 52 HA SER 52 26.288 -3.687 -2.570 428 HB2 SER 52 2HB SER 52 28.597 -3.948 -1.615 429 HB3 SER 52 3HB SER 52 28.357 -2.452 -2.517 430 HG SER 52 HG SER 52 29.087 -2.771 0.040 431 H LYS 53 H LYS 53 25.906 -2.657 0.743 432 HA LYS 53 HA LYS 53 25.327 -5.443 1.487 433 HB2 LYS 53 2HB LYS 53 27.564 -4.182 2.354 434 HB3 LYS 53 3HB LYS 53 26.429 -3.708 3.612 435 HG2 LYS 53 2HG LYS 53 26.787 -5.652 4.601 436 HG3 LYS 53 3HG LYS 53 26.040 -6.456 3.219 437 HD2 LYS 53 2HD LYS 53 28.042 -7.477 3.048 438 HD3 LYS 53 3HD LYS 53 28.521 -5.980 2.245 439 HE2 LYS 53 2HE LYS 53 29.467 -5.118 4.257 440 HE3 LYS 53 3HE LYS 53 28.782 -6.432 5.211 441 HZ1 LYS 53 3HZ LYS 53 31.249 -6.341 3.843 442 HZ2 LYS 53 1HZ LYS 53 30.313 -7.607 3.223 443 HZ3 LYS 53 2HZ LYS 53 30.654 -7.539 4.879 444 H GLY 54 H GLY 54 23.285 -5.624 2.115 445 HA2 GLY 54 2HA GLY 54 21.888 -4.673 4.100 446 HA3 GLY 54 3HA GLY 54 21.887 -3.234 3.091 447 H HIS 55 H HIS 55 21.913 -5.444 0.819 448 HA HIS 55 HA HIS 55 18.979 -5.667 0.750 449 HB2 HIS 55 2HB HIS 55 19.137 -5.700 -1.667 450 HB3 HIS 55 3HB HIS 55 20.011 -4.300 -1.051 451 HD1 HIS 55 HD1 HIS 55 22.724 -4.752 -0.827 452 HD2 HIS 55 HD2 HIS 55 20.570 -7.181 -3.419 453 HE1 HIS 55 HE1 HIS 55 24.429 -5.763 -2.375 454 H GLU 56 H GLU 56 18.200 -7.627 1.115 455 HA GLU 56 HA GLU 56 19.679 -9.952 0.101 456 HB2 GLU 56 2HB GLU 56 19.548 -9.306 2.787 457 HB3 GLU 56 3HB GLU 56 18.256 -10.483 2.595 458 HG2 GLU 56 2HG GLU 56 20.792 -11.212 1.314 459 HG3 GLU 56 3HG GLU 56 20.845 -11.099 3.073 460 H LEU 57 H LEU 57 18.437 -11.083 -1.224 461 HA LEU 57 HA LEU 57 15.603 -10.645 -1.358 462 HB2 LEU 57 2HB LEU 57 17.460 -12.493 -2.839 463 HB3 LEU 57 3HB LEU 57 15.727 -12.412 -3.148 464 HG LEU 57 HG LEU 57 16.756 -11.123 -4.832 465 HD11 LEU 57 1HD1 LEU 57 14.855 -10.087 -3.295 466 HD12 LEU 57 2HD1 LEU 57 15.566 -9.198 -4.641 467 HD13 LEU 57 3HD1 LEU 57 16.113 -8.888 -2.994 468 HD21 LEU 57 3HD2 LEU 57 18.887 -10.892 -3.280 469 HD22 LEU 57 1HD2 LEU 57 18.172 -9.313 -2.950 470 HD23 LEU 57 2HD2 LEU 57 18.576 -9.769 -4.605 471 H LEU 58 H LEU 58 14.405 -11.485 0.242 472 HA LEU 58 HA LEU 58 14.927 -13.648 1.848 473 HB2 LEU 58 2HB LEU 58 12.665 -12.000 1.233 474 HB3 LEU 58 3HB LEU 58 12.145 -13.674 1.413 475 HG LEU 58 HG LEU 58 13.921 -12.765 3.551 476 HD11 LEU 58 1HD1 LEU 58 11.186 -11.637 3.747 477 HD12 LEU 58 2HD1 LEU 58 12.371 -10.755 2.785 478 HD13 LEU 58 3HD1 LEU 58 12.693 -11.096 4.485 479 HD21 LEU 58 3HD2 LEU 58 11.977 -13.715 4.883 480 HD22 LEU 58 1HD2 LEU 58 12.828 -14.832 3.816 481 HD23 LEU 58 2HD2 LEU 58 11.269 -14.164 3.330 482 H ASN 59 H ASN 59 13.310 -13.626 -1.298 483 HA ASN 59 HA ASN 59 13.736 -16.528 -1.448 484 HB2 ASN 59 2HB ASN 59 11.267 -15.598 -1.001 485 HB3 ASN 59 3HB ASN 59 11.300 -15.427 -2.754 486 HD21 ASN 59 1HD2 ASN 59 12.086 -17.774 -0.217 487 HD22 ASN 59 2HD2 ASN 59 11.519 -19.157 -1.084 488 H SER 60 H SER 60 15.147 -16.828 -3.036 489 HA SER 60 HA SER 60 15.923 -15.062 -4.984 490 HB2 SER 60 2HB SER 60 17.382 -16.793 -5.044 491 HB3 SER 60 3HB SER 60 16.151 -17.970 -4.587 492 HG SER 60 HG SER 60 17.017 -18.186 -6.765 493 H LEU 61 H LEU 61 15.005 -14.222 -6.730 494 HA LEU 61 HA LEU 61 12.402 -14.553 -7.500 495 HB2 LEU 61 2HB LEU 61 12.960 -13.460 -9.566 496 HB3 LEU 61 3HB LEU 61 13.878 -12.733 -8.248 497 HG LEU 61 HG LEU 61 15.081 -14.814 -10.052 498 HD11 LEU 61 1HD1 LEU 61 15.115 -13.400 -11.755 499 HD12 LEU 61 2HD1 LEU 61 16.001 -12.241 -10.764 500 HD13 LEU 61 3HD1 LEU 61 14.238 -12.199 -10.806 501 HD21 LEU 61 3HD2 LEU 61 17.117 -13.327 -9.355 502 HD22 LEU 61 1HD2 LEU 61 16.486 -14.550 -8.252 503 HD23 LEU 61 2HD2 LEU 61 16.058 -12.854 -8.025 504 H ARG 62 H ARG 62 11.255 -16.028 -8.578 505 HA ARG 62 HA ARG 62 12.623 -18.391 -9.577 506 HB2 ARG 62 2HB ARG 62 10.379 -18.183 -8.143 507 HB3 ARG 62 3HB ARG 62 9.666 -18.122 -9.749 508 HG2 ARG 62 2HG ARG 62 9.738 -20.330 -9.815 509 HG3 ARG 62 3HG ARG 62 11.501 -20.242 -9.794 510 HD2 ARG 62 2HD ARG 62 11.554 -20.388 -7.415 511 HD3 ARG 62 3HD ARG 62 9.806 -20.189 -7.306 512 HE ARG 62 HE ARG 62 9.555 -22.421 -7.759 513 HH11 ARG 62 1HH1 ARG 62 12.810 -21.451 -8.520 514 HH12 ARG 62 2HH1 ARG 62 13.369 -23.069 -8.788 515 HH21 ARG 62 1HH2 ARG 62 10.278 -24.556 -8.109 516 HH22 ARG 62 2HH2 ARG 62 11.927 -24.834 -8.555 517 H PHE 63 H PHE 63 13.415 -16.593 -11.251 518 HA PHE 63 HA PHE 63 11.757 -15.803 -13.353 519 HB2 PHE 63 2HB PHE 63 13.732 -15.259 -14.543 520 HB3 PHE 63 3HB PHE 63 14.130 -15.025 -12.844 521 HD1 PHE 63 HD2 PHE 63 15.201 -17.106 -11.660 522 HD2 PHE 63 HD1 PHE 63 15.171 -16.465 -15.868 523 HE1 PHE 63 HE2 PHE 63 17.124 -18.622 -11.901 524 HE2 PHE 63 HE1 PHE 63 17.093 -17.980 -16.116 525 HZ PHE 63 HZ PHE 63 18.073 -19.060 -14.131 526 H ASN 64 H ASN 64 12.953 -18.890 -12.543 527 HA ASN 64 HA ASN 64 13.302 -20.205 -14.919 528 HB2 ASN 64 2HB ASN 64 11.985 -21.141 -12.369 529 HB3 ASN 64 3HB ASN 64 12.314 -22.223 -13.719 530 HD21 ASN 64 1HD2 ASN 64 14.595 -22.246 -14.482 531 HD22 ASN 64 2HD2 ASN 64 15.836 -22.160 -13.283 532 H GLN 65 H GLN 65 10.347 -18.972 -13.573 533 HA GLN 65 HA GLN 65 8.843 -20.162 -15.808 534 HB2 GLN 65 2HB GLN 65 8.299 -20.253 -13.076 535 HB3 GLN 65 3HB GLN 65 7.197 -19.032 -13.700 536 HG2 GLN 65 2HG GLN 65 7.262 -21.376 -15.391 537 HG3 GLN 65 3HG GLN 65 6.833 -21.774 -13.728 538 HE21 GLN 65 1HE2 GLN 65 5.369 -21.503 -16.415 539 HE22 GLN 65 2HE2 GLN 65 3.956 -20.597 -16.007 540 H ALA 66 H ALA 66 6.597 -18.574 -15.728 541 HA ALA 66 HA ALA 66 7.360 -16.364 -17.269 542 HB1 ALA 66 1HB ALA 66 4.763 -16.065 -15.982 543 HB2 ALA 66 2HB ALA 66 5.174 -16.190 -17.693 544 HB3 ALA 66 3HB ALA 66 4.997 -17.650 -16.720 545 H ASP 67 H ASP 67 5.955 -14.183 -16.432 546 HA ASP 67 HA ASP 67 7.676 -12.739 -14.902 547 HB2 ASP 67 2HB ASP 67 5.945 -11.121 -14.588 548 HB3 ASP 67 3HB ASP 67 5.667 -11.872 -16.157 549 H TRP 68 H TRP 68 8.449 -13.073 -12.935 550 HA TRP 68 HA TRP 68 6.655 -14.204 -10.890 551 HB2 TRP 68 2HB TRP 68 8.971 -15.306 -11.739 552 HB3 TRP 68 3HB TRP 68 9.582 -14.284 -10.441 553 HD1 TRP 68 HD1 TRP 68 9.410 -15.237 -8.055 554 HE1 TRP 68 HE1 TRP 68 8.263 -17.276 -6.982 555 HE3 TRP 68 HE3 TRP 68 6.688 -16.846 -12.073 556 HZ2 TRP 68 HZ2 TRP 68 6.445 -19.299 -7.738 557 HZ3 TRP 68 HZ3 TRP 68 5.271 -18.841 -11.814 558 HH2 TRP 68 HH2 TRP 68 5.154 -20.041 -9.691 559 H THR 69 H THR 69 7.592 -13.632 -8.588 560 HA THR 69 HA THR 69 8.058 -10.720 -8.553 561 HB THR 69 HB THR 69 6.742 -12.199 -6.291 562 HG1 THR 69 HG1 THR 69 5.634 -12.415 -8.452 563 HG21 THR 69 3HG2 THR 69 6.992 -10.136 -5.437 564 HG22 THR 69 1HG2 THR 69 5.646 -9.698 -6.487 565 HG23 THR 69 2HG2 THR 69 7.304 -9.418 -7.017 566 H ILE 70 H ILE 70 9.404 -9.872 -6.916 567 HA ILE 70 HA ILE 70 11.025 -11.829 -5.441 568 HB ILE 70 HB ILE 70 12.341 -11.242 -7.386 569 HG12 ILE 70 2HG1 ILE 70 14.342 -10.429 -6.284 570 HG13 ILE 70 3HG1 ILE 70 13.385 -9.725 -4.986 571 HG21 ILE 70 1HG2 ILE 70 12.929 -8.509 -6.968 572 HG22 ILE 70 2HG2 ILE 70 12.135 -9.257 -8.353 573 HG23 ILE 70 3HG2 ILE 70 11.174 -8.674 -6.994 574 HD11 ILE 70 3HD1 ILE 70 14.596 -12.159 -4.914 575 HD12 ILE 70 1HD1 ILE 70 13.253 -11.659 -3.887 576 HD13 ILE 70 2HD1 ILE 70 12.943 -12.584 -5.357 577 H VAL 71 H VAL 71 11.222 -11.342 -3.357 578 HA VAL 71 HA VAL 71 10.377 -8.688 -2.454 579 HB VAL 71 HB VAL 71 10.312 -9.732 -0.189 580 HG11 VAL 71 1HG1 VAL 71 8.484 -11.542 -1.157 581 HG12 VAL 71 2HG1 VAL 71 8.178 -9.832 -0.844 582 HG13 VAL 71 3HG1 VAL 71 8.612 -10.368 -2.467 583 HG21 VAL 71 3HG2 VAL 71 11.963 -11.491 -0.563 584 HG22 VAL 71 1HG2 VAL 71 10.431 -12.170 -0.013 585 HG23 VAL 71 2HG2 VAL 71 10.881 -12.273 -1.715 586 H VAL 72 H VAL 72 11.745 -7.254 -1.594 587 HA VAL 72 HA VAL 72 14.483 -8.156 -0.972 588 HB VAL 72 HB VAL 72 13.780 -5.375 -1.890 589 HG11 VAL 72 1HG1 VAL 72 16.003 -4.948 -1.884 590 HG12 VAL 72 2HG1 VAL 72 16.008 -6.230 -0.671 591 HG13 VAL 72 3HG1 VAL 72 16.432 -6.596 -2.343 592 HG21 VAL 72 3HG2 VAL 72 15.091 -6.595 -3.991 593 HG22 VAL 72 1HG2 VAL 72 13.943 -7.820 -3.450 594 HG23 VAL 72 2HG2 VAL 72 13.370 -6.218 -3.916 595 H ARG 73 H ARG 73 15.127 -7.855 1.054 596 HA ARG 73 HA ARG 73 13.540 -6.084 2.777 597 HB2 ARG 73 2HB ARG 73 14.643 -7.365 4.646 598 HB3 ARG 73 3HB ARG 73 13.571 -8.310 3.622 599 HG2 ARG 73 2HG ARG 73 15.205 -9.698 3.049 600 HG3 ARG 73 3HG ARG 73 16.290 -8.366 2.645 601 HD2 ARG 73 2HD ARG 73 17.296 -9.638 4.403 602 HD3 ARG 73 3HD ARG 73 16.757 -8.101 5.078 603 HE ARG 73 HE ARG 73 15.256 -9.235 6.394 604 HH11 ARG 73 1HH1 ARG 73 16.508 -11.373 3.948 605 HH12 ARG 73 2HH1 ARG 73 15.804 -12.795 4.645 606 HH21 ARG 73 1HH2 ARG 73 14.324 -11.099 7.321 607 HH22 ARG 73 2HH2 ARG 73 14.561 -12.638 6.563 608 H LYS 74 H LYS 74 14.388 -4.120 2.974 609 HA LYS 74 HA LYS 74 17.056 -3.432 2.440 610 HB2 LYS 74 2HB LYS 74 14.723 -2.071 3.693 611 HB3 LYS 74 3HB LYS 74 16.312 -1.362 3.950 612 HG2 LYS 74 2HG LYS 74 16.132 -1.952 1.205 613 HG3 LYS 74 3HG LYS 74 14.607 -1.192 1.667 614 HD2 LYS 74 2HD LYS 74 17.027 0.075 2.762 615 HD3 LYS 74 3HD LYS 74 16.856 0.169 1.008 616 HE2 LYS 74 2HE LYS 74 15.305 1.750 1.196 617 HE3 LYS 74 3HE LYS 74 14.342 0.736 2.270 618 HZ1 LYS 74 3HZ LYS 74 16.376 1.601 3.851 619 HZ2 LYS 74 1HZ LYS 74 14.811 2.244 3.817 620 HZ3 LYS 74 2HZ LYS 74 16.039 2.957 2.898 621 H LYS 75 H LYS 75 18.677 -2.618 3.910 622 HA LYS 75 HA LYS 75 18.584 -2.921 6.694 623 HB2 LYS 75 2HB LYS 75 18.889 -5.379 5.331 624 HB3 LYS 75 3HB LYS 75 20.461 -4.987 6.017 625 HG2 LYS 75 2HG LYS 75 18.456 -4.481 7.977 626 HG3 LYS 75 3HG LYS 75 18.213 -6.097 7.308 627 HD2 LYS 75 2HD LYS 75 20.888 -6.117 7.631 628 HD3 LYS 75 3HD LYS 75 20.428 -5.027 8.942 629 HE2 LYS 75 2HE LYS 75 19.291 -7.783 8.482 630 HE3 LYS 75 3HE LYS 75 20.538 -7.381 9.661 631 HZ1 LYS 75 3HZ LYS 75 17.677 -6.874 9.742 632 HZ2 LYS 75 1HZ LYS 75 18.662 -5.635 10.339 633 HZ3 LYS 75 2HZ LYS 75 18.758 -7.187 11.005 634 H ALA 76 H ALA 76 21.002 -3.168 7.557 635 HA ALA 76 HA ALA 76 22.982 -2.059 7.774 636 HB1 ALA 76 1HB ALA 76 23.022 -3.506 5.352 637 HB2 ALA 76 2HB ALA 76 23.834 -1.968 5.053 638 HB3 ALA 76 3HB ALA 76 24.389 -3.020 6.355 Start of MODEL 10 1 H1 MET 1 H MET 1 0.627 -3.796 -1.401 2 HA MET 1 HA MET 1 1.439 -1.062 -2.141 3 HB2 MET 1 2HB MET 1 0.071 -1.900 0.173 4 HB3 MET 1 3HB MET 1 1.720 -1.560 0.682 5 HG2 MET 1 2HG MET 1 0.982 0.536 0.888 6 HG3 MET 1 3HG MET 1 1.213 0.601 -0.858 7 HE1 MET 1 3HE MET 1 -2.191 -1.233 0.970 8 HE2 MET 1 1HE MET 1 -0.984 -0.389 1.940 9 HE3 MET 1 2HE MET 1 -2.540 0.374 1.610 10 H LYS 2 H LYS 2 3.493 -0.455 -0.768 11 HA LYS 2 HA LYS 2 5.777 -0.728 -0.854 12 HB2 LYS 2 2HB LYS 2 6.559 -2.416 0.735 13 HB3 LYS 2 3HB LYS 2 5.165 -1.553 1.371 14 HG2 LYS 2 2HG LYS 2 3.720 -3.417 0.797 15 HG3 LYS 2 3HG LYS 2 5.091 -4.280 0.095 16 HD2 LYS 2 2HD LYS 2 6.193 -4.157 2.349 17 HD3 LYS 2 3HD LYS 2 4.668 -3.535 2.985 18 HE2 LYS 2 2HE LYS 2 3.553 -5.591 2.123 19 HE3 LYS 2 3HE LYS 2 5.142 -6.213 1.682 20 HZ1 LYS 2 3HZ LYS 2 4.654 -7.125 3.770 21 HZ2 LYS 2 1HZ LYS 2 4.091 -5.655 4.392 22 HZ3 LYS 2 2HZ LYS 2 5.742 -5.871 4.094 23 H ARG 3 H ARG 3 4.656 -1.649 -3.231 24 HA ARG 3 HA ARG 3 6.599 -3.711 -3.946 25 HB2 ARG 3 2HB ARG 3 5.081 -5.171 -4.919 26 HB3 ARG 3 3HB ARG 3 4.219 -4.651 -3.477 27 HG2 ARG 3 2HG ARG 3 3.821 -3.552 -6.252 28 HG3 ARG 3 3HG ARG 3 2.764 -4.703 -5.432 29 HD2 ARG 3 2HD ARG 3 2.442 -2.993 -3.634 30 HD3 ARG 3 3HD ARG 3 3.331 -1.851 -4.640 31 HE ARG 3 HE ARG 3 1.078 -3.091 -5.944 32 HH11 ARG 3 1HH1 ARG 3 2.180 -0.430 -3.989 33 HH12 ARG 3 2HH1 ARG 3 0.873 0.614 -4.441 34 HH21 ARG 3 1HH2 ARG 3 -0.647 -1.726 -6.548 35 HH22 ARG 3 2HH2 ARG 3 -0.735 -0.125 -5.896 36 H PHE 4 H PHE 4 6.842 -3.912 -6.333 37 HA PHE 4 HA PHE 4 6.084 -1.467 -7.771 38 HB2 PHE 4 2HB PHE 4 8.657 -1.945 -6.814 39 HB3 PHE 4 3HB PHE 4 8.738 -2.392 -8.515 40 HD1 PHE 4 HD2 PHE 4 7.000 0.312 -6.615 41 HD2 PHE 4 HD1 PHE 4 9.654 -0.720 -9.778 42 HE1 PHE 4 HE2 PHE 4 7.190 2.688 -7.225 43 HE2 PHE 4 HE1 PHE 4 9.850 1.655 -10.393 44 HZ PHE 4 HZ PHE 4 8.616 3.362 -9.117 45 H ASP 5 H ASP 5 5.023 -2.015 -9.544 46 HA ASP 5 HA ASP 5 5.354 -4.677 -10.677 47 HB2 ASP 5 2HB ASP 5 3.205 -2.805 -10.476 48 HB3 ASP 5 3HB ASP 5 3.499 -3.132 -12.181 49 H LEU 6 H LEU 6 7.222 -4.719 -11.837 50 HA LEU 6 HA LEU 6 7.769 -2.591 -13.755 51 HB2 LEU 6 2HB LEU 6 9.340 -4.939 -12.744 52 HB3 LEU 6 3HB LEU 6 9.860 -4.017 -14.153 53 HG LEU 6 HG LEU 6 11.083 -3.239 -12.257 54 HD11 LEU 6 1HD1 LEU 6 9.877 -1.604 -13.934 55 HD12 LEU 6 2HD1 LEU 6 10.788 -0.994 -12.553 56 HD13 LEU 6 3HD1 LEU 6 9.030 -1.099 -12.472 57 HD21 LEU 6 3HD2 LEU 6 8.535 -2.503 -10.854 58 HD22 LEU 6 1HD2 LEU 6 10.171 -2.612 -10.201 59 HD23 LEU 6 2HD2 LEU 6 9.292 -4.081 -10.627 60 H ARG 7 H ARG 7 5.799 -5.100 -13.814 61 HA ARG 7 HA ARG 7 6.410 -6.750 -15.923 62 HB2 ARG 7 2HB ARG 7 4.013 -5.935 -14.528 63 HB3 ARG 7 3HB ARG 7 3.685 -6.169 -16.240 64 HG2 ARG 7 2HG ARG 7 4.223 -8.415 -16.173 65 HG3 ARG 7 3HG ARG 7 5.194 -8.242 -14.709 66 HD2 ARG 7 2HD ARG 7 3.377 -9.120 -13.710 67 HD3 ARG 7 3HD ARG 7 2.780 -7.463 -13.789 68 HE ARG 7 HE ARG 7 2.085 -8.748 -16.168 69 HH11 ARG 7 1HH1 ARG 7 1.351 -8.911 -12.768 70 HH12 ARG 7 2HH1 ARG 7 -0.254 -9.516 -13.011 71 HH21 ARG 7 1HH2 ARG 7 -0.026 -9.544 -16.500 72 HH22 ARG 7 2HH2 ARG 7 -1.036 -9.876 -15.134 73 HA PRO 8 HA PRO 8 4.489 -3.616 -19.052 74 HB2 PRO 8 2HB PRO 8 3.886 -1.135 -18.130 75 HB3 PRO 8 3HB PRO 8 2.739 -2.479 -18.092 76 HG2 PRO 8 2HG PRO 8 4.469 -1.402 -15.899 77 HG3 PRO 8 3HG PRO 8 2.771 -1.909 -15.838 78 HD2 PRO 8 2HD PRO 8 4.794 -3.484 -14.967 79 HD3 PRO 8 3HD PRO 8 3.313 -4.144 -15.689 80 H LEU 9 H LEU 9 6.869 -2.868 -16.719 81 HA LEU 9 HA LEU 9 8.106 -0.728 -18.211 82 HB2 LEU 9 2HB LEU 9 8.440 -1.997 -15.611 83 HB3 LEU 9 3HB LEU 9 9.974 -1.628 -16.395 84 HG LEU 9 HG LEU 9 8.450 0.696 -16.656 85 HD11 LEU 9 1HD1 LEU 9 8.409 0.325 -13.771 86 HD12 LEU 9 2HD1 LEU 9 7.276 -0.726 -14.619 87 HD13 LEU 9 3HD1 LEU 9 7.194 1.021 -14.844 88 HD21 LEU 9 3HD2 LEU 9 10.962 0.051 -15.985 89 HD22 LEU 9 1HD2 LEU 9 10.337 0.481 -14.393 90 HD23 LEU 9 2HD2 LEU 9 10.270 1.651 -15.711 91 H LYS 10 H LYS 10 9.770 -0.867 -19.608 92 HA LYS 10 HA LYS 10 10.441 -3.434 -20.688 93 HB2 LYS 10 2HB LYS 10 11.683 -2.241 -22.338 94 HB3 LYS 10 3HB LYS 10 10.220 -1.316 -22.028 95 HG2 LYS 10 2HG LYS 10 11.512 0.176 -20.550 96 HG3 LYS 10 3HG LYS 10 12.973 -0.724 -20.961 97 HD2 LYS 10 2HD LYS 10 13.043 1.088 -22.416 98 HD3 LYS 10 3HD LYS 10 12.338 -0.191 -23.408 99 HE2 LYS 10 2HE LYS 10 10.106 0.871 -22.331 100 HE3 LYS 10 3HE LYS 10 11.138 2.300 -22.377 101 HZ1 LYS 10 3HZ LYS 10 9.811 2.026 -24.403 102 HZ2 LYS 10 1HZ LYS 10 10.568 0.544 -24.704 103 HZ3 LYS 10 2HZ LYS 10 11.470 1.974 -24.726 104 H ALA 11 H ALA 11 12.706 -4.129 -21.028 105 HA ALA 11 HA ALA 11 14.082 -4.283 -18.546 106 HB1 ALA 11 1HB ALA 11 14.591 -6.176 -19.631 107 HB2 ALA 11 2HB ALA 11 14.355 -5.446 -21.219 108 HB3 ALA 11 3HB ALA 11 15.880 -5.222 -20.363 109 H GLY 12 H GLY 12 16.013 -3.374 -17.893 110 HA2 GLY 12 2HA GLY 12 18.025 -2.122 -18.343 111 HA3 GLY 12 3HA GLY 12 17.176 -1.319 -19.656 112 H ILE 13 H ILE 13 14.799 -0.661 -18.306 113 HA ILE 13 HA ILE 13 15.809 1.476 -16.571 114 HB ILE 13 HB ILE 13 13.050 1.253 -17.769 115 HG12 ILE 13 2HG1 ILE 13 15.459 2.743 -18.834 116 HG13 ILE 13 3HG1 ILE 13 14.753 1.298 -19.549 117 HG21 ILE 13 1HG2 ILE 13 12.595 3.081 -16.600 118 HG22 ILE 13 2HG2 ILE 13 14.189 2.982 -15.853 119 HG23 ILE 13 3HG2 ILE 13 13.965 3.917 -17.331 120 HD11 ILE 13 3HD1 ILE 13 13.922 4.089 -19.734 121 HD12 ILE 13 1HD1 ILE 13 13.643 2.741 -20.835 122 HD13 ILE 13 2HD1 ILE 13 12.604 2.959 -19.427 123 H PHE 14 H PHE 14 13.688 -1.294 -16.615 124 HA PHE 14 HA PHE 14 12.190 -0.811 -14.310 125 HB2 PHE 14 2HB PHE 14 11.594 -3.081 -14.368 126 HB3 PHE 14 3HB PHE 14 11.953 -2.697 -16.049 127 HD1 PHE 14 HD1 PHE 14 14.662 -2.958 -16.495 128 HD2 PHE 14 HD2 PHE 14 12.296 -5.154 -13.722 129 HE1 PHE 14 HE1 PHE 14 16.292 -4.799 -16.568 130 HE2 PHE 14 HE2 PHE 14 13.923 -6.998 -13.789 131 HZ PHE 14 HZ PHE 14 15.924 -6.822 -15.213 132 H GLU 15 H GLU 15 15.498 -1.755 -14.703 133 HA GLU 15 HA GLU 15 15.801 -2.638 -11.964 134 HB2 GLU 15 2HB GLU 15 17.143 -3.754 -13.615 135 HB3 GLU 15 3HB GLU 15 17.779 -2.225 -14.207 136 HG2 GLU 15 2HG GLU 15 18.283 -2.594 -11.378 137 HG3 GLU 15 3HG GLU 15 18.959 -3.895 -12.357 138 H ARG 16 H ARG 16 16.176 0.274 -13.798 139 HA ARG 16 HA ARG 16 17.811 1.592 -11.811 140 HB2 ARG 16 2HB ARG 16 16.726 2.259 -14.485 141 HB3 ARG 16 3HB ARG 16 16.970 3.612 -13.388 142 HG2 ARG 16 2HG ARG 16 19.165 3.581 -13.705 143 HG3 ARG 16 3HG ARG 16 19.253 1.843 -13.407 144 HD2 ARG 16 2HD ARG 16 19.238 1.340 -15.601 145 HD3 ARG 16 3HD ARG 16 18.062 2.598 -15.982 146 HE ARG 16 HE ARG 16 19.791 3.978 -16.546 147 HH11 ARG 16 1HH1 ARG 16 21.027 1.363 -14.609 148 HH12 ARG 16 2HH1 ARG 16 22.686 1.810 -14.829 149 HH21 ARG 16 1HH2 ARG 16 21.972 4.577 -16.845 150 HH22 ARG 16 2HH2 ARG 16 23.222 3.639 -16.101 151 H LEU 17 H LEU 17 14.432 1.508 -12.778 152 HA LEU 17 HA LEU 17 13.606 3.671 -11.114 153 HB2 LEU 17 2HB LEU 17 12.438 1.969 -13.053 154 HB3 LEU 17 3HB LEU 17 11.465 1.852 -11.588 155 HG LEU 17 HG LEU 17 10.513 3.526 -13.008 156 HD11 LEU 17 1HD1 LEU 17 11.986 5.142 -10.968 157 HD12 LEU 17 2HD1 LEU 17 10.831 3.906 -10.469 158 HD13 LEU 17 3HD1 LEU 17 10.302 5.251 -11.480 159 HD21 LEU 17 3HD2 LEU 17 12.850 3.922 -14.119 160 HD22 LEU 17 1HD2 LEU 17 12.977 5.204 -12.914 161 HD23 LEU 17 2HD2 LEU 17 11.649 5.214 -14.076 162 H GLU 18 H GLU 18 14.073 0.257 -10.651 163 HA GLU 18 HA GLU 18 12.487 -0.192 -8.404 164 HB2 GLU 18 2HB GLU 18 14.298 -1.667 -9.877 165 HB3 GLU 18 3HB GLU 18 15.071 -1.554 -8.302 166 HG2 GLU 18 2HG GLU 18 13.704 -3.065 -7.444 167 HG3 GLU 18 3HG GLU 18 12.284 -2.188 -8.009 168 H GLU 19 H GLU 19 15.498 1.500 -8.742 169 HA GLU 19 HA GLU 19 16.100 1.492 -5.921 170 HB2 GLU 19 2HB GLU 19 17.972 1.573 -7.397 171 HB3 GLU 19 3HB GLU 19 17.299 2.935 -8.281 172 HG2 GLU 19 2HG GLU 19 17.649 3.507 -5.458 173 HG3 GLU 19 3HG GLU 19 19.155 3.058 -6.256 174 H LEU 20 H LEU 20 14.482 3.578 -8.204 175 HA LEU 20 HA LEU 20 14.471 5.963 -6.738 176 HB2 LEU 20 2HB LEU 20 13.219 4.923 -9.082 177 HB3 LEU 20 3HB LEU 20 12.003 5.738 -8.101 178 HG LEU 20 HG LEU 20 13.974 7.594 -8.095 179 HD11 LEU 20 1HD1 LEU 20 14.090 6.267 -10.800 180 HD12 LEU 20 2HD1 LEU 20 15.380 6.268 -9.598 181 HD13 LEU 20 3HD1 LEU 20 14.871 7.782 -10.345 182 HD21 LEU 20 3HD2 LEU 20 12.646 8.519 -10.141 183 HD22 LEU 20 1HD2 LEU 20 11.845 8.328 -8.581 184 HD23 LEU 20 2HD2 LEU 20 11.603 7.127 -9.849 185 H ILE 21 H ILE 21 12.411 3.121 -6.569 186 HA ILE 21 HA ILE 21 10.648 4.359 -4.623 187 HB ILE 21 HB ILE 21 9.717 2.813 -6.297 188 HG12 ILE 21 2HG1 ILE 21 8.421 1.394 -4.704 189 HG13 ILE 21 3HG1 ILE 21 9.536 1.870 -3.427 190 HG21 ILE 21 1HG2 ILE 21 11.331 0.708 -4.863 191 HG22 ILE 21 2HG2 ILE 21 10.151 0.415 -6.140 192 HG23 ILE 21 3HG2 ILE 21 11.630 1.309 -6.494 193 HD11 ILE 21 3HD1 ILE 21 8.568 4.222 -4.683 194 HD12 ILE 21 1HD1 ILE 21 7.195 3.182 -4.305 195 HD13 ILE 21 2HD1 ILE 21 8.314 3.664 -3.029 196 H GLU 22 H GLU 22 13.304 2.079 -4.722 197 HA GLU 22 HA GLU 22 13.062 0.915 -2.206 198 HB2 GLU 22 2HB GLU 22 14.829 0.676 -4.239 199 HB3 GLU 22 3HB GLU 22 15.805 1.579 -3.089 200 HG2 GLU 22 2HG GLU 22 16.223 -0.266 -1.953 201 HG3 GLU 22 3HG GLU 22 14.498 -0.532 -1.703 202 H LYS 23 H LYS 23 14.085 4.099 -3.119 203 HA LYS 23 HA LYS 23 15.493 4.787 -0.765 204 HB2 LYS 23 2HB LYS 23 14.561 6.119 -3.162 205 HB3 LYS 23 3HB LYS 23 14.323 7.135 -1.746 206 HG2 LYS 23 2HG LYS 23 16.727 6.735 -1.168 207 HG3 LYS 23 3HG LYS 23 16.901 5.946 -2.737 208 HD2 LYS 23 2HD LYS 23 15.782 8.721 -2.501 209 HD3 LYS 23 3HD LYS 23 17.523 8.436 -2.545 210 HE2 LYS 23 2HE LYS 23 15.806 7.166 -4.622 211 HE3 LYS 23 3HE LYS 23 16.153 8.890 -4.749 212 HZ1 LYS 23 3HZ LYS 23 18.084 6.645 -4.749 213 HZ2 LYS 23 1HZ LYS 23 18.559 8.252 -4.521 214 HZ3 LYS 23 2HZ LYS 23 17.815 7.787 -5.967 215 H GLU 24 H GLU 24 12.097 5.099 -1.708 216 HA GLU 24 HA GLU 24 11.313 6.473 0.666 217 HB2 GLU 24 2HB GLU 24 10.142 5.985 -1.773 218 HB3 GLU 24 3HB GLU 24 9.222 4.939 -0.700 219 HG2 GLU 24 2HG GLU 24 9.574 7.546 0.468 220 HG3 GLU 24 3HG GLU 24 8.854 7.663 -1.137 221 H MET 25 H MET 25 11.517 3.115 -0.301 222 HA MET 25 HA MET 25 9.935 1.930 1.657 223 HB2 MET 25 2HB MET 25 12.449 0.937 0.311 224 HB3 MET 25 3HB MET 25 11.444 -0.065 1.349 225 HG2 MET 25 2HG MET 25 10.512 1.287 -1.172 226 HG3 MET 25 3HG MET 25 11.002 -0.401 -1.045 227 HE1 MET 25 3HE MET 25 9.762 -2.136 0.610 228 HE2 MET 25 1HE MET 25 9.795 -0.986 1.947 229 HE3 MET 25 2HE MET 25 8.277 -1.754 1.482 230 H GLN 26 H GLN 26 10.382 1.059 3.697 231 HA GLN 26 HA GLN 26 12.088 2.621 5.334 232 HB2 GLN 26 2HB GLN 26 10.116 0.513 5.694 233 HB3 GLN 26 3HB GLN 26 11.475 0.336 6.795 234 HG2 GLN 26 2HG GLN 26 10.302 1.725 8.093 235 HG3 GLN 26 3HG GLN 26 10.971 2.977 7.047 236 HE21 GLN 26 1HE2 GLN 26 9.611 3.154 4.915 237 HE22 GLN 26 2HE2 GLN 26 7.910 3.316 5.171 238 HA PRO 27 HA PRO 27 15.908 0.468 5.301 239 HB2 PRO 27 2HB PRO 27 16.650 0.540 7.911 240 HB3 PRO 27 3HB PRO 27 16.662 1.968 6.869 241 HG2 PRO 27 2HG PRO 27 14.614 1.103 8.873 242 HG3 PRO 27 3HG PRO 27 15.272 2.722 8.574 243 HD2 PRO 27 2HD PRO 27 12.863 1.930 7.623 244 HD3 PRO 27 3HD PRO 27 13.901 3.080 6.756 245 H ASN 28 H ASN 28 13.220 -0.824 6.868 246 HA ASN 28 HA ASN 28 14.457 -3.465 6.908 247 HB2 ASN 28 2HB ASN 28 14.302 -2.129 9.260 248 HB3 ASN 28 3HB ASN 28 12.726 -2.916 9.245 249 HD21 ASN 28 1HD2 ASN 28 14.561 -3.529 11.162 250 HD22 ASN 28 2HD2 ASN 28 15.151 -5.134 10.919 251 H GLU 29 H GLU 29 12.576 -2.235 5.137 252 HA GLU 29 HA GLU 29 10.120 -3.739 5.750 253 HB2 GLU 29 2HB GLU 29 10.597 -1.102 4.622 254 HB3 GLU 29 3HB GLU 29 9.568 -2.080 3.585 255 HG2 GLU 29 2HG GLU 29 8.290 -2.573 5.806 256 HG3 GLU 29 3HG GLU 29 9.079 -1.094 6.352 257 H VAL 30 H VAL 30 8.995 -4.677 3.854 258 HA VAL 30 HA VAL 30 10.953 -5.958 2.090 259 HB VAL 30 HB VAL 30 9.257 -7.277 3.504 260 HG11 VAL 30 1HG1 VAL 30 7.049 -7.472 2.783 261 HG12 VAL 30 2HG1 VAL 30 7.366 -5.739 2.675 262 HG13 VAL 30 3HG1 VAL 30 7.394 -6.734 1.219 263 HG21 VAL 30 3HG2 VAL 30 8.743 -8.638 1.193 264 HG22 VAL 30 1HG2 VAL 30 10.140 -7.661 0.741 265 HG23 VAL 30 2HG2 VAL 30 10.236 -8.751 2.125 266 H ALA 31 H ALA 31 10.773 -5.954 -0.132 267 HA ALA 31 HA ALA 31 8.680 -4.247 -1.300 268 HB1 ALA 31 1HB ALA 31 10.193 -3.042 -2.614 269 HB2 ALA 31 2HB ALA 31 10.951 -3.104 -1.022 270 HB3 ALA 31 3HB ALA 31 11.506 -4.179 -2.306 271 H ILE 32 H ILE 32 7.521 -5.471 -2.625 272 HA ILE 32 HA ILE 32 8.749 -7.774 -3.933 273 HB ILE 32 HB ILE 32 5.857 -6.911 -3.814 274 HG12 ILE 32 2HG1 ILE 32 6.437 -9.432 -2.566 275 HG13 ILE 32 3HG1 ILE 32 7.504 -8.198 -1.905 276 HG21 ILE 32 1HG2 ILE 32 5.763 -9.505 -4.502 277 HG22 ILE 32 2HG2 ILE 32 5.754 -8.188 -5.673 278 HG23 ILE 32 3HG2 ILE 32 7.258 -9.032 -5.310 279 HD11 ILE 32 3HD1 ILE 32 4.852 -7.160 -2.068 280 HD12 ILE 32 1HD1 ILE 32 4.828 -8.716 -1.239 281 HD13 ILE 32 2HD1 ILE 32 5.865 -7.418 -0.648 282 H PHE 33 H PHE 33 9.663 -7.450 -5.846 283 HA PHE 33 HA PHE 33 8.487 -5.452 -7.657 284 HB2 PHE 33 2HB PHE 33 11.258 -6.646 -7.811 285 HB3 PHE 33 3HB PHE 33 10.642 -5.262 -8.708 286 HD1 PHE 33 HD2 PHE 33 9.252 -3.814 -6.511 287 HD2 PHE 33 HD1 PHE 33 13.049 -5.734 -6.632 288 HE1 PHE 33 HE2 PHE 33 10.067 -2.307 -4.745 289 HE2 PHE 33 HE1 PHE 33 13.869 -4.231 -4.865 290 HZ PHE 33 HZ PHE 33 12.378 -2.514 -3.920 291 H MET 34 H MET 34 7.211 -6.307 -9.153 292 HA MET 34 HA MET 34 7.501 -9.070 -9.964 293 HB2 MET 34 2HB MET 34 5.319 -7.563 -9.630 294 HB3 MET 34 3HB MET 34 5.589 -7.254 -11.340 295 HG2 MET 34 2HG MET 34 5.397 -9.561 -11.871 296 HG3 MET 34 3HG MET 34 5.413 -10.015 -10.169 297 HE1 MET 34 3HE MET 34 2.658 -9.810 -8.635 298 HE2 MET 34 1HE MET 34 3.940 -8.599 -8.611 299 HE3 MET 34 2HE MET 34 2.278 -8.116 -8.949 300 H PHE 35 H PHE 35 8.511 -9.777 -11.730 301 HA PHE 35 HA PHE 35 9.167 -7.833 -13.842 302 HB2 PHE 35 2HB PHE 35 11.346 -8.890 -14.125 303 HB3 PHE 35 3HB PHE 35 11.160 -8.323 -12.469 304 HD1 PHE 35 HD1 PHE 35 10.458 -10.030 -10.708 305 HD2 PHE 35 HD2 PHE 35 11.908 -11.101 -14.563 306 HE1 PHE 35 HE1 PHE 35 11.002 -12.280 -9.874 307 HE2 PHE 35 HE2 PHE 35 12.453 -13.353 -13.737 308 HZ PHE 35 HZ PHE 35 12.000 -13.945 -11.390 309 H GLU 36 H GLU 36 8.475 -8.406 -15.792 310 HA GLU 36 HA GLU 36 7.813 -11.239 -16.258 311 HB2 GLU 36 2HB GLU 36 6.082 -10.528 -17.763 312 HB3 GLU 36 3HB GLU 36 5.884 -9.658 -16.249 313 HG2 GLU 36 2HG GLU 36 5.662 -7.882 -17.593 314 HG3 GLU 36 3HG GLU 36 7.425 -7.913 -17.600 315 H VAL 37 H VAL 37 10.016 -8.902 -17.014 316 HA VAL 37 HA VAL 37 10.359 -9.534 -19.814 317 HB VAL 37 HB VAL 37 12.297 -8.027 -18.065 318 HG11 VAL 37 1HG1 VAL 37 13.416 -8.263 -20.024 319 HG12 VAL 37 2HG1 VAL 37 11.941 -8.470 -20.970 320 HG13 VAL 37 3HG1 VAL 37 12.444 -6.858 -20.459 321 HG21 VAL 37 3HG2 VAL 37 10.533 -6.654 -17.694 322 HG22 VAL 37 1HG2 VAL 37 10.956 -6.062 -19.301 323 HG23 VAL 37 2HG2 VAL 37 9.648 -7.229 -19.107 324 H GLY 38 H GLY 38 12.386 -10.375 -20.678 325 HA2 GLY 38 2HA GLY 38 13.143 -12.799 -19.422 326 HA3 GLY 38 3HA GLY 38 13.905 -12.091 -20.838 327 H ASP 39 H ASP 39 14.168 -9.633 -18.864 328 HA ASP 39 HA ASP 39 16.881 -10.296 -18.119 329 HB2 ASP 39 2HB ASP 39 15.235 -7.826 -18.253 330 HB3 ASP 39 3HB ASP 39 16.558 -7.838 -17.089 331 H PHE 40 H PHE 40 16.354 -11.966 -16.573 332 HA PHE 40 HA PHE 40 15.091 -11.091 -14.094 333 HB2 PHE 40 2HB PHE 40 16.002 -13.721 -13.772 334 HB3 PHE 40 3HB PHE 40 14.355 -13.205 -14.119 335 HD1 PHE 40 HD1 PHE 40 17.546 -14.204 -15.714 336 HD2 PHE 40 HD2 PHE 40 13.339 -13.728 -16.156 337 HE1 PHE 40 HE1 PHE 40 17.646 -15.365 -17.881 338 HE2 PHE 40 HE2 PHE 40 13.433 -14.889 -18.324 339 HZ PHE 40 HZ PHE 40 15.588 -15.710 -19.188 340 H SER 41 H SER 41 18.203 -11.522 -15.437 341 HA SER 41 HA SER 41 19.606 -11.998 -12.986 342 HB2 SER 41 2HB SER 41 21.476 -12.181 -14.283 343 HB3 SER 41 3HB SER 41 20.282 -12.348 -15.570 344 HG SER 41 HG SER 41 22.122 -10.426 -15.213 345 H ASN 42 H ASN 42 18.239 -9.259 -14.456 346 HA ASN 42 HA ASN 42 20.047 -7.337 -13.278 347 HB2 ASN 42 2HB ASN 42 17.878 -7.298 -15.214 348 HB3 ASN 42 3HB ASN 42 17.740 -5.978 -14.056 349 HD21 ASN 42 1HD2 ASN 42 18.295 -4.331 -15.380 350 HD22 ASN 42 2HD2 ASN 42 19.854 -4.156 -16.104 351 H ILE 43 H ILE 43 17.112 -8.946 -12.427 352 HA ILE 43 HA ILE 43 15.857 -7.262 -10.682 353 HB ILE 43 HB ILE 43 16.215 -10.215 -10.731 354 HG12 ILE 43 2HG1 ILE 43 14.490 -9.047 -12.079 355 HG13 ILE 43 3HG1 ILE 43 13.794 -10.182 -10.927 356 HG21 ILE 43 1HG2 ILE 43 15.292 -8.648 -8.352 357 HG22 ILE 43 2HG2 ILE 43 14.659 -10.260 -8.676 358 HG23 ILE 43 3HG2 ILE 43 16.388 -10.028 -8.420 359 HD11 ILE 43 3HD1 ILE 43 13.954 -7.676 -9.642 360 HD12 ILE 43 1HD1 ILE 43 13.270 -7.410 -11.245 361 HD13 ILE 43 2HD1 ILE 43 12.515 -8.563 -10.144 362 HA PRO 44 HA PRO 44 18.821 -8.581 -7.095 363 HB2 PRO 44 2HB PRO 44 21.076 -9.927 -7.784 364 HB3 PRO 44 3HB PRO 44 19.554 -10.738 -7.395 365 HG2 PRO 44 2HG PRO 44 20.732 -10.105 -10.073 366 HG3 PRO 44 3HG PRO 44 19.934 -11.591 -9.524 367 HD2 PRO 44 2HD PRO 44 18.669 -9.728 -11.027 368 HD3 PRO 44 3HD PRO 44 17.822 -10.715 -9.819 369 H LYS 45 H LYS 45 19.821 -7.380 -10.145 370 HA LYS 45 HA LYS 45 22.242 -6.124 -9.214 371 HB2 LYS 45 2HB LYS 45 21.399 -6.863 -11.669 372 HB3 LYS 45 3HB LYS 45 20.952 -5.163 -11.700 373 HG2 LYS 45 2HG LYS 45 23.557 -5.261 -10.667 374 HG3 LYS 45 3HG LYS 45 23.524 -6.369 -12.040 375 HD2 LYS 45 2HD LYS 45 22.368 -4.477 -13.311 376 HD3 LYS 45 3HD LYS 45 22.883 -3.433 -11.983 377 HE2 LYS 45 2HE LYS 45 24.998 -5.148 -13.066 378 HE3 LYS 45 3HE LYS 45 24.352 -3.981 -14.218 379 HZ1 LYS 45 3HZ LYS 45 26.072 -3.548 -11.994 380 HZ2 LYS 45 1HZ LYS 45 24.691 -2.576 -11.885 381 HZ3 LYS 45 2HZ LYS 45 25.673 -2.499 -13.259 382 H SER 46 H SER 46 18.883 -5.298 -9.481 383 HA SER 46 HA SER 46 19.182 -2.473 -9.354 384 HB2 SER 46 2HB SER 46 16.712 -3.610 -8.216 385 HB3 SER 46 3HB SER 46 16.920 -2.422 -9.502 386 HG SER 46 HG SER 46 16.108 -4.250 -10.444 387 H ALA 47 H ALA 47 18.229 -4.865 -6.887 388 HA ALA 47 HA ALA 47 18.115 -3.128 -4.714 389 HB1 ALA 47 1HB ALA 47 19.089 -5.924 -4.341 390 HB2 ALA 47 2HB ALA 47 17.936 -4.996 -3.381 391 HB3 ALA 47 3HB ALA 47 17.457 -5.643 -4.950 392 H GLU 48 H GLU 48 20.850 -4.504 -6.346 393 HA GLU 48 HA GLU 48 22.731 -4.045 -4.235 394 HB2 GLU 48 2HB GLU 48 22.977 -5.734 -6.110 395 HB3 GLU 48 3HB GLU 48 23.350 -4.381 -7.168 396 HG2 GLU 48 2HG GLU 48 25.005 -4.117 -4.909 397 HG3 GLU 48 3HG GLU 48 25.065 -5.811 -5.393 398 H PHE 49 H PHE 49 21.397 -2.171 -6.822 399 HA PHE 49 HA PHE 49 23.399 -0.240 -7.137 400 HB2 PHE 49 2HB PHE 49 20.870 -0.684 -8.188 401 HB3 PHE 49 3HB PHE 49 20.704 0.851 -7.342 402 HD1 PHE 49 HD2 PHE 49 22.248 2.734 -7.926 403 HD2 PHE 49 HD1 PHE 49 22.003 -0.831 -10.238 404 HE1 PHE 49 HE2 PHE 49 23.311 3.893 -9.818 405 HE2 PHE 49 HE1 PHE 49 23.066 0.322 -12.134 406 HZ PHE 49 HZ PHE 49 23.721 2.687 -11.926 407 H ILE 50 H ILE 50 21.126 -0.763 -4.597 408 HA ILE 50 HA ILE 50 21.223 1.891 -3.517 409 HB ILE 50 HB ILE 50 20.364 -0.672 -2.169 410 HG12 ILE 50 2HG1 ILE 50 19.095 -0.140 -4.245 411 HG13 ILE 50 3HG1 ILE 50 18.103 -0.075 -2.793 412 HG21 ILE 50 1HG2 ILE 50 18.935 1.315 -1.011 413 HG22 ILE 50 2HG2 ILE 50 20.439 0.663 -0.363 414 HG23 ILE 50 3HG2 ILE 50 20.461 2.140 -1.326 415 HD11 ILE 50 3HD1 ILE 50 19.267 2.287 -4.248 416 HD12 ILE 50 1HD1 ILE 50 17.586 1.758 -4.289 417 HD13 ILE 50 2HD1 ILE 50 18.285 2.360 -2.786 418 H GLN 51 H GLN 51 22.230 -1.150 -1.961 419 HA GLN 51 HA GLN 51 24.785 0.060 -1.239 420 HB2 GLN 51 2HB GLN 51 22.707 0.160 0.550 421 HB3 GLN 51 3HB GLN 51 23.524 -1.325 1.020 422 HG2 GLN 51 2HG GLN 51 24.996 1.262 0.655 423 HG3 GLN 51 3HG GLN 51 24.236 0.813 2.181 424 HE21 GLN 51 1HE2 GLN 51 25.234 -0.601 3.499 425 HE22 GLN 51 2HE2 GLN 51 26.750 -1.355 3.156 426 H SER 52 H SER 52 26.407 -1.363 -1.336 427 HA SER 52 HA SER 52 26.136 -3.896 -2.400 428 HB2 SER 52 2HB SER 52 28.467 -4.297 -1.585 429 HB3 SER 52 3HB SER 52 28.272 -2.759 -2.426 430 HG SER 52 HG SER 52 28.632 -3.259 0.317 431 H LYS 53 H LYS 53 26.003 -2.874 0.940 432 HA LYS 53 HA LYS 53 25.412 -5.656 1.713 433 HB2 LYS 53 2HB LYS 53 27.251 -3.685 2.899 434 HB3 LYS 53 3HB LYS 53 26.207 -4.502 4.056 435 HG2 LYS 53 2HG LYS 53 27.428 -6.348 3.958 436 HG3 LYS 53 3HG LYS 53 27.338 -6.387 2.196 437 HD2 LYS 53 2HD LYS 53 29.387 -5.503 1.960 438 HD3 LYS 53 3HD LYS 53 29.122 -4.318 3.241 439 HE2 LYS 53 2HE LYS 53 30.752 -5.589 4.215 440 HE3 LYS 53 3HE LYS 53 29.321 -6.450 4.780 441 HZ1 LYS 53 3HZ LYS 53 30.969 -7.196 2.424 442 HZ2 LYS 53 1HZ LYS 53 29.594 -8.021 2.964 443 HZ3 LYS 53 2HZ LYS 53 30.984 -7.974 3.926 444 H GLY 54 H GLY 54 23.306 -5.827 2.110 445 HA2 GLY 54 2HA GLY 54 21.867 -4.858 4.130 446 HA3 GLY 54 3HA GLY 54 21.790 -3.508 3.009 447 H HIS 55 H HIS 55 21.531 -4.745 0.590 448 HA HIS 55 HA HIS 55 18.782 -5.517 0.643 449 HB2 HIS 55 2HB HIS 55 18.946 -5.628 -1.763 450 HB3 HIS 55 3HB HIS 55 19.827 -4.207 -1.207 451 HD1 HIS 55 HD1 HIS 55 22.535 -4.642 -0.986 452 HD2 HIS 55 HD2 HIS 55 20.372 -7.204 -3.439 453 HE1 HIS 55 HE1 HIS 55 24.234 -5.726 -2.491 454 H GLU 56 H GLU 56 18.034 -7.475 1.077 455 HA GLU 56 HA GLU 56 19.578 -9.811 0.188 456 HB2 GLU 56 2HB GLU 56 19.399 -9.065 2.832 457 HB3 GLU 56 3HB GLU 56 18.096 -10.234 2.678 458 HG2 GLU 56 2HG GLU 56 20.644 -11.049 1.472 459 HG3 GLU 56 3HG GLU 56 20.665 -10.861 3.225 460 H LEU 57 H LEU 57 18.391 -11.018 -1.121 461 HA LEU 57 HA LEU 57 15.538 -10.659 -1.293 462 HB2 LEU 57 2HB LEU 57 17.461 -12.449 -2.764 463 HB3 LEU 57 3HB LEU 57 15.730 -12.400 -3.091 464 HG LEU 57 HG LEU 57 16.737 -11.082 -4.758 465 HD11 LEU 57 1HD1 LEU 57 14.846 -10.062 -3.161 466 HD12 LEU 57 2HD1 LEU 57 15.488 -9.210 -4.565 467 HD13 LEU 57 3HD1 LEU 57 16.096 -8.835 -2.952 468 HD21 LEU 57 3HD2 LEU 57 18.577 -9.780 -4.535 469 HD22 LEU 57 1HD2 LEU 57 18.847 -10.819 -3.135 470 HD23 LEU 57 2HD2 LEU 57 18.124 -9.224 -2.923 471 H LEU 58 H LEU 58 14.420 -11.523 0.364 472 HA LEU 58 HA LEU 58 15.024 -13.701 1.922 473 HB2 LEU 58 2HB LEU 58 12.706 -12.092 1.382 474 HB3 LEU 58 3HB LEU 58 12.238 -13.778 1.594 475 HG LEU 58 HG LEU 58 14.032 -12.544 3.625 476 HD11 LEU 58 1HD1 LEU 58 11.899 -11.086 2.962 477 HD12 LEU 58 2HD1 LEU 58 12.468 -11.247 4.623 478 HD13 LEU 58 3HD1 LEU 58 11.122 -12.233 4.054 479 HD21 LEU 58 3HD2 LEU 58 12.413 -14.903 3.311 480 HD22 LEU 58 1HD2 LEU 58 11.949 -14.018 4.765 481 HD23 LEU 58 2HD2 LEU 58 13.623 -14.527 4.539 482 H ASN 59 H ASN 59 13.338 -13.655 -1.184 483 HA ASN 59 HA ASN 59 13.776 -16.554 -1.375 484 HB2 ASN 59 2HB ASN 59 11.310 -15.635 -0.886 485 HB3 ASN 59 3HB ASN 59 11.320 -15.447 -2.637 486 HD21 ASN 59 1HD2 ASN 59 12.628 -17.884 -0.413 487 HD22 ASN 59 2HD2 ASN 59 11.867 -19.234 -1.177 488 H SER 60 H SER 60 15.194 -16.801 -2.969 489 HA SER 60 HA SER 60 15.923 -15.017 -4.912 490 HB2 SER 60 2HB SER 60 17.400 -16.727 -5.019 491 HB3 SER 60 3HB SER 60 16.194 -17.920 -4.536 492 HG SER 60 HG SER 60 16.374 -18.481 -6.567 493 H LEU 61 H LEU 61 14.967 -14.162 -6.629 494 HA LEU 61 HA LEU 61 12.365 -14.500 -7.378 495 HB2 LEU 61 2HB LEU 61 12.898 -13.407 -9.451 496 HB3 LEU 61 3HB LEU 61 13.833 -12.681 -8.145 497 HG LEU 61 HG LEU 61 15.004 -14.758 -9.976 498 HD11 LEU 61 1HD1 LEU 61 15.939 -12.187 -10.668 499 HD12 LEU 61 2HD1 LEU 61 14.177 -12.125 -10.688 500 HD13 LEU 61 3HD1 LEU 61 15.028 -13.324 -11.663 501 HD21 LEU 61 3HD2 LEU 61 16.439 -14.531 -8.198 502 HD22 LEU 61 1HD2 LEU 61 16.016 -12.840 -7.930 503 HD23 LEU 61 2HD2 LEU 61 17.058 -13.285 -9.282 504 H ARG 62 H ARG 62 11.202 -15.964 -8.456 505 HA ARG 62 HA ARG 62 12.544 -18.342 -9.448 506 HB2 ARG 62 2HB ARG 62 10.323 -18.142 -8.016 507 HB3 ARG 62 3HB ARG 62 9.586 -17.993 -9.606 508 HG2 ARG 62 2HG ARG 62 9.453 -20.259 -9.178 509 HG3 ARG 62 3HG ARG 62 10.906 -20.134 -10.171 510 HD2 ARG 62 2HD ARG 62 12.325 -20.387 -8.310 511 HD3 ARG 62 3HD ARG 62 11.015 -20.082 -7.170 512 HE ARG 62 HE ARG 62 10.464 -22.295 -7.280 513 HH11 ARG 62 1HH1 ARG 62 12.457 -21.493 -10.020 514 HH12 ARG 62 2HH1 ARG 62 12.602 -23.133 -10.560 515 HH21 ARG 62 1HH2 ARG 62 10.648 -24.458 -7.980 516 HH22 ARG 62 2HH2 ARG 62 11.572 -24.819 -9.399 517 H PHE 63 H PHE 63 13.425 -16.691 -11.154 518 HA PHE 63 HA PHE 63 11.754 -15.872 -13.273 519 HB2 PHE 63 2HB PHE 63 13.739 -15.299 -14.434 520 HB3 PHE 63 3HB PHE 63 14.097 -15.035 -12.731 521 HD1 PHE 63 HD2 PHE 63 15.164 -17.111 -11.504 522 HD2 PHE 63 HD1 PHE 63 15.258 -16.453 -15.708 523 HE1 PHE 63 HE2 PHE 63 17.125 -18.585 -11.688 524 HE2 PHE 63 HE1 PHE 63 17.219 -17.927 -15.899 525 HZ PHE 63 HZ PHE 63 18.156 -18.995 -13.887 526 H ASN 64 H ASN 64 13.104 -16.793 -15.562 527 HA ASN 64 HA ASN 64 13.120 -18.479 -17.092 528 HB2 ASN 64 2HB ASN 64 13.685 -19.813 -14.570 529 HB3 ASN 64 3HB ASN 64 12.821 -20.866 -15.686 530 HD21 ASN 64 1HD2 ASN 64 14.799 -22.106 -15.667 531 HD22 ASN 64 2HD2 ASN 64 16.097 -21.648 -16.711 532 H GLN 65 H GLN 65 10.606 -17.599 -15.301 533 HA GLN 65 HA GLN 65 8.743 -19.207 -16.880 534 HB2 GLN 65 2HB GLN 65 9.146 -19.530 -14.072 535 HB3 GLN 65 3HB GLN 65 7.554 -18.825 -14.324 536 HG2 GLN 65 2HG GLN 65 7.875 -20.903 -16.215 537 HG3 GLN 65 3HG GLN 65 8.384 -21.520 -14.644 538 HE21 GLN 65 1HE2 GLN 65 6.797 -20.544 -12.849 539 HE22 GLN 65 2HE2 GLN 65 5.132 -20.871 -13.171 540 H ALA 66 H ALA 66 6.374 -18.266 -15.915 541 HA ALA 66 HA ALA 66 6.069 -15.818 -17.191 542 HB1 ALA 66 1HB ALA 66 4.286 -16.822 -14.982 543 HB2 ALA 66 2HB ALA 66 3.852 -15.773 -16.333 544 HB3 ALA 66 3HB ALA 66 4.260 -17.464 -16.625 545 H ASP 67 H ASP 67 5.246 -13.778 -16.163 546 HA ASP 67 HA ASP 67 7.132 -12.479 -14.708 547 HB2 ASP 67 2HB ASP 67 5.501 -10.787 -14.211 548 HB3 ASP 67 3HB ASP 67 5.124 -11.445 -15.801 549 H TRP 68 H TRP 68 8.000 -12.867 -12.792 550 HA TRP 68 HA TRP 68 6.320 -14.066 -10.694 551 HB2 TRP 68 2HB TRP 68 8.671 -15.014 -11.665 552 HB3 TRP 68 3HB TRP 68 9.251 -14.031 -10.324 553 HD1 TRP 68 HD1 TRP 68 9.298 -15.206 -8.050 554 HE1 TRP 68 HE1 TRP 68 8.222 -17.317 -7.046 555 HE3 TRP 68 HE3 TRP 68 6.282 -16.520 -11.963 556 HZ2 TRP 68 HZ2 TRP 68 6.344 -19.280 -7.811 557 HZ3 TRP 68 HZ3 TRP 68 4.877 -18.529 -11.747 558 HH2 TRP 68 HH2 TRP 68 4.909 -19.879 -9.713 559 H THR 69 H THR 69 7.552 -13.533 -8.430 560 HA THR 69 HA THR 69 7.899 -10.610 -8.330 561 HB THR 69 HB THR 69 6.807 -11.011 -5.921 562 HG1 THR 69 HG1 THR 69 5.020 -12.487 -6.236 563 HG21 THR 69 3HG2 THR 69 5.021 -10.766 -8.330 564 HG22 THR 69 1HG2 THR 69 6.109 -9.471 -7.832 565 HG23 THR 69 2HG2 THR 69 4.832 -10.018 -6.745 566 H ILE 70 H ILE 70 9.478 -9.855 -7.000 567 HA ILE 70 HA ILE 70 10.963 -11.852 -5.421 568 HB ILE 70 HB ILE 70 12.299 -11.269 -7.340 569 HG12 ILE 70 2HG1 ILE 70 14.299 -10.440 -6.233 570 HG13 ILE 70 3HG1 ILE 70 13.332 -9.762 -4.928 571 HG21 ILE 70 1HG2 ILE 70 11.123 -8.714 -6.995 572 HG22 ILE 70 2HG2 ILE 70 12.872 -8.522 -6.895 573 HG23 ILE 70 3HG2 ILE 70 12.149 -9.281 -8.313 574 HD11 ILE 70 3HD1 ILE 70 13.263 -11.699 -3.845 575 HD12 ILE 70 1HD1 ILE 70 12.872 -12.603 -5.307 576 HD13 ILE 70 2HD1 ILE 70 14.551 -12.216 -4.932 577 H VAL 71 H VAL 71 11.020 -11.432 -3.321 578 HA VAL 71 HA VAL 71 10.242 -8.794 -2.359 579 HB VAL 71 HB VAL 71 10.317 -9.923 -0.096 580 HG11 VAL 71 1HG1 VAL 71 8.312 -11.520 -0.869 581 HG12 VAL 71 2HG1 VAL 71 8.158 -9.765 -0.766 582 HG13 VAL 71 3HG1 VAL 71 8.470 -10.534 -2.322 583 HG21 VAL 71 3HG2 VAL 71 11.871 -11.736 -0.813 584 HG22 VAL 71 1HG2 VAL 71 10.426 -12.315 0.016 585 HG23 VAL 71 2HG2 VAL 71 10.547 -12.441 -1.739 586 H VAL 72 H VAL 72 11.602 -7.349 -1.505 587 HA VAL 72 HA VAL 72 14.355 -8.221 -0.903 588 HB VAL 72 HB VAL 72 13.642 -5.460 -1.874 589 HG11 VAL 72 1HG1 VAL 72 15.873 -5.042 -1.919 590 HG12 VAL 72 2HG1 VAL 72 15.871 -6.266 -0.647 591 HG13 VAL 72 3HG1 VAL 72 16.291 -6.712 -2.302 592 HG21 VAL 72 3HG2 VAL 72 13.788 -7.933 -3.390 593 HG22 VAL 72 1HG2 VAL 72 13.225 -6.336 -3.883 594 HG23 VAL 72 2HG2 VAL 72 14.943 -6.728 -3.959 595 H ARG 73 H ARG 73 14.998 -7.877 1.116 596 HA ARG 73 HA ARG 73 13.393 -6.102 2.814 597 HB2 ARG 73 2HB ARG 73 14.574 -7.304 4.694 598 HB3 ARG 73 3HB ARG 73 13.506 -8.300 3.714 599 HG2 ARG 73 2HG ARG 73 15.164 -9.648 3.106 600 HG3 ARG 73 3HG ARG 73 16.222 -8.293 2.703 601 HD2 ARG 73 2HD ARG 73 17.340 -9.379 4.439 602 HD3 ARG 73 3HD ARG 73 16.525 -8.034 5.236 603 HE ARG 73 HE ARG 73 14.828 -10.242 5.347 604 HH11 ARG 73 1HH1 ARG 73 17.930 -9.252 6.580 605 HH12 ARG 73 2HH1 ARG 73 17.812 -10.213 8.017 606 HH21 ARG 73 1HH2 ARG 73 14.661 -11.512 7.234 607 HH22 ARG 73 2HH2 ARG 73 15.953 -11.500 8.387 608 H LYS 74 H LYS 74 14.171 -4.122 3.069 609 HA LYS 74 HA LYS 74 16.825 -3.365 2.460 610 HB2 LYS 74 2HB LYS 74 14.432 -2.040 3.616 611 HB3 LYS 74 3HB LYS 74 15.987 -1.280 3.929 612 HG2 LYS 74 2HG LYS 74 16.291 -1.580 1.337 613 HG3 LYS 74 3HG LYS 74 14.526 -1.632 1.363 614 HD2 LYS 74 2HD LYS 74 14.462 0.584 1.515 615 HD3 LYS 74 3HD LYS 74 15.369 0.511 3.027 616 HE2 LYS 74 2HE LYS 74 17.371 0.147 1.271 617 HE3 LYS 74 3HE LYS 74 16.283 1.121 0.283 618 HZ1 LYS 74 3HZ LYS 74 17.828 1.867 2.617 619 HZ2 LYS 74 1HZ LYS 74 16.251 2.478 2.580 620 HZ3 LYS 74 2HZ LYS 74 17.317 2.810 1.309 621 H LYS 75 H LYS 75 18.410 -2.451 3.913 622 HA LYS 75 HA LYS 75 18.312 -2.657 6.703 623 HB2 LYS 75 2HB LYS 75 18.658 -5.159 5.453 624 HB3 LYS 75 3HB LYS 75 20.237 -4.711 6.085 625 HG2 LYS 75 2HG LYS 75 18.223 -4.171 8.048 626 HG3 LYS 75 3HG LYS 75 18.080 -5.835 7.476 627 HD2 LYS 75 2HD LYS 75 20.375 -6.281 8.019 628 HD3 LYS 75 3HD LYS 75 20.664 -4.581 8.398 629 HE2 LYS 75 2HE LYS 75 18.470 -5.849 9.893 630 HE3 LYS 75 3HE LYS 75 20.077 -6.489 10.234 631 HZ1 LYS 75 3HZ LYS 75 19.590 -3.580 10.231 632 HZ2 LYS 75 1HZ LYS 75 20.813 -4.453 11.009 633 HZ3 LYS 75 2HZ LYS 75 19.229 -4.510 11.598 634 H ALA 76 H ALA 76 20.727 -2.810 7.589 635 HA ALA 76 HA ALA 76 22.073 -0.556 6.730 636 HB1 ALA 76 1HB ALA 76 22.451 -1.598 8.904 637 HB2 ALA 76 2HB ALA 76 23.253 -2.959 8.119 638 HB3 ALA 76 3HB ALA 76 23.971 -1.350 8.045 Start of MODEL 11 1 H1 MET 1 H MET 1 1.018 0.501 0.558 2 HA MET 1 HA MET 1 2.134 -0.246 -1.916 3 HB2 MET 1 2HB MET 1 1.211 2.009 -1.368 4 HB3 MET 1 3HB MET 1 2.635 2.308 -0.380 5 HG2 MET 1 2HG MET 1 3.371 3.285 -2.265 6 HG3 MET 1 3HG MET 1 3.837 1.633 -2.665 7 HE1 MET 1 3HE MET 1 2.036 4.447 -5.068 8 HE2 MET 1 1HE MET 1 3.571 4.071 -4.283 9 HE3 MET 1 2HE MET 1 3.134 3.272 -5.793 10 H LYS 2 H LYS 2 3.670 -1.871 -1.493 11 HA LYS 2 HA LYS 2 6.294 -0.821 -0.794 12 HB2 LYS 2 2HB LYS 2 6.695 -2.908 0.632 13 HB3 LYS 2 3HB LYS 2 5.726 -1.623 1.342 14 HG2 LYS 2 2HG LYS 2 3.686 -2.862 0.735 15 HG3 LYS 2 3HG LYS 2 4.694 -4.169 0.108 16 HD2 LYS 2 2HD LYS 2 5.761 -4.205 2.439 17 HD3 LYS 2 3HD LYS 2 4.375 -3.236 2.946 18 HE2 LYS 2 2HE LYS 2 2.904 -4.959 2.687 19 HE3 LYS 2 3HE LYS 2 3.834 -5.702 1.387 20 HZ1 LYS 2 3HZ LYS 2 4.201 -5.938 4.297 21 HZ2 LYS 2 1HZ LYS 2 5.525 -6.165 3.267 22 HZ3 LYS 2 2HZ LYS 2 4.160 -7.154 3.121 23 H ARG 3 H ARG 3 4.952 -1.756 -3.226 24 HA ARG 3 HA ARG 3 6.951 -3.741 -4.011 25 HB2 ARG 3 2HB ARG 3 5.245 -5.032 -5.260 26 HB3 ARG 3 3HB ARG 3 4.993 -5.075 -3.520 27 HG2 ARG 3 2HG ARG 3 3.561 -2.928 -4.910 28 HG3 ARG 3 3HG ARG 3 3.065 -4.563 -5.350 29 HD2 ARG 3 2HD ARG 3 2.490 -5.095 -3.128 30 HD3 ARG 3 3HD ARG 3 3.343 -3.691 -2.489 31 HE ARG 3 HE ARG 3 1.240 -2.917 -4.237 32 HH11 ARG 3 1HH1 ARG 3 1.892 -4.067 -1.017 33 HH12 ARG 3 2HH1 ARG 3 0.472 -3.348 -0.332 34 HH21 ARG 3 1HH2 ARG 3 -0.633 -1.967 -3.348 35 HH22 ARG 3 2HH2 ARG 3 -0.964 -2.155 -1.659 36 H PHE 4 H PHE 4 7.093 -3.962 -6.403 37 HA PHE 4 HA PHE 4 6.159 -1.580 -7.839 38 HB2 PHE 4 2HB PHE 4 8.795 -1.914 -6.979 39 HB3 PHE 4 3HB PHE 4 8.825 -2.355 -8.683 40 HD1 PHE 4 HD2 PHE 4 6.968 0.237 -6.745 41 HD2 PHE 4 HD1 PHE 4 9.650 -0.623 -9.936 42 HE1 PHE 4 HE2 PHE 4 7.000 2.620 -7.356 43 HE2 PHE 4 HE1 PHE 4 9.687 1.759 -10.552 44 HZ PHE 4 HZ PHE 4 8.360 3.384 -9.262 45 H ASP 5 H ASP 5 5.068 -2.211 -9.567 46 HA ASP 5 HA ASP 5 5.516 -4.866 -10.679 47 HB2 ASP 5 2HB ASP 5 3.261 -3.130 -10.407 48 HB3 ASP 5 3HB ASP 5 3.501 -3.470 -12.119 49 H LEU 6 H LEU 6 7.310 -4.825 -11.940 50 HA LEU 6 HA LEU 6 7.649 -2.681 -13.890 51 HB2 LEU 6 2HB LEU 6 9.399 -4.936 -12.957 52 HB3 LEU 6 3HB LEU 6 9.801 -3.971 -14.376 53 HG LEU 6 HG LEU 6 11.055 -3.141 -12.520 54 HD11 LEU 6 1HD1 LEU 6 8.917 -1.095 -12.585 55 HD12 LEU 6 2HD1 LEU 6 9.624 -1.575 -14.127 56 HD13 LEU 6 3HD1 LEU 6 10.653 -0.934 -12.847 57 HD21 LEU 6 3HD2 LEU 6 10.139 -2.498 -10.437 58 HD22 LEU 6 1HD2 LEU 6 9.471 -4.091 -10.796 59 HD23 LEU 6 2HD2 LEU 6 8.485 -2.647 -11.034 60 H ARG 7 H ARG 7 5.806 -5.273 -13.851 61 HA ARG 7 HA ARG 7 6.414 -6.917 -15.969 62 HB2 ARG 7 2HB ARG 7 4.077 -6.268 -14.439 63 HB3 ARG 7 3HB ARG 7 3.635 -6.412 -16.135 64 HG2 ARG 7 2HG ARG 7 4.345 -8.638 -16.251 65 HG3 ARG 7 3HG ARG 7 5.266 -8.511 -14.750 66 HD2 ARG 7 2HD ARG 7 3.430 -9.598 -13.955 67 HD3 ARG 7 3HD ARG 7 2.872 -7.936 -13.770 68 HE ARG 7 HE ARG 7 2.201 -9.091 -16.311 69 HH11 ARG 7 1HH1 ARG 7 1.236 -8.755 -12.983 70 HH12 ARG 7 2HH1 ARG 7 -0.442 -9.039 -13.305 71 HH21 ARG 7 1HH2 ARG 7 -0.006 -9.466 -16.748 72 HH22 ARG 7 2HH2 ARG 7 -1.148 -9.444 -15.447 73 HA PRO 8 HA PRO 8 4.203 -3.919 -19.038 74 HB2 PRO 8 2HB PRO 8 3.507 -1.464 -18.111 75 HB3 PRO 8 3HB PRO 8 2.436 -2.867 -18.015 76 HG2 PRO 8 2HG PRO 8 4.195 -1.678 -15.904 77 HG3 PRO 8 3HG PRO 8 2.530 -2.274 -15.768 78 HD2 PRO 8 2HD PRO 8 4.669 -3.731 -14.970 79 HD3 PRO 8 3HD PRO 8 3.196 -4.476 -15.625 80 H LEU 9 H LEU 9 6.685 -3.125 -16.874 81 HA LEU 9 HA LEU 9 7.727 -0.891 -18.390 82 HB2 LEU 9 2HB LEU 9 8.165 -2.060 -15.803 83 HB3 LEU 9 3HB LEU 9 9.701 -1.858 -16.644 84 HG LEU 9 HG LEU 9 8.338 0.566 -16.978 85 HD11 LEU 9 1HD1 LEU 9 8.252 0.954 -14.325 86 HD12 LEU 9 2HD1 LEU 9 7.711 -0.723 -14.400 87 HD13 LEU 9 3HD1 LEU 9 6.840 0.525 -15.292 88 HD21 LEU 9 3HD2 LEU 9 10.268 1.428 -16.168 89 HD22 LEU 9 1HD2 LEU 9 10.828 -0.228 -16.404 90 HD23 LEU 9 2HD2 LEU 9 10.324 0.312 -14.802 91 H LYS 10 H LYS 10 9.955 -0.920 -19.230 92 HA LYS 10 HA LYS 10 10.466 -3.442 -20.631 93 HB2 LYS 10 2HB LYS 10 11.647 -2.181 -22.259 94 HB3 LYS 10 3HB LYS 10 10.189 -1.268 -21.894 95 HG2 LYS 10 2HG LYS 10 11.499 0.182 -20.398 96 HG3 LYS 10 3HG LYS 10 12.956 -0.709 -20.844 97 HD2 LYS 10 2HD LYS 10 13.015 1.143 -22.251 98 HD3 LYS 10 3HD LYS 10 12.304 -0.110 -23.270 99 HE2 LYS 10 2HE LYS 10 10.330 1.380 -21.725 100 HE3 LYS 10 3HE LYS 10 11.262 2.397 -22.822 101 HZ1 LYS 10 3HZ LYS 10 9.296 1.547 -23.910 102 HZ2 LYS 10 1HZ LYS 10 9.751 -0.047 -23.573 103 HZ3 LYS 10 2HZ LYS 10 10.677 0.891 -24.633 104 H ALA 11 H ALA 11 12.733 -4.093 -20.958 105 HA ALA 11 HA ALA 11 14.115 -4.230 -18.474 106 HB1 ALA 11 1HB ALA 11 15.374 -4.980 -21.082 107 HB2 ALA 11 2HB ALA 11 15.541 -5.741 -19.499 108 HB3 ALA 11 3HB ALA 11 14.049 -5.937 -20.419 109 H GLY 12 H GLY 12 16.102 -3.354 -17.876 110 HA2 GLY 12 2HA GLY 12 18.067 -2.054 -18.310 111 HA3 GLY 12 3HA GLY 12 17.215 -1.273 -19.633 112 H ILE 13 H ILE 13 14.857 -0.537 -18.397 113 HA ILE 13 HA ILE 13 15.836 1.554 -16.590 114 HB ILE 13 HB ILE 13 13.143 1.437 -17.940 115 HG12 ILE 13 2HG1 ILE 13 15.671 2.818 -18.869 116 HG13 ILE 13 3HG1 ILE 13 14.919 1.423 -19.637 117 HG21 ILE 13 1HG2 ILE 13 12.697 3.270 -16.776 118 HG22 ILE 13 2HG2 ILE 13 14.256 3.125 -15.965 119 HG23 ILE 13 3HG2 ILE 13 14.119 4.065 -17.450 120 HD11 ILE 13 3HD1 ILE 13 12.869 2.901 -19.925 121 HD12 ILE 13 1HD1 ILE 13 13.930 4.247 -19.513 122 HD13 ILE 13 2HD1 ILE 13 14.274 3.254 -20.930 123 H PHE 14 H PHE 14 13.779 -1.224 -16.721 124 HA PHE 14 HA PHE 14 12.085 -0.706 -14.551 125 HB2 PHE 14 2HB PHE 14 11.508 -2.978 -14.624 126 HB3 PHE 14 3HB PHE 14 12.003 -2.624 -16.276 127 HD1 PHE 14 HD1 PHE 14 14.690 -2.923 -16.580 128 HD2 PHE 14 HD2 PHE 14 12.217 -4.983 -13.794 129 HE1 PHE 14 HE1 PHE 14 16.331 -4.754 -16.482 130 HE2 PHE 14 HE2 PHE 14 13.855 -6.816 -13.691 131 HZ PHE 14 HZ PHE 14 15.915 -6.703 -15.035 132 H GLU 15 H GLU 15 15.407 -1.740 -14.695 133 HA GLU 15 HA GLU 15 15.516 -2.533 -11.923 134 HB2 GLU 15 2HB GLU 15 16.978 -3.681 -13.434 135 HB3 GLU 15 3HB GLU 15 17.638 -2.168 -14.038 136 HG2 GLU 15 2HG GLU 15 17.985 -2.381 -11.186 137 HG3 GLU 15 3HG GLU 15 18.673 -3.774 -12.019 138 H ARG 16 H ARG 16 16.191 0.319 -13.818 139 HA ARG 16 HA ARG 16 17.679 1.686 -11.801 140 HB2 ARG 16 2HB ARG 16 16.621 2.289 -14.478 141 HB3 ARG 16 3HB ARG 16 16.688 3.673 -13.395 142 HG2 ARG 16 2HG ARG 16 18.938 3.751 -13.416 143 HG3 ARG 16 3HG ARG 16 19.106 1.995 -13.475 144 HD2 ARG 16 2HD ARG 16 19.265 1.981 -15.705 145 HD3 ARG 16 3HD ARG 16 17.922 3.107 -15.891 146 HE ARG 16 HE ARG 16 20.006 4.642 -15.006 147 HH11 ARG 16 1HH1 ARG 16 19.467 2.504 -17.700 148 HH12 ARG 16 2HH1 ARG 16 20.539 3.358 -18.760 149 HH21 ARG 16 1HH2 ARG 16 21.420 5.775 -16.392 150 HH22 ARG 16 2HH2 ARG 16 21.650 5.218 -18.015 151 H LEU 17 H LEU 17 14.301 1.756 -12.869 152 HA LEU 17 HA LEU 17 13.482 3.804 -11.088 153 HB2 LEU 17 2HB LEU 17 12.312 2.198 -13.112 154 HB3 LEU 17 3HB LEU 17 11.316 2.048 -11.666 155 HG LEU 17 HG LEU 17 10.444 3.794 -13.079 156 HD11 LEU 17 1HD1 LEU 17 10.755 4.016 -10.465 157 HD12 LEU 17 2HD1 LEU 17 10.071 5.323 -11.431 158 HD13 LEU 17 3HD1 LEU 17 11.765 5.380 -10.944 159 HD21 LEU 17 3HD2 LEU 17 11.924 4.815 -14.409 160 HD22 LEU 17 1HD2 LEU 17 13.269 4.500 -13.312 161 HD23 LEU 17 2HD2 LEU 17 12.211 5.884 -13.035 162 H GLU 18 H GLU 18 14.015 0.411 -10.722 163 HA GLU 18 HA GLU 18 12.350 -0.172 -8.558 164 HB2 GLU 18 2HB GLU 18 14.187 -1.569 -10.023 165 HB3 GLU 18 3HB GLU 18 15.007 -1.432 -8.474 166 HG2 GLU 18 2HG GLU 18 13.768 -3.054 -7.633 167 HG3 GLU 18 3HG GLU 18 12.292 -2.170 -8.019 168 H GLU 19 H GLU 19 15.378 1.547 -8.715 169 HA GLU 19 HA GLU 19 15.829 1.486 -5.870 170 HB2 GLU 19 2HB GLU 19 17.772 1.610 -7.248 171 HB3 GLU 19 3HB GLU 19 17.137 2.990 -8.133 172 HG2 GLU 19 2HG GLU 19 17.355 3.477 -5.274 173 HG3 GLU 19 3HG GLU 19 18.897 3.084 -6.032 174 H LEU 20 H LEU 20 14.238 3.562 -8.158 175 HA LEU 20 HA LEU 20 14.170 5.947 -6.689 176 HB2 LEU 20 2HB LEU 20 12.969 4.890 -9.053 177 HB3 LEU 20 3HB LEU 20 11.726 5.684 -8.088 178 HG LEU 20 HG LEU 20 13.700 7.557 -8.061 179 HD11 LEU 20 1HD1 LEU 20 14.867 5.963 -9.750 180 HD12 LEU 20 2HD1 LEU 20 14.834 7.698 -10.063 181 HD13 LEU 20 3HD1 LEU 20 13.708 6.630 -10.900 182 HD21 LEU 20 3HD2 LEU 20 12.229 8.198 -10.307 183 HD22 LEU 20 1HD2 LEU 20 11.804 8.576 -8.638 184 HD23 LEU 20 2HD2 LEU 20 11.161 7.124 -9.404 185 H ILE 21 H ILE 21 12.154 3.071 -6.557 186 HA ILE 21 HA ILE 21 10.361 4.280 -4.614 187 HB ILE 21 HB ILE 21 9.427 2.778 -6.317 188 HG12 ILE 21 2HG1 ILE 21 8.137 1.311 -4.770 189 HG13 ILE 21 3HG1 ILE 21 9.261 1.732 -3.482 190 HG21 ILE 21 1HG2 ILE 21 11.042 0.626 -4.955 191 HG22 ILE 21 2HG2 ILE 21 9.876 0.385 -6.255 192 HG23 ILE 21 3HG2 ILE 21 11.357 1.292 -6.557 193 HD11 ILE 21 3HD1 ILE 21 6.911 3.007 -4.035 194 HD12 ILE 21 1HD1 ILE 21 8.243 3.671 -3.090 195 HD13 ILE 21 2HD1 ILE 21 8.104 4.052 -4.806 196 H GLU 22 H GLU 22 12.989 1.960 -4.742 197 HA GLU 22 HA GLU 22 12.730 0.759 -2.252 198 HB2 GLU 22 2HB GLU 22 14.524 0.578 -4.281 199 HB3 GLU 22 3HB GLU 22 15.488 1.418 -3.074 200 HG2 GLU 22 2HG GLU 22 15.823 -0.455 -1.952 201 HG3 GLU 22 3HG GLU 22 14.091 -0.766 -1.856 202 H LYS 23 H LYS 23 13.753 3.961 -3.085 203 HA LYS 23 HA LYS 23 15.157 4.595 -0.713 204 HB2 LYS 23 2HB LYS 23 14.242 5.976 -3.083 205 HB3 LYS 23 3HB LYS 23 13.975 6.960 -1.650 206 HG2 LYS 23 2HG LYS 23 16.085 7.613 -2.209 207 HG3 LYS 23 3HG LYS 23 16.453 6.280 -1.112 208 HD2 LYS 23 2HD LYS 23 16.440 4.825 -3.249 209 HD3 LYS 23 3HD LYS 23 16.599 6.361 -4.105 210 HE2 LYS 23 2HE LYS 23 18.782 5.361 -3.721 211 HE3 LYS 23 3HE LYS 23 18.619 6.864 -2.814 212 HZ1 LYS 23 3HZ LYS 23 17.812 4.511 -1.356 213 HZ2 LYS 23 1HZ LYS 23 18.802 5.797 -0.875 214 HZ3 LYS 23 2HZ LYS 23 19.450 4.523 -1.778 215 H GLU 24 H GLU 24 11.763 4.935 -1.659 216 HA GLU 24 HA GLU 24 10.960 6.264 0.727 217 HB2 GLU 24 2HB GLU 24 9.794 5.790 -1.707 218 HB3 GLU 24 3HB GLU 24 8.906 4.689 -0.662 219 HG2 GLU 24 2HG GLU 24 9.219 7.347 0.481 220 HG3 GLU 24 3HG GLU 24 8.350 7.343 -1.053 221 H MET 25 H MET 25 11.399 2.941 -0.174 222 HA MET 25 HA MET 25 9.782 1.711 1.768 223 HB2 MET 25 2HB MET 25 12.259 0.807 0.311 224 HB3 MET 25 3HB MET 25 11.428 -0.227 1.465 225 HG2 MET 25 2HG MET 25 9.711 0.974 -0.589 226 HG3 MET 25 3HG MET 25 10.920 -0.161 -1.186 227 HE1 MET 25 3HE MET 25 9.354 -0.601 2.484 228 HE2 MET 25 1HE MET 25 8.274 0.429 1.544 229 HE3 MET 25 2HE MET 25 7.764 -1.195 2.005 230 H GLN 26 H GLN 26 10.286 0.823 3.795 231 HA GLN 26 HA GLN 26 11.942 2.433 5.431 232 HB2 GLN 26 2HB GLN 26 10.080 0.226 5.785 233 HB3 GLN 26 3HB GLN 26 11.458 0.106 6.871 234 HG2 GLN 26 2HG GLN 26 10.610 1.661 8.189 235 HG3 GLN 26 3HG GLN 26 10.507 2.798 6.846 236 HE21 GLN 26 1HE2 GLN 26 8.574 3.078 5.785 237 HE22 GLN 26 2HE2 GLN 26 7.079 2.444 6.375 238 HA PRO 27 HA PRO 27 15.858 0.462 5.333 239 HB2 PRO 27 2HB PRO 27 16.618 0.515 7.939 240 HB3 PRO 27 3HB PRO 27 16.554 1.963 6.928 241 HG2 PRO 27 2HG PRO 27 14.565 0.960 8.928 242 HG3 PRO 27 3HG PRO 27 15.144 2.614 8.658 243 HD2 PRO 27 2HD PRO 27 12.768 1.729 7.708 244 HD3 PRO 27 3HD PRO 27 13.742 2.946 6.859 245 H ASN 28 H ASN 28 13.250 -0.982 6.913 246 HA ASN 28 HA ASN 28 14.615 -3.563 6.889 247 HB2 ASN 28 2HB ASN 28 14.423 -2.301 9.262 248 HB3 ASN 28 3HB ASN 28 12.857 -3.106 9.235 249 HD21 ASN 28 1HD2 ASN 28 16.126 -3.420 9.906 250 HD22 ASN 28 2HD2 ASN 28 16.182 -5.135 10.112 251 H GLU 29 H GLU 29 12.649 -2.351 5.164 252 HA GLU 29 HA GLU 29 10.270 -3.981 5.742 253 HB2 GLU 29 2HB GLU 29 10.639 -1.322 4.665 254 HB3 GLU 29 3HB GLU 29 9.714 -2.323 3.554 255 HG2 GLU 29 2HG GLU 29 8.987 -2.244 6.447 256 HG3 GLU 29 3HG GLU 29 8.495 -0.936 5.372 257 H VAL 30 H VAL 30 9.147 -4.792 3.702 258 HA VAL 30 HA VAL 30 11.167 -6.125 2.046 259 HB VAL 30 HB VAL 30 9.400 -7.444 3.327 260 HG11 VAL 30 1HG1 VAL 30 7.196 -7.555 2.524 261 HG12 VAL 30 2HG1 VAL 30 7.563 -5.830 2.601 262 HG13 VAL 30 3HG1 VAL 30 7.598 -6.673 1.051 263 HG21 VAL 30 3HG2 VAL 30 10.804 -8.250 1.381 264 HG22 VAL 30 1HG2 VAL 30 9.297 -9.121 1.663 265 HG23 VAL 30 2HG2 VAL 30 9.401 -7.939 0.358 266 H ALA 31 H ALA 31 11.010 -6.193 -0.209 267 HA ALA 31 HA ALA 31 9.112 -4.309 -1.434 268 HB1 ALA 31 1HB ALA 31 11.608 -3.532 -1.099 269 HB2 ALA 31 2HB ALA 31 11.861 -4.494 -2.556 270 HB3 ALA 31 3HB ALA 31 10.719 -3.150 -2.574 271 H ILE 32 H ILE 32 7.852 -5.472 -2.727 272 HA ILE 32 HA ILE 32 8.919 -7.854 -4.042 273 HB ILE 32 HB ILE 32 6.088 -6.827 -3.812 274 HG12 ILE 32 2HG1 ILE 32 6.631 -9.445 -2.706 275 HG13 ILE 32 3HG1 ILE 32 7.698 -8.238 -1.999 276 HG21 ILE 32 1HG2 ILE 32 5.945 -9.456 -4.593 277 HG22 ILE 32 2HG2 ILE 32 5.698 -8.056 -5.635 278 HG23 ILE 32 3HG2 ILE 32 7.281 -8.829 -5.559 279 HD11 ILE 32 3HD1 ILE 32 5.032 -7.215 -2.107 280 HD12 ILE 32 1HD1 ILE 32 5.039 -8.796 -1.325 281 HD13 ILE 32 2HD1 ILE 32 6.066 -7.501 -0.708 282 H PHE 33 H PHE 33 9.915 -7.446 -5.911 283 HA PHE 33 HA PHE 33 8.732 -5.469 -7.738 284 HB2 PHE 33 2HB PHE 33 11.514 -6.649 -7.829 285 HB3 PHE 33 3HB PHE 33 10.903 -5.309 -8.794 286 HD1 PHE 33 HD2 PHE 33 9.464 -3.770 -6.708 287 HD2 PHE 33 HD1 PHE 33 13.261 -5.690 -6.631 288 HE1 PHE 33 HE2 PHE 33 10.226 -2.185 -4.988 289 HE2 PHE 33 HE1 PHE 33 14.030 -4.109 -4.910 290 HZ PHE 33 HZ PHE 33 12.512 -2.352 -4.087 291 H MET 34 H MET 34 7.381 -6.411 -9.128 292 HA MET 34 HA MET 34 7.748 -9.141 -9.985 293 HB2 MET 34 2HB MET 34 5.524 -7.807 -9.569 294 HB3 MET 34 3HB MET 34 5.758 -7.285 -11.232 295 HG2 MET 34 2HG MET 34 5.760 -9.592 -11.981 296 HG3 MET 34 3HG MET 34 5.596 -10.147 -10.317 297 HE1 MET 34 3HE MET 34 3.087 -10.168 -9.009 298 HE2 MET 34 1HE MET 34 3.785 -8.553 -8.889 299 HE3 MET 34 2HE MET 34 2.092 -8.750 -9.345 300 H PHE 35 H PHE 35 8.528 -9.853 -11.894 301 HA PHE 35 HA PHE 35 9.127 -7.887 -13.989 302 HB2 PHE 35 2HB PHE 35 11.361 -8.718 -14.292 303 HB3 PHE 35 3HB PHE 35 11.168 -8.305 -12.591 304 HD1 PHE 35 HD1 PHE 35 10.496 -10.256 -11.016 305 HD2 PHE 35 HD2 PHE 35 12.206 -10.781 -14.878 306 HE1 PHE 35 HE1 PHE 35 11.219 -12.521 -10.384 307 HE2 PHE 35 HE2 PHE 35 12.932 -13.047 -14.252 308 HZ PHE 35 HZ PHE 35 12.438 -13.920 -12.003 309 H GLU 36 H GLU 36 8.515 -8.544 -15.946 310 HA GLU 36 HA GLU 36 7.798 -11.375 -16.288 311 HB2 GLU 36 2HB GLU 36 6.302 -10.647 -18.059 312 HB3 GLU 36 3HB GLU 36 5.968 -9.752 -16.583 313 HG2 GLU 36 2HG GLU 36 6.047 -7.931 -17.848 314 HG3 GLU 36 3HG GLU 36 7.796 -8.154 -17.860 315 H VAL 37 H VAL 37 10.129 -9.120 -17.128 316 HA VAL 37 HA VAL 37 10.710 -10.212 -19.753 317 HB VAL 37 HB VAL 37 12.403 -8.277 -18.177 318 HG11 VAL 37 1HG1 VAL 37 13.745 -8.746 -19.927 319 HG12 VAL 37 2HG1 VAL 37 12.419 -9.357 -20.917 320 HG13 VAL 37 3HG1 VAL 37 12.689 -7.620 -20.779 321 HG21 VAL 37 3HG2 VAL 37 9.884 -7.851 -19.701 322 HG22 VAL 37 1HG2 VAL 37 10.475 -7.049 -18.246 323 HG23 VAL 37 2HG2 VAL 37 11.152 -6.631 -19.820 324 H GLY 38 H GLY 38 12.749 -11.177 -20.299 325 HA2 GLY 38 2HA GLY 38 13.607 -13.084 -18.321 326 HA3 GLY 38 3HA GLY 38 14.189 -12.960 -19.974 327 H ASP 39 H ASP 39 14.349 -11.216 -16.874 328 HA ASP 39 HA ASP 39 17.235 -10.952 -17.237 329 HB2 ASP 39 2HB ASP 39 15.288 -8.688 -17.083 330 HB3 ASP 39 3HB ASP 39 16.867 -8.501 -16.324 331 H PHE 40 H PHE 40 17.337 -12.502 -15.551 332 HA PHE 40 HA PHE 40 16.245 -11.785 -12.955 333 HB2 PHE 40 2HB PHE 40 16.863 -13.966 -12.242 334 HB3 PHE 40 3HB PHE 40 16.248 -14.150 -13.881 335 HD1 PHE 40 HD1 PHE 40 17.833 -14.489 -15.758 336 HD2 PHE 40 HD2 PHE 40 19.093 -14.519 -11.693 337 HE1 PHE 40 HE1 PHE 40 19.921 -15.614 -16.417 338 HE2 PHE 40 HE2 PHE 40 21.182 -15.642 -12.345 339 HZ PHE 40 HZ PHE 40 21.599 -16.190 -14.709 340 H SER 41 H SER 41 19.148 -11.420 -14.699 341 HA SER 41 HA SER 41 20.891 -11.287 -12.406 342 HB2 SER 41 2HB SER 41 22.286 -11.802 -14.106 343 HB3 SER 41 3HB SER 41 21.177 -11.171 -15.323 344 HG SER 41 HG SER 41 22.281 -9.389 -15.359 345 H ASN 42 H ASN 42 18.715 -9.186 -13.937 346 HA ASN 42 HA ASN 42 20.085 -6.770 -13.044 347 HB2 ASN 42 2HB ASN 42 18.070 -7.403 -15.042 348 HB3 ASN 42 3HB ASN 42 17.591 -6.032 -14.046 349 HD21 ASN 42 1HD2 ASN 42 19.854 -4.729 -13.539 350 HD22 ASN 42 2HD2 ASN 42 20.606 -4.188 -14.998 351 H ILE 43 H ILE 43 17.480 -8.867 -12.146 352 HA ILE 43 HA ILE 43 15.874 -7.249 -10.594 353 HB ILE 43 HB ILE 43 16.599 -10.132 -10.473 354 HG12 ILE 43 2HG1 ILE 43 14.834 -9.291 -11.980 355 HG13 ILE 43 3HG1 ILE 43 14.190 -10.404 -10.778 356 HG21 ILE 43 1HG2 ILE 43 14.942 -10.291 -8.510 357 HG22 ILE 43 2HG2 ILE 43 16.604 -9.813 -8.169 358 HG23 ILE 43 3HG2 ILE 43 15.333 -8.593 -8.237 359 HD11 ILE 43 3HD1 ILE 43 13.539 -7.630 -11.282 360 HD12 ILE 43 1HD1 ILE 43 12.646 -8.861 -10.390 361 HD13 ILE 43 2HD1 ILE 43 13.914 -7.935 -9.586 362 HA PRO 44 HA PRO 44 18.764 -8.029 -6.796 363 HB2 PRO 44 2HB PRO 44 21.202 -9.113 -7.297 364 HB3 PRO 44 3HB PRO 44 19.771 -10.089 -6.947 365 HG2 PRO 44 2HG PRO 44 21.017 -9.432 -9.589 366 HG3 PRO 44 3HG PRO 44 20.376 -10.980 -9.008 367 HD2 PRO 44 2HD PRO 44 18.982 -9.356 -10.668 368 HD3 PRO 44 3HD PRO 44 18.194 -10.388 -9.457 369 H LYS 45 H LYS 45 20.040 -7.029 -9.879 370 HA LYS 45 HA LYS 45 22.192 -5.449 -8.962 371 HB2 LYS 45 2HB LYS 45 21.377 -6.230 -11.398 372 HB3 LYS 45 3HB LYS 45 20.725 -4.597 -11.399 373 HG2 LYS 45 2HG LYS 45 23.350 -4.379 -10.440 374 HG3 LYS 45 3HG LYS 45 23.416 -5.480 -11.818 375 HD2 LYS 45 2HD LYS 45 21.952 -3.710 -13.004 376 HD3 LYS 45 3HD LYS 45 22.490 -2.630 -11.717 377 HE2 LYS 45 2HE LYS 45 24.776 -3.979 -12.676 378 HE3 LYS 45 3HE LYS 45 23.868 -3.441 -14.088 379 HZ1 LYS 45 3HZ LYS 45 24.579 -1.388 -13.743 380 HZ2 LYS 45 1HZ LYS 45 25.507 -1.920 -12.432 381 HZ3 LYS 45 2HZ LYS 45 23.926 -1.374 -12.182 382 H SER 46 H SER 46 18.762 -4.875 -9.213 383 HA SER 46 HA SER 46 18.851 -2.045 -8.993 384 HB2 SER 46 2HB SER 46 16.441 -3.185 -7.867 385 HB3 SER 46 3HB SER 46 16.642 -2.234 -9.337 386 HG SER 46 HG SER 46 16.459 -4.965 -9.006 387 H ALA 47 H ALA 47 18.167 -4.597 -6.604 388 HA ALA 47 HA ALA 47 17.908 -2.916 -4.379 389 HB1 ALA 47 1HB ALA 47 17.393 -5.454 -4.681 390 HB2 ALA 47 2HB ALA 47 19.043 -5.663 -4.093 391 HB3 ALA 47 3HB ALA 47 17.850 -4.829 -3.096 392 H GLU 48 H GLU 48 20.705 -4.015 -6.086 393 HA GLU 48 HA GLU 48 22.579 -3.565 -3.966 394 HB2 GLU 48 2HB GLU 48 22.910 -5.103 -5.959 395 HB3 GLU 48 3HB GLU 48 23.184 -3.657 -6.920 396 HG2 GLU 48 2HG GLU 48 24.868 -3.338 -4.754 397 HG3 GLU 48 3HG GLU 48 24.967 -5.058 -5.122 398 H PHE 49 H PHE 49 21.182 -1.651 -6.523 399 HA PHE 49 HA PHE 49 23.012 0.435 -6.685 400 HB2 PHE 49 2HB PHE 49 20.456 -0.103 -7.693 401 HB3 PHE 49 3HB PHE 49 20.289 1.415 -6.817 402 HD1 PHE 49 HD2 PHE 49 21.759 3.342 -7.424 403 HD2 PHE 49 HD1 PHE 49 21.551 -0.203 -9.771 404 HE1 PHE 49 HE2 PHE 49 22.742 4.550 -9.328 405 HE2 PHE 49 HE1 PHE 49 22.536 0.999 -11.679 406 HZ PHE 49 HZ PHE 49 23.132 3.379 -11.459 407 H ILE 50 H ILE 50 20.769 -0.371 -4.181 408 HA ILE 50 HA ILE 50 20.770 2.217 -2.934 409 HB ILE 50 HB ILE 50 19.953 -0.441 -1.757 410 HG12 ILE 50 2HG1 ILE 50 18.710 0.136 -3.828 411 HG13 ILE 50 3HG1 ILE 50 17.682 0.136 -2.399 412 HG21 ILE 50 1HG2 ILE 50 19.934 2.328 -0.776 413 HG22 ILE 50 2HG2 ILE 50 18.433 1.436 -0.537 414 HG23 ILE 50 3HG2 ILE 50 19.945 0.806 0.115 415 HD11 ILE 50 3HD1 ILE 50 17.223 2.007 -3.923 416 HD12 ILE 50 1HD1 ILE 50 17.725 2.540 -2.319 417 HD13 ILE 50 2HD1 ILE 50 18.866 2.595 -3.663 418 H GLN 51 H GLN 51 22.503 -0.821 -2.505 419 HA GLN 51 HA GLN 51 24.771 0.368 -1.385 420 HB2 GLN 51 2HB GLN 51 22.763 0.298 0.483 421 HB3 GLN 51 3HB GLN 51 23.627 -1.197 0.819 422 HG2 GLN 51 2HG GLN 51 25.001 1.464 0.600 423 HG3 GLN 51 3HG GLN 51 24.355 0.836 2.115 424 HE21 GLN 51 1HE2 GLN 51 25.392 -0.825 3.148 425 HE22 GLN 51 2HE2 GLN 51 26.949 -1.406 2.677 426 H SER 52 H SER 52 26.443 -1.023 -1.497 427 HA SER 52 HA SER 52 26.248 -3.444 -2.803 428 HB2 SER 52 2HB SER 52 28.553 -3.901 -1.902 429 HB3 SER 52 3HB SER 52 28.370 -2.320 -2.663 430 HG SER 52 HG SER 52 27.938 -2.557 0.095 431 H LYS 53 H LYS 53 25.914 -2.746 0.595 432 HA LYS 53 HA LYS 53 25.252 -5.574 1.059 433 HB2 LYS 53 2HB LYS 53 27.488 -4.308 2.105 434 HB3 LYS 53 3HB LYS 53 26.318 -4.230 3.416 435 HG2 LYS 53 2HG LYS 53 27.127 -6.254 3.930 436 HG3 LYS 53 3HG LYS 53 26.037 -6.807 2.656 437 HD2 LYS 53 2HD LYS 53 27.730 -7.336 1.275 438 HD3 LYS 53 3HD LYS 53 28.652 -5.891 1.697 439 HE2 LYS 53 2HE LYS 53 29.927 -7.031 3.124 440 HE3 LYS 53 3HE LYS 53 28.519 -7.737 3.915 441 HZ1 LYS 53 3HZ LYS 53 28.633 -9.602 2.660 442 HZ2 LYS 53 1HZ LYS 53 30.273 -9.190 2.606 443 HZ3 LYS 53 2HZ LYS 53 29.262 -8.810 1.305 444 H GLY 54 H GLY 54 23.348 -5.904 2.040 445 HA2 GLY 54 2HA GLY 54 21.965 -5.032 4.000 446 HA3 GLY 54 3HA GLY 54 21.948 -3.529 3.089 447 H HIS 55 H HIS 55 21.892 -5.585 0.676 448 HA HIS 55 HA HIS 55 18.956 -5.802 0.686 449 HB2 HIS 55 2HB HIS 55 19.055 -5.678 -1.750 450 HB3 HIS 55 3HB HIS 55 19.865 -4.287 -1.035 451 HD1 HIS 55 HD1 HIS 55 22.595 -4.582 -0.899 452 HD2 HIS 55 HD2 HIS 55 20.541 -6.966 -3.612 453 HE1 HIS 55 HE1 HIS 55 24.327 -5.381 -2.537 454 H GLU 56 H GLU 56 18.210 -7.792 0.943 455 HA GLU 56 HA GLU 56 19.634 -10.016 -0.340 456 HB2 GLU 56 2HB GLU 56 19.672 -9.590 2.394 457 HB3 GLU 56 3HB GLU 56 18.379 -10.764 2.187 458 HG2 GLU 56 2HG GLU 56 20.834 -11.352 0.694 459 HG3 GLU 56 3HG GLU 56 20.997 -11.384 2.449 460 H LEU 57 H LEU 57 18.351 -11.458 -1.350 461 HA LEU 57 HA LEU 57 15.523 -10.865 -1.504 462 HB2 LEU 57 2HB LEU 57 17.216 -12.923 -2.913 463 HB3 LEU 57 3HB LEU 57 15.509 -12.631 -3.241 464 HG LEU 57 HG LEU 57 16.663 -11.535 -4.961 465 HD11 LEU 57 1HD1 LEU 57 14.978 -10.176 -3.446 466 HD12 LEU 57 2HD1 LEU 57 15.822 -9.424 -4.799 467 HD13 LEU 57 3HD1 LEU 57 16.412 -9.192 -3.154 468 HD21 LEU 57 3HD2 LEU 57 18.389 -9.881 -3.218 469 HD22 LEU 57 1HD2 LEU 57 18.695 -10.545 -4.823 470 HD23 LEU 57 2HD2 LEU 57 18.831 -11.580 -3.401 471 H LEU 58 H LEU 58 14.404 -11.560 0.231 472 HA LEU 58 HA LEU 58 14.939 -13.773 1.819 473 HB2 LEU 58 2HB LEU 58 12.799 -11.878 1.483 474 HB3 LEU 58 3HB LEU 58 12.154 -13.486 1.801 475 HG LEU 58 HG LEU 58 14.312 -12.726 3.616 476 HD11 LEU 58 1HD1 LEU 58 13.008 -10.547 3.052 477 HD12 LEU 58 2HD1 LEU 58 13.341 -10.961 4.733 478 HD13 LEU 58 3HD1 LEU 58 11.744 -11.266 4.050 479 HD21 LEU 58 3HD2 LEU 58 12.204 -14.499 3.556 480 HD22 LEU 58 1HD2 LEU 58 11.673 -13.273 4.708 481 HD23 LEU 58 2HD2 LEU 58 13.202 -14.117 4.960 482 H ASN 59 H ASN 59 12.955 -13.515 -1.094 483 HA ASN 59 HA ASN 59 12.868 -16.458 -1.192 484 HB2 ASN 59 2HB ASN 59 10.655 -15.106 -0.715 485 HB3 ASN 59 3HB ASN 59 10.697 -14.831 -2.454 486 HD21 ASN 59 1HD2 ASN 59 9.767 -16.296 -3.685 487 HD22 ASN 59 2HD2 ASN 59 9.393 -17.919 -3.225 488 H SER 60 H SER 60 13.838 -17.280 -2.917 489 HA SER 60 HA SER 60 15.153 -15.842 -4.859 490 HB2 SER 60 2HB SER 60 15.905 -17.969 -5.015 491 HB3 SER 60 3HB SER 60 14.364 -18.649 -4.496 492 HG SER 60 HG SER 60 15.362 -18.388 -6.990 493 H LEU 61 H LEU 61 14.756 -15.713 -7.194 494 HA LEU 61 HA LEU 61 11.958 -15.013 -7.712 495 HB2 LEU 61 2HB LEU 61 13.108 -14.007 -9.834 496 HB3 LEU 61 3HB LEU 61 13.177 -13.170 -8.284 497 HG LEU 61 HG LEU 61 15.412 -15.003 -8.999 498 HD11 LEU 61 1HD1 LEU 61 16.528 -13.340 -10.306 499 HD12 LEU 61 2HD1 LEU 61 15.206 -12.196 -10.072 500 HD13 LEU 61 3HD1 LEU 61 14.953 -13.650 -11.037 501 HD21 LEU 61 3HD2 LEU 61 16.631 -13.708 -7.538 502 HD22 LEU 61 1HD2 LEU 61 15.021 -13.610 -6.823 503 HD23 LEU 61 2HD2 LEU 61 15.633 -12.277 -7.803 504 H ARG 62 H ARG 62 10.726 -16.163 -9.054 505 HA ARG 62 HA ARG 62 11.833 -18.519 -10.312 506 HB2 ARG 62 2HB ARG 62 9.464 -18.083 -9.128 507 HB3 ARG 62 3HB ARG 62 9.011 -17.735 -10.791 508 HG2 ARG 62 2HG ARG 62 8.652 -19.923 -10.974 509 HG3 ARG 62 3HG ARG 62 10.409 -20.077 -11.036 510 HD2 ARG 62 2HD ARG 62 10.561 -20.791 -8.863 511 HD3 ARG 62 3HD ARG 62 9.089 -19.952 -8.373 512 HE ARG 62 HE ARG 62 8.611 -22.114 -10.197 513 HH11 ARG 62 1HH1 ARG 62 9.081 -21.253 -6.856 514 HH12 ARG 62 2HH1 ARG 62 8.229 -22.633 -6.246 515 HH21 ARG 62 1HH2 ARG 62 7.488 -23.935 -9.405 516 HH22 ARG 62 2HH2 ARG 62 7.324 -24.158 -7.696 517 H PHE 63 H PHE 63 13.039 -16.474 -11.518 518 HA PHE 63 HA PHE 63 11.864 -15.188 -13.650 519 HB2 PHE 63 2HB PHE 63 14.012 -14.464 -13.427 520 HB3 PHE 63 3HB PHE 63 14.615 -16.059 -12.991 521 HD1 PHE 63 HD2 PHE 63 12.849 -14.792 -16.020 522 HD2 PHE 63 HD1 PHE 63 16.341 -16.610 -14.402 523 HE1 PHE 63 HE2 PHE 63 13.755 -15.066 -18.291 524 HE2 PHE 63 HE1 PHE 63 17.253 -16.886 -16.670 525 HZ PHE 63 HZ PHE 63 15.959 -16.115 -18.619 526 H ASN 64 H ASN 64 13.287 -18.438 -13.588 527 HA ASN 64 HA ASN 64 13.134 -19.148 -16.224 528 HB2 ASN 64 2HB ASN 64 12.607 -20.782 -13.743 529 HB3 ASN 64 3HB ASN 64 12.646 -21.499 -15.351 530 HD21 ASN 64 1HD2 ASN 64 14.480 -20.211 -12.755 531 HD22 ASN 64 2HD2 ASN 64 16.046 -20.537 -13.408 532 H GLN 65 H GLN 65 10.517 -18.666 -13.995 533 HA GLN 65 HA GLN 65 8.580 -19.815 -15.859 534 HB2 GLN 65 2HB GLN 65 8.712 -19.636 -13.053 535 HB3 GLN 65 3HB GLN 65 7.388 -18.586 -13.542 536 HG2 GLN 65 2HG GLN 65 6.357 -20.628 -13.209 537 HG3 GLN 65 3HG GLN 65 6.601 -20.578 -14.955 538 HE21 GLN 65 1HE2 GLN 65 6.328 -22.910 -14.755 539 HE22 GLN 65 2HE2 GLN 65 7.703 -23.880 -14.362 540 H ALA 66 H ALA 66 6.367 -18.292 -15.424 541 HA ALA 66 HA ALA 66 6.807 -16.085 -17.150 542 HB1 ALA 66 1HB ALA 66 4.682 -17.479 -16.866 543 HB2 ALA 66 2HB ALA 66 4.344 -16.449 -15.474 544 HB3 ALA 66 3HB ALA 66 4.494 -15.738 -17.081 545 H ASP 67 H ASP 67 5.396 -13.980 -16.286 546 HA ASP 67 HA ASP 67 7.117 -12.445 -14.830 547 HB2 ASP 67 2HB ASP 67 5.230 -10.933 -14.380 548 HB3 ASP 67 3HB ASP 67 5.204 -11.518 -16.041 549 H TRP 68 H TRP 68 7.993 -13.013 -12.938 550 HA TRP 68 HA TRP 68 6.210 -13.976 -10.804 551 HB2 TRP 68 2HB TRP 68 8.489 -15.144 -11.727 552 HB3 TRP 68 3HB TRP 68 9.126 -14.177 -10.400 553 HD1 TRP 68 HD1 TRP 68 9.059 -15.311 -8.108 554 HE1 TRP 68 HE1 TRP 68 7.790 -17.294 -7.068 555 HE3 TRP 68 HE3 TRP 68 5.962 -16.432 -12.017 556 HZ2 TRP 68 HZ2 TRP 68 5.746 -19.096 -7.807 557 HZ3 TRP 68 HZ3 TRP 68 4.380 -18.300 -11.770 558 HH2 TRP 68 HH2 TRP 68 4.276 -19.604 -9.708 559 H THR 69 H THR 69 7.479 -13.462 -8.555 560 HA THR 69 HA THR 69 8.045 -10.570 -8.566 561 HB THR 69 HB THR 69 6.968 -10.795 -6.136 562 HG1 THR 69 HG1 THR 69 6.473 -13.071 -6.585 563 HG21 THR 69 3HG2 THR 69 5.113 -9.655 -6.955 564 HG22 THR 69 1HG2 THR 69 5.072 -10.592 -8.448 565 HG23 THR 69 2HG2 THR 69 6.322 -9.371 -8.207 566 H ILE 70 H ILE 70 9.621 -9.848 -7.178 567 HA ILE 70 HA ILE 70 11.051 -11.914 -5.637 568 HB ILE 70 HB ILE 70 12.397 -11.344 -7.553 569 HG12 ILE 70 2HG1 ILE 70 14.422 -10.510 -6.427 570 HG13 ILE 70 3HG1 ILE 70 13.443 -9.964 -5.070 571 HG21 ILE 70 1HG2 ILE 70 13.074 -8.632 -7.087 572 HG22 ILE 70 2HG2 ILE 70 12.284 -9.340 -8.495 573 HG23 ILE 70 3HG2 ILE 70 11.315 -8.749 -7.146 574 HD11 ILE 70 3HD1 ILE 70 14.715 -12.378 -5.271 575 HD12 ILE 70 1HD1 ILE 70 13.405 -11.989 -4.156 576 HD13 ILE 70 2HD1 ILE 70 13.050 -12.775 -5.695 577 H VAL 71 H VAL 71 11.122 -11.528 -3.531 578 HA VAL 71 HA VAL 71 10.423 -8.887 -2.524 579 HB VAL 71 HB VAL 71 10.450 -10.025 -0.287 580 HG11 VAL 71 1HG1 VAL 71 8.487 -11.670 -1.111 581 HG12 VAL 71 2HG1 VAL 71 8.298 -9.922 -0.963 582 HG13 VAL 71 3HG1 VAL 71 8.645 -10.643 -2.535 583 HG21 VAL 71 3HG2 VAL 71 12.036 -11.817 -0.917 584 HG22 VAL 71 1HG2 VAL 71 10.556 -12.435 -0.183 585 HG23 VAL 71 2HG2 VAL 71 10.783 -12.533 -1.930 586 H VAL 72 H VAL 72 11.805 -7.500 -1.597 587 HA VAL 72 HA VAL 72 14.545 -8.436 -1.043 588 HB VAL 72 HB VAL 72 13.842 -5.684 -2.062 589 HG11 VAL 72 1HG1 VAL 72 16.073 -5.206 -2.040 590 HG12 VAL 72 2HG1 VAL 72 16.004 -6.324 -0.676 591 HG13 VAL 72 3HG1 VAL 72 16.550 -6.890 -2.256 592 HG21 VAL 72 3HG2 VAL 72 13.661 -6.546 -4.103 593 HG22 VAL 72 1HG2 VAL 72 15.340 -7.074 -3.987 594 HG23 VAL 72 2HG2 VAL 72 14.038 -8.160 -3.501 595 H ARG 73 H ARG 73 15.255 -8.066 0.954 596 HA ARG 73 HA ARG 73 13.646 -6.356 2.706 597 HB2 ARG 73 2HB ARG 73 14.935 -7.493 4.540 598 HB3 ARG 73 3HB ARG 73 13.929 -8.563 3.573 599 HG2 ARG 73 2HG ARG 73 15.676 -9.772 2.914 600 HG3 ARG 73 3HG ARG 73 16.627 -8.336 2.528 601 HD2 ARG 73 2HD ARG 73 17.786 -9.493 4.246 602 HD3 ARG 73 3HD ARG 73 17.046 -8.076 4.990 603 HE ARG 73 HE ARG 73 15.248 -10.151 5.305 604 HH11 ARG 73 1HH1 ARG 73 18.513 -9.425 6.271 605 HH12 ARG 73 2HH1 ARG 73 18.425 -10.351 7.733 606 HH21 ARG 73 1HH2 ARG 73 15.120 -11.373 7.227 607 HH22 ARG 73 2HH2 ARG 73 16.495 -11.459 8.275 608 H LYS 74 H LYS 74 14.348 -4.422 3.309 609 HA LYS 74 HA LYS 74 16.961 -3.509 2.513 610 HB2 LYS 74 2HB LYS 74 14.503 -2.270 3.640 611 HB3 LYS 74 3HB LYS 74 16.025 -1.431 3.913 612 HG2 LYS 74 2HG LYS 74 15.840 -2.230 1.169 613 HG3 LYS 74 3HG LYS 74 14.391 -1.339 1.639 614 HD2 LYS 74 2HD LYS 74 17.127 -0.327 2.337 615 HD3 LYS 74 3HD LYS 74 16.417 -0.015 0.751 616 HE2 LYS 74 2HE LYS 74 14.432 0.952 1.919 617 HE3 LYS 74 3HE LYS 74 15.309 0.783 3.439 618 HZ1 LYS 74 3HZ LYS 74 16.714 2.173 1.310 619 HZ2 LYS 74 1HZ LYS 74 16.640 2.516 2.965 620 HZ3 LYS 74 2HZ LYS 74 15.371 2.979 1.948 621 H LYS 75 H LYS 75 18.484 -2.494 3.966 622 HA LYS 75 HA LYS 75 18.334 -2.730 6.773 623 HB2 LYS 75 2HB LYS 75 18.890 -5.158 5.542 624 HB3 LYS 75 3HB LYS 75 20.472 -4.563 6.026 625 HG2 LYS 75 2HG LYS 75 18.281 -4.453 8.023 626 HG3 LYS 75 3HG LYS 75 18.973 -6.029 7.630 627 HD2 LYS 75 2HD LYS 75 21.241 -4.681 7.959 628 HD3 LYS 75 3HD LYS 75 20.203 -3.692 8.989 629 HE2 LYS 75 2HE LYS 75 19.806 -5.416 10.469 630 HE3 LYS 75 3HE LYS 75 20.149 -6.663 9.271 631 HZ1 LYS 75 3HZ LYS 75 22.462 -5.119 9.681 632 HZ2 LYS 75 1HZ LYS 75 22.222 -6.764 9.996 633 HZ3 LYS 75 2HZ LYS 75 21.874 -5.616 11.188 634 H ALA 76 H ALA 76 20.377 -2.586 3.911 635 HA ALA 76 HA ALA 76 21.724 -0.261 4.896 636 HB1 ALA 76 1HB ALA 76 24.025 -1.325 4.694 637 HB2 ALA 76 2HB ALA 76 23.085 -1.725 6.132 638 HB3 ALA 76 3HB ALA 76 23.196 -2.878 4.803 Start of MODEL 12 1 H1 MET 1 H MET 1 0.928 -1.014 -0.131 2 HA MET 1 HA MET 1 1.765 -0.328 -2.197 3 HB2 MET 1 2HB MET 1 2.202 2.364 -0.892 4 HB3 MET 1 3HB MET 1 2.436 1.988 -2.594 5 HG2 MET 1 2HG MET 1 0.345 2.598 -2.954 6 HG3 MET 1 3HG MET 1 -0.177 1.201 -2.015 7 HE1 MET 1 3HE MET 1 1.310 4.801 0.011 8 HE2 MET 1 1HE MET 1 1.485 4.463 -1.712 9 HE3 MET 1 2HE MET 1 0.182 5.508 -1.147 10 H LYS 2 H LYS 2 3.234 -1.952 -1.111 11 HA LYS 2 HA LYS 2 5.890 -0.737 -0.721 12 HB2 LYS 2 2HB LYS 2 6.353 -2.775 0.752 13 HB3 LYS 2 3HB LYS 2 5.327 -1.516 1.426 14 HG2 LYS 2 2HG LYS 2 3.344 -2.854 0.793 15 HG3 LYS 2 3HG LYS 2 4.427 -4.139 0.253 16 HD2 LYS 2 2HD LYS 2 5.391 -3.706 2.737 17 HD3 LYS 2 3HD LYS 2 3.692 -3.294 2.983 18 HE2 LYS 2 2HE LYS 2 4.026 -5.720 1.423 19 HE3 LYS 2 3HE LYS 2 4.798 -5.834 3.004 20 HZ1 LYS 2 3HZ LYS 2 2.140 -4.689 3.019 21 HZ2 LYS 2 1HZ LYS 2 2.833 -5.834 4.054 22 HZ3 LYS 2 2HZ LYS 2 2.206 -6.315 2.558 23 H ARG 3 H ARG 3 4.663 -1.718 -3.163 24 HA ARG 3 HA ARG 3 6.704 -3.691 -3.865 25 HB2 ARG 3 2HB ARG 3 5.134 -5.099 -5.051 26 HB3 ARG 3 3HB ARG 3 4.626 -4.946 -3.374 27 HG2 ARG 3 2HG ARG 3 3.442 -2.940 -5.128 28 HG3 ARG 3 3HG ARG 3 3.031 -4.599 -5.567 29 HD2 ARG 3 2HD ARG 3 2.679 -4.738 -2.912 30 HD3 ARG 3 3HD ARG 3 2.317 -3.031 -3.165 31 HE ARG 3 HE ARG 3 0.359 -3.637 -4.176 32 HH11 ARG 3 1HH1 ARG 3 2.467 -6.404 -4.038 33 HH12 ARG 3 2HH1 ARG 3 1.264 -7.513 -4.607 34 HH21 ARG 3 1HH2 ARG 3 -1.234 -5.087 -4.927 35 HH22 ARG 3 2HH2 ARG 3 -0.840 -6.763 -5.114 36 H PHE 4 H PHE 4 7.039 -3.870 -6.202 37 HA PHE 4 HA PHE 4 6.144 -1.482 -7.672 38 HB2 PHE 4 2HB PHE 4 8.747 -1.946 -6.798 39 HB3 PHE 4 3HB PHE 4 8.773 -2.419 -8.493 40 HD1 PHE 4 HD2 PHE 4 7.081 0.311 -6.590 41 HD2 PHE 4 HD1 PHE 4 9.662 -0.764 -9.799 42 HE1 PHE 4 HE2 PHE 4 7.250 2.677 -7.242 43 HE2 PHE 4 HE1 PHE 4 9.837 1.601 -10.456 44 HZ PHE 4 HZ PHE 4 8.629 3.325 -9.177 45 H ASP 5 H ASP 5 5.201 -1.929 -9.546 46 HA ASP 5 HA ASP 5 5.423 -4.643 -10.618 47 HB2 ASP 5 2HB ASP 5 3.302 -2.716 -10.421 48 HB3 ASP 5 3HB ASP 5 3.550 -3.140 -12.112 49 H LEU 6 H LEU 6 7.258 -4.715 -11.823 50 HA LEU 6 HA LEU 6 7.760 -2.604 -13.780 51 HB2 LEU 6 2HB LEU 6 9.400 -4.919 -12.787 52 HB3 LEU 6 3HB LEU 6 9.889 -3.928 -14.160 53 HG LEU 6 HG LEU 6 11.087 -3.150 -12.266 54 HD11 LEU 6 1HD1 LEU 6 8.995 -1.081 -12.197 55 HD12 LEU 6 2HD1 LEU 6 9.586 -1.519 -13.799 56 HD13 LEU 6 3HD1 LEU 6 10.714 -0.951 -12.568 57 HD21 LEU 6 3HD2 LEU 6 10.173 -2.660 -10.161 58 HD22 LEU 6 1HD2 LEU 6 9.431 -4.189 -10.631 59 HD23 LEU 6 2HD2 LEU 6 8.520 -2.686 -10.776 60 H ARG 7 H ARG 7 5.829 -5.134 -13.759 61 HA ARG 7 HA ARG 7 6.454 -6.839 -15.823 62 HB2 ARG 7 2HB ARG 7 4.010 -5.948 -14.498 63 HB3 ARG 7 3HB ARG 7 3.743 -6.402 -16.176 64 HG2 ARG 7 2HG ARG 7 4.147 -8.591 -15.794 65 HG3 ARG 7 3HG ARG 7 5.362 -8.263 -14.556 66 HD2 ARG 7 2HD ARG 7 3.460 -9.290 -13.513 67 HD3 ARG 7 3HD ARG 7 3.534 -7.601 -13.014 68 HE ARG 7 HE ARG 7 1.492 -7.298 -13.974 69 HH11 ARG 7 1HH1 ARG 7 2.977 -10.103 -15.404 70 HH12 ARG 7 2HH1 ARG 7 1.589 -10.513 -16.357 71 HH21 ARG 7 1HH2 ARG 7 -0.341 -7.826 -15.224 72 HH22 ARG 7 2HH2 ARG 7 -0.297 -9.217 -16.255 73 HA PRO 8 HA PRO 8 4.462 -3.832 -19.031 74 HB2 PRO 8 2HB PRO 8 3.806 -1.340 -18.177 75 HB3 PRO 8 3HB PRO 8 2.689 -2.707 -18.097 76 HG2 PRO 8 2HG PRO 8 4.401 -1.531 -15.942 77 HG3 PRO 8 3HG PRO 8 2.715 -2.073 -15.860 78 HD2 PRO 8 2HD PRO 8 4.774 -3.578 -14.952 79 HD3 PRO 8 3HD PRO 8 3.306 -4.291 -15.651 80 H LEU 9 H LEU 9 6.832 -2.969 -16.729 81 HA LEU 9 HA LEU 9 8.012 -0.828 -18.251 82 HB2 LEU 9 2HB LEU 9 8.387 -2.061 -15.655 83 HB3 LEU 9 3HB LEU 9 9.922 -1.747 -16.461 84 HG LEU 9 HG LEU 9 8.476 0.615 -16.754 85 HD11 LEU 9 1HD1 LEU 9 8.399 0.339 -13.870 86 HD12 LEU 9 2HD1 LEU 9 7.271 -0.751 -14.675 87 HD13 LEU 9 3HD1 LEU 9 7.188 0.984 -14.979 88 HD21 LEU 9 3HD2 LEU 9 10.301 1.537 -15.764 89 HD22 LEU 9 1HD2 LEU 9 10.959 -0.067 -16.089 90 HD23 LEU 9 2HD2 LEU 9 10.356 0.329 -14.480 91 H LYS 10 H LYS 10 9.924 -0.886 -19.424 92 HA LYS 10 HA LYS 10 10.536 -3.458 -20.615 93 HB2 LYS 10 2HB LYS 10 11.752 -2.234 -22.267 94 HB3 LYS 10 3HB LYS 10 10.263 -1.351 -21.959 95 HG2 LYS 10 2HG LYS 10 11.501 0.186 -20.493 96 HG3 LYS 10 3HG LYS 10 12.991 -0.680 -20.875 97 HD2 LYS 10 2HD LYS 10 13.030 1.126 -22.344 98 HD3 LYS 10 3HD LYS 10 12.385 -0.186 -23.334 99 HE2 LYS 10 2HE LYS 10 10.209 1.078 -22.019 100 HE3 LYS 10 3HE LYS 10 11.215 2.337 -22.734 101 HZ1 LYS 10 3HZ LYS 10 11.137 0.754 -24.785 102 HZ2 LYS 10 1HZ LYS 10 9.854 1.812 -24.475 103 HZ3 LYS 10 2HZ LYS 10 9.725 0.179 -24.051 104 H ALA 11 H ALA 11 12.799 -4.127 -20.943 105 HA ALA 11 HA ALA 11 14.191 -4.232 -18.469 106 HB1 ALA 11 1HB ALA 11 14.886 -6.091 -19.468 107 HB2 ALA 11 2HB ALA 11 14.356 -5.511 -21.047 108 HB3 ALA 11 3HB ALA 11 15.959 -5.089 -20.446 109 H GLY 12 H GLY 12 16.081 -3.259 -17.815 110 HA2 GLY 12 2HA GLY 12 18.081 -1.985 -18.299 111 HA3 GLY 12 3HA GLY 12 17.203 -1.200 -19.604 112 H ILE 13 H ILE 13 14.829 -0.586 -18.230 113 HA ILE 13 HA ILE 13 15.817 1.568 -16.503 114 HB ILE 13 HB ILE 13 13.051 1.312 -17.676 115 HG12 ILE 13 2HG1 ILE 13 15.439 2.805 -18.783 116 HG13 ILE 13 3HG1 ILE 13 14.724 1.356 -19.481 117 HG21 ILE 13 1HG2 ILE 13 14.146 3.962 -17.160 118 HG22 ILE 13 2HG2 ILE 13 12.590 3.270 -16.705 119 HG23 ILE 13 3HG2 ILE 13 14.014 2.968 -15.710 120 HD11 ILE 13 3HD1 ILE 13 12.579 3.036 -19.317 121 HD12 ILE 13 1HD1 ILE 13 13.902 4.143 -19.686 122 HD13 ILE 13 2HD1 ILE 13 13.572 2.775 -20.751 123 H PHE 14 H PHE 14 13.711 -1.218 -16.546 124 HA PHE 14 HA PHE 14 12.225 -0.763 -14.233 125 HB2 PHE 14 2HB PHE 14 11.659 -3.039 -14.292 126 HB3 PHE 14 3HB PHE 14 12.011 -2.652 -15.973 127 HD1 PHE 14 HD1 PHE 14 14.719 -2.880 -16.427 128 HD2 PHE 14 HD2 PHE 14 12.392 -5.100 -13.640 129 HE1 PHE 14 HE1 PHE 14 16.374 -4.700 -16.501 130 HE2 PHE 14 HE2 PHE 14 14.043 -6.923 -13.708 131 HZ PHE 14 HZ PHE 14 16.037 -6.724 -15.139 132 H GLU 15 H GLU 15 15.546 -1.658 -14.638 133 HA GLU 15 HA GLU 15 15.872 -2.544 -11.903 134 HB2 GLU 15 2HB GLU 15 17.244 -3.643 -13.515 135 HB3 GLU 15 3HB GLU 15 17.804 -2.114 -14.178 136 HG2 GLU 15 2HG GLU 15 18.384 -2.424 -11.340 137 HG3 GLU 15 3HG GLU 15 19.138 -3.653 -12.354 138 H ARG 16 H ARG 16 16.218 0.379 -13.735 139 HA ARG 16 HA ARG 16 17.809 1.715 -11.723 140 HB2 ARG 16 2HB ARG 16 16.794 2.347 -14.424 141 HB3 ARG 16 3HB ARG 16 16.945 3.717 -13.333 142 HG2 ARG 16 2HG ARG 16 19.202 3.647 -13.334 143 HG3 ARG 16 3HG ARG 16 19.256 1.888 -13.462 144 HD2 ARG 16 2HD ARG 16 19.746 2.126 -15.616 145 HD3 ARG 16 3HD ARG 16 18.125 2.775 -15.858 146 HE ARG 16 HE ARG 16 19.872 4.802 -14.943 147 HH11 ARG 16 1HH1 ARG 16 19.110 2.908 -17.763 148 HH12 ARG 16 2HH1 ARG 16 19.659 4.113 -18.881 149 HH21 ARG 16 1HH2 ARG 16 20.598 6.396 -16.405 150 HH22 ARG 16 2HH2 ARG 16 20.505 6.096 -18.108 151 H LEU 17 H LEU 17 14.448 1.539 -12.708 152 HA LEU 17 HA LEU 17 13.564 3.719 -11.087 153 HB2 LEU 17 2HB LEU 17 12.454 1.997 -13.032 154 HB3 LEU 17 3HB LEU 17 11.473 1.834 -11.577 155 HG LEU 17 HG LEU 17 10.551 3.499 -13.106 156 HD11 LEU 17 1HD1 LEU 17 9.995 5.025 -11.485 157 HD12 LEU 17 2HD1 LEU 17 11.631 5.094 -10.831 158 HD13 LEU 17 3HD1 LEU 17 10.607 3.698 -10.497 159 HD21 LEU 17 3HD2 LEU 17 12.886 5.289 -12.590 160 HD22 LEU 17 1HD2 LEU 17 11.685 5.351 -13.880 161 HD23 LEU 17 2HD2 LEU 17 12.949 4.121 -13.911 162 H GLU 18 H GLU 18 14.162 0.349 -10.556 163 HA GLU 18 HA GLU 18 12.535 -0.142 -8.343 164 HB2 GLU 18 2HB GLU 18 14.511 -1.525 -9.742 165 HB3 GLU 18 3HB GLU 18 15.137 -1.411 -8.103 166 HG2 GLU 18 2HG GLU 18 13.822 -3.065 -7.471 167 HG3 GLU 18 3HG GLU 18 12.401 -2.135 -7.944 168 H GLU 19 H GLU 19 15.486 1.665 -8.636 169 HA GLU 19 HA GLU 19 16.035 1.721 -5.810 170 HB2 GLU 19 2HB GLU 19 17.900 1.896 -7.320 171 HB3 GLU 19 3HB GLU 19 17.174 3.275 -8.135 172 HG2 GLU 19 2HG GLU 19 17.484 3.754 -5.302 173 HG3 GLU 19 3HG GLU 19 19.016 3.341 -6.071 174 H LEU 20 H LEU 20 14.382 3.740 -8.142 175 HA LEU 20 HA LEU 20 14.202 6.116 -6.698 176 HB2 LEU 20 2HB LEU 20 12.982 4.955 -9.016 177 HB3 LEU 20 3HB LEU 20 11.756 5.772 -8.048 178 HG LEU 20 HG LEU 20 13.693 7.669 -8.126 179 HD11 LEU 20 1HD1 LEU 20 14.449 5.798 -10.101 180 HD12 LEU 20 2HD1 LEU 20 15.139 7.388 -9.780 181 HD13 LEU 20 3HD1 LEU 20 13.819 7.218 -10.936 182 HD21 LEU 20 3HD2 LEU 20 12.320 8.692 -9.939 183 HD22 LEU 20 1HD2 LEU 20 11.383 8.104 -8.566 184 HD23 LEU 20 2HD2 LEU 20 11.437 7.169 -10.061 185 H ILE 21 H ILE 21 12.363 3.143 -6.445 186 HA ILE 21 HA ILE 21 10.488 4.303 -4.555 187 HB ILE 21 HB ILE 21 9.658 2.647 -6.147 188 HG12 ILE 21 2HG1 ILE 21 8.487 1.189 -4.558 189 HG13 ILE 21 3HG1 ILE 21 9.659 1.595 -3.308 190 HG21 ILE 21 1HG2 ILE 21 11.663 1.324 -6.443 191 HG22 ILE 21 2HG2 ILE 21 11.564 0.755 -4.778 192 HG23 ILE 21 3HG2 ILE 21 10.329 0.284 -5.945 193 HD11 ILE 21 3HD1 ILE 21 8.368 3.920 -4.506 194 HD12 ILE 21 1HD1 ILE 21 7.258 2.822 -3.687 195 HD13 ILE 21 2HD1 ILE 21 8.628 3.507 -2.812 196 H GLU 22 H GLU 22 13.342 2.286 -4.557 197 HA GLU 22 HA GLU 22 13.187 1.158 -2.022 198 HB2 GLU 22 2HB GLU 22 15.340 1.775 -3.939 199 HB3 GLU 22 3HB GLU 22 15.858 1.624 -2.266 200 HG2 GLU 22 2HG GLU 22 14.437 -0.435 -3.931 201 HG3 GLU 22 3HG GLU 22 16.088 -0.499 -3.318 202 H LYS 23 H LYS 23 13.871 4.419 -2.981 203 HA LYS 23 HA LYS 23 15.142 5.296 -0.609 204 HB2 LYS 23 2HB LYS 23 14.129 6.480 -3.055 205 HB3 LYS 23 3HB LYS 23 13.770 7.493 -1.663 206 HG2 LYS 23 2HG LYS 23 15.932 8.030 -1.325 207 HG3 LYS 23 3HG LYS 23 16.517 6.437 -1.811 208 HD2 LYS 23 2HD LYS 23 16.036 7.039 -4.171 209 HD3 LYS 23 3HD LYS 23 15.596 8.661 -3.631 210 HE2 LYS 23 2HE LYS 23 17.916 8.754 -2.577 211 HE3 LYS 23 3HE LYS 23 18.285 7.321 -3.534 212 HZ1 LYS 23 3HZ LYS 23 17.519 10.004 -4.537 213 HZ2 LYS 23 1HZ LYS 23 17.593 8.631 -5.522 214 HZ3 LYS 23 2HZ LYS 23 18.991 9.202 -4.761 215 H GLU 24 H GLU 24 11.763 5.162 -1.626 216 HA GLU 24 HA GLU 24 10.786 6.498 0.716 217 HB2 GLU 24 2HB GLU 24 9.734 5.774 -1.780 218 HB3 GLU 24 3HB GLU 24 8.805 4.856 -0.604 219 HG2 GLU 24 2HG GLU 24 9.164 7.617 0.199 220 HG3 GLU 24 3HG GLU 24 8.368 7.467 -1.367 221 H MET 25 H MET 25 11.338 3.183 -0.254 222 HA MET 25 HA MET 25 9.814 1.902 1.734 223 HB2 MET 25 2HB MET 25 12.317 0.974 0.316 224 HB3 MET 25 3HB MET 25 11.276 -0.056 1.289 225 HG2 MET 25 2HG MET 25 10.430 1.413 -1.198 226 HG3 MET 25 3HG MET 25 10.870 -0.292 -1.117 227 HE1 MET 25 3HE MET 25 9.756 -1.921 0.552 228 HE2 MET 25 1HE MET 25 9.327 -0.906 1.930 229 HE3 MET 25 2HE MET 25 8.076 -1.815 1.082 230 H GLN 26 H GLN 26 10.347 1.103 3.757 231 HA GLN 26 HA GLN 26 12.091 2.668 5.321 232 HB2 GLN 26 2HB GLN 26 10.244 0.458 5.740 233 HB3 GLN 26 3HB GLN 26 11.666 0.334 6.768 234 HG2 GLN 26 2HG GLN 26 11.036 2.946 7.084 235 HG3 GLN 26 3HG GLN 26 9.439 2.239 6.841 236 HE21 GLN 26 1HE2 GLN 26 8.828 2.650 8.960 237 HE22 GLN 26 2HE2 GLN 26 9.448 1.741 10.292 238 HA PRO 27 HA PRO 27 16.000 0.698 5.067 239 HB2 PRO 27 2HB PRO 27 16.852 0.716 7.645 240 HB3 PRO 27 3HB PRO 27 16.752 2.177 6.656 241 HG2 PRO 27 2HG PRO 27 14.836 1.147 8.712 242 HG3 PRO 27 3HG PRO 27 15.404 2.805 8.444 243 HD2 PRO 27 2HD PRO 27 12.996 1.932 7.568 244 HD3 PRO 27 3HD PRO 27 13.940 3.160 6.700 245 H ASN 28 H ASN 28 13.441 -0.780 6.671 246 HA ASN 28 HA ASN 28 14.773 -3.362 6.535 247 HB2 ASN 28 2HB ASN 28 14.709 -2.097 8.962 248 HB3 ASN 28 3HB ASN 28 13.232 -3.054 9.022 249 HD21 ASN 28 1HD2 ASN 28 13.543 -5.372 8.273 250 HD22 ASN 28 2HD2 ASN 28 14.949 -6.181 8.867 251 H GLU 29 H GLU 29 12.739 -2.186 4.949 252 HA GLU 29 HA GLU 29 10.354 -3.718 5.737 253 HB2 GLU 29 2HB GLU 29 10.718 -1.094 4.597 254 HB3 GLU 29 3HB GLU 29 9.726 -2.084 3.536 255 HG2 GLU 29 2HG GLU 29 9.137 -1.922 6.462 256 HG3 GLU 29 3HG GLU 29 8.587 -0.665 5.355 257 H VAL 30 H VAL 30 9.085 -4.603 3.849 258 HA VAL 30 HA VAL 30 10.937 -6.033 2.092 259 HB VAL 30 HB VAL 30 8.380 -6.672 3.337 260 HG11 VAL 30 1HG1 VAL 30 7.599 -8.107 1.454 261 HG12 VAL 30 2HG1 VAL 30 7.450 -6.376 1.148 262 HG13 VAL 30 3HG1 VAL 30 8.765 -7.293 0.413 263 HG21 VAL 30 3HG2 VAL 30 10.122 -8.077 3.909 264 HG22 VAL 30 1HG2 VAL 30 9.298 -9.016 2.664 265 HG23 VAL 30 2HG2 VAL 30 10.765 -8.121 2.267 266 H ALA 31 H ALA 31 10.782 -6.026 -0.124 267 HA ALA 31 HA ALA 31 8.782 -4.243 -1.334 268 HB1 ALA 31 1HB ALA 31 11.128 -3.213 -1.002 269 HB2 ALA 31 2HB ALA 31 11.599 -4.256 -2.344 270 HB3 ALA 31 3HB ALA 31 10.337 -3.046 -2.569 271 H ILE 32 H ILE 32 7.612 -5.441 -2.675 272 HA ILE 32 HA ILE 32 8.812 -7.769 -3.969 273 HB ILE 32 HB ILE 32 5.986 -6.879 -3.519 274 HG12 ILE 32 2HG1 ILE 32 6.843 -9.687 -3.191 275 HG13 ILE 32 3HG1 ILE 32 7.627 -8.531 -2.120 276 HG21 ILE 32 1HG2 ILE 32 5.742 -7.473 -5.741 277 HG22 ILE 32 2HG2 ILE 32 6.995 -8.711 -5.654 278 HG23 ILE 32 3HG2 ILE 32 5.421 -8.996 -4.911 279 HD11 ILE 32 3HD1 ILE 32 4.656 -8.900 -2.414 280 HD12 ILE 32 1HD1 ILE 32 5.650 -9.538 -1.105 281 HD13 ILE 32 2HD1 ILE 32 5.467 -7.795 -1.304 282 H PHE 33 H PHE 33 9.829 -7.322 -5.817 283 HA PHE 33 HA PHE 33 8.664 -5.341 -7.642 284 HB2 PHE 33 2HB PHE 33 11.403 -6.606 -7.802 285 HB3 PHE 33 3HB PHE 33 10.826 -5.197 -8.686 286 HD1 PHE 33 HD2 PHE 33 9.453 -3.772 -6.439 287 HD2 PHE 33 HD1 PHE 33 13.232 -5.719 -6.649 288 HE1 PHE 33 HE2 PHE 33 10.303 -2.306 -4.655 289 HE2 PHE 33 HE1 PHE 33 14.088 -4.257 -4.864 290 HZ PHE 33 HZ PHE 33 12.624 -2.547 -3.866 291 H MET 34 H MET 34 7.276 -6.232 -9.029 292 HA MET 34 HA MET 34 7.533 -8.963 -9.904 293 HB2 MET 34 2HB MET 34 5.421 -7.222 -9.636 294 HB3 MET 34 3HB MET 34 5.653 -7.265 -11.379 295 HG2 MET 34 2HG MET 34 4.258 -9.020 -11.223 296 HG3 MET 34 3HG MET 34 5.753 -9.884 -10.870 297 HE1 MET 34 3HE MET 34 2.538 -8.559 -7.902 298 HE2 MET 34 1HE MET 34 3.906 -7.458 -8.068 299 HE3 MET 34 2HE MET 34 2.914 -7.850 -9.473 300 H PHE 35 H PHE 35 8.603 -9.663 -11.629 301 HA PHE 35 HA PHE 35 9.245 -7.735 -13.762 302 HB2 PHE 35 2HB PHE 35 11.417 -8.804 -14.043 303 HB3 PHE 35 3HB PHE 35 11.236 -8.237 -12.386 304 HD1 PHE 35 HD1 PHE 35 10.577 -9.924 -10.612 305 HD2 PHE 35 HD2 PHE 35 11.912 -11.035 -14.498 306 HE1 PHE 35 HE1 PHE 35 11.107 -12.179 -9.781 307 HE2 PHE 35 HE2 PHE 35 12.444 -13.292 -13.674 308 HZ PHE 35 HZ PHE 35 12.040 -13.866 -11.313 309 H GLU 36 H GLU 36 8.640 -8.324 -15.742 310 HA GLU 36 HA GLU 36 7.931 -11.149 -16.191 311 HB2 GLU 36 2HB GLU 36 6.164 -10.474 -17.621 312 HB3 GLU 36 3HB GLU 36 6.035 -9.473 -16.182 313 HG2 GLU 36 2HG GLU 36 5.749 -7.889 -17.782 314 HG3 GLU 36 3HG GLU 36 7.501 -7.819 -17.608 315 H VAL 37 H VAL 37 10.130 -8.805 -16.955 316 HA VAL 37 HA VAL 37 10.473 -9.399 -19.753 317 HB VAL 37 HB VAL 37 12.467 -8.016 -17.966 318 HG11 VAL 37 1HG1 VAL 37 13.581 -8.192 -19.925 319 HG12 VAL 37 2HG1 VAL 37 12.105 -8.386 -20.873 320 HG13 VAL 37 3HG1 VAL 37 12.612 -6.781 -20.344 321 HG21 VAL 37 3HG2 VAL 37 9.892 -7.029 -19.103 322 HG22 VAL 37 1HG2 VAL 37 10.635 -6.694 -17.539 323 HG23 VAL 37 2HG2 VAL 37 11.266 -5.927 -18.997 324 H GLY 38 H GLY 38 12.468 -10.284 -20.645 325 HA2 GLY 38 2HA GLY 38 13.143 -12.766 -19.450 326 HA3 GLY 38 3HA GLY 38 13.914 -12.058 -20.862 327 H ASP 39 H ASP 39 14.287 -9.651 -18.842 328 HA ASP 39 HA ASP 39 16.971 -10.466 -18.104 329 HB2 ASP 39 2HB ASP 39 15.480 -7.857 -18.087 330 HB3 ASP 39 3HB ASP 39 17.007 -8.022 -17.224 331 H PHE 40 H PHE 40 16.374 -12.048 -16.512 332 HA PHE 40 HA PHE 40 15.127 -11.051 -14.072 333 HB2 PHE 40 2HB PHE 40 15.990 -13.741 -13.764 334 HB3 PHE 40 3HB PHE 40 14.344 -13.139 -13.933 335 HD1 PHE 40 HD1 PHE 40 17.228 -14.547 -15.711 336 HD2 PHE 40 HD2 PHE 40 13.167 -13.306 -16.007 337 HE1 PHE 40 HE1 PHE 40 17.044 -15.680 -17.887 338 HE2 PHE 40 HE2 PHE 40 12.976 -14.438 -18.183 339 HZ PHE 40 HZ PHE 40 14.916 -15.628 -19.125 340 H SER 41 H SER 41 18.227 -11.625 -15.372 341 HA SER 41 HA SER 41 19.596 -12.121 -12.908 342 HB2 SER 41 2HB SER 41 21.501 -12.306 -14.179 343 HB3 SER 41 3HB SER 41 20.297 -12.566 -15.441 344 HG SER 41 HG SER 41 21.907 -10.334 -14.938 345 H ASN 42 H ASN 42 18.351 -9.344 -14.433 346 HA ASN 42 HA ASN 42 20.204 -7.474 -13.249 347 HB2 ASN 42 2HB ASN 42 17.953 -7.360 -15.130 348 HB3 ASN 42 3HB ASN 42 18.031 -5.983 -14.034 349 HD21 ASN 42 1HD2 ASN 42 18.522 -4.626 -15.782 350 HD22 ASN 42 2HD2 ASN 42 20.101 -4.595 -16.482 351 H ILE 43 H ILE 43 17.236 -9.001 -12.381 352 HA ILE 43 HA ILE 43 16.011 -7.270 -10.661 353 HB ILE 43 HB ILE 43 16.321 -10.229 -10.660 354 HG12 ILE 43 2HG1 ILE 43 14.621 -9.047 -12.035 355 HG13 ILE 43 3HG1 ILE 43 13.905 -10.163 -10.878 356 HG21 ILE 43 1HG2 ILE 43 14.772 -10.235 -8.613 357 HG22 ILE 43 2HG2 ILE 43 16.496 -9.978 -8.349 358 HG23 ILE 43 3HG2 ILE 43 15.386 -8.608 -8.318 359 HD11 ILE 43 3HD1 ILE 43 14.103 -7.626 -9.636 360 HD12 ILE 43 1HD1 ILE 43 13.385 -7.407 -11.232 361 HD13 ILE 43 2HD1 ILE 43 12.656 -8.529 -10.083 362 HA PRO 44 HA PRO 44 18.963 -8.588 -7.061 363 HB2 PRO 44 2HB PRO 44 21.205 -9.959 -7.742 364 HB3 PRO 44 3HB PRO 44 19.677 -10.753 -7.344 365 HG2 PRO 44 2HG PRO 44 20.856 -10.153 -10.029 366 HG3 PRO 44 3HG PRO 44 20.047 -11.627 -9.467 367 HD2 PRO 44 2HD PRO 44 18.794 -9.766 -10.983 368 HD3 PRO 44 3HD PRO 44 17.942 -10.737 -9.766 369 H LYS 45 H LYS 45 19.968 -7.422 -10.123 370 HA LYS 45 HA LYS 45 22.403 -6.181 -9.210 371 HB2 LYS 45 2HB LYS 45 21.551 -6.928 -11.655 372 HB3 LYS 45 3HB LYS 45 21.099 -5.228 -11.696 373 HG2 LYS 45 2HG LYS 45 23.722 -5.353 -10.671 374 HG3 LYS 45 3HG LYS 45 23.660 -6.418 -12.078 375 HD2 LYS 45 2HD LYS 45 22.469 -4.457 -13.244 376 HD3 LYS 45 3HD LYS 45 23.084 -3.477 -11.911 377 HE2 LYS 45 2HE LYS 45 24.990 -3.275 -13.037 378 HE3 LYS 45 3HE LYS 45 25.261 -4.997 -12.777 379 HZ1 LYS 45 3HZ LYS 45 25.401 -4.750 -15.063 380 HZ2 LYS 45 1HZ LYS 45 24.120 -3.647 -15.139 381 HZ3 LYS 45 2HZ LYS 45 23.811 -5.284 -14.847 382 H SER 46 H SER 46 19.050 -5.332 -9.438 383 HA SER 46 HA SER 46 19.394 -2.504 -9.315 384 HB2 SER 46 2HB SER 46 16.886 -3.598 -8.225 385 HB3 SER 46 3HB SER 46 17.138 -2.416 -9.509 386 HG SER 46 HG SER 46 16.266 -4.653 -10.014 387 H ALA 47 H ALA 47 18.342 -4.890 -6.882 388 HA ALA 47 HA ALA 47 18.176 -3.217 -4.692 389 HB1 ALA 47 1HB ALA 47 17.624 -5.740 -4.951 390 HB2 ALA 47 2HB ALA 47 19.274 -5.979 -4.376 391 HB3 ALA 47 3HB ALA 47 18.109 -5.115 -3.374 392 H GLU 48 H GLU 48 21.005 -4.516 -6.259 393 HA GLU 48 HA GLU 48 22.833 -3.982 -4.138 394 HB2 GLU 48 2HB GLU 48 23.220 -5.610 -6.012 395 HB3 GLU 48 3HB GLU 48 23.453 -4.235 -7.083 396 HG2 GLU 48 2HG GLU 48 25.121 -3.876 -4.818 397 HG3 GLU 48 3HG GLU 48 25.343 -5.520 -5.414 398 H PHE 49 H PHE 49 21.656 -2.174 -6.907 399 HA PHE 49 HA PHE 49 23.497 -0.124 -7.049 400 HB2 PHE 49 2HB PHE 49 20.964 -0.646 -8.124 401 HB3 PHE 49 3HB PHE 49 20.808 0.914 -7.324 402 HD1 PHE 49 HD2 PHE 49 22.290 2.790 -7.988 403 HD2 PHE 49 HD1 PHE 49 22.187 -0.887 -10.130 404 HE1 PHE 49 HE2 PHE 49 23.371 3.883 -9.909 405 HE2 PHE 49 HE1 PHE 49 23.269 0.200 -12.054 406 HZ PHE 49 HZ PHE 49 23.861 2.588 -11.946 407 H ILE 50 H ILE 50 20.989 -0.673 -4.685 408 HA ILE 50 HA ILE 50 20.974 1.914 -3.534 409 HB ILE 50 HB ILE 50 20.298 -0.703 -2.188 410 HG12 ILE 50 2HG1 ILE 50 19.066 -0.252 -4.341 411 HG13 ILE 50 3HG1 ILE 50 18.039 -0.391 -2.918 412 HG21 ILE 50 1HG2 ILE 50 18.705 0.962 -0.962 413 HG22 ILE 50 2HG2 ILE 50 20.390 0.820 -0.465 414 HG23 ILE 50 3HG2 ILE 50 19.883 2.166 -1.484 415 HD11 ILE 50 3HD1 ILE 50 17.903 2.049 -2.795 416 HD12 ILE 50 1HD1 ILE 50 18.902 2.168 -4.244 417 HD13 ILE 50 2HD1 ILE 50 17.305 1.424 -4.332 418 H GLN 51 H GLN 51 22.301 -1.093 -2.142 419 HA GLN 51 HA GLN 51 24.735 0.258 -1.371 420 HB2 GLN 51 2HB GLN 51 22.664 0.420 0.414 421 HB3 GLN 51 3HB GLN 51 23.499 -1.027 0.963 422 HG2 GLN 51 2HG GLN 51 24.591 1.758 0.718 423 HG3 GLN 51 3HG GLN 51 24.398 0.786 2.175 424 HE21 GLN 51 1HE2 GLN 51 25.850 -0.885 2.589 425 HE22 GLN 51 2HE2 GLN 51 27.379 -0.988 1.790 426 H SER 52 H SER 52 26.404 -1.126 -1.308 427 HA SER 52 HA SER 52 26.244 -3.698 -2.282 428 HB2 SER 52 2HB SER 52 28.533 -4.021 -1.294 429 HB3 SER 52 3HB SER 52 28.359 -2.545 -2.243 430 HG SER 52 HG SER 52 27.832 -1.587 -0.062 431 H LYS 53 H LYS 53 25.858 -2.568 0.995 432 HA LYS 53 HA LYS 53 25.225 -5.323 1.815 433 HB2 LYS 53 2HB LYS 53 27.375 -3.838 2.757 434 HB3 LYS 53 3HB LYS 53 26.150 -3.638 4.003 435 HG2 LYS 53 2HG LYS 53 26.980 -5.547 4.814 436 HG3 LYS 53 3HG LYS 53 26.007 -6.310 3.554 437 HD2 LYS 53 2HD LYS 53 27.814 -6.865 2.317 438 HD3 LYS 53 3HD LYS 53 28.674 -5.375 2.715 439 HE2 LYS 53 2HE LYS 53 29.969 -6.691 3.984 440 HE3 LYS 53 3HE LYS 53 28.623 -6.664 5.122 441 HZ1 LYS 53 3HZ LYS 53 29.547 -8.809 3.394 442 HZ2 LYS 53 1HZ LYS 53 27.868 -8.648 3.531 443 HZ3 LYS 53 2HZ LYS 53 28.811 -8.884 4.915 444 H GLY 54 H GLY 54 23.104 -5.406 2.159 445 HA2 GLY 54 2HA GLY 54 21.648 -4.388 4.131 446 HA3 GLY 54 3HA GLY 54 21.672 -3.018 3.031 447 H HIS 55 H HIS 55 21.783 -5.188 0.813 448 HA HIS 55 HA HIS 55 18.867 -5.552 0.707 449 HB2 HIS 55 2HB HIS 55 19.075 -5.626 -1.702 450 HB3 HIS 55 3HB HIS 55 19.902 -4.192 -1.102 451 HD1 HIS 55 HD1 HIS 55 22.619 -4.558 -0.829 452 HD2 HIS 55 HD2 HIS 55 20.578 -7.121 -3.384 453 HE1 HIS 55 HE1 HIS 55 24.378 -5.561 -2.321 454 H GLU 56 H GLU 56 18.143 -7.529 1.094 455 HA GLU 56 HA GLU 56 19.706 -9.826 0.147 456 HB2 GLU 56 2HB GLU 56 19.535 -9.120 2.826 457 HB3 GLU 56 3HB GLU 56 18.316 -10.374 2.648 458 HG2 GLU 56 2HG GLU 56 20.901 -10.970 1.396 459 HG3 GLU 56 3HG GLU 56 20.929 -10.833 3.153 460 H LEU 57 H LEU 57 18.497 -11.020 -1.152 461 HA LEU 57 HA LEU 57 15.643 -10.689 -1.258 462 HB2 LEU 57 2HB LEU 57 17.499 -12.534 -2.753 463 HB3 LEU 57 3HB LEU 57 15.776 -12.366 -3.082 464 HG LEU 57 HG LEU 57 16.829 -11.088 -4.732 465 HD11 LEU 57 1HD1 LEU 57 15.107 -9.921 -3.025 466 HD12 LEU 57 2HD1 LEU 57 15.738 -9.136 -4.472 467 HD13 LEU 57 3HD1 LEU 57 16.471 -8.810 -2.901 468 HD21 LEU 57 3HD2 LEU 57 18.806 -10.020 -4.551 469 HD22 LEU 57 1HD2 LEU 57 18.991 -11.038 -3.122 470 HD23 LEU 57 2HD2 LEU 57 18.433 -9.373 -2.952 471 H LEU 58 H LEU 58 14.495 -11.583 0.347 472 HA LEU 58 HA LEU 58 15.126 -13.709 1.958 473 HB2 LEU 58 2HB LEU 58 12.797 -12.168 1.362 474 HB3 LEU 58 3HB LEU 58 12.342 -13.864 1.502 475 HG LEU 58 HG LEU 58 14.052 -12.781 3.659 476 HD11 LEU 58 1HD1 LEU 58 12.077 -11.125 2.913 477 HD12 LEU 58 2HD1 LEU 58 12.584 -11.341 4.588 478 HD13 LEU 58 3HD1 LEU 58 11.175 -12.207 3.975 479 HD21 LEU 58 3HD2 LEU 58 13.384 -14.705 4.537 480 HD22 LEU 58 1HD2 LEU 58 12.299 -14.987 3.176 481 HD23 LEU 58 2HD2 LEU 58 11.732 -14.087 4.583 482 H ASN 59 H ASN 59 13.460 -13.793 -1.166 483 HA ASN 59 HA ASN 59 14.065 -16.664 -1.320 484 HB2 ASN 59 2HB ASN 59 11.551 -15.881 -0.829 485 HB3 ASN 59 3HB ASN 59 11.542 -15.725 -2.584 486 HD21 ASN 59 1HD2 ASN 59 12.203 -17.620 -3.823 487 HD22 ASN 59 2HD2 ASN 59 11.828 -19.189 -3.203 488 H SER 60 H SER 60 15.213 -17.123 -3.070 489 HA SER 60 HA SER 60 16.036 -15.302 -4.970 490 HB2 SER 60 2HB SER 60 17.386 -17.110 -5.160 491 HB3 SER 60 3HB SER 60 16.110 -18.231 -4.689 492 HG SER 60 HG SER 60 16.871 -17.354 -7.209 493 H LEU 61 H LEU 61 15.075 -14.333 -6.623 494 HA LEU 61 HA LEU 61 12.425 -14.506 -7.283 495 HB2 LEU 61 2HB LEU 61 12.970 -13.382 -9.365 496 HB3 LEU 61 3HB LEU 61 13.886 -12.703 -8.021 497 HG LEU 61 HG LEU 61 15.113 -14.757 -9.827 498 HD11 LEU 61 1HD1 LEU 61 14.204 -12.182 -10.639 499 HD12 LEU 61 2HD1 LEU 61 15.105 -13.383 -11.563 500 HD13 LEU 61 3HD1 LEU 61 15.968 -12.182 -10.603 501 HD21 LEU 61 3HD2 LEU 61 16.058 -12.700 -7.875 502 HD22 LEU 61 1HD2 LEU 61 17.122 -13.240 -9.175 503 HD23 LEU 61 2HD2 LEU 61 16.493 -14.405 -8.009 504 H ARG 62 H ARG 62 11.166 -15.895 -8.342 505 HA ARG 62 HA ARG 62 12.381 -18.250 -9.539 506 HB2 ARG 62 2HB ARG 62 10.249 -18.055 -7.954 507 HB3 ARG 62 3HB ARG 62 9.429 -17.854 -9.497 508 HG2 ARG 62 2HG ARG 62 9.298 -20.135 -9.086 509 HG3 ARG 62 3HG ARG 62 10.654 -19.990 -10.206 510 HD2 ARG 62 2HD ARG 62 12.226 -20.415 -8.561 511 HD3 ARG 62 3HD ARG 62 11.139 -19.938 -7.258 512 HE ARG 62 HE ARG 62 11.441 -22.542 -8.352 513 HH11 ARG 62 1HH1 ARG 62 9.091 -20.359 -6.997 514 HH12 ARG 62 2HH1 ARG 62 8.057 -21.624 -6.420 515 HH21 ARG 62 1HH2 ARG 62 10.087 -24.216 -7.597 516 HH22 ARG 62 2HH2 ARG 62 8.625 -23.817 -6.761 517 H PHE 63 H PHE 63 13.242 -16.761 -11.283 518 HA PHE 63 HA PHE 63 11.379 -15.792 -13.240 519 HB2 PHE 63 2HB PHE 63 13.343 -15.177 -14.530 520 HB3 PHE 63 3HB PHE 63 13.579 -14.716 -12.848 521 HD1 PHE 63 HD2 PHE 63 15.153 -15.937 -11.433 522 HD2 PHE 63 HD1 PHE 63 14.690 -16.864 -15.561 523 HE1 PHE 63 HE2 PHE 63 17.270 -17.189 -11.386 524 HE2 PHE 63 HE1 PHE 63 16.805 -18.119 -15.520 525 HZ PHE 63 HZ PHE 63 18.099 -18.282 -13.431 526 H ASN 64 H ASN 64 11.802 -18.785 -12.455 527 HA ASN 64 HA ASN 64 12.756 -20.267 -14.565 528 HB2 ASN 64 2HB ASN 64 10.475 -20.777 -12.663 529 HB3 ASN 64 3HB ASN 64 10.959 -21.966 -13.869 530 HD21 ASN 64 1HD2 ASN 64 12.951 -22.987 -13.680 531 HD22 ASN 64 2HD2 ASN 64 13.850 -22.975 -12.204 532 H GLN 65 H GLN 65 9.483 -18.945 -14.164 533 HA GLN 65 HA GLN 65 9.167 -18.730 -17.015 534 HB2 GLN 65 2HB GLN 65 7.687 -20.806 -15.436 535 HB3 GLN 65 3HB GLN 65 6.934 -20.062 -16.840 536 HG2 GLN 65 2HG GLN 65 9.434 -21.720 -16.741 537 HG3 GLN 65 3HG GLN 65 7.923 -22.071 -17.578 538 HE21 GLN 65 1HE2 GLN 65 10.674 -21.899 -18.583 539 HE22 GLN 65 2HE2 GLN 65 10.638 -20.726 -19.851 540 H ALA 66 H ALA 66 7.442 -17.390 -17.618 541 HA ALA 66 HA ALA 66 6.050 -15.604 -17.382 542 HB1 ALA 66 1HB ALA 66 4.193 -15.858 -15.924 543 HB2 ALA 66 2HB ALA 66 4.621 -17.471 -16.494 544 HB3 ALA 66 3HB ALA 66 5.085 -16.957 -14.872 545 H ASP 67 H ASP 67 5.334 -13.820 -15.809 546 HA ASP 67 HA ASP 67 7.685 -12.733 -14.613 547 HB2 ASP 67 2HB ASP 67 6.523 -10.755 -14.479 548 HB3 ASP 67 3HB ASP 67 5.585 -11.564 -15.730 549 H TRP 68 H TRP 68 8.368 -12.844 -12.573 550 HA TRP 68 HA TRP 68 6.533 -13.978 -10.566 551 HB2 TRP 68 2HB TRP 68 8.857 -15.088 -11.372 552 HB3 TRP 68 3HB TRP 68 9.454 -14.063 -10.070 553 HD1 TRP 68 HD1 TRP 68 9.378 -15.112 -7.736 554 HE1 TRP 68 HE1 TRP 68 8.159 -17.101 -6.649 555 HE3 TRP 68 HE3 TRP 68 6.393 -16.475 -11.656 556 HZ2 TRP 68 HZ2 TRP 68 6.193 -18.998 -7.360 557 HZ3 TRP 68 HZ3 TRP 68 4.872 -18.388 -11.371 558 HH2 TRP 68 HH2 TRP 68 4.776 -19.623 -9.267 559 H THR 69 H THR 69 7.625 -13.441 -8.246 560 HA THR 69 HA THR 69 8.042 -10.523 -8.195 561 HB THR 69 HB THR 69 6.254 -10.250 -6.900 562 HG1 THR 69 HG1 THR 69 6.975 -12.364 -5.163 563 HG21 THR 69 3HG2 THR 69 5.338 -12.146 -8.201 564 HG22 THR 69 1HG2 THR 69 4.654 -12.042 -6.580 565 HG23 THR 69 2HG2 THR 69 5.889 -13.248 -6.940 566 H ILE 70 H ILE 70 9.721 -9.794 -7.029 567 HA ILE 70 HA ILE 70 11.212 -11.763 -5.423 568 HB ILE 70 HB ILE 70 12.502 -11.021 -7.332 569 HG12 ILE 70 2HG1 ILE 70 14.488 -10.207 -6.182 570 HG13 ILE 70 3HG1 ILE 70 13.511 -9.663 -4.823 571 HG21 ILE 70 1HG2 ILE 70 12.366 -8.966 -8.158 572 HG22 ILE 70 2HG2 ILE 70 11.233 -8.560 -6.870 573 HG23 ILE 70 3HG2 ILE 70 12.959 -8.278 -6.646 574 HD11 ILE 70 3HD1 ILE 70 14.826 -12.022 -4.935 575 HD12 ILE 70 1HD1 ILE 70 13.421 -11.705 -3.918 576 HD13 ILE 70 2HD1 ILE 70 13.219 -12.502 -5.479 577 H VAL 71 H VAL 71 11.176 -11.445 -3.306 578 HA VAL 71 HA VAL 71 10.336 -8.871 -2.236 579 HB VAL 71 HB VAL 71 11.032 -11.218 -0.515 580 HG11 VAL 71 1HG1 VAL 71 10.422 -9.056 0.495 581 HG12 VAL 71 2HG1 VAL 71 8.865 -9.128 -0.332 582 HG13 VAL 71 3HG1 VAL 71 9.270 -10.331 0.892 583 HG21 VAL 71 3HG2 VAL 71 9.689 -12.430 -1.920 584 HG22 VAL 71 1HG2 VAL 71 8.469 -11.739 -0.850 585 HG23 VAL 71 2HG2 VAL 71 8.764 -11.019 -2.433 586 H VAL 72 H VAL 72 11.770 -7.382 -1.680 587 HA VAL 72 HA VAL 72 14.478 -8.247 -0.902 588 HB VAL 72 HB VAL 72 13.773 -5.492 -1.892 589 HG11 VAL 72 1HG1 VAL 72 16.011 -5.085 -1.943 590 HG12 VAL 72 2HG1 VAL 72 15.983 -6.273 -0.638 591 HG13 VAL 72 3HG1 VAL 72 16.423 -6.767 -2.274 592 HG21 VAL 72 3HG2 VAL 72 15.079 -6.736 -3.972 593 HG22 VAL 72 1HG2 VAL 72 13.959 -7.974 -3.404 594 HG23 VAL 72 2HG2 VAL 72 13.351 -6.393 -3.894 595 H ARG 73 H ARG 73 15.079 -7.893 1.128 596 HA ARG 73 HA ARG 73 13.432 -6.125 2.790 597 HB2 ARG 73 2HB ARG 73 14.633 -7.301 4.689 598 HB3 ARG 73 3HB ARG 73 13.552 -8.298 3.725 599 HG2 ARG 73 2HG ARG 73 15.203 -9.644 3.073 600 HG3 ARG 73 3HG ARG 73 16.285 -8.294 2.726 601 HD2 ARG 73 2HD ARG 73 17.322 -9.503 4.459 602 HD3 ARG 73 3HD ARG 73 16.603 -8.092 5.233 603 HE ARG 73 HE ARG 73 15.177 -9.481 6.379 604 HH11 ARG 73 1HH1 ARG 73 16.744 -11.264 3.833 605 HH12 ARG 73 2HH1 ARG 73 16.169 -12.804 4.379 606 HH21 ARG 73 1HH2 ARG 73 14.413 -11.502 7.109 607 HH22 ARG 73 2HH2 ARG 73 14.843 -12.938 6.242 608 H LYS 74 H LYS 74 14.186 -4.117 2.924 609 HA LYS 74 HA LYS 74 16.768 -3.264 2.333 610 HB2 LYS 74 2HB LYS 74 14.427 -2.085 3.735 611 HB3 LYS 74 3HB LYS 74 15.980 -1.294 3.968 612 HG2 LYS 74 2HG LYS 74 15.201 -1.946 1.188 613 HG3 LYS 74 3HG LYS 74 14.319 -0.649 1.998 614 HD2 LYS 74 2HD LYS 74 17.316 -0.727 2.033 615 HD3 LYS 74 3HD LYS 74 16.444 -0.059 0.651 616 HE2 LYS 74 2HE LYS 74 15.969 1.823 1.748 617 HE3 LYS 74 3HE LYS 74 15.417 0.941 3.171 618 HZ1 LYS 74 3HZ LYS 74 18.228 1.629 2.506 619 HZ2 LYS 74 1HZ LYS 74 17.755 0.684 3.827 620 HZ3 LYS 74 2HZ LYS 74 17.290 2.308 3.739 621 H LYS 75 H LYS 75 18.421 -2.390 3.733 622 HA LYS 75 HA LYS 75 18.522 -2.750 6.503 623 HB2 LYS 75 2HB LYS 75 18.878 -5.172 5.056 624 HB3 LYS 75 3HB LYS 75 20.438 -4.724 5.732 625 HG2 LYS 75 2HG LYS 75 18.496 -4.341 7.752 626 HG3 LYS 75 3HG LYS 75 18.213 -5.924 7.024 627 HD2 LYS 75 2HD LYS 75 20.774 -6.224 7.265 628 HD3 LYS 75 3HD LYS 75 20.657 -4.890 8.416 629 HE2 LYS 75 2HE LYS 75 19.385 -6.116 9.906 630 HE3 LYS 75 3HE LYS 75 18.810 -7.225 8.661 631 HZ1 LYS 75 3HZ LYS 75 21.094 -8.122 8.540 632 HZ2 LYS 75 1HZ LYS 75 20.368 -8.358 10.050 633 HZ3 LYS 75 2HZ LYS 75 21.529 -7.144 9.850 634 H ALA 76 H ALA 76 21.102 -3.112 7.085 635 HA ALA 76 HA ALA 76 22.680 -1.462 5.251 636 HB1 ALA 76 1HB ALA 76 23.244 -0.652 7.942 637 HB2 ALA 76 2HB ALA 76 22.730 0.324 6.566 638 HB3 ALA 76 3HB ALA 76 21.526 -0.446 7.599 Start of MODEL 13 1 H1 MET 1 H MET 1 1.883 -0.566 0.412 2 HA MET 1 HA MET 1 2.230 -0.326 -2.007 3 HB2 MET 1 2HB MET 1 2.996 2.496 -1.239 4 HB3 MET 1 3HB MET 1 3.019 1.817 -2.862 5 HG2 MET 1 2HG MET 1 0.993 2.705 -3.076 6 HG3 MET 1 3HG MET 1 0.443 1.358 -2.081 7 HE1 MET 1 3HE MET 1 1.235 5.072 -2.376 8 HE2 MET 1 1HE MET 1 -0.495 4.758 -2.513 9 HE3 MET 1 2HE MET 1 0.123 5.718 -1.168 10 H LYS 2 H LYS 2 3.678 -1.883 -0.857 11 HA LYS 2 HA LYS 2 6.417 -0.813 -0.652 12 HB2 LYS 2 2HB LYS 2 6.829 -2.913 0.743 13 HB3 LYS 2 3HB LYS 2 5.871 -1.638 1.484 14 HG2 LYS 2 2HG LYS 2 3.822 -2.868 0.888 15 HG3 LYS 2 3HG LYS 2 4.821 -4.167 0.232 16 HD2 LYS 2 2HD LYS 2 5.927 -4.155 2.581 17 HD3 LYS 2 3HD LYS 2 4.463 -3.301 3.076 18 HE2 LYS 2 2HE LYS 2 4.592 -6.007 1.749 19 HE3 LYS 2 3HE LYS 2 4.238 -5.697 3.448 20 HZ1 LYS 2 3HZ LYS 2 2.323 -4.293 2.542 21 HZ2 LYS 2 1HZ LYS 2 2.164 -5.976 2.483 22 HZ3 LYS 2 2HZ LYS 2 2.569 -5.116 1.085 23 H ARG 3 H ARG 3 5.052 -1.678 -3.080 24 HA ARG 3 HA ARG 3 6.996 -3.698 -3.913 25 HB2 ARG 3 2HB ARG 3 5.320 -4.999 -5.096 26 HB3 ARG 3 3HB ARG 3 4.910 -4.908 -3.388 27 HG2 ARG 3 2HG ARG 3 3.708 -2.804 -5.029 28 HG3 ARG 3 3HG ARG 3 3.189 -4.441 -5.436 29 HD2 ARG 3 2HD ARG 3 2.951 -4.644 -2.817 30 HD3 ARG 3 3HD ARG 3 2.810 -2.890 -2.923 31 HE ARG 3 HE ARG 3 0.733 -3.144 -3.859 32 HH11 ARG 3 1HH1 ARG 3 2.408 -6.196 -3.925 33 HH12 ARG 3 2HH1 ARG 3 1.019 -7.095 -4.437 34 HH21 ARG 3 1HH2 ARG 3 -1.102 -4.318 -4.534 35 HH22 ARG 3 2HH2 ARG 3 -0.977 -6.026 -4.785 36 H PHE 4 H PHE 4 7.157 -3.860 -6.297 37 HA PHE 4 HA PHE 4 6.261 -1.438 -7.691 38 HB2 PHE 4 2HB PHE 4 8.889 -1.836 -6.832 39 HB3 PHE 4 3HB PHE 4 8.916 -2.239 -8.546 40 HD1 PHE 4 HD2 PHE 4 7.068 0.335 -6.577 41 HD2 PHE 4 HD1 PHE 4 9.802 -0.489 -9.733 42 HE1 PHE 4 HE2 PHE 4 7.142 2.730 -7.134 43 HE2 PHE 4 HE1 PHE 4 9.881 1.906 -10.295 44 HZ PHE 4 HZ PHE 4 8.549 3.518 -8.995 45 H ASP 5 H ASP 5 5.156 -2.025 -9.425 46 HA ASP 5 HA ASP 5 5.548 -4.667 -10.582 47 HB2 ASP 5 2HB ASP 5 3.344 -2.877 -10.303 48 HB3 ASP 5 3HB ASP 5 3.599 -3.169 -12.021 49 H LEU 6 H LEU 6 7.326 -4.700 -11.851 50 HA LEU 6 HA LEU 6 7.752 -2.536 -13.771 51 HB2 LEU 6 2HB LEU 6 9.452 -4.803 -12.784 52 HB3 LEU 6 3HB LEU 6 9.889 -3.882 -14.222 53 HG LEU 6 HG LEU 6 11.132 -3.045 -12.349 54 HD11 LEU 6 1HD1 LEU 6 10.784 -0.817 -12.709 55 HD12 LEU 6 2HD1 LEU 6 9.029 -0.959 -12.613 56 HD13 LEU 6 3HD1 LEU 6 9.879 -1.489 -14.065 57 HD21 LEU 6 3HD2 LEU 6 10.215 -2.361 -10.308 58 HD22 LEU 6 1HD2 LEU 6 9.389 -3.875 -10.672 59 HD23 LEU 6 2HD2 LEU 6 8.572 -2.337 -10.949 60 H ARG 7 H ARG 7 5.880 -5.113 -13.757 61 HA ARG 7 HA ARG 7 6.501 -6.761 -15.868 62 HB2 ARG 7 2HB ARG 7 4.174 -6.131 -14.346 63 HB3 ARG 7 3HB ARG 7 3.718 -6.179 -16.044 64 HG2 ARG 7 2HG ARG 7 4.411 -8.415 -16.274 65 HG3 ARG 7 3HG ARG 7 5.287 -8.382 -14.743 66 HD2 ARG 7 2HD ARG 7 3.471 -9.218 -13.772 67 HD3 ARG 7 3HD ARG 7 2.661 -7.688 -14.104 68 HE ARG 7 HE ARG 7 2.614 -9.548 -16.302 69 HH11 ARG 7 1HH1 ARG 7 1.022 -8.489 -13.392 70 HH12 ARG 7 2HH1 ARG 7 -0.527 -9.109 -13.858 71 HH21 ARG 7 1HH2 ARG 7 0.579 -10.369 -16.926 72 HH22 ARG 7 2HH2 ARG 7 -0.778 -10.179 -15.868 73 HA PRO 8 HA PRO 8 4.365 -3.740 -18.968 74 HB2 PRO 8 2HB PRO 8 3.673 -1.281 -18.051 75 HB3 PRO 8 3HB PRO 8 2.589 -2.675 -17.972 76 HG2 PRO 8 2HG PRO 8 4.324 -1.502 -15.833 77 HG3 PRO 8 3HG PRO 8 2.653 -2.085 -15.724 78 HD2 PRO 8 2HD PRO 8 4.767 -3.559 -14.894 79 HD3 PRO 8 3HD PRO 8 3.299 -4.292 -15.573 80 H LEU 9 H LEU 9 6.814 -2.958 -16.758 81 HA LEU 9 HA LEU 9 7.902 -0.748 -18.284 82 HB2 LEU 9 2HB LEU 9 8.337 -1.950 -15.674 83 HB3 LEU 9 3HB LEU 9 9.847 -1.568 -16.498 84 HG LEU 9 HG LEU 9 8.251 0.714 -16.772 85 HD11 LEU 9 1HD1 LEU 9 7.055 1.045 -14.922 86 HD12 LEU 9 2HD1 LEU 9 8.334 0.422 -13.881 87 HD13 LEU 9 3HD1 LEU 9 7.204 -0.691 -14.651 88 HD21 LEU 9 3HD2 LEU 9 10.083 1.737 -15.929 89 HD22 LEU 9 1HD2 LEU 9 10.804 0.148 -16.183 90 HD23 LEU 9 2HD2 LEU 9 10.229 0.609 -14.580 91 H LYS 10 H LYS 10 9.898 -0.774 -19.370 92 HA LYS 10 HA LYS 10 10.509 -3.321 -20.612 93 HB2 LYS 10 2HB LYS 10 11.754 -2.084 -22.210 94 HB3 LYS 10 3HB LYS 10 10.310 -1.138 -21.877 95 HG2 LYS 10 2HG LYS 10 11.610 0.288 -20.360 96 HG3 LYS 10 3HG LYS 10 13.058 -0.644 -20.747 97 HD2 LYS 10 2HD LYS 10 13.194 1.222 -22.147 98 HD3 LYS 10 3HD LYS 10 12.549 -0.047 -23.191 99 HE2 LYS 10 2HE LYS 10 10.241 0.860 -22.515 100 HE3 LYS 10 3HE LYS 10 11.119 2.281 -21.951 101 HZ1 LYS 10 3HZ LYS 10 12.061 1.713 -24.497 102 HZ2 LYS 10 1HZ LYS 10 11.097 3.019 -24.023 103 HZ3 LYS 10 2HZ LYS 10 10.376 1.596 -24.584 104 H ALA 11 H ALA 11 12.787 -3.992 -20.906 105 HA ALA 11 HA ALA 11 14.106 -4.146 -18.378 106 HB1 ALA 11 1HB ALA 11 15.693 -5.575 -19.481 107 HB2 ALA 11 2HB ALA 11 14.070 -5.994 -20.031 108 HB3 ALA 11 3HB ALA 11 15.134 -5.041 -21.066 109 H GLY 12 H GLY 12 16.114 -3.324 -17.769 110 HA2 GLY 12 2HA GLY 12 18.135 -2.105 -18.240 111 HA3 GLY 12 3HA GLY 12 17.287 -1.286 -19.543 112 H ILE 13 H ILE 13 14.976 -0.480 -18.270 113 HA ILE 13 HA ILE 13 16.050 1.558 -16.455 114 HB ILE 13 HB ILE 13 13.331 1.558 -17.755 115 HG12 ILE 13 2HG1 ILE 13 15.893 2.824 -18.752 116 HG13 ILE 13 3HG1 ILE 13 15.067 1.457 -19.493 117 HG21 ILE 13 1HG2 ILE 13 14.469 4.135 -17.285 118 HG22 ILE 13 2HG2 ILE 13 12.999 3.430 -16.614 119 HG23 ILE 13 3HG2 ILE 13 14.545 3.185 -15.801 120 HD11 ILE 13 3HD1 ILE 13 14.059 4.281 -19.271 121 HD12 ILE 13 1HD1 ILE 13 14.569 3.437 -20.733 122 HD13 ILE 13 2HD1 ILE 13 13.110 2.926 -19.882 123 H PHE 14 H PHE 14 13.847 -1.117 -16.607 124 HA PHE 14 HA PHE 14 12.225 -0.562 -14.396 125 HB2 PHE 14 2HB PHE 14 11.533 -2.799 -14.501 126 HB3 PHE 14 3HB PHE 14 12.019 -2.440 -16.154 127 HD1 PHE 14 HD1 PHE 14 14.730 -2.829 -16.432 128 HD2 PHE 14 HD2 PHE 14 12.104 -4.892 -13.793 129 HE1 PHE 14 HE1 PHE 14 16.278 -4.741 -16.393 130 HE2 PHE 14 HE2 PHE 14 13.648 -6.808 -13.749 131 HZ PHE 14 HZ PHE 14 15.738 -6.733 -15.050 132 H GLU 15 H GLU 15 15.509 -1.635 -14.606 133 HA GLU 15 HA GLU 15 15.627 -2.544 -11.863 134 HB2 GLU 15 2HB GLU 15 17.034 -3.695 -13.418 135 HB3 GLU 15 3HB GLU 15 17.724 -2.187 -14.002 136 HG2 GLU 15 2HG GLU 15 18.093 -2.551 -11.145 137 HG3 GLU 15 3HG GLU 15 18.810 -3.848 -12.100 138 H ARG 16 H ARG 16 16.254 0.362 -13.657 139 HA ARG 16 HA ARG 16 17.846 1.622 -11.632 140 HB2 ARG 16 2HB ARG 16 16.858 2.276 -14.297 141 HB3 ARG 16 3HB ARG 16 16.797 3.650 -13.202 142 HG2 ARG 16 2HG ARG 16 19.042 3.836 -13.089 143 HG3 ARG 16 3HG ARG 16 19.301 2.093 -13.196 144 HD2 ARG 16 2HD ARG 16 19.497 2.139 -15.433 145 HD3 ARG 16 3HD ARG 16 18.184 3.300 -15.620 146 HE ARG 16 HE ARG 16 20.610 4.429 -14.559 147 HH11 ARG 16 1HH1 ARG 16 18.836 3.616 -17.441 148 HH12 ARG 16 2HH1 ARG 16 19.657 4.777 -18.431 149 HH21 ARG 16 1HH2 ARG 16 21.698 5.962 -15.851 150 HH22 ARG 16 2HH2 ARG 16 21.285 6.110 -17.526 151 H LEU 17 H LEU 17 14.478 1.950 -12.727 152 HA LEU 17 HA LEU 17 13.722 3.921 -10.874 153 HB2 LEU 17 2HB LEU 17 12.473 2.314 -12.871 154 HB3 LEU 17 3HB LEU 17 11.493 2.260 -11.407 155 HG LEU 17 HG LEU 17 10.695 4.001 -12.880 156 HD11 LEU 17 1HD1 LEU 17 10.475 5.675 -11.304 157 HD12 LEU 17 2HD1 LEU 17 12.125 5.483 -10.713 158 HD13 LEU 17 3HD1 LEU 17 10.899 4.281 -10.309 159 HD21 LEU 17 3HD2 LEU 17 12.000 5.757 -13.711 160 HD22 LEU 17 1HD2 LEU 17 13.000 4.322 -13.941 161 HD23 LEU 17 2HD2 LEU 17 13.327 5.418 -12.598 162 H GLU 18 H GLU 18 14.263 0.545 -10.520 163 HA GLU 18 HA GLU 18 12.601 -0.095 -8.381 164 HB2 GLU 18 2HB GLU 18 14.643 -1.358 -9.789 165 HB3 GLU 18 3HB GLU 18 15.233 -1.306 -8.134 166 HG2 GLU 18 2HG GLU 18 13.950 -3.020 -7.607 167 HG3 GLU 18 3HG GLU 18 12.514 -2.108 -8.070 168 H GLU 19 H GLU 19 15.617 1.675 -8.467 169 HA GLU 19 HA GLU 19 15.956 1.662 -5.605 170 HB2 GLU 19 2HB GLU 19 17.935 1.764 -6.976 171 HB3 GLU 19 3HB GLU 19 17.341 3.194 -7.808 172 HG2 GLU 19 2HG GLU 19 17.474 3.582 -4.941 173 HG3 GLU 19 3HG GLU 19 19.034 3.135 -5.629 174 H LEU 20 H LEU 20 14.369 3.634 -7.959 175 HA LEU 20 HA LEU 20 14.265 6.074 -6.576 176 HB2 LEU 20 2HB LEU 20 13.078 4.908 -8.907 177 HB3 LEU 20 3HB LEU 20 11.843 5.762 -7.983 178 HG LEU 20 HG LEU 20 13.916 7.572 -8.064 179 HD11 LEU 20 1HD1 LEU 20 15.068 7.487 -9.991 180 HD12 LEU 20 2HD1 LEU 20 13.703 6.845 -10.904 181 HD13 LEU 20 3HD1 LEU 20 14.689 5.766 -9.918 182 HD21 LEU 20 3HD2 LEU 20 11.591 8.127 -8.340 183 HD22 LEU 20 1HD2 LEU 20 11.528 7.268 -9.879 184 HD23 LEU 20 2HD2 LEU 20 12.494 8.736 -9.728 185 H ILE 21 H ILE 21 12.350 3.152 -6.313 186 HA ILE 21 HA ILE 21 10.492 4.406 -4.454 187 HB ILE 21 HB ILE 21 9.616 2.813 -6.110 188 HG12 ILE 21 2HG1 ILE 21 8.276 1.457 -4.555 189 HG13 ILE 21 3HG1 ILE 21 9.411 1.818 -3.259 190 HG21 ILE 21 1HG2 ILE 21 11.261 0.768 -4.625 191 HG22 ILE 21 2HG2 ILE 21 10.100 0.426 -5.907 192 HG23 ILE 21 3HG2 ILE 21 11.561 1.347 -6.263 193 HD11 ILE 21 3HD1 ILE 21 8.571 3.876 -2.919 194 HD12 ILE 21 1HD1 ILE 21 8.232 4.142 -4.629 195 HD13 ILE 21 2HD1 ILE 21 7.135 3.163 -3.654 196 H GLU 22 H GLU 22 13.192 2.176 -4.464 197 HA GLU 22 HA GLU 22 12.935 1.045 -1.939 198 HB2 GLU 22 2HB GLU 22 15.229 1.612 -3.755 199 HB3 GLU 22 3HB GLU 22 15.588 1.161 -2.094 200 HG2 GLU 22 2HG GLU 22 14.061 -0.439 -4.129 201 HG3 GLU 22 3HG GLU 22 15.642 -0.804 -3.439 202 H LYS 23 H LYS 23 14.073 4.213 -2.889 203 HA LYS 23 HA LYS 23 15.312 4.958 -0.475 204 HB2 LYS 23 2HB LYS 23 14.488 6.250 -2.941 205 HB3 LYS 23 3HB LYS 23 14.229 7.294 -1.549 206 HG2 LYS 23 2HG LYS 23 16.362 7.875 -1.823 207 HG3 LYS 23 3HG LYS 23 16.736 6.321 -1.074 208 HD2 LYS 23 2HD LYS 23 17.798 5.738 -2.939 209 HD3 LYS 23 3HD LYS 23 16.250 5.781 -3.786 210 HE2 LYS 23 2HE LYS 23 17.721 8.334 -3.339 211 HE3 LYS 23 3HE LYS 23 18.290 7.235 -4.595 212 HZ1 LYS 23 3HZ LYS 23 16.567 7.729 -5.905 213 HZ2 LYS 23 1HZ LYS 23 16.359 9.088 -4.918 214 HZ3 LYS 23 2HZ LYS 23 15.446 7.692 -4.639 215 H GLU 24 H GLU 24 11.965 5.084 -1.554 216 HA GLU 24 HA GLU 24 11.081 6.533 0.778 217 HB2 GLU 24 2HB GLU 24 10.033 6.007 -1.770 218 HB3 GLU 24 3HB GLU 24 8.960 5.184 -0.647 219 HG2 GLU 24 2HG GLU 24 9.649 7.876 0.209 220 HG3 GLU 24 3HG GLU 24 8.842 7.831 -1.357 221 H MET 25 H MET 25 11.992 3.395 0.236 222 HA MET 25 HA MET 25 10.015 2.151 1.961 223 HB2 MET 25 2HB MET 25 12.463 1.069 0.563 224 HB3 MET 25 3HB MET 25 11.417 0.096 1.588 225 HG2 MET 25 2HG MET 25 10.531 1.548 -0.894 226 HG3 MET 25 3HG MET 25 10.944 -0.163 -0.811 227 HE1 MET 25 3HE MET 25 9.553 -1.953 0.603 228 HE2 MET 25 1HE MET 25 9.779 -0.954 2.040 229 HE3 MET 25 2HE MET 25 8.168 -1.526 1.608 230 H GLN 26 H GLN 26 10.614 0.980 3.893 231 HA GLN 26 HA GLN 26 12.288 2.521 5.605 232 HB2 GLN 26 2HB GLN 26 10.357 0.387 5.873 233 HB3 GLN 26 3HB GLN 26 11.768 0.078 6.876 234 HG2 GLN 26 2HG GLN 26 10.852 1.405 8.392 235 HG3 GLN 26 3HG GLN 26 11.205 2.752 7.311 236 HE21 GLN 26 1HE2 GLN 26 8.793 0.148 7.484 237 HE22 GLN 26 2HE2 GLN 26 7.423 1.172 7.244 238 HA PRO 27 HA PRO 27 16.172 0.512 5.270 239 HB2 PRO 27 2HB PRO 27 17.047 0.546 7.840 240 HB3 PRO 27 3HB PRO 27 16.958 1.998 6.836 241 HG2 PRO 27 2HG PRO 27 15.047 1.016 8.920 242 HG3 PRO 27 3HG PRO 27 15.635 2.663 8.629 243 HD2 PRO 27 2HD PRO 27 13.208 1.814 7.783 244 HD3 PRO 27 3HD PRO 27 14.160 3.019 6.894 245 H ASN 28 H ASN 28 13.603 -0.921 6.883 246 HA ASN 28 HA ASN 28 14.939 -3.511 6.823 247 HB2 ASN 28 2HB ASN 28 14.787 -2.222 9.216 248 HB3 ASN 28 3HB ASN 28 13.273 -3.121 9.227 249 HD21 ASN 28 1HD2 ASN 28 16.695 -3.287 9.427 250 HD22 ASN 28 2HD2 ASN 28 16.814 -4.979 9.758 251 H GLU 29 H GLU 29 13.009 -2.410 5.092 252 HA GLU 29 HA GLU 29 10.591 -3.941 5.788 253 HB2 GLU 29 2HB GLU 29 11.001 -1.328 4.568 254 HB3 GLU 29 3HB GLU 29 9.954 -2.356 3.599 255 HG2 GLU 29 2HG GLU 29 9.507 -1.944 6.535 256 HG3 GLU 29 3HG GLU 29 8.851 -0.850 5.319 257 H VAL 30 H VAL 30 9.382 -4.555 3.614 258 HA VAL 30 HA VAL 30 11.348 -6.027 1.992 259 HB VAL 30 HB VAL 30 9.833 -7.494 3.198 260 HG11 VAL 30 1HG1 VAL 30 7.607 -6.069 1.745 261 HG12 VAL 30 2HG1 VAL 30 7.430 -7.467 2.807 262 HG13 VAL 30 3HG1 VAL 30 7.971 -5.922 3.463 263 HG21 VAL 30 3HG2 VAL 30 8.717 -7.710 0.468 264 HG22 VAL 30 1HG2 VAL 30 10.475 -7.716 0.609 265 HG23 VAL 30 2HG2 VAL 30 9.518 -8.924 1.467 266 H ALA 31 H ALA 31 11.194 -6.043 -0.241 267 HA ALA 31 HA ALA 31 9.245 -4.186 -1.434 268 HB1 ALA 31 1HB ALA 31 12.060 -4.420 -2.449 269 HB2 ALA 31 2HB ALA 31 10.865 -3.165 -2.781 270 HB3 ALA 31 3HB ALA 31 11.617 -3.268 -1.189 271 H ILE 32 H ILE 32 7.951 -5.337 -2.701 272 HA ILE 32 HA ILE 32 8.957 -7.747 -4.008 273 HB ILE 32 HB ILE 32 6.202 -6.669 -3.508 274 HG12 ILE 32 2HG1 ILE 32 6.882 -9.507 -3.076 275 HG13 ILE 32 3HG1 ILE 32 7.786 -8.368 -2.084 276 HG21 ILE 32 1HG2 ILE 32 7.081 -8.481 -5.674 277 HG22 ILE 32 2HG2 ILE 32 5.624 -8.937 -4.792 278 HG23 ILE 32 3HG2 ILE 32 5.709 -7.374 -5.605 279 HD11 ILE 32 3HD1 ILE 32 5.162 -9.343 -1.709 280 HD12 ILE 32 1HD1 ILE 32 6.066 -8.203 -0.712 281 HD13 ILE 32 2HD1 ILE 32 5.054 -7.612 -2.030 282 H PHE 33 H PHE 33 9.993 -7.308 -5.860 283 HA PHE 33 HA PHE 33 8.827 -5.339 -7.700 284 HB2 PHE 33 2HB PHE 33 11.563 -6.622 -7.818 285 HB3 PHE 33 3HB PHE 33 10.989 -5.271 -8.790 286 HD1 PHE 33 HD2 PHE 33 9.618 -3.686 -6.670 287 HD2 PHE 33 HD1 PHE 33 13.374 -5.688 -6.686 288 HE1 PHE 33 HE2 PHE 33 10.460 -2.112 -4.977 289 HE2 PHE 33 HE1 PHE 33 14.222 -4.117 -4.992 290 HZ PHE 33 HZ PHE 33 12.765 -2.326 -4.136 291 H MET 34 H MET 34 7.414 -6.246 -9.052 292 HA MET 34 HA MET 34 7.670 -8.989 -9.904 293 HB2 MET 34 2HB MET 34 5.651 -6.830 -10.189 294 HB3 MET 34 3HB MET 34 5.669 -8.069 -11.437 295 HG2 MET 34 2HG MET 34 5.816 -9.444 -9.009 296 HG3 MET 34 3HG MET 34 4.617 -8.174 -8.772 297 HE1 MET 34 3HE MET 34 4.479 -10.480 -12.608 298 HE2 MET 34 1HE MET 34 5.911 -10.019 -11.688 299 HE3 MET 34 2HE MET 34 5.123 -11.565 -11.375 300 H PHE 35 H PHE 35 8.413 -9.738 -11.810 301 HA PHE 35 HA PHE 35 9.007 -7.825 -13.949 302 HB2 PHE 35 2HB PHE 35 11.241 -8.637 -14.250 303 HB3 PHE 35 3HB PHE 35 11.062 -8.213 -12.551 304 HD1 PHE 35 HD1 PHE 35 10.324 -10.196 -10.991 305 HD2 PHE 35 HD2 PHE 35 12.186 -10.659 -14.790 306 HE1 PHE 35 HE1 PHE 35 11.067 -12.452 -10.348 307 HE2 PHE 35 HE2 PHE 35 12.931 -12.916 -14.154 308 HZ PHE 35 HZ PHE 35 12.371 -13.815 -11.931 309 H GLU 36 H GLU 36 8.472 -8.551 -15.915 310 HA GLU 36 HA GLU 36 7.664 -11.366 -16.150 311 HB2 GLU 36 2HB GLU 36 6.252 -10.676 -17.995 312 HB3 GLU 36 3HB GLU 36 5.921 -9.671 -16.591 313 HG2 GLU 36 2HG GLU 36 6.188 -7.905 -17.894 314 HG3 GLU 36 3HG GLU 36 7.902 -8.306 -17.983 315 H VAL 37 H VAL 37 10.107 -9.240 -17.023 316 HA VAL 37 HA VAL 37 10.727 -10.345 -19.603 317 HB VAL 37 HB VAL 37 12.678 -8.822 -17.901 318 HG11 VAL 37 1HG1 VAL 37 13.788 -9.359 -19.815 319 HG12 VAL 37 2HG1 VAL 37 12.313 -9.435 -20.782 320 HG13 VAL 37 3HG1 VAL 37 13.010 -7.871 -20.356 321 HG21 VAL 37 3HG2 VAL 37 10.732 -7.488 -17.704 322 HG22 VAL 37 1HG2 VAL 37 11.702 -6.753 -18.980 323 HG23 VAL 37 2HG2 VAL 37 10.300 -7.739 -19.395 324 H GLY 38 H GLY 38 12.819 -11.397 -20.066 325 HA2 GLY 38 2HA GLY 38 13.237 -13.585 -18.219 326 HA3 GLY 38 3HA GLY 38 13.963 -13.405 -19.810 327 H ASP 39 H ASP 39 14.348 -10.572 -18.095 328 HA ASP 39 HA ASP 39 17.163 -11.124 -17.692 329 HB2 ASP 39 2HB ASP 39 15.447 -8.700 -17.770 330 HB3 ASP 39 3HB ASP 39 16.912 -8.609 -16.796 331 H PHE 40 H PHE 40 17.180 -12.573 -15.962 332 HA PHE 40 HA PHE 40 15.979 -11.766 -13.440 333 HB2 PHE 40 2HB PHE 40 16.473 -13.947 -12.654 334 HB3 PHE 40 3HB PHE 40 15.964 -14.153 -14.327 335 HD1 PHE 40 HD1 PHE 40 17.567 -14.760 -16.051 336 HD2 PHE 40 HD2 PHE 40 18.737 -14.372 -11.977 337 HE1 PHE 40 HE1 PHE 40 19.659 -15.959 -16.541 338 HE2 PHE 40 HE2 PHE 40 20.831 -15.569 -12.460 339 HZ PHE 40 HZ PHE 40 21.295 -16.364 -14.745 340 H SER 41 H SER 41 19.016 -11.644 -15.030 341 HA SER 41 HA SER 41 20.660 -11.521 -12.695 342 HB2 SER 41 2HB SER 41 22.416 -11.408 -14.145 343 HB3 SER 41 3HB SER 41 21.202 -11.945 -15.305 344 HG SER 41 HG SER 41 22.558 -9.976 -15.781 345 H ASN 42 H ASN 42 18.619 -9.306 -14.299 346 HA ASN 42 HA ASN 42 19.991 -6.943 -13.324 347 HB2 ASN 42 2HB ASN 42 17.755 -7.509 -15.166 348 HB3 ASN 42 3HB ASN 42 17.594 -6.026 -14.229 349 HD21 ASN 42 1HD2 ASN 42 19.332 -4.476 -14.353 350 HD22 ASN 42 2HD2 ASN 42 20.268 -4.363 -15.801 351 H ILE 43 H ILE 43 17.405 -9.039 -12.376 352 HA ILE 43 HA ILE 43 15.852 -7.448 -10.751 353 HB ILE 43 HB ILE 43 16.595 -10.329 -10.678 354 HG12 ILE 43 2HG1 ILE 43 14.781 -9.479 -12.124 355 HG13 ILE 43 3HG1 ILE 43 14.184 -10.614 -10.919 356 HG21 ILE 43 1HG2 ILE 43 16.672 -10.013 -8.370 357 HG22 ILE 43 2HG2 ILE 43 15.377 -8.817 -8.396 358 HG23 ILE 43 3HG2 ILE 43 15.009 -10.521 -8.667 359 HD11 ILE 43 3HD1 ILE 43 13.466 -7.860 -11.380 360 HD12 ILE 43 1HD1 ILE 43 12.648 -9.098 -10.428 361 HD13 ILE 43 2HD1 ILE 43 13.940 -8.139 -9.705 362 HA PRO 44 HA PRO 44 18.872 -8.250 -7.060 363 HB2 PRO 44 2HB PRO 44 21.297 -9.315 -7.653 364 HB3 PRO 44 3HB PRO 44 19.884 -10.303 -7.265 365 HG2 PRO 44 2HG PRO 44 21.036 -9.612 -9.941 366 HG3 PRO 44 3HG PRO 44 20.424 -11.170 -9.355 367 HD2 PRO 44 2HD PRO 44 18.966 -9.538 -10.950 368 HD3 PRO 44 3HD PRO 44 18.225 -10.586 -9.724 369 H LYS 45 H LYS 45 20.047 -7.219 -10.174 370 HA LYS 45 HA LYS 45 22.224 -5.644 -9.333 371 HB2 LYS 45 2HB LYS 45 21.297 -6.374 -11.740 372 HB3 LYS 45 3HB LYS 45 20.627 -4.749 -11.673 373 HG2 LYS 45 2HG LYS 45 23.300 -4.530 -10.842 374 HG3 LYS 45 3HG LYS 45 23.298 -5.585 -12.258 375 HD2 LYS 45 2HD LYS 45 21.756 -3.792 -13.302 376 HD3 LYS 45 3HD LYS 45 22.358 -2.748 -12.012 377 HE2 LYS 45 2HE LYS 45 24.667 -3.836 -12.961 378 HE3 LYS 45 3HE LYS 45 23.697 -3.735 -14.430 379 HZ1 LYS 45 3HZ LYS 45 23.256 -1.332 -13.392 380 HZ2 LYS 45 1HZ LYS 45 24.525 -1.657 -14.462 381 HZ3 LYS 45 2HZ LYS 45 24.815 -1.609 -12.797 382 H SER 46 H SER 46 18.787 -5.071 -9.384 383 HA SER 46 HA SER 46 18.915 -2.240 -9.084 384 HB2 SER 46 2HB SER 46 16.528 -3.486 -7.958 385 HB3 SER 46 3HB SER 46 16.677 -2.355 -9.303 386 HG SER 46 HG SER 46 15.910 -4.638 -9.700 387 H ALA 47 H ALA 47 18.316 -4.898 -6.793 388 HA ALA 47 HA ALA 47 18.090 -3.321 -4.488 389 HB1 ALA 47 1HB ALA 47 17.630 -5.868 -4.916 390 HB2 ALA 47 2HB ALA 47 19.280 -6.046 -4.317 391 HB3 ALA 47 3HB ALA 47 18.053 -5.285 -3.305 392 H GLU 48 H GLU 48 20.862 -4.352 -6.294 393 HA GLU 48 HA GLU 48 22.785 -3.964 -4.218 394 HB2 GLU 48 2HB GLU 48 23.107 -5.395 -6.270 395 HB3 GLU 48 3HB GLU 48 23.275 -3.911 -7.197 396 HG2 GLU 48 2HG GLU 48 25.043 -3.630 -5.066 397 HG3 GLU 48 3HG GLU 48 25.214 -5.304 -5.591 398 H PHE 49 H PHE 49 21.441 -1.964 -6.780 399 HA PHE 49 HA PHE 49 23.210 0.159 -6.773 400 HB2 PHE 49 2HB PHE 49 20.710 -0.372 -7.891 401 HB3 PHE 49 3HB PHE 49 20.460 1.082 -6.930 402 HD1 PHE 49 HD2 PHE 49 21.905 3.084 -7.355 403 HD2 PHE 49 HD1 PHE 49 21.855 -0.299 -9.938 404 HE1 PHE 49 HE2 PHE 49 22.911 4.440 -9.145 405 HE2 PHE 49 HE1 PHE 49 22.861 1.051 -11.732 406 HZ PHE 49 HZ PHE 49 23.389 3.424 -11.337 407 H ILE 50 H ILE 50 20.829 -0.735 -4.405 408 HA ILE 50 HA ILE 50 20.736 1.768 -3.045 409 HB ILE 50 HB ILE 50 20.111 -0.941 -1.875 410 HG12 ILE 50 2HG1 ILE 50 18.927 -0.523 -4.043 411 HG13 ILE 50 3HG1 ILE 50 17.849 -0.683 -2.661 412 HG21 ILE 50 1HG2 ILE 50 20.084 0.551 -0.114 413 HG22 ILE 50 2HG2 ILE 50 19.506 1.882 -1.114 414 HG23 ILE 50 3HG2 ILE 50 18.404 0.588 -0.647 415 HD11 ILE 50 3HD1 ILE 50 17.647 1.752 -2.552 416 HD12 ILE 50 1HD1 ILE 50 18.701 1.894 -3.958 417 HD13 ILE 50 2HD1 ILE 50 17.128 1.111 -4.111 418 H GLN 51 H GLN 51 22.581 -1.217 -2.602 419 HA GLN 51 HA GLN 51 24.803 0.069 -1.479 420 HB2 GLN 51 2HB GLN 51 22.858 0.030 0.378 421 HB3 GLN 51 3HB GLN 51 23.569 -1.550 0.677 422 HG2 GLN 51 2HG GLN 51 24.668 -0.100 2.140 423 HG3 GLN 51 3HG GLN 51 25.802 -0.357 0.815 424 HE21 GLN 51 1HE2 GLN 51 23.306 1.859 1.974 425 HE22 GLN 51 2HE2 GLN 51 24.024 3.289 1.324 426 H SER 52 H SER 52 26.528 -1.245 -1.621 427 HA SER 52 HA SER 52 26.436 -3.672 -2.924 428 HB2 SER 52 2HB SER 52 28.762 -4.029 -2.034 429 HB3 SER 52 3HB SER 52 28.507 -2.453 -2.784 430 HG SER 52 HG SER 52 28.475 -1.508 -0.805 431 H LYS 53 H LYS 53 26.091 -2.994 0.479 432 HA LYS 53 HA LYS 53 25.498 -5.835 0.934 433 HB2 LYS 53 2HB LYS 53 26.544 -5.567 3.224 434 HB3 LYS 53 3HB LYS 53 27.666 -5.608 1.870 435 HG2 LYS 53 2HG LYS 53 28.367 -3.504 2.219 436 HG3 LYS 53 3HG LYS 53 26.756 -2.926 2.649 437 HD2 LYS 53 2HD LYS 53 27.604 -2.802 4.729 438 HD3 LYS 53 3HD LYS 53 27.320 -4.544 4.760 439 HE2 LYS 53 2HE LYS 53 29.884 -3.526 3.635 440 HE3 LYS 53 3HE LYS 53 29.669 -3.524 5.384 441 HZ1 LYS 53 3HZ LYS 53 30.123 -5.675 5.412 442 HZ2 LYS 53 1HZ LYS 53 30.352 -5.671 3.736 443 HZ3 LYS 53 2HZ LYS 53 28.823 -6.001 4.380 444 H GLY 54 H GLY 54 23.540 -6.113 1.776 445 HA2 GLY 54 2HA GLY 54 22.244 -5.309 3.866 446 HA3 GLY 54 3HA GLY 54 22.208 -3.787 2.987 447 H HIS 55 H HIS 55 22.096 -5.870 0.566 448 HA HIS 55 HA HIS 55 19.155 -6.015 0.613 449 HB2 HIS 55 2HB HIS 55 19.238 -5.944 -1.831 450 HB3 HIS 55 3HB HIS 55 20.068 -4.552 -1.142 451 HD1 HIS 55 HD1 HIS 55 22.783 -4.827 -1.052 452 HD2 HIS 55 HD2 HIS 55 20.710 -7.330 -3.641 453 HE1 HIS 55 HE1 HIS 55 24.501 -5.687 -2.676 454 H GLU 56 H GLU 56 18.361 -7.981 0.907 455 HA GLU 56 HA GLU 56 19.730 -10.262 -0.339 456 HB2 GLU 56 2HB GLU 56 19.750 -9.791 2.389 457 HB3 GLU 56 3HB GLU 56 18.431 -10.934 2.187 458 HG2 GLU 56 2HG GLU 56 20.884 -11.611 0.730 459 HG3 GLU 56 3HG GLU 56 21.030 -11.615 2.486 460 H LEU 57 H LEU 57 18.411 -11.443 -1.553 461 HA LEU 57 HA LEU 57 15.597 -10.865 -1.624 462 HB2 LEU 57 2HB LEU 57 17.272 -12.879 -3.113 463 HB3 LEU 57 3HB LEU 57 15.560 -12.590 -3.416 464 HG LEU 57 HG LEU 57 16.691 -11.428 -5.108 465 HD11 LEU 57 1HD1 LEU 57 15.033 -10.127 -3.468 466 HD12 LEU 57 2HD1 LEU 57 15.774 -9.373 -4.879 467 HD13 LEU 57 3HD1 LEU 57 16.466 -9.117 -3.278 468 HD21 LEU 57 3HD2 LEU 57 18.669 -10.254 -4.912 469 HD22 LEU 57 1HD2 LEU 57 18.899 -11.552 -3.739 470 HD23 LEU 57 2HD2 LEU 57 18.436 -9.940 -3.191 471 H LEU 58 H LEU 58 14.448 -11.609 0.067 472 HA LEU 58 HA LEU 58 14.929 -13.839 1.621 473 HB2 LEU 58 2HB LEU 58 12.847 -11.936 1.300 474 HB3 LEU 58 3HB LEU 58 12.113 -13.537 1.372 475 HG LEU 58 HG LEU 58 14.117 -13.013 3.455 476 HD11 LEU 58 1HD1 LEU 58 11.482 -11.684 3.857 477 HD12 LEU 58 2HD1 LEU 58 12.763 -10.816 3.011 478 HD13 LEU 58 3HD1 LEU 58 13.027 -11.394 4.656 479 HD21 LEU 58 3HD2 LEU 58 12.927 -14.991 3.702 480 HD22 LEU 58 1HD2 LEU 58 11.399 -14.249 3.225 481 HD23 LEU 58 2HD2 LEU 58 12.099 -13.890 4.805 482 H ASN 59 H ASN 59 12.915 -13.591 -1.292 483 HA ASN 59 HA ASN 59 12.906 -16.535 -1.428 484 HB2 ASN 59 2HB ASN 59 10.673 -15.242 -1.100 485 HB3 ASN 59 3HB ASN 59 10.853 -14.823 -2.801 486 HD21 ASN 59 1HD2 ASN 59 9.976 -16.157 -4.202 487 HD22 ASN 59 2HD2 ASN 59 9.578 -17.815 -3.918 488 H SER 60 H SER 60 13.702 -17.478 -3.213 489 HA SER 60 HA SER 60 15.190 -15.947 -5.076 490 HB2 SER 60 2HB SER 60 16.168 -17.988 -5.019 491 HB3 SER 60 3HB SER 60 14.669 -18.798 -4.566 492 HG SER 60 HG SER 60 15.577 -19.265 -6.728 493 H LEU 61 H LEU 61 14.435 -14.840 -6.743 494 HA LEU 61 HA LEU 61 11.827 -14.767 -7.629 495 HB2 LEU 61 2HB LEU 61 12.890 -13.881 -9.805 496 HB3 LEU 61 3HB LEU 61 13.117 -12.981 -8.307 497 HG LEU 61 HG LEU 61 15.235 -14.928 -8.929 498 HD11 LEU 61 1HD1 LEU 61 14.967 -12.422 -10.580 499 HD12 LEU 61 2HD1 LEU 61 14.661 -14.053 -11.175 500 HD13 LEU 61 3HD1 LEU 61 16.278 -13.601 -10.637 501 HD21 LEU 61 3HD2 LEU 61 14.888 -12.287 -7.664 502 HD22 LEU 61 1HD2 LEU 61 16.427 -12.555 -8.484 503 HD23 LEU 61 2HD2 LEU 61 15.911 -13.648 -7.199 504 H ARG 62 H ARG 62 10.584 -16.020 -8.866 505 HA ARG 62 HA ARG 62 11.696 -18.462 -9.954 506 HB2 ARG 62 2HB ARG 62 9.353 -17.978 -8.747 507 HB3 ARG 62 3HB ARG 62 8.851 -17.743 -10.416 508 HG2 ARG 62 2HG ARG 62 8.441 -19.956 -10.267 509 HG3 ARG 62 3HG ARG 62 10.150 -20.055 -10.697 510 HD2 ARG 62 2HD ARG 62 10.797 -20.498 -8.494 511 HD3 ARG 62 3HD ARG 62 9.268 -19.919 -7.834 512 HE ARG 62 HE ARG 62 8.810 -22.148 -9.500 513 HH11 ARG 62 1HH1 ARG 62 10.141 -21.303 -6.396 514 HH12 ARG 62 2HH1 ARG 62 9.789 -22.841 -5.680 515 HH21 ARG 62 1HH2 ARG 62 8.342 -24.178 -8.569 516 HH22 ARG 62 2HH2 ARG 62 8.767 -24.476 -6.918 517 H PHE 63 H PHE 63 12.822 -16.452 -11.327 518 HA PHE 63 HA PHE 63 11.584 -15.365 -13.524 519 HB2 PHE 63 2HB PHE 63 13.716 -14.585 -13.433 520 HB3 PHE 63 3HB PHE 63 14.360 -16.115 -12.848 521 HD1 PHE 63 HD2 PHE 63 12.578 -15.097 -15.966 522 HD2 PHE 63 HD1 PHE 63 16.033 -16.866 -14.219 523 HE1 PHE 63 HE2 PHE 63 13.462 -15.578 -18.211 524 HE2 PHE 63 HE1 PHE 63 16.923 -17.349 -16.461 525 HZ PHE 63 HZ PHE 63 15.637 -16.706 -18.461 526 H ASN 64 H ASN 64 12.922 -18.615 -13.165 527 HA ASN 64 HA ASN 64 12.855 -19.568 -15.721 528 HB2 ASN 64 2HB ASN 64 12.367 -20.814 -13.059 529 HB3 ASN 64 3HB ASN 64 11.962 -21.760 -14.488 530 HD21 ASN 64 1HD2 ASN 64 14.086 -22.006 -12.406 531 HD22 ASN 64 2HD2 ASN 64 15.562 -22.128 -13.296 532 H GLN 65 H GLN 65 10.150 -18.782 -13.681 533 HA GLN 65 HA GLN 65 8.275 -19.924 -15.624 534 HB2 GLN 65 2HB GLN 65 8.262 -19.795 -12.822 535 HB3 GLN 65 3HB GLN 65 7.017 -18.669 -13.346 536 HG2 GLN 65 2HG GLN 65 6.300 -20.663 -14.885 537 HG3 GLN 65 3HG GLN 65 7.175 -21.619 -13.690 538 HE21 GLN 65 1HE2 GLN 65 4.255 -20.214 -14.482 539 HE22 GLN 65 2HE2 GLN 65 3.476 -20.336 -12.945 540 H ALA 66 H ALA 66 6.087 -18.338 -15.290 541 HA ALA 66 HA ALA 66 6.641 -16.161 -16.999 542 HB1 ALA 66 1HB ALA 66 4.158 -16.414 -15.328 543 HB2 ALA 66 2HB ALA 66 4.343 -15.683 -16.923 544 HB3 ALA 66 3HB ALA 66 4.453 -17.434 -16.737 545 H ASP 67 H ASP 67 5.326 -13.980 -16.167 546 HA ASP 67 HA ASP 67 7.111 -12.509 -14.723 547 HB2 ASP 67 2HB ASP 67 5.317 -10.893 -14.324 548 HB3 ASP 67 3HB ASP 67 5.225 -11.533 -15.963 549 H TRP 68 H TRP 68 7.939 -12.982 -12.795 550 HA TRP 68 HA TRP 68 6.113 -13.884 -10.668 551 HB2 TRP 68 2HB TRP 68 8.341 -15.158 -11.547 552 HB3 TRP 68 3HB TRP 68 9.027 -14.171 -10.259 553 HD1 TRP 68 HD1 TRP 68 8.912 -15.195 -7.914 554 HE1 TRP 68 HE1 TRP 68 7.591 -17.104 -6.802 555 HE3 TRP 68 HE3 TRP 68 5.805 -16.399 -11.792 556 HZ2 TRP 68 HZ2 TRP 68 5.508 -18.885 -7.479 557 HZ3 TRP 68 HZ3 TRP 68 4.177 -18.218 -11.478 558 HH2 TRP 68 HH2 TRP 68 4.034 -19.434 -9.366 559 H THR 69 H THR 69 7.348 -13.365 -8.415 560 HA THR 69 HA THR 69 7.967 -10.483 -8.472 561 HB THR 69 HB THR 69 6.537 -10.008 -6.771 562 HG1 THR 69 HG1 THR 69 6.028 -11.545 -5.113 563 HG21 THR 69 3HG2 THR 69 5.328 -11.369 -8.648 564 HG22 THR 69 1HG2 THR 69 4.463 -10.952 -7.170 565 HG23 THR 69 2HG2 THR 69 5.124 -12.573 -7.377 566 H ILE 70 H ILE 70 9.578 -9.745 -7.130 567 HA ILE 70 HA ILE 70 11.069 -11.803 -5.635 568 HB ILE 70 HB ILE 70 12.342 -11.194 -7.600 569 HG12 ILE 70 2HG1 ILE 70 14.405 -10.413 -6.528 570 HG13 ILE 70 3HG1 ILE 70 13.482 -9.852 -5.137 571 HG21 ILE 70 1HG2 ILE 70 11.267 -8.616 -7.108 572 HG22 ILE 70 2HG2 ILE 70 13.025 -8.489 -7.081 573 HG23 ILE 70 3HG2 ILE 70 12.213 -9.167 -8.491 574 HD11 ILE 70 3HD1 ILE 70 13.512 -11.863 -4.211 575 HD12 ILE 70 1HD1 ILE 70 12.970 -12.638 -5.699 576 HD13 ILE 70 2HD1 ILE 70 14.686 -12.319 -5.445 577 H VAL 71 H VAL 71 11.175 -11.429 -3.530 578 HA VAL 71 HA VAL 71 10.503 -8.790 -2.495 579 HB VAL 71 HB VAL 71 10.435 -9.878 -0.293 580 HG11 VAL 71 1HG1 VAL 71 8.700 -11.767 -1.170 581 HG12 VAL 71 2HG1 VAL 71 8.320 -10.049 -1.041 582 HG13 VAL 71 3HG1 VAL 71 8.815 -10.730 -2.592 583 HG21 VAL 71 3HG2 VAL 71 10.636 -12.364 -0.194 584 HG22 VAL 71 1HG2 VAL 71 11.280 -12.326 -1.835 585 HG23 VAL 71 2HG2 VAL 71 12.154 -11.530 -0.526 586 H VAL 72 H VAL 72 11.929 -7.400 -1.662 587 HA VAL 72 HA VAL 72 14.666 -8.365 -1.137 588 HB VAL 72 HB VAL 72 13.958 -5.601 -2.120 589 HG11 VAL 72 1HG1 VAL 72 16.237 -5.195 -2.273 590 HG12 VAL 72 2HG1 VAL 72 16.110 -6.123 -0.778 591 HG13 VAL 72 3HG1 VAL 72 16.646 -6.910 -2.263 592 HG21 VAL 72 3HG2 VAL 72 14.099 -8.064 -3.582 593 HG22 VAL 72 1HG2 VAL 72 13.732 -6.440 -4.165 594 HG23 VAL 72 2HG2 VAL 72 15.405 -6.992 -4.087 595 H ARG 73 H ARG 73 15.385 -8.050 0.863 596 HA ARG 73 HA ARG 73 13.844 -6.312 2.646 597 HB2 ARG 73 2HB ARG 73 15.153 -7.499 4.450 598 HB3 ARG 73 3HB ARG 73 14.063 -8.513 3.514 599 HG2 ARG 73 2HG ARG 73 15.725 -9.807 2.804 600 HG3 ARG 73 3HG ARG 73 16.724 -8.419 2.367 601 HD2 ARG 73 2HD ARG 73 17.994 -9.376 4.027 602 HD3 ARG 73 3HD ARG 73 17.047 -8.211 4.951 603 HE ARG 73 HE ARG 73 15.650 -10.627 4.917 604 HH11 ARG 73 1HH1 ARG 73 18.618 -9.315 6.179 605 HH12 ARG 73 2HH1 ARG 73 18.663 -10.384 7.541 606 HH21 ARG 73 1HH2 ARG 73 15.699 -12.040 6.707 607 HH22 ARG 73 2HH2 ARG 73 17.003 -11.934 7.841 608 H LYS 74 H LYS 74 14.577 -4.329 2.977 609 HA LYS 74 HA LYS 74 17.244 -3.549 2.284 610 HB2 LYS 74 2HB LYS 74 14.967 -2.075 3.611 611 HB3 LYS 74 3HB LYS 74 16.516 -1.326 3.245 612 HG2 LYS 74 2HG LYS 74 16.082 -1.187 1.037 613 HG3 LYS 74 3HG LYS 74 15.183 -2.707 1.006 614 HD2 LYS 74 2HD LYS 74 14.154 -0.116 2.162 615 HD3 LYS 74 3HD LYS 74 13.766 -0.727 0.552 616 HE2 LYS 74 2HE LYS 74 13.322 -2.670 2.690 617 HE3 LYS 74 3HE LYS 74 12.333 -1.218 2.838 618 HZ1 LYS 74 3HZ LYS 74 12.444 -3.113 0.564 619 HZ2 LYS 74 1HZ LYS 74 11.721 -1.588 0.445 620 HZ3 LYS 74 2HZ LYS 74 11.113 -2.730 1.535 621 H LYS 75 H LYS 75 18.860 -2.746 3.665 622 HA LYS 75 HA LYS 75 18.709 -2.578 6.448 623 HB2 LYS 75 2HB LYS 75 18.833 -5.260 5.512 624 HB3 LYS 75 3HB LYS 75 20.387 -4.882 6.244 625 HG2 LYS 75 2HG LYS 75 18.534 -3.862 8.031 626 HG3 LYS 75 3HG LYS 75 17.826 -5.385 7.488 627 HD2 LYS 75 2HD LYS 75 20.709 -5.292 8.268 628 HD3 LYS 75 3HD LYS 75 19.468 -5.345 9.523 629 HE2 LYS 75 2HE LYS 75 18.546 -7.380 8.502 630 HE3 LYS 75 3HE LYS 75 19.809 -7.328 7.273 631 HZ1 LYS 75 3HZ LYS 75 19.925 -8.341 9.931 632 HZ2 LYS 75 1HZ LYS 75 21.141 -7.196 9.665 633 HZ3 LYS 75 2HZ LYS 75 21.017 -8.548 8.656 634 H ALA 76 H ALA 76 21.136 -3.052 7.368 635 HA ALA 76 HA ALA 76 22.895 -1.551 5.546 636 HB1 ALA 76 1HB ALA 76 22.405 -1.422 8.443 637 HB2 ALA 76 2HB ALA 76 24.096 -1.297 7.956 638 HB3 ALA 76 3HB ALA 76 22.908 -0.162 7.316 Start of MODEL 14 1 H1 MET 1 H MET 1 -0.381 -3.913 -1.359 2 HA MET 1 HA MET 1 1.093 -2.046 -2.048 3 HB2 MET 1 2HB MET 1 1.199 -2.468 0.940 4 HB3 MET 1 3HB MET 1 1.267 -0.935 0.080 5 HG2 MET 1 2HG MET 1 -0.921 -0.764 0.311 6 HG3 MET 1 3HG MET 1 -1.107 -2.164 -0.742 7 HE1 MET 1 3HE MET 1 -2.794 -0.908 1.999 8 HE2 MET 1 1HE MET 1 -2.468 -1.850 3.454 9 HE3 MET 1 2HE MET 1 -1.246 -0.741 2.830 10 H LYS 2 H LYS 2 3.124 -0.982 -0.611 11 HA LYS 2 HA LYS 2 5.418 -0.935 -0.812 12 HB2 LYS 2 2HB LYS 2 6.499 -2.545 0.717 13 HB3 LYS 2 3HB LYS 2 5.086 -1.785 1.438 14 HG2 LYS 2 2HG LYS 2 3.766 -3.771 1.010 15 HG3 LYS 2 3HG LYS 2 5.139 -4.533 0.204 16 HD2 LYS 2 2HD LYS 2 6.410 -4.293 2.355 17 HD3 LYS 2 3HD LYS 2 4.902 -3.774 3.113 18 HE2 LYS 2 2HE LYS 2 4.712 -6.262 1.566 19 HE3 LYS 2 3HE LYS 2 5.771 -6.350 2.972 20 HZ1 LYS 2 3HZ LYS 2 4.052 -6.174 4.385 21 HZ2 LYS 2 1HZ LYS 2 3.135 -6.724 3.073 22 HZ3 LYS 2 2HZ LYS 2 3.209 -5.070 3.419 23 H ARG 3 H ARG 3 4.501 -1.857 -3.175 24 HA ARG 3 HA ARG 3 6.572 -3.781 -3.914 25 HB2 ARG 3 2HB ARG 3 5.104 -5.193 -5.145 26 HB3 ARG 3 3HB ARG 3 4.398 -5.004 -3.545 27 HG2 ARG 3 2HG ARG 3 3.351 -2.952 -5.188 28 HG3 ARG 3 3HG ARG 3 3.238 -4.471 -6.079 29 HD2 ARG 3 2HD ARG 3 2.145 -3.863 -3.338 30 HD3 ARG 3 3HD ARG 3 1.229 -4.196 -4.807 31 HE ARG 3 HE ARG 3 2.340 -6.110 -3.015 32 HH11 ARG 3 1HH1 ARG 3 1.580 -5.530 -6.363 33 HH12 ARG 3 2HH1 ARG 3 1.406 -7.210 -6.750 34 HH21 ARG 3 1HH2 ARG 3 2.115 -8.325 -3.512 35 HH22 ARG 3 2HH2 ARG 3 1.710 -8.799 -5.128 36 H PHE 4 H PHE 4 6.967 -3.836 -6.255 37 HA PHE 4 HA PHE 4 6.103 -1.376 -7.619 38 HB2 PHE 4 2HB PHE 4 8.674 -1.834 -6.664 39 HB3 PHE 4 3HB PHE 4 8.781 -2.231 -8.376 40 HD1 PHE 4 HD2 PHE 4 7.034 0.392 -6.371 41 HD2 PHE 4 HD1 PHE 4 9.618 -0.513 -9.630 42 HE1 PHE 4 HE2 PHE 4 7.187 2.788 -6.911 43 HE2 PHE 4 HE1 PHE 4 9.775 1.881 -10.175 44 HZ PHE 4 HZ PHE 4 8.557 3.535 -8.816 45 H ASP 5 H ASP 5 5.004 -1.909 -9.375 46 HA ASP 5 HA ASP 5 5.307 -4.506 -10.602 47 HB2 ASP 5 2HB ASP 5 3.305 -2.433 -10.544 48 HB3 ASP 5 3HB ASP 5 3.645 -2.897 -12.209 49 H LEU 6 H LEU 6 7.422 -4.431 -11.432 50 HA LEU 6 HA LEU 6 8.173 -2.388 -13.323 51 HB2 LEU 6 2HB LEU 6 9.464 -4.815 -12.172 52 HB3 LEU 6 3HB LEU 6 10.117 -4.126 -13.657 53 HG LEU 6 HG LEU 6 11.425 -3.202 -11.960 54 HD11 LEU 6 1HD1 LEU 6 9.415 -1.014 -12.075 55 HD12 LEU 6 2HD1 LEU 6 10.131 -1.582 -13.583 56 HD13 LEU 6 3HD1 LEU 6 11.164 -0.958 -12.297 57 HD21 LEU 6 3HD2 LEU 6 9.020 -2.359 -10.376 58 HD22 LEU 6 1HD2 LEU 6 10.701 -2.487 -9.857 59 HD23 LEU 6 2HD2 LEU 6 9.759 -3.947 -10.162 60 H ARG 7 H ARG 7 6.263 -5.096 -13.499 61 HA ARG 7 HA ARG 7 6.930 -6.451 -15.786 62 HB2 ARG 7 2HB ARG 7 4.544 -6.042 -14.226 63 HB3 ARG 7 3HB ARG 7 4.142 -6.077 -15.937 64 HG2 ARG 7 2HG ARG 7 4.647 -8.266 -16.153 65 HG3 ARG 7 3HG ARG 7 5.969 -8.188 -14.986 66 HD2 ARG 7 2HD ARG 7 4.599 -9.221 -13.562 67 HD3 ARG 7 3HD ARG 7 3.722 -7.695 -13.460 68 HE ARG 7 HE ARG 7 2.897 -10.093 -14.846 69 HH11 ARG 7 1HH1 ARG 7 2.463 -6.659 -14.467 70 HH12 ARG 7 2HH1 ARG 7 0.857 -6.659 -15.118 71 HH21 ARG 7 1HH2 ARG 7 0.783 -10.105 -15.704 72 HH22 ARG 7 2HH2 ARG 7 -0.098 -8.619 -15.820 73 HA PRO 8 HA PRO 8 4.598 -3.279 -18.562 74 HB2 PRO 8 2HB PRO 8 3.656 -1.018 -17.391 75 HB3 PRO 8 3HB PRO 8 2.712 -2.508 -17.500 76 HG2 PRO 8 2HG PRO 8 4.291 -1.429 -15.196 77 HG3 PRO 8 3HG PRO 8 2.683 -2.176 -15.198 78 HD2 PRO 8 2HD PRO 8 4.917 -3.529 -14.483 79 HD3 PRO 8 3HD PRO 8 3.538 -4.315 -15.280 80 H LEU 9 H LEU 9 6.981 -2.611 -16.286 81 HA LEU 9 HA LEU 9 7.861 -0.125 -17.518 82 HB2 LEU 9 2HB LEU 9 8.301 -1.495 -15.010 83 HB3 LEU 9 3HB LEU 9 9.823 -0.988 -15.740 84 HG LEU 9 HG LEU 9 8.190 1.253 -15.928 85 HD11 LEU 9 1HD1 LEU 9 7.507 -0.372 -13.556 86 HD12 LEU 9 2HD1 LEU 9 6.547 0.816 -14.437 87 HD13 LEU 9 3HD1 LEU 9 7.776 1.351 -13.291 88 HD21 LEU 9 3HD2 LEU 9 10.521 0.376 -14.325 89 HD22 LEU 9 1HD2 LEU 9 9.688 1.841 -13.804 90 HD23 LEU 9 2HD2 LEU 9 10.352 1.736 -15.435 91 H LYS 10 H LYS 10 7.872 -2.818 -18.884 92 HA LYS 10 HA LYS 10 9.262 -4.149 -20.135 93 HB2 LYS 10 2HB LYS 10 10.527 -2.925 -21.741 94 HB3 LYS 10 3HB LYS 10 9.114 -1.950 -21.357 95 HG2 LYS 10 2HG LYS 10 10.408 -0.485 -19.987 96 HG3 LYS 10 3HG LYS 10 11.820 -1.537 -20.108 97 HD2 LYS 10 2HD LYS 10 12.425 -0.128 -21.758 98 HD3 LYS 10 3HD LYS 10 11.298 -1.079 -22.728 99 HE2 LYS 10 2HE LYS 10 9.525 0.599 -21.863 100 HE3 LYS 10 3HE LYS 10 10.913 1.612 -21.470 101 HZ1 LYS 10 3HZ LYS 10 11.513 1.783 -23.697 102 HZ2 LYS 10 1HZ LYS 10 9.827 1.916 -23.736 103 HZ3 LYS 10 2HZ LYS 10 10.570 0.460 -24.168 104 H ALA 11 H ALA 11 11.960 -3.873 -20.831 105 HA ALA 11 HA ALA 11 13.254 -4.421 -18.241 106 HB1 ALA 11 1HB ALA 11 13.320 -6.429 -19.396 107 HB2 ALA 11 2HB ALA 11 13.595 -5.644 -20.951 108 HB3 ALA 11 3HB ALA 11 14.894 -5.722 -19.761 109 H GLY 12 H GLY 12 15.486 -3.819 -17.992 110 HA2 GLY 12 2HA GLY 12 17.436 -2.633 -18.653 111 HA3 GLY 12 3HA GLY 12 16.494 -1.835 -19.903 112 H ILE 13 H ILE 13 14.392 -0.786 -18.571 113 HA ILE 13 HA ILE 13 15.695 1.261 -16.947 114 HB ILE 13 HB ILE 13 12.815 1.333 -17.789 115 HG12 ILE 13 2HG1 ILE 13 15.214 2.126 -19.455 116 HG13 ILE 13 3HG1 ILE 13 14.075 0.834 -19.817 117 HG21 ILE 13 1HG2 ILE 13 14.851 3.516 -17.368 118 HG22 ILE 13 2HG2 ILE 13 13.129 3.727 -17.683 119 HG23 ILE 13 3HG2 ILE 13 13.665 2.991 -16.173 120 HD11 ILE 13 3HD1 ILE 13 13.037 2.339 -21.077 121 HD12 ILE 13 1HD1 ILE 13 12.445 3.020 -19.562 122 HD13 ILE 13 2HD1 ILE 13 13.889 3.687 -20.324 123 H PHE 14 H PHE 14 13.620 -1.450 -16.623 124 HA PHE 14 HA PHE 14 12.177 -0.733 -14.321 125 HB2 PHE 14 2HB PHE 14 11.551 -2.983 -14.172 126 HB3 PHE 14 3HB PHE 14 11.876 -2.768 -15.889 127 HD1 PHE 14 HD1 PHE 14 14.490 -3.181 -16.467 128 HD2 PHE 14 HD2 PHE 14 12.324 -4.921 -13.243 129 HE1 PHE 14 HE1 PHE 14 16.097 -5.043 -16.397 130 HE2 PHE 14 HE2 PHE 14 13.928 -6.785 -13.167 131 HZ PHE 14 HZ PHE 14 15.818 -6.847 -14.745 132 H GLU 15 H GLU 15 15.437 -1.890 -14.775 133 HA GLU 15 HA GLU 15 15.865 -2.493 -11.992 134 HB2 GLU 15 2HB GLU 15 17.128 -3.744 -13.606 135 HB3 GLU 15 3HB GLU 15 17.742 -2.272 -14.346 136 HG2 GLU 15 2HG GLU 15 18.348 -2.537 -11.495 137 HG3 GLU 15 3HG GLU 15 19.072 -3.775 -12.520 138 H ARG 16 H ARG 16 15.886 0.314 -13.907 139 HA ARG 16 HA ARG 16 17.742 1.763 -12.200 140 HB2 ARG 16 2HB ARG 16 16.475 2.198 -14.816 141 HB3 ARG 16 3HB ARG 16 16.603 3.647 -13.827 142 HG2 ARG 16 2HG ARG 16 18.822 3.777 -14.084 143 HG3 ARG 16 3HG ARG 16 19.043 2.033 -13.928 144 HD2 ARG 16 2HD ARG 16 19.206 1.808 -16.132 145 HD3 ARG 16 3HD ARG 16 17.660 2.623 -16.368 146 HE ARG 16 HE ARG 16 18.795 4.520 -16.949 147 HH11 ARG 16 1HH1 ARG 16 20.975 2.351 -15.318 148 HH12 ARG 16 2HH1 ARG 16 22.381 3.312 -15.642 149 HH21 ARG 16 1HH2 ARG 16 20.638 5.793 -17.383 150 HH22 ARG 16 2HH2 ARG 16 22.187 5.269 -16.816 151 H LEU 17 H LEU 17 14.286 1.623 -12.887 152 HA LEU 17 HA LEU 17 13.600 3.821 -11.197 153 HB2 LEU 17 2HB LEU 17 12.264 2.030 -12.987 154 HB3 LEU 17 3HB LEU 17 11.382 2.101 -11.463 155 HG LEU 17 HG LEU 17 10.455 3.698 -13.007 156 HD11 LEU 17 1HD1 LEU 17 10.699 4.266 -10.566 157 HD12 LEU 17 2HD1 LEU 17 10.499 5.639 -11.654 158 HD13 LEU 17 3HD1 LEU 17 12.095 5.245 -11.016 159 HD21 LEU 17 3HD2 LEU 17 11.777 4.591 -14.554 160 HD22 LEU 17 1HD2 LEU 17 13.229 4.146 -13.657 161 HD23 LEU 17 2HD2 LEU 17 12.406 5.665 -13.303 162 H GLU 18 H GLU 18 14.018 0.390 -10.748 163 HA GLU 18 HA GLU 18 12.607 -0.018 -8.389 164 HB2 GLU 18 2HB GLU 18 14.271 -1.534 -9.970 165 HB3 GLU 18 3HB GLU 18 15.190 -1.397 -8.478 166 HG2 GLU 18 2HG GLU 18 13.733 -2.657 -7.298 167 HG3 GLU 18 3HG GLU 18 12.334 -2.094 -8.210 168 H GLU 19 H GLU 19 15.639 1.595 -8.943 169 HA GLU 19 HA GLU 19 16.413 1.619 -6.168 170 HB2 GLU 19 2HB GLU 19 18.212 1.658 -7.702 171 HB3 GLU 19 3HB GLU 19 17.485 2.951 -8.645 172 HG2 GLU 19 2HG GLU 19 17.990 3.701 -5.879 173 HG3 GLU 19 3HG GLU 19 19.448 3.240 -6.756 174 H LEU 20 H LEU 20 14.716 3.729 -8.379 175 HA LEU 20 HA LEU 20 14.828 6.101 -6.868 176 HB2 LEU 20 2HB LEU 20 13.445 5.120 -9.202 177 HB3 LEU 20 3HB LEU 20 12.374 6.098 -8.201 178 HG LEU 20 HG LEU 20 14.551 7.701 -8.309 179 HD11 LEU 20 1HD1 LEU 20 15.404 7.725 -10.576 180 HD12 LEU 20 2HD1 LEU 20 14.414 6.325 -10.988 181 HD13 LEU 20 3HD1 LEU 20 15.726 6.163 -9.821 182 HD21 LEU 20 3HD2 LEU 20 13.297 8.796 -10.267 183 HD22 LEU 20 1HD2 LEU 20 12.444 8.603 -8.736 184 HD23 LEU 20 2HD2 LEU 20 12.130 7.489 -10.066 185 H ILE 21 H ILE 21 12.809 3.264 -6.652 186 HA ILE 21 HA ILE 21 10.977 4.512 -4.778 187 HB ILE 21 HB ILE 21 10.086 2.887 -6.367 188 HG12 ILE 21 2HG1 ILE 21 8.838 1.494 -4.784 189 HG13 ILE 21 3HG1 ILE 21 10.023 1.837 -3.529 190 HG21 ILE 21 1HG2 ILE 21 10.649 0.483 -6.105 191 HG22 ILE 21 2HG2 ILE 21 11.994 1.466 -6.682 192 HG23 ILE 21 3HG2 ILE 21 11.941 0.947 -4.997 193 HD11 ILE 21 3HD1 ILE 21 7.713 3.152 -3.780 194 HD12 ILE 21 1HD1 ILE 21 9.171 3.874 -3.098 195 HD13 ILE 21 2HD1 ILE 21 8.743 4.174 -4.783 196 H GLU 22 H GLU 22 13.766 2.420 -4.744 197 HA GLU 22 HA GLU 22 13.529 1.306 -2.197 198 HB2 GLU 22 2HB GLU 22 15.515 1.458 -4.224 199 HB3 GLU 22 3HB GLU 22 16.274 1.916 -2.706 200 HG2 GLU 22 2HG GLU 22 16.390 -0.516 -3.286 201 HG3 GLU 22 3HG GLU 22 15.724 -0.145 -1.697 202 H LYS 23 H LYS 23 14.419 4.508 -3.202 203 HA LYS 23 HA LYS 23 15.709 5.343 -0.826 204 HB2 LYS 23 2HB LYS 23 14.669 6.606 -3.267 205 HB3 LYS 23 3HB LYS 23 14.620 7.641 -1.847 206 HG2 LYS 23 2HG LYS 23 17.062 7.022 -1.505 207 HG3 LYS 23 3HG LYS 23 17.006 6.366 -3.143 208 HD2 LYS 23 2HD LYS 23 16.224 9.192 -2.440 209 HD3 LYS 23 3HD LYS 23 17.840 8.726 -2.976 210 HE2 LYS 23 2HE LYS 23 15.817 7.664 -4.737 211 HE3 LYS 23 3HE LYS 23 15.653 9.411 -4.574 212 HZ1 LYS 23 3HZ LYS 23 18.175 9.414 -4.987 213 HZ2 LYS 23 1HZ LYS 23 17.142 9.177 -6.305 214 HZ3 LYS 23 2HZ LYS 23 17.936 7.858 -5.605 215 H GLU 24 H GLU 24 12.353 5.182 -1.812 216 HA GLU 24 HA GLU 24 11.412 6.700 0.456 217 HB2 GLU 24 2HB GLU 24 10.355 6.013 -2.026 218 HB3 GLU 24 3HB GLU 24 9.399 5.085 -0.880 219 HG2 GLU 24 2HG GLU 24 9.793 7.844 -0.053 220 HG3 GLU 24 3HG GLU 24 8.973 7.696 -1.606 221 H MET 25 H MET 25 11.493 3.304 -0.538 222 HA MET 25 HA MET 25 10.001 2.155 1.477 223 HB2 MET 25 2HB MET 25 12.521 1.074 0.202 224 HB3 MET 25 3HB MET 25 11.365 0.121 1.122 225 HG2 MET 25 2HG MET 25 10.783 1.583 -1.444 226 HG3 MET 25 3HG MET 25 11.072 -0.148 -1.285 227 HE1 MET 25 3HE MET 25 8.291 -1.640 0.444 228 HE2 MET 25 1HE MET 25 9.995 -1.289 0.735 229 HE3 MET 25 2HE MET 25 8.754 -0.498 1.706 230 H GLN 26 H GLN 26 10.458 1.319 3.521 231 HA GLN 26 HA GLN 26 12.207 2.864 5.119 232 HB2 GLN 26 2HB GLN 26 10.230 0.769 5.521 233 HB3 GLN 26 3HB GLN 26 11.606 0.590 6.601 234 HG2 GLN 26 2HG GLN 26 11.107 3.243 6.831 235 HG3 GLN 26 3HG GLN 26 9.484 2.609 6.562 236 HE21 GLN 26 1HE2 GLN 26 8.483 1.494 8.151 237 HE22 GLN 26 2HE2 GLN 26 9.159 1.217 9.716 238 HA PRO 27 HA PRO 27 16.013 0.688 5.051 239 HB2 PRO 27 2HB PRO 27 16.779 0.738 7.655 240 HB3 PRO 27 3HB PRO 27 16.790 2.173 6.623 241 HG2 PRO 27 2HG PRO 27 14.754 1.305 8.639 242 HG3 PRO 27 3HG PRO 27 15.419 2.923 8.345 243 HD2 PRO 27 2HD PRO 27 12.998 2.150 7.410 244 HD3 PRO 27 3HD PRO 27 14.033 3.301 6.542 245 H ASN 28 H ASN 28 13.327 -0.609 6.599 246 HA ASN 28 HA ASN 28 14.526 -3.258 6.585 247 HB2 ASN 28 2HB ASN 28 14.432 -1.913 8.974 248 HB3 ASN 28 3HB ASN 28 12.916 -2.809 9.003 249 HD21 ASN 28 1HD2 ASN 28 13.221 -5.161 8.206 250 HD22 ASN 28 2HD2 ASN 28 14.547 -6.007 8.922 251 H GLU 29 H GLU 29 12.618 -2.036 4.888 252 HA GLU 29 HA GLU 29 10.135 -3.433 5.628 253 HB2 GLU 29 2HB GLU 29 10.659 -0.848 4.444 254 HB3 GLU 29 3HB GLU 29 9.628 -1.812 3.397 255 HG2 GLU 29 2HG GLU 29 8.302 -2.259 5.599 256 HG3 GLU 29 3HG GLU 29 9.112 -0.792 6.146 257 H VAL 30 H VAL 30 8.900 -4.342 3.758 258 HA VAL 30 HA VAL 30 10.743 -5.835 2.045 259 HB VAL 30 HB VAL 30 8.234 -6.444 3.332 260 HG11 VAL 30 1HG1 VAL 30 7.218 -7.715 1.474 261 HG12 VAL 30 2HG1 VAL 30 7.202 -5.973 1.197 262 HG13 VAL 30 3HG1 VAL 30 8.383 -6.987 0.369 263 HG21 VAL 30 3HG2 VAL 30 9.836 -8.013 3.731 264 HG22 VAL 30 1HG2 VAL 30 9.048 -8.777 2.351 265 HG23 VAL 30 2HG2 VAL 30 10.540 -7.865 2.121 266 H ALA 31 H ALA 31 10.566 -5.911 -0.183 267 HA ALA 31 HA ALA 31 8.610 -4.139 -1.459 268 HB1 ALA 31 1HB ALA 31 10.932 -3.054 -1.048 269 HB2 ALA 31 2HB ALA 31 11.448 -4.067 -2.397 270 HB3 ALA 31 3HB ALA 31 10.161 -2.883 -2.625 271 H ILE 32 H ILE 32 7.519 -5.398 -2.812 272 HA ILE 32 HA ILE 32 8.850 -7.674 -4.073 273 HB ILE 32 HB ILE 32 5.980 -6.920 -3.665 274 HG12 ILE 32 2HG1 ILE 32 6.734 -9.700 -3.334 275 HG13 ILE 32 3HG1 ILE 32 7.789 -8.643 -2.403 276 HG21 ILE 32 1HG2 ILE 32 5.505 -9.026 -5.080 277 HG22 ILE 32 2HG2 ILE 32 5.821 -7.502 -5.906 278 HG23 ILE 32 3HG2 ILE 32 7.092 -8.718 -5.784 279 HD11 ILE 32 3HD1 ILE 32 4.786 -8.740 -2.253 280 HD12 ILE 32 1HD1 ILE 32 5.920 -9.378 -1.064 281 HD13 ILE 32 2HD1 ILE 32 5.822 -7.640 -1.344 282 H PHE 33 H PHE 33 9.832 -7.255 -5.939 283 HA PHE 33 HA PHE 33 8.610 -5.321 -7.784 284 HB2 PHE 33 2HB PHE 33 11.422 -6.416 -7.904 285 HB3 PHE 33 3HB PHE 33 10.774 -5.028 -8.771 286 HD1 PHE 33 HD2 PHE 33 9.294 -3.724 -6.518 287 HD2 PHE 33 HD1 PHE 33 13.182 -5.444 -6.713 288 HE1 PHE 33 HE2 PHE 33 10.036 -2.243 -4.699 289 HE2 PHE 33 HE1 PHE 33 13.931 -3.967 -4.894 290 HZ PHE 33 HZ PHE 33 12.358 -2.362 -3.885 291 H MET 34 H MET 34 7.240 -6.391 -9.083 292 HA MET 34 HA MET 34 7.794 -9.065 -10.007 293 HB2 MET 34 2HB MET 34 5.550 -7.114 -10.379 294 HB3 MET 34 3HB MET 34 5.670 -8.519 -11.430 295 HG2 MET 34 2HG MET 34 5.353 -10.013 -9.666 296 HG3 MET 34 3HG MET 34 5.718 -8.792 -8.450 297 HE1 MET 34 3HE MET 34 2.550 -7.750 -11.263 298 HE2 MET 34 1HE MET 34 3.815 -8.938 -11.579 299 HE3 MET 34 2HE MET 34 2.215 -9.471 -11.063 300 H PHE 35 H PHE 35 8.332 -9.707 -12.067 301 HA PHE 35 HA PHE 35 8.753 -7.673 -14.116 302 HB2 PHE 35 2HB PHE 35 11.046 -8.333 -14.538 303 HB3 PHE 35 3HB PHE 35 10.888 -7.842 -12.855 304 HD1 PHE 35 HD1 PHE 35 10.305 -9.847 -11.210 305 HD2 PHE 35 HD2 PHE 35 12.227 -10.244 -14.987 306 HE1 PHE 35 HE1 PHE 35 11.267 -11.994 -10.491 307 HE2 PHE 35 HE2 PHE 35 13.191 -12.392 -14.274 308 HZ PHE 35 HZ PHE 35 12.712 -13.270 -12.024 309 H GLU 36 H GLU 36 8.156 -8.385 -16.062 310 HA GLU 36 HA GLU 36 7.786 -11.286 -16.409 311 HB2 GLU 36 2HB GLU 36 6.000 -10.802 -17.946 312 HB3 GLU 36 3HB GLU 36 5.716 -9.901 -16.463 313 HG2 GLU 36 2HG GLU 36 5.244 -8.321 -18.046 314 HG3 GLU 36 3HG GLU 36 6.943 -7.981 -17.722 315 H VAL 37 H VAL 37 9.651 -8.680 -17.366 316 HA VAL 37 HA VAL 37 10.141 -9.626 -20.072 317 HB VAL 37 HB VAL 37 11.761 -7.484 -18.743 318 HG11 VAL 37 1HG1 VAL 37 12.596 -7.762 -20.845 319 HG12 VAL 37 2HG1 VAL 37 11.055 -8.314 -21.505 320 HG13 VAL 37 3HG1 VAL 37 11.321 -6.597 -21.201 321 HG21 VAL 37 3HG2 VAL 37 9.546 -6.830 -18.159 322 HG22 VAL 37 1HG2 VAL 37 10.031 -5.850 -19.543 323 HG23 VAL 37 2HG2 VAL 37 8.941 -7.218 -19.769 324 H GLY 38 H GLY 38 12.504 -9.792 -20.752 325 HA2 GLY 38 2HA GLY 38 13.709 -11.927 -19.370 326 HA3 GLY 38 3HA GLY 38 14.463 -10.983 -20.646 327 H ASP 39 H ASP 39 16.473 -11.041 -19.598 328 HA ASP 39 HA ASP 39 18.093 -10.439 -18.098 329 HB2 ASP 39 2HB ASP 39 16.412 -8.021 -18.557 330 HB3 ASP 39 3HB ASP 39 17.638 -7.942 -17.295 331 H PHE 40 H PHE 40 17.262 -12.066 -16.574 332 HA PHE 40 HA PHE 40 15.736 -11.031 -14.320 333 HB2 PHE 40 2HB PHE 40 16.624 -13.688 -13.833 334 HB3 PHE 40 3HB PHE 40 14.994 -13.136 -14.208 335 HD1 PHE 40 HD1 PHE 40 18.116 -14.461 -15.627 336 HD2 PHE 40 HD2 PHE 40 14.052 -13.439 -16.371 337 HE1 PHE 40 HE1 PHE 40 18.213 -15.656 -17.776 338 HE2 PHE 40 HE2 PHE 40 14.142 -14.633 -18.521 339 HZ PHE 40 HZ PHE 40 16.224 -15.744 -19.225 340 H SER 41 H SER 41 18.978 -11.522 -15.233 341 HA SER 41 HA SER 41 20.063 -11.927 -12.613 342 HB2 SER 41 2HB SER 41 22.108 -12.083 -13.649 343 HB3 SER 41 3HB SER 41 21.068 -12.404 -15.037 344 HG SER 41 HG SER 41 22.614 -10.825 -15.543 345 H ASN 42 H ASN 42 18.879 -9.236 -14.302 346 HA ASN 42 HA ASN 42 20.544 -7.271 -12.996 347 HB2 ASN 42 2HB ASN 42 18.684 -7.309 -15.186 348 HB3 ASN 42 3HB ASN 42 18.235 -6.033 -14.058 349 HD21 ASN 42 1HD2 ASN 42 19.313 -5.855 -16.760 350 HD22 ASN 42 2HD2 ASN 42 20.765 -4.926 -16.634 351 H ILE 43 H ILE 43 17.547 -8.880 -12.395 352 HA ILE 43 HA ILE 43 16.120 -7.159 -10.826 353 HB ILE 43 HB ILE 43 16.494 -10.111 -10.756 354 HG12 ILE 43 2HG1 ILE 43 14.916 -8.988 -12.312 355 HG13 ILE 43 3HG1 ILE 43 14.112 -10.105 -11.215 356 HG21 ILE 43 1HG2 ILE 43 16.426 -9.839 -8.444 357 HG22 ILE 43 2HG2 ILE 43 15.303 -8.483 -8.541 358 HG23 ILE 43 3HG2 ILE 43 14.739 -10.120 -8.875 359 HD11 ILE 43 3HD1 ILE 43 13.546 -8.127 -9.783 360 HD12 ILE 43 1HD1 ILE 43 14.141 -7.106 -11.092 361 HD13 ILE 43 2HD1 ILE 43 12.762 -8.172 -11.362 362 HA PRO 44 HA PRO 44 18.714 -8.369 -6.929 363 HB2 PRO 44 2HB PRO 44 21.024 -9.732 -7.351 364 HB3 PRO 44 3HB PRO 44 19.470 -10.533 -7.093 365 HG2 PRO 44 2HG PRO 44 20.910 -9.975 -9.657 366 HG3 PRO 44 3HG PRO 44 20.059 -11.445 -9.149 367 HD2 PRO 44 2HD PRO 44 18.952 -9.627 -10.823 368 HD3 PRO 44 3HD PRO 44 17.988 -10.581 -9.677 369 H LYS 45 H LYS 45 20.084 -7.318 -9.911 370 HA LYS 45 HA LYS 45 22.395 -6.036 -8.803 371 HB2 LYS 45 2HB LYS 45 21.772 -6.793 -11.296 372 HB3 LYS 45 3HB LYS 45 21.258 -5.114 -11.391 373 HG2 LYS 45 2HG LYS 45 23.777 -5.067 -10.174 374 HG3 LYS 45 3HG LYS 45 23.901 -6.221 -11.503 375 HD2 LYS 45 2HD LYS 45 22.707 -4.389 -12.887 376 HD3 LYS 45 3HD LYS 45 23.207 -3.307 -11.585 377 HE2 LYS 45 2HE LYS 45 25.134 -5.115 -13.021 378 HE3 LYS 45 3HE LYS 45 24.761 -3.488 -13.588 379 HZ1 LYS 45 3HZ LYS 45 26.230 -2.700 -12.155 380 HZ2 LYS 45 1HZ LYS 45 26.568 -4.259 -11.593 381 HZ3 LYS 45 2HZ LYS 45 25.350 -3.343 -10.861 382 H SER 46 H SER 46 19.089 -5.115 -9.473 383 HA SER 46 HA SER 46 19.401 -2.319 -9.299 384 HB2 SER 46 2HB SER 46 16.859 -3.461 -8.306 385 HB3 SER 46 3HB SER 46 17.140 -2.236 -9.543 386 HG SER 46 HG SER 46 16.308 -4.292 -10.319 387 H ALA 47 H ALA 47 18.228 -4.635 -6.852 388 HA ALA 47 HA ALA 47 18.066 -2.822 -4.731 389 HB1 ALA 47 1HB ALA 47 17.188 -5.240 -4.919 390 HB2 ALA 47 2HB ALA 47 18.775 -5.699 -4.300 391 HB3 ALA 47 3HB ALA 47 17.724 -4.653 -3.345 392 H GLU 48 H GLU 48 20.797 -4.355 -6.183 393 HA GLU 48 HA GLU 48 22.571 -4.074 -3.957 394 HB2 GLU 48 2HB GLU 48 22.835 -5.703 -5.882 395 HB3 GLU 48 3HB GLU 48 23.344 -4.335 -6.861 396 HG2 GLU 48 2HG GLU 48 24.764 -4.618 -4.313 397 HG3 GLU 48 3HG GLU 48 25.011 -5.937 -5.455 398 H PHE 49 H PHE 49 21.677 -2.107 -6.712 399 HA PHE 49 HA PHE 49 23.740 -0.273 -6.782 400 HB2 PHE 49 2HB PHE 49 21.252 -0.509 -7.978 401 HB3 PHE 49 3HB PHE 49 21.129 0.998 -7.078 402 HD1 PHE 49 HD2 PHE 49 22.758 2.827 -7.522 403 HD2 PHE 49 HD1 PHE 49 22.540 -0.665 -9.946 404 HE1 PHE 49 HE2 PHE 49 23.990 3.992 -9.304 405 HE2 PHE 49 HE1 PHE 49 23.772 0.494 -11.733 406 HZ PHE 49 HZ PHE 49 24.498 2.826 -11.414 407 H ILE 50 H ILE 50 21.166 -0.608 -4.460 408 HA ILE 50 HA ILE 50 21.547 1.966 -3.250 409 HB ILE 50 HB ILE 50 20.173 -0.446 -2.066 410 HG12 ILE 50 2HG1 ILE 50 19.253 0.164 -4.290 411 HG13 ILE 50 3HG1 ILE 50 18.103 0.430 -2.985 412 HG21 ILE 50 1HG2 ILE 50 20.448 2.393 -1.293 413 HG22 ILE 50 2HG2 ILE 50 18.856 1.666 -1.084 414 HG23 ILE 50 3HG2 ILE 50 20.261 0.955 -0.289 415 HD11 ILE 50 3HD1 ILE 50 17.981 2.263 -4.505 416 HD12 ILE 50 1HD1 ILE 50 18.724 2.831 -3.010 417 HD13 ILE 50 2HD1 ILE 50 19.725 2.509 -4.426 418 H GLN 51 H GLN 51 21.917 -1.269 -1.798 419 HA GLN 51 HA GLN 51 24.437 -0.374 -0.589 420 HB2 GLN 51 2HB GLN 51 22.692 -0.075 1.098 421 HB3 GLN 51 3HB GLN 51 22.181 -1.744 0.885 422 HG2 GLN 51 2HG GLN 51 23.477 -1.662 2.857 423 HG3 GLN 51 3HG GLN 51 24.466 -2.444 1.624 424 HE21 GLN 51 1HE2 GLN 51 26.428 -1.949 2.483 425 HE22 GLN 51 2HE2 GLN 51 27.043 -0.339 2.603 426 H SER 52 H SER 52 25.988 -1.742 -1.135 427 HA SER 52 HA SER 52 25.700 -4.113 -2.492 428 HB2 SER 52 2HB SER 52 27.833 -2.818 -2.186 429 HB3 SER 52 3HB SER 52 27.965 -3.521 -0.574 430 HG SER 52 HG SER 52 28.463 -5.413 -1.420 431 H LYS 53 H LYS 53 25.882 -3.611 1.000 432 HA LYS 53 HA LYS 53 25.097 -6.428 1.371 433 HB2 LYS 53 2HB LYS 53 27.414 -5.435 2.256 434 HB3 LYS 53 3HB LYS 53 26.392 -4.938 3.599 435 HG2 LYS 53 2HG LYS 53 26.866 -6.957 4.427 436 HG3 LYS 53 3HG LYS 53 25.644 -7.533 3.290 437 HD2 LYS 53 2HD LYS 53 27.198 -8.775 2.300 438 HD3 LYS 53 3HD LYS 53 28.057 -7.301 1.848 439 HE2 LYS 53 2HE LYS 53 28.377 -8.510 4.573 440 HE3 LYS 53 3HE LYS 53 29.312 -9.102 3.201 441 HZ1 LYS 53 3HZ LYS 53 29.478 -6.540 4.598 442 HZ2 LYS 53 1HZ LYS 53 29.784 -6.541 2.934 443 HZ3 LYS 53 2HZ LYS 53 30.713 -7.508 3.965 444 H GLY 54 H GLY 54 23.216 -4.404 0.896 445 HA2 GLY 54 2HA GLY 54 21.891 -4.299 3.532 446 HA3 GLY 54 3HA GLY 54 21.888 -2.907 2.459 447 H HIS 55 H HIS 55 21.737 -5.361 0.379 448 HA HIS 55 HA HIS 55 18.792 -5.391 0.404 449 HB2 HIS 55 2HB HIS 55 18.842 -5.600 -1.991 450 HB3 HIS 55 3HB HIS 55 19.886 -4.256 -1.542 451 HD1 HIS 55 HD1 HIS 55 22.553 -5.088 -1.298 452 HD2 HIS 55 HD2 HIS 55 20.011 -7.253 -3.771 453 HE1 HIS 55 HE1 HIS 55 24.058 -6.372 -2.852 454 H GLU 56 H GLU 56 17.911 -7.263 0.954 455 HA GLU 56 HA GLU 56 19.315 -9.748 0.228 456 HB2 GLU 56 2HB GLU 56 18.976 -8.848 2.803 457 HB3 GLU 56 3HB GLU 56 17.597 -9.920 2.597 458 HG2 GLU 56 2HG GLU 56 20.157 -11.000 1.657 459 HG3 GLU 56 3HG GLU 56 20.056 -10.709 3.393 460 H LEU 57 H LEU 57 18.162 -10.953 -1.113 461 HA LEU 57 HA LEU 57 15.339 -10.435 -1.493 462 HB2 LEU 57 2HB LEU 57 17.259 -12.312 -2.857 463 HB3 LEU 57 3HB LEU 57 15.561 -12.147 -3.298 464 HG LEU 57 HG LEU 57 16.748 -10.879 -4.877 465 HD11 LEU 57 1HD1 LEU 57 15.570 -8.974 -4.735 466 HD12 LEU 57 2HD1 LEU 57 16.202 -8.578 -3.137 467 HD13 LEU 57 3HD1 LEU 57 14.874 -9.727 -3.300 468 HD21 LEU 57 3HD2 LEU 57 18.821 -10.834 -3.298 469 HD22 LEU 57 1HD2 LEU 57 18.175 -9.267 -2.808 470 HD23 LEU 57 2HD2 LEU 57 18.598 -9.558 -4.495 471 H LEU 58 H LEU 58 14.093 -11.265 0.090 472 HA LEU 58 HA LEU 58 14.545 -13.507 1.634 473 HB2 LEU 58 2HB LEU 58 12.390 -11.705 1.145 474 HB3 LEU 58 3HB LEU 58 11.754 -13.348 1.187 475 HG LEU 58 HG LEU 58 13.416 -13.194 3.410 476 HD11 LEU 58 1HD1 LEU 58 12.966 -10.587 2.720 477 HD12 LEU 58 2HD1 LEU 58 13.345 -11.166 4.342 478 HD13 LEU 58 3HD1 LEU 58 11.666 -10.904 3.870 479 HD21 LEU 58 3HD2 LEU 58 10.477 -13.162 2.910 480 HD22 LEU 58 1HD2 LEU 58 11.074 -12.938 4.554 481 HD23 LEU 58 2HD2 LEU 58 11.480 -14.403 3.661 482 H ASN 59 H ASN 59 12.798 -13.277 -1.446 483 HA ASN 59 HA ASN 59 13.025 -16.204 -1.685 484 HB2 ASN 59 2HB ASN 59 10.658 -15.114 -1.328 485 HB3 ASN 59 3HB ASN 59 10.805 -14.716 -3.038 486 HD21 ASN 59 1HD2 ASN 59 9.651 -16.930 -0.930 487 HD22 ASN 59 2HD2 ASN 59 9.594 -18.317 -1.959 488 H SER 60 H SER 60 14.634 -16.501 -3.098 489 HA SER 60 HA SER 60 15.603 -14.799 -5.011 490 HB2 SER 60 2HB SER 60 16.967 -16.515 -5.561 491 HB3 SER 60 3HB SER 60 16.177 -17.367 -4.234 492 HG SER 60 HG SER 60 16.256 -18.304 -6.526 493 H LEU 61 H LEU 61 14.833 -13.960 -6.827 494 HA LEU 61 HA LEU 61 12.301 -14.231 -7.802 495 HB2 LEU 61 2HB LEU 61 13.065 -13.232 -9.855 496 HB3 LEU 61 3HB LEU 61 13.887 -12.487 -8.486 497 HG LEU 61 HG LEU 61 15.166 -14.652 -10.135 498 HD11 LEU 61 1HD1 LEU 61 16.227 -12.088 -10.748 499 HD12 LEU 61 2HD1 LEU 61 14.485 -12.049 -11.016 500 HD13 LEU 61 3HD1 LEU 61 15.475 -13.261 -11.830 501 HD21 LEU 61 3HD2 LEU 61 16.401 -14.426 -8.205 502 HD22 LEU 61 1HD2 LEU 61 16.046 -12.705 -8.050 503 HD23 LEU 61 2HD2 LEU 61 17.197 -13.262 -9.266 504 H ARG 62 H ARG 62 11.186 -15.669 -8.970 505 HA ARG 62 HA ARG 62 12.555 -18.103 -9.813 506 HB2 ARG 62 2HB ARG 62 10.269 -17.850 -8.473 507 HB3 ARG 62 3HB ARG 62 9.609 -17.770 -10.101 508 HG2 ARG 62 2HG ARG 62 9.467 -20.015 -9.649 509 HG3 ARG 62 3HG ARG 62 11.016 -19.922 -10.489 510 HD2 ARG 62 2HD ARG 62 12.231 -20.090 -8.475 511 HD3 ARG 62 3HD ARG 62 10.802 -19.763 -7.496 512 HE ARG 62 HE ARG 62 11.630 -22.295 -8.554 513 HH11 ARG 62 1HH1 ARG 62 8.898 -20.407 -7.510 514 HH12 ARG 62 2HH1 ARG 62 7.924 -21.788 -7.126 515 HH21 ARG 62 1HH2 ARG 62 10.359 -24.121 -8.052 516 HH22 ARG 62 2HH2 ARG 62 8.757 -23.900 -7.434 517 H PHE 63 H PHE 63 13.392 -16.236 -11.460 518 HA PHE 63 HA PHE 63 11.905 -15.442 -13.636 519 HB2 PHE 63 2HB PHE 63 13.958 -15.130 -14.805 520 HB3 PHE 63 3HB PHE 63 14.306 -14.839 -13.104 521 HD1 PHE 63 HD2 PHE 63 15.051 -17.052 -11.798 522 HD2 PHE 63 HD1 PHE 63 15.459 -16.390 -15.983 523 HE1 PHE 63 HE2 PHE 63 16.855 -18.722 -11.883 524 HE2 PHE 63 HE1 PHE 63 17.263 -18.060 -16.075 525 HZ PHE 63 HZ PHE 63 17.965 -19.228 -14.023 526 H ASN 64 H ASN 64 13.055 -18.608 -12.845 527 HA ASN 64 HA ASN 64 13.151 -19.888 -15.278 528 HB2 ASN 64 2HB ASN 64 12.320 -20.790 -12.540 529 HB3 ASN 64 3HB ASN 64 12.179 -21.893 -13.906 530 HD21 ASN 64 1HD2 ASN 64 13.980 -22.805 -14.760 531 HD22 ASN 64 2HD2 ASN 64 15.565 -22.598 -14.104 532 H GLN 65 H GLN 65 10.387 -18.656 -13.591 533 HA GLN 65 HA GLN 65 8.599 -19.919 -15.558 534 HB2 GLN 65 2HB GLN 65 8.402 -19.717 -12.766 535 HB3 GLN 65 3HB GLN 65 7.217 -18.584 -13.402 536 HG2 GLN 65 2HG GLN 65 6.071 -20.607 -13.134 537 HG3 GLN 65 3HG GLN 65 6.393 -20.477 -14.862 538 HE21 GLN 65 1HE2 GLN 65 8.030 -21.699 -11.956 539 HE22 GLN 65 2HE2 GLN 65 8.543 -23.189 -12.665 540 H ALA 66 H ALA 66 6.427 -18.282 -15.404 541 HA ALA 66 HA ALA 66 7.174 -16.134 -17.098 542 HB1 ALA 66 1HB ALA 66 4.972 -15.933 -17.528 543 HB2 ALA 66 2HB ALA 66 4.878 -17.491 -16.705 544 HB3 ALA 66 3HB ALA 66 4.522 -16.005 -15.824 545 H ASP 67 H ASP 67 5.570 -14.019 -16.301 546 HA ASP 67 HA ASP 67 7.198 -12.409 -14.845 547 HB2 ASP 67 2HB ASP 67 5.353 -10.931 -14.520 548 HB3 ASP 67 3HB ASP 67 5.078 -11.751 -16.054 549 H TRP 68 H TRP 68 8.118 -12.856 -12.950 550 HA TRP 68 HA TRP 68 6.445 -13.982 -10.806 551 HB2 TRP 68 2HB TRP 68 8.799 -14.959 -11.752 552 HB3 TRP 68 3HB TRP 68 9.374 -13.937 -10.437 553 HD1 TRP 68 HD1 TRP 68 9.378 -15.019 -8.113 554 HE1 TRP 68 HE1 TRP 68 8.315 -17.112 -7.059 555 HE3 TRP 68 HE3 TRP 68 6.463 -16.514 -12.038 556 HZ2 TRP 68 HZ2 TRP 68 6.484 -19.130 -7.794 557 HZ3 TRP 68 HZ3 TRP 68 5.086 -18.536 -11.781 558 HH2 TRP 68 HH2 TRP 68 5.098 -19.817 -9.702 559 H THR 69 H THR 69 7.655 -13.366 -8.564 560 HA THR 69 HA THR 69 8.018 -10.443 -8.572 561 HB THR 69 HB THR 69 6.364 -10.080 -7.106 562 HG1 THR 69 HG1 THR 69 6.292 -11.096 -5.167 563 HG21 THR 69 3HG2 THR 69 4.515 -11.552 -7.209 564 HG22 THR 69 1HG2 THR 69 5.549 -12.957 -7.464 565 HG23 THR 69 2HG2 THR 69 5.366 -11.753 -8.740 566 H ILE 70 H ILE 70 9.614 -9.651 -7.294 567 HA ILE 70 HA ILE 70 11.121 -11.605 -5.681 568 HB ILE 70 HB ILE 70 12.426 -10.936 -7.609 569 HG12 ILE 70 2HG1 ILE 70 14.418 -10.129 -6.478 570 HG13 ILE 70 3HG1 ILE 70 13.449 -9.506 -5.147 571 HG21 ILE 70 1HG2 ILE 70 11.211 -8.417 -7.163 572 HG22 ILE 70 2HG2 ILE 70 12.957 -8.200 -7.053 573 HG23 ILE 70 3HG2 ILE 70 12.247 -8.914 -8.501 574 HD11 ILE 70 3HD1 ILE 70 14.710 -11.909 -5.177 575 HD12 ILE 70 1HD1 ILE 70 13.338 -11.498 -4.148 576 HD13 ILE 70 2HD1 ILE 70 13.076 -12.357 -5.667 577 H VAL 71 H VAL 71 11.047 -11.224 -3.577 578 HA VAL 71 HA VAL 71 10.252 -8.599 -2.598 579 HB VAL 71 HB VAL 71 10.842 -10.992 -0.874 580 HG11 VAL 71 1HG1 VAL 71 10.482 -9.210 0.527 581 HG12 VAL 71 2HG1 VAL 71 9.362 -8.421 -0.585 582 HG13 VAL 71 3HG1 VAL 71 8.838 -9.822 0.350 583 HG21 VAL 71 3HG2 VAL 71 8.656 -10.623 -2.797 584 HG22 VAL 71 1HG2 VAL 71 9.266 -12.093 -2.036 585 HG23 VAL 71 2HG2 VAL 71 8.139 -11.052 -1.167 586 H VAL 72 H VAL 72 11.589 -7.167 -1.692 587 HA VAL 72 HA VAL 72 14.317 -8.050 -1.007 588 HB VAL 72 HB VAL 72 13.659 -5.276 -1.970 589 HG11 VAL 72 1HG1 VAL 72 15.901 -4.897 -1.982 590 HG12 VAL 72 2HG1 VAL 72 15.844 -6.111 -0.703 591 HG13 VAL 72 3HG1 VAL 72 16.297 -6.577 -2.343 592 HG21 VAL 72 3HG2 VAL 72 13.821 -7.736 -3.516 593 HG22 VAL 72 1HG2 VAL 72 13.257 -6.134 -3.992 594 HG23 VAL 72 2HG2 VAL 72 14.978 -6.516 -4.049 595 H ARG 73 H ARG 73 14.905 -7.710 1.031 596 HA ARG 73 HA ARG 73 13.265 -5.910 2.674 597 HB2 ARG 73 2HB ARG 73 14.301 -7.170 4.599 598 HB3 ARG 73 3HB ARG 73 13.248 -8.118 3.558 599 HG2 ARG 73 2HG ARG 73 14.875 -9.555 3.127 600 HG3 ARG 73 3HG ARG 73 15.952 -8.256 2.610 601 HD2 ARG 73 2HD ARG 73 16.857 -9.575 4.495 602 HD3 ARG 73 3HD ARG 73 16.649 -7.867 4.883 603 HE ARG 73 HE ARG 73 14.347 -9.284 5.658 604 HH11 ARG 73 1HH1 ARG 73 17.693 -8.895 6.538 605 HH12 ARG 73 2HH1 ARG 73 17.432 -9.265 8.210 606 HH21 ARG 73 1HH2 ARG 73 13.991 -9.773 7.858 607 HH22 ARG 73 2HH2 ARG 73 15.326 -9.765 8.960 608 H LYS 74 H LYS 74 14.121 -3.947 2.856 609 HA LYS 74 HA LYS 74 16.784 -3.254 2.382 610 HB2 LYS 74 2HB LYS 74 14.430 -1.924 3.602 611 HB3 LYS 74 3HB LYS 74 16.002 -1.230 3.974 612 HG2 LYS 74 2HG LYS 74 16.175 -1.561 1.278 613 HG3 LYS 74 3HG LYS 74 14.463 -1.186 1.488 614 HD2 LYS 74 2HD LYS 74 15.196 0.948 1.404 615 HD3 LYS 74 3HD LYS 74 15.566 0.670 3.108 616 HE2 LYS 74 2HE LYS 74 17.823 0.467 2.723 617 HE3 LYS 74 3HE LYS 74 17.600 -0.059 1.055 618 HZ1 LYS 74 3HZ LYS 74 17.212 2.118 0.349 619 HZ2 LYS 74 1HZ LYS 74 18.507 2.263 1.428 620 HZ3 LYS 74 2HZ LYS 74 16.946 2.693 1.918 621 H LYS 75 H LYS 75 18.413 -2.485 3.857 622 HA LYS 75 HA LYS 75 18.337 -2.790 6.633 623 HB2 LYS 75 2HB LYS 75 18.603 -5.264 5.244 624 HB3 LYS 75 3HB LYS 75 20.138 -4.916 6.029 625 HG2 LYS 75 2HG LYS 75 17.943 -4.394 7.815 626 HG3 LYS 75 3HG LYS 75 17.864 -6.039 7.179 627 HD2 LYS 75 2HD LYS 75 20.350 -4.827 8.378 628 HD3 LYS 75 3HD LYS 75 19.185 -5.781 9.299 629 HE2 LYS 75 2HE LYS 75 19.866 -7.728 8.386 630 HE3 LYS 75 3HE LYS 75 20.126 -7.011 6.797 631 HZ1 LYS 75 3HZ LYS 75 22.180 -7.794 7.918 632 HZ2 LYS 75 1HZ LYS 75 21.949 -6.607 9.102 633 HZ3 LYS 75 2HZ LYS 75 22.218 -6.156 7.494 634 H ALA 76 H ALA 76 20.767 -3.156 7.465 635 HA ALA 76 HA ALA 76 22.406 -1.328 5.845 636 HB1 ALA 76 1HB ALA 76 22.536 -1.898 8.803 637 HB2 ALA 76 2HB ALA 76 23.559 -0.759 7.927 638 HB3 ALA 76 3HB ALA 76 21.824 -0.472 8.049 Start of MODEL 15 1 H1 MET 1 H MET 1 1.965 -0.980 1.359 2 HA MET 1 HA MET 1 1.929 -0.602 -1.499 3 HB2 MET 1 2HB MET 1 1.689 1.674 0.390 4 HB3 MET 1 3HB MET 1 2.818 1.872 -0.944 5 HG2 MET 1 2HG MET 1 1.164 2.312 -2.338 6 HG3 MET 1 3HG MET 1 0.368 0.793 -1.933 7 HE1 MET 1 3HE MET 1 1.203 4.253 -0.773 8 HE2 MET 1 1HE MET 1 -0.228 4.761 -1.672 9 HE3 MET 1 2HE MET 1 -0.218 4.844 0.090 10 H LYS 2 H LYS 2 3.563 -2.280 -0.976 11 HA LYS 2 HA LYS 2 6.179 -1.015 -0.641 12 HB2 LYS 2 2HB LYS 2 6.878 -3.025 0.760 13 HB3 LYS 2 3HB LYS 2 5.863 -1.827 1.551 14 HG2 LYS 2 2HG LYS 2 3.897 -3.262 1.110 15 HG3 LYS 2 3HG LYS 2 4.982 -4.483 0.441 16 HD2 LYS 2 2HD LYS 2 6.212 -4.262 2.719 17 HD3 LYS 2 3HD LYS 2 4.697 -3.542 3.269 18 HE2 LYS 2 2HE LYS 2 3.484 -5.510 2.832 19 HE3 LYS 2 3HE LYS 2 4.780 -6.189 1.849 20 HZ1 LYS 2 3HZ LYS 2 6.135 -6.166 3.969 21 HZ2 LYS 2 1HZ LYS 2 4.888 -7.306 3.885 22 HZ3 LYS 2 2HZ LYS 2 4.683 -5.892 4.791 23 H ARG 3 H ARG 3 4.934 -1.837 -3.010 24 HA ARG 3 HA ARG 3 6.814 -3.906 -3.865 25 HB2 ARG 3 2HB ARG 3 5.114 -5.130 -5.090 26 HB3 ARG 3 3HB ARG 3 4.681 -5.056 -3.388 27 HG2 ARG 3 2HG ARG 3 3.572 -2.879 -4.995 28 HG3 ARG 3 3HG ARG 3 3.014 -4.488 -5.460 29 HD2 ARG 3 2HD ARG 3 2.425 -4.914 -3.089 30 HD3 ARG 3 3HD ARG 3 2.878 -3.252 -2.713 31 HE ARG 3 HE ARG 3 0.867 -2.570 -3.546 32 HH11 ARG 3 1HH1 ARG 3 1.557 -5.759 -4.762 33 HH12 ARG 3 2HH1 ARG 3 0.012 -5.944 -5.524 34 HH21 ARG 3 1HH2 ARG 3 -1.170 -2.803 -4.545 35 HH22 ARG 3 2HH2 ARG 3 -1.538 -4.262 -5.401 36 H PHE 4 H PHE 4 6.960 -4.035 -6.264 37 HA PHE 4 HA PHE 4 6.146 -1.573 -7.625 38 HB2 PHE 4 2HB PHE 4 8.747 -1.980 -6.699 39 HB3 PHE 4 3HB PHE 4 8.824 -2.366 -8.415 40 HD1 PHE 4 HD2 PHE 4 6.915 0.188 -6.480 41 HD2 PHE 4 HD1 PHE 4 9.749 -0.604 -9.555 42 HE1 PHE 4 HE2 PHE 4 7.005 2.589 -7.011 43 HE2 PHE 4 HE1 PHE 4 9.845 1.796 -10.090 44 HZ PHE 4 HZ PHE 4 8.471 3.395 -8.818 45 H ASP 5 H ASP 5 5.288 -1.987 -9.549 46 HA ASP 5 HA ASP 5 5.644 -4.658 -10.694 47 HB2 ASP 5 2HB ASP 5 3.441 -2.816 -10.505 48 HB3 ASP 5 3HB ASP 5 3.747 -3.207 -12.195 49 H LEU 6 H LEU 6 7.326 -4.776 -12.040 50 HA LEU 6 HA LEU 6 7.871 -2.521 -13.839 51 HB2 LEU 6 2HB LEU 6 9.532 -4.817 -12.855 52 HB3 LEU 6 3HB LEU 6 10.010 -3.878 -14.267 53 HG LEU 6 HG LEU 6 11.219 -3.056 -12.383 54 HD11 LEU 6 1HD1 LEU 6 8.976 -1.101 -12.824 55 HD12 LEU 6 2HD1 LEU 6 10.228 -1.421 -14.023 56 HD13 LEU 6 3HD1 LEU 6 10.665 -0.757 -12.449 57 HD21 LEU 6 3HD2 LEU 6 8.608 -2.524 -10.982 58 HD22 LEU 6 1HD2 LEU 6 10.241 -2.361 -10.336 59 HD23 LEU 6 2HD2 LEU 6 9.590 -3.961 -10.693 60 H ARG 7 H ARG 7 5.952 -5.036 -13.956 61 HA ARG 7 HA ARG 7 6.592 -6.690 -16.043 62 HB2 ARG 7 2HB ARG 7 4.220 -5.942 -14.657 63 HB3 ARG 7 3HB ARG 7 3.861 -5.944 -16.378 64 HG2 ARG 7 2HG ARG 7 4.443 -8.215 -16.601 65 HG3 ARG 7 3HG ARG 7 5.216 -8.250 -15.015 66 HD2 ARG 7 2HD ARG 7 3.185 -9.295 -14.619 67 HD3 ARG 7 3HD ARG 7 2.872 -7.633 -14.120 68 HE ARG 7 HE ARG 7 2.144 -7.779 -16.774 69 HH11 ARG 7 1HH1 ARG 7 1.220 -9.334 -13.800 70 HH12 ARG 7 2HH1 ARG 7 -0.416 -9.609 -14.300 71 HH21 ARG 7 1HH2 ARG 7 -0.007 -8.135 -17.444 72 HH22 ARG 7 2HH2 ARG 7 -1.112 -8.928 -16.374 73 HA PRO 8 HA PRO 8 4.821 -3.552 -19.253 74 HB2 PRO 8 2HB PRO 8 4.208 -1.060 -18.368 75 HB3 PRO 8 3HB PRO 8 3.048 -2.394 -18.364 76 HG2 PRO 8 2HG PRO 8 4.708 -1.320 -16.116 77 HG3 PRO 8 3HG PRO 8 3.004 -1.811 -16.113 78 HD2 PRO 8 2HD PRO 8 4.979 -3.400 -15.161 79 HD3 PRO 8 3HD PRO 8 3.519 -4.051 -15.933 80 H LEU 9 H LEU 9 7.090 -2.747 -16.809 81 HA LEU 9 HA LEU 9 8.412 -0.661 -18.297 82 HB2 LEU 9 2HB LEU 9 8.624 -1.874 -15.654 83 HB3 LEU 9 3HB LEU 9 10.189 -1.505 -16.375 84 HG LEU 9 HG LEU 9 8.636 0.794 -16.746 85 HD11 LEU 9 1HD1 LEU 9 7.299 1.104 -14.996 86 HD12 LEU 9 2HD1 LEU 9 8.525 0.535 -13.863 87 HD13 LEU 9 3HD1 LEU 9 7.470 -0.622 -14.675 88 HD21 LEU 9 3HD2 LEU 9 10.466 0.665 -14.432 89 HD22 LEU 9 1HD2 LEU 9 10.418 1.797 -15.783 90 HD23 LEU 9 2HD2 LEU 9 11.140 0.203 -15.995 91 H LYS 10 H LYS 10 9.816 -0.972 -19.882 92 HA LYS 10 HA LYS 10 10.619 -3.516 -20.768 93 HB2 LYS 10 2HB LYS 10 11.898 -2.389 -22.419 94 HB3 LYS 10 3HB LYS 10 10.479 -1.389 -22.135 95 HG2 LYS 10 2HG LYS 10 11.809 0.078 -20.693 96 HG3 LYS 10 3HG LYS 10 13.232 -0.917 -21.009 97 HD2 LYS 10 2HD LYS 10 13.431 0.877 -22.502 98 HD3 LYS 10 3HD LYS 10 12.787 -0.440 -23.485 99 HE2 LYS 10 2HE LYS 10 10.704 0.524 -23.650 100 HE3 LYS 10 3HE LYS 10 10.890 1.435 -22.153 101 HZ1 LYS 10 3HZ LYS 10 10.979 2.738 -24.301 102 HZ2 LYS 10 1HZ LYS 10 12.497 2.037 -24.563 103 HZ3 LYS 10 2HZ LYS 10 12.238 3.012 -23.205 104 H ALA 11 H ALA 11 12.888 -4.246 -21.026 105 HA ALA 11 HA ALA 11 14.186 -4.336 -18.488 106 HB1 ALA 11 1HB ALA 11 15.408 -5.284 -21.060 107 HB2 ALA 11 2HB ALA 11 15.625 -5.922 -19.429 108 HB3 ALA 11 3HB ALA 11 14.097 -6.165 -20.275 109 H GLY 12 H GLY 12 16.172 -3.497 -17.865 110 HA2 GLY 12 2HA GLY 12 18.225 -2.330 -18.357 111 HA3 GLY 12 3HA GLY 12 17.401 -1.537 -19.691 112 H ILE 13 H ILE 13 15.070 -0.708 -18.416 113 HA ILE 13 HA ILE 13 16.156 1.396 -16.686 114 HB ILE 13 HB ILE 13 13.422 1.345 -17.952 115 HG12 ILE 13 2HG1 ILE 13 15.976 2.560 -19.030 116 HG13 ILE 13 3HG1 ILE 13 15.118 1.185 -19.716 117 HG21 ILE 13 1HG2 ILE 13 14.582 3.936 -17.582 118 HG22 ILE 13 2HG2 ILE 13 13.102 3.269 -16.894 119 HG23 ILE 13 3HG2 ILE 13 14.642 3.035 -16.067 120 HD11 ILE 13 3HD1 ILE 13 14.421 2.898 -21.067 121 HD12 ILE 13 1HD1 ILE 13 13.131 2.856 -19.865 122 HD13 ILE 13 2HD1 ILE 13 14.403 4.073 -19.752 123 H PHE 14 H PHE 14 13.900 -1.254 -16.751 124 HA PHE 14 HA PHE 14 12.320 -0.641 -14.536 125 HB2 PHE 14 2HB PHE 14 11.638 -2.887 -14.552 126 HB3 PHE 14 3HB PHE 14 12.091 -2.573 -16.224 127 HD1 PHE 14 HD1 PHE 14 14.834 -2.926 -16.483 128 HD2 PHE 14 HD2 PHE 14 12.197 -4.988 -13.855 129 HE1 PHE 14 HE1 PHE 14 16.392 -4.830 -16.419 130 HE2 PHE 14 HE2 PHE 14 13.751 -6.895 -13.786 131 HZ PHE 14 HZ PHE 14 15.852 -6.817 -15.068 132 H GLU 15 H GLU 15 15.600 -1.745 -14.738 133 HA GLU 15 HA GLU 15 15.741 -2.552 -11.967 134 HB2 GLU 15 2HB GLU 15 17.119 -3.719 -13.587 135 HB3 GLU 15 3HB GLU 15 17.882 -2.211 -14.072 136 HG2 GLU 15 2HG GLU 15 18.136 -2.655 -11.231 137 HG3 GLU 15 3HG GLU 15 18.785 -4.004 -12.162 138 H ARG 16 H ARG 16 15.940 0.356 -13.687 139 HA ARG 16 HA ARG 16 17.665 1.671 -11.744 140 HB2 ARG 16 2HB ARG 16 16.778 2.205 -14.460 141 HB3 ARG 16 3HB ARG 16 16.610 3.620 -13.430 142 HG2 ARG 16 2HG ARG 16 18.796 3.996 -13.448 143 HG3 ARG 16 3HG ARG 16 19.158 2.321 -13.028 144 HD2 ARG 16 2HD ARG 16 19.456 1.701 -15.192 145 HD3 ARG 16 3HD ARG 16 18.250 2.835 -15.795 146 HE ARG 16 HE ARG 16 20.330 4.395 -14.925 147 HH11 ARG 16 1HH1 ARG 16 19.937 1.808 -17.221 148 HH12 ARG 16 2HH1 ARG 16 21.200 2.369 -18.266 149 HH21 ARG 16 1HH2 ARG 16 21.995 5.143 -16.293 150 HH22 ARG 16 2HH2 ARG 16 22.370 4.266 -17.737 151 H LEU 17 H LEU 17 14.291 1.417 -12.601 152 HA LEU 17 HA LEU 17 13.438 3.626 -10.980 153 HB2 LEU 17 2HB LEU 17 12.284 1.891 -12.904 154 HB3 LEU 17 3HB LEU 17 11.322 1.776 -11.432 155 HG LEU 17 HG LEU 17 10.379 3.426 -12.930 156 HD11 LEU 17 1HD1 LEU 17 11.538 5.250 -10.945 157 HD12 LEU 17 2HD1 LEU 17 10.839 3.774 -10.282 158 HD13 LEU 17 3HD1 LEU 17 9.853 4.846 -11.275 159 HD21 LEU 17 3HD2 LEU 17 12.650 5.293 -12.656 160 HD22 LEU 17 1HD2 LEU 17 11.531 5.050 -13.998 161 HD23 LEU 17 2HD2 LEU 17 12.879 3.937 -13.762 162 H GLU 18 H GLU 18 14.048 0.255 -10.484 163 HA GLU 18 HA GLU 18 12.459 -0.268 -8.256 164 HB2 GLU 18 2HB GLU 18 14.465 -1.603 -9.675 165 HB3 GLU 18 3HB GLU 18 15.067 -1.509 -8.026 166 HG2 GLU 18 2HG GLU 18 13.846 -3.301 -7.588 167 HG3 GLU 18 3HG GLU 18 12.423 -2.270 -7.732 168 H GLU 19 H GLU 19 15.363 1.602 -8.566 169 HA GLU 19 HA GLU 19 15.930 1.648 -5.738 170 HB2 GLU 19 2HB GLU 19 17.824 1.848 -7.151 171 HB3 GLU 19 3HB GLU 19 17.069 3.112 -8.111 172 HG2 GLU 19 2HG GLU 19 17.289 3.850 -5.319 173 HG3 GLU 19 3HG GLU 19 18.852 3.459 -6.034 174 H LEU 20 H LEU 20 14.232 3.632 -8.060 175 HA LEU 20 HA LEU 20 14.046 6.015 -6.614 176 HB2 LEU 20 2HB LEU 20 12.763 4.809 -8.909 177 HB3 LEU 20 3HB LEU 20 11.620 5.750 -7.953 178 HG LEU 20 HG LEU 20 13.700 7.490 -8.154 179 HD11 LEU 20 1HD1 LEU 20 13.553 6.574 -10.951 180 HD12 LEU 20 2HD1 LEU 20 14.530 5.589 -9.863 181 HD13 LEU 20 3HD1 LEU 20 14.888 7.305 -10.060 182 HD21 LEU 20 3HD2 LEU 20 11.384 8.046 -8.531 183 HD22 LEU 20 1HD2 LEU 20 11.370 7.121 -10.033 184 HD23 LEU 20 2HD2 LEU 20 12.345 8.586 -9.909 185 H ILE 21 H ILE 21 12.343 2.996 -6.281 186 HA ILE 21 HA ILE 21 10.441 4.157 -4.393 187 HB ILE 21 HB ILE 21 9.579 2.554 -6.038 188 HG12 ILE 21 2HG1 ILE 21 8.356 1.111 -4.474 189 HG13 ILE 21 3HG1 ILE 21 9.530 1.469 -3.212 190 HG21 ILE 21 1HG2 ILE 21 11.604 1.197 -6.279 191 HG22 ILE 21 2HG2 ILE 21 11.355 0.545 -4.660 192 HG23 ILE 21 3HG2 ILE 21 10.190 0.201 -5.938 193 HD11 ILE 21 3HD1 ILE 21 8.626 3.477 -2.761 194 HD12 ILE 21 1HD1 ILE 21 8.215 3.796 -4.446 195 HD13 ILE 21 2HD1 ILE 21 7.190 2.741 -3.472 196 H GLU 22 H GLU 22 13.201 1.990 -4.502 197 HA GLU 22 HA GLU 22 13.034 0.895 -1.940 198 HB2 GLU 22 2HB GLU 22 14.747 0.611 -4.020 199 HB3 GLU 22 3HB GLU 22 15.745 1.550 -2.918 200 HG2 GLU 22 2HG GLU 22 16.202 -0.261 -1.744 201 HG3 GLU 22 3HG GLU 22 14.486 -0.532 -1.446 202 H LYS 23 H LYS 23 13.960 4.059 -2.995 203 HA LYS 23 HA LYS 23 15.411 4.830 -0.673 204 HB2 LYS 23 2HB LYS 23 14.361 6.140 -3.092 205 HB3 LYS 23 3HB LYS 23 14.457 7.182 -1.679 206 HG2 LYS 23 2HG LYS 23 16.862 5.597 -2.064 207 HG3 LYS 23 3HG LYS 23 16.495 6.641 -3.440 208 HD2 LYS 23 2HD LYS 23 16.216 8.523 -1.779 209 HD3 LYS 23 3HD LYS 23 16.896 7.439 -0.563 210 HE2 LYS 23 2HE LYS 23 18.756 8.611 -1.289 211 HE3 LYS 23 3HE LYS 23 18.827 7.142 -2.262 212 HZ1 LYS 23 3HZ LYS 23 18.214 9.882 -3.075 213 HZ2 LYS 23 1HZ LYS 23 17.419 8.630 -3.890 214 HZ3 LYS 23 2HZ LYS 23 19.109 8.691 -3.877 215 H GLU 24 H GLU 24 12.026 4.860 -1.568 216 HA GLU 24 HA GLU 24 11.270 6.408 0.767 217 HB2 GLU 24 2HB GLU 24 10.094 5.833 -1.744 218 HB3 GLU 24 3HB GLU 24 9.029 5.163 -0.516 219 HG2 GLU 24 2HG GLU 24 9.960 7.844 0.124 220 HG3 GLU 24 3HG GLU 24 9.058 7.761 -1.388 221 H MET 25 H MET 25 12.080 3.249 0.200 222 HA MET 25 HA MET 25 10.125 2.035 1.960 223 HB2 MET 25 2HB MET 25 12.547 0.957 0.520 224 HB3 MET 25 3HB MET 25 11.573 -0.019 1.611 225 HG2 MET 25 2HG MET 25 10.527 1.365 -0.847 226 HG3 MET 25 3HG MET 25 11.007 -0.329 -0.769 227 HE1 MET 25 3HE MET 25 9.678 -2.200 0.551 228 HE2 MET 25 1HE MET 25 10.035 -1.283 2.015 229 HE3 MET 25 2HE MET 25 8.389 -1.833 1.699 230 H GLN 26 H GLN 26 10.814 0.762 3.849 231 HA GLN 26 HA GLN 26 12.452 2.348 5.577 232 HB2 GLN 26 2HB GLN 26 10.566 0.159 5.841 233 HB3 GLN 26 3HB GLN 26 11.977 -0.083 6.862 234 HG2 GLN 26 2HG GLN 26 10.942 1.202 8.344 235 HG3 GLN 26 3HG GLN 26 11.358 2.555 7.294 236 HE21 GLN 26 1HE2 GLN 26 8.877 0.883 8.778 237 HE22 GLN 26 2HE2 GLN 26 7.545 1.564 7.915 238 HA PRO 27 HA PRO 27 16.355 0.375 5.241 239 HB2 PRO 27 2HB PRO 27 17.207 0.332 7.818 240 HB3 PRO 27 3HB PRO 27 17.114 1.816 6.862 241 HG2 PRO 27 2HG PRO 27 15.193 0.749 8.895 242 HG3 PRO 27 3HG PRO 27 15.770 2.410 8.664 243 HD2 PRO 27 2HD PRO 27 13.357 1.567 7.769 244 HD3 PRO 27 3HD PRO 27 14.306 2.810 6.928 245 H ASN 28 H ASN 28 13.787 -1.128 6.802 246 HA ASN 28 HA ASN 28 15.114 -3.710 6.619 247 HB2 ASN 28 2HB ASN 28 15.040 -2.502 9.070 248 HB3 ASN 28 3HB ASN 28 13.551 -3.442 9.099 249 HD21 ASN 28 1HD2 ASN 28 14.229 -4.908 10.600 250 HD22 ASN 28 2HD2 ASN 28 15.471 -6.071 10.298 251 H GLU 29 H GLU 29 13.123 -2.542 5.012 252 HA GLU 29 HA GLU 29 10.734 -4.102 5.742 253 HB2 GLU 29 2HB GLU 29 11.086 -1.427 4.645 254 HB3 GLU 29 3HB GLU 29 9.999 -2.406 3.669 255 HG2 GLU 29 2HG GLU 29 8.860 -2.960 5.921 256 HG3 GLU 29 3HG GLU 29 9.715 -1.536 6.512 257 H VAL 30 H VAL 30 9.527 -5.045 3.913 258 HA VAL 30 HA VAL 30 11.393 -6.239 2.005 259 HB VAL 30 HB VAL 30 9.750 -7.589 3.472 260 HG11 VAL 30 1HG1 VAL 30 7.528 -7.785 2.821 261 HG12 VAL 30 2HG1 VAL 30 7.829 -6.051 2.683 262 HG13 VAL 30 3HG1 VAL 30 7.824 -7.064 1.239 263 HG21 VAL 30 3HG2 VAL 30 9.829 -9.336 1.957 264 HG22 VAL 30 1HG2 VAL 30 9.537 -8.284 0.572 265 HG23 VAL 30 2HG2 VAL 30 11.112 -8.280 1.365 266 H ALA 31 H ALA 31 11.128 -6.153 -0.201 267 HA ALA 31 HA ALA 31 8.990 -4.398 -1.213 268 HB1 ALA 31 1HB ALA 31 11.885 -4.384 -2.059 269 HB2 ALA 31 2HB ALA 31 10.593 -3.472 -2.842 270 HB3 ALA 31 3HB ALA 31 11.039 -3.114 -1.174 271 H ILE 32 H ILE 32 7.700 -5.590 -2.446 272 HA ILE 32 HA ILE 32 8.721 -7.937 -3.823 273 HB ILE 32 HB ILE 32 5.938 -6.828 -3.494 274 HG12 ILE 32 2HG1 ILE 32 6.393 -9.561 -2.662 275 HG13 ILE 32 3HG1 ILE 32 7.544 -8.477 -1.889 276 HG21 ILE 32 1HG2 ILE 32 5.243 -9.014 -4.582 277 HG22 ILE 32 2HG2 ILE 32 5.896 -7.773 -5.649 278 HG23 ILE 32 3HG2 ILE 32 6.904 -9.134 -5.159 279 HD11 ILE 32 3HD1 ILE 32 4.957 -9.000 -1.079 280 HD12 ILE 32 1HD1 ILE 32 5.998 -7.696 -0.509 281 HD13 ILE 32 2HD1 ILE 32 4.863 -7.406 -1.827 282 H PHE 33 H PHE 33 9.753 -7.536 -5.678 283 HA PHE 33 HA PHE 33 8.681 -5.496 -7.494 284 HB2 PHE 33 2HB PHE 33 11.346 -6.928 -7.552 285 HB3 PHE 33 3HB PHE 33 10.849 -5.636 -8.641 286 HD1 PHE 33 HD2 PHE 33 9.488 -3.874 -6.613 287 HD2 PHE 33 HD1 PHE 33 13.211 -5.935 -6.534 288 HE1 PHE 33 HE2 PHE 33 10.375 -2.205 -5.037 289 HE2 PHE 33 HE1 PHE 33 14.103 -4.271 -4.957 290 HZ PHE 33 HZ PHE 33 12.685 -2.402 -4.208 291 H MET 34 H MET 34 7.642 -6.047 -9.296 292 HA MET 34 HA MET 34 7.549 -8.879 -10.033 293 HB2 MET 34 2HB MET 34 5.584 -6.886 -9.838 294 HB3 MET 34 3HB MET 34 5.775 -7.186 -11.560 295 HG2 MET 34 2HG MET 34 5.399 -9.574 -11.178 296 HG3 MET 34 3HG MET 34 5.184 -9.257 -9.459 297 HE1 MET 34 3HE MET 34 2.123 -8.938 -8.714 298 HE2 MET 34 1HE MET 34 3.625 -8.061 -8.419 299 HE3 MET 34 2HE MET 34 2.224 -7.213 -9.070 300 H PHE 35 H PHE 35 8.605 -9.613 -11.751 301 HA PHE 35 HA PHE 35 9.348 -7.705 -13.868 302 HB2 PHE 35 2HB PHE 35 11.486 -8.832 -14.127 303 HB3 PHE 35 3HB PHE 35 11.304 -8.288 -12.462 304 HD1 PHE 35 HD1 PHE 35 10.375 -10.043 -10.788 305 HD2 PHE 35 HD2 PHE 35 12.110 -11.010 -14.552 306 HE1 PHE 35 HE1 PHE 35 10.823 -12.327 -9.990 307 HE2 PHE 35 HE2 PHE 35 12.560 -13.296 -13.761 308 HZ PHE 35 HZ PHE 35 11.915 -13.958 -11.478 309 H GLU 36 H GLU 36 8.817 -8.290 -15.879 310 HA GLU 36 HA GLU 36 7.637 -10.939 -16.266 311 HB2 GLU 36 2HB GLU 36 6.472 -10.050 -18.108 312 HB3 GLU 36 3HB GLU 36 6.434 -8.778 -16.895 313 HG2 GLU 36 2HG GLU 36 6.979 -7.560 -18.736 314 HG3 GLU 36 3HG GLU 36 8.591 -7.961 -18.147 315 H VAL 37 H VAL 37 10.386 -9.048 -17.133 316 HA VAL 37 HA VAL 37 11.108 -10.518 -19.478 317 HB VAL 37 HB VAL 37 13.024 -8.945 -17.772 318 HG11 VAL 37 1HG1 VAL 37 14.320 -9.778 -19.430 319 HG12 VAL 37 2HG1 VAL 37 12.960 -9.998 -20.533 320 HG13 VAL 37 3HG1 VAL 37 13.669 -8.397 -20.313 321 HG21 VAL 37 3HG2 VAL 37 10.987 -7.902 -19.733 322 HG22 VAL 37 1HG2 VAL 37 11.145 -7.494 -18.024 323 HG23 VAL 37 2HG2 VAL 37 12.377 -6.972 -19.173 324 H GLY 38 H GLY 38 13.045 -11.848 -19.676 325 HA2 GLY 38 2HA GLY 38 13.148 -13.821 -17.577 326 HA3 GLY 38 3HA GLY 38 14.009 -13.878 -19.108 327 H ASP 39 H ASP 39 14.615 -10.912 -17.831 328 HA ASP 39 HA ASP 39 17.296 -11.649 -17.091 329 HB2 ASP 39 2HB ASP 39 15.845 -8.999 -17.127 330 HB3 ASP 39 3HB ASP 39 17.534 -9.175 -16.658 331 H PHE 40 H PHE 40 17.025 -12.938 -15.243 332 HA PHE 40 HA PHE 40 15.732 -11.819 -12.905 333 HB2 PHE 40 2HB PHE 40 16.056 -13.933 -11.883 334 HB3 PHE 40 3HB PHE 40 15.663 -14.277 -13.564 335 HD1 PHE 40 HD2 PHE 40 18.286 -14.311 -11.018 336 HD2 PHE 40 HD1 PHE 40 17.310 -15.193 -15.066 337 HE1 PHE 40 HE2 PHE 40 20.347 -15.639 -11.222 338 HE2 PHE 40 HE1 PHE 40 19.370 -16.524 -15.276 339 HZ PHE 40 HZ PHE 40 20.892 -16.747 -13.353 340 H SER 41 H SER 41 18.895 -12.030 -14.241 341 HA SER 41 HA SER 41 20.364 -11.746 -11.815 342 HB2 SER 41 2HB SER 41 22.203 -11.896 -13.134 343 HB3 SER 41 3HB SER 41 21.046 -12.374 -14.376 344 HG SER 41 HG SER 41 22.041 -10.734 -15.334 345 H ASN 42 H ASN 42 18.572 -9.590 -13.772 346 HA ASN 42 HA ASN 42 19.983 -7.205 -12.966 347 HB2 ASN 42 2HB ASN 42 17.662 -7.846 -14.701 348 HB3 ASN 42 3HB ASN 42 17.675 -6.245 -13.967 349 HD21 ASN 42 1HD2 ASN 42 19.357 -8.433 -16.102 350 HD22 ASN 42 2HD2 ASN 42 20.317 -7.234 -16.893 351 H ILE 43 H ILE 43 17.324 -9.105 -11.824 352 HA ILE 43 HA ILE 43 15.819 -7.328 -10.368 353 HB ILE 43 HB ILE 43 16.510 -10.196 -9.995 354 HG12 ILE 43 2HG1 ILE 43 14.686 -9.445 -11.494 355 HG13 ILE 43 3HG1 ILE 43 14.098 -10.463 -10.183 356 HG21 ILE 43 1HG2 ILE 43 14.946 -10.142 -7.952 357 HG22 ILE 43 2HG2 ILE 43 16.627 -9.658 -7.734 358 HG23 ILE 43 3HG2 ILE 43 15.367 -8.431 -7.861 359 HD11 ILE 43 3HD1 ILE 43 12.558 -8.693 -10.431 360 HD12 ILE 43 1HD1 ILE 43 13.484 -8.354 -8.969 361 HD13 ILE 43 2HD1 ILE 43 13.843 -7.485 -10.461 362 HA PRO 44 HA PRO 44 18.861 -7.776 -6.630 363 HB2 PRO 44 2HB PRO 44 21.282 -8.893 -7.140 364 HB3 PRO 44 3HB PRO 44 19.873 -9.839 -6.645 365 HG2 PRO 44 2HG PRO 44 21.000 -9.412 -9.385 366 HG3 PRO 44 3HG PRO 44 20.395 -10.905 -8.645 367 HD2 PRO 44 2HD PRO 44 18.920 -9.436 -10.377 368 HD3 PRO 44 3HD PRO 44 18.191 -10.360 -9.048 369 H LYS 45 H LYS 45 19.954 -7.017 -9.840 370 HA LYS 45 HA LYS 45 22.148 -5.365 -9.161 371 HB2 LYS 45 2HB LYS 45 21.250 -6.361 -11.480 372 HB3 LYS 45 3HB LYS 45 20.559 -4.748 -11.596 373 HG2 LYS 45 2HG LYS 45 23.258 -4.484 -10.766 374 HG3 LYS 45 3HG LYS 45 23.208 -5.584 -12.145 375 HD2 LYS 45 2HD LYS 45 21.684 -3.821 -13.232 376 HD3 LYS 45 3HD LYS 45 22.276 -2.736 -11.972 377 HE2 LYS 45 2HE LYS 45 24.084 -4.286 -13.815 378 HE3 LYS 45 3HE LYS 45 23.524 -2.650 -14.157 379 HZ1 LYS 45 3HZ LYS 45 24.588 -2.817 -11.534 380 HZ2 LYS 45 1HZ LYS 45 25.065 -1.825 -12.818 381 HZ3 LYS 45 2HZ LYS 45 25.721 -3.375 -12.659 382 H SER 46 H SER 46 18.710 -4.843 -9.262 383 HA SER 46 HA SER 46 18.809 -1.992 -9.280 384 HB2 SER 46 2HB SER 46 16.420 -3.105 -8.043 385 HB3 SER 46 3HB SER 46 16.580 -2.163 -9.526 386 HG SER 46 HG SER 46 15.810 -4.219 -10.018 387 H ALA 47 H ALA 47 18.062 -4.350 -6.711 388 HA ALA 47 HA ALA 47 17.889 -2.519 -4.607 389 HB1 ALA 47 1HB ALA 47 18.911 -5.319 -4.254 390 HB2 ALA 47 2HB ALA 47 17.919 -4.357 -3.158 391 HB3 ALA 47 3HB ALA 47 17.225 -4.987 -4.652 392 H GLU 48 H GLU 48 20.633 -3.754 -6.286 393 HA GLU 48 HA GLU 48 22.552 -3.262 -4.219 394 HB2 GLU 48 2HB GLU 48 22.823 -4.874 -6.159 395 HB3 GLU 48 3HB GLU 48 23.097 -3.469 -7.179 396 HG2 GLU 48 2HG GLU 48 24.747 -3.619 -4.748 397 HG3 GLU 48 3HG GLU 48 25.053 -4.857 -5.966 398 H PHE 49 H PHE 49 21.128 -1.405 -6.799 399 HA PHE 49 HA PHE 49 22.988 0.637 -7.089 400 HB2 PHE 49 2HB PHE 49 20.358 0.130 -7.951 401 HB3 PHE 49 3HB PHE 49 20.308 1.703 -7.161 402 HD1 PHE 49 HD2 PHE 49 21.656 3.563 -8.012 403 HD2 PHE 49 HD1 PHE 49 21.514 -0.192 -10.012 404 HE1 PHE 49 HE2 PHE 49 22.594 4.607 -10.032 405 HE2 PHE 49 HE1 PHE 49 22.454 0.847 -12.035 406 HZ PHE 49 HZ PHE 49 22.994 3.250 -12.048 407 H ILE 50 H ILE 50 20.865 -0.064 -4.463 408 HA ILE 50 HA ILE 50 20.928 2.563 -3.302 409 HB ILE 50 HB ILE 50 20.178 -0.056 -1.999 410 HG12 ILE 50 2HG1 ILE 50 18.842 0.500 -4.039 411 HG13 ILE 50 3HG1 ILE 50 17.890 0.459 -2.559 412 HG21 ILE 50 1HG2 ILE 50 20.059 2.789 -1.154 413 HG22 ILE 50 2HG2 ILE 50 18.742 1.722 -0.672 414 HG23 ILE 50 3HG2 ILE 50 20.400 1.340 -0.208 415 HD11 ILE 50 3HD1 ILE 50 17.921 2.882 -2.451 416 HD12 ILE 50 1HD1 ILE 50 18.920 2.945 -3.903 417 HD13 ILE 50 2HD1 ILE 50 17.270 2.328 -3.994 418 H GLN 51 H GLN 51 22.145 -0.544 -2.037 419 HA GLN 51 HA GLN 51 24.660 0.716 -1.309 420 HB2 GLN 51 2HB GLN 51 22.663 0.684 0.566 421 HB3 GLN 51 3HB GLN 51 23.521 -0.808 0.929 422 HG2 GLN 51 2HG GLN 51 25.618 0.471 1.095 423 HG3 GLN 51 3HG GLN 51 24.708 1.955 0.813 424 HE21 GLN 51 1HE2 GLN 51 22.479 1.545 2.326 425 HE22 GLN 51 2HE2 GLN 51 22.909 1.458 3.997 426 H SER 52 H SER 52 26.328 -0.663 -1.460 427 HA SER 52 HA SER 52 26.129 -3.118 -2.690 428 HB2 SER 52 2HB SER 52 28.214 -1.670 -2.290 429 HB3 SER 52 3HB SER 52 28.343 -2.499 -0.739 430 HG SER 52 HG SER 52 29.545 -3.475 -2.498 431 H LYS 53 H LYS 53 25.897 -2.346 0.709 432 HA LYS 53 HA LYS 53 25.363 -5.189 1.268 433 HB2 LYS 53 2HB LYS 53 26.122 -4.569 3.651 434 HB3 LYS 53 3HB LYS 53 27.358 -4.792 2.419 435 HG2 LYS 53 2HG LYS 53 27.841 -2.540 2.304 436 HG3 LYS 53 3HG LYS 53 26.272 -2.064 2.957 437 HD2 LYS 53 2HD LYS 53 27.358 -1.785 4.895 438 HD3 LYS 53 3HD LYS 53 27.347 -3.547 5.001 439 HE2 LYS 53 2HE LYS 53 29.548 -3.727 4.466 440 HE3 LYS 53 3HE LYS 53 29.521 -2.311 3.417 441 HZ1 LYS 53 3HZ LYS 53 29.729 -2.394 6.367 442 HZ2 LYS 53 1HZ LYS 53 29.302 -0.981 5.540 443 HZ3 LYS 53 2HZ LYS 53 30.805 -1.704 5.259 444 H GLY 54 H GLY 54 23.415 -5.634 2.084 445 HA2 GLY 54 2HA GLY 54 21.826 -4.873 3.916 446 HA3 GLY 54 3HA GLY 54 21.781 -3.361 3.022 447 H HIS 55 H HIS 55 22.001 -5.192 0.522 448 HA HIS 55 HA HIS 55 19.112 -5.743 0.374 449 HB2 HIS 55 2HB HIS 55 19.217 -5.305 -1.983 450 HB3 HIS 55 3HB HIS 55 20.023 -3.974 -1.158 451 HD1 HIS 55 HD1 HIS 55 22.789 -4.409 -1.003 452 HD2 HIS 55 HD2 HIS 55 20.655 -6.238 -4.063 453 HE1 HIS 55 HE1 HIS 55 24.495 -4.996 -2.754 454 H GLU 56 H GLU 56 18.570 -7.813 0.373 455 HA GLU 56 HA GLU 56 20.180 -9.731 -1.122 456 HB2 GLU 56 2HB GLU 56 20.341 -9.524 1.690 457 HB3 GLU 56 3HB GLU 56 19.392 -10.965 1.351 458 HG2 GLU 56 2HG GLU 56 21.819 -10.675 -0.270 459 HG3 GLU 56 3HG GLU 56 22.092 -10.887 1.458 460 H LEU 57 H LEU 57 18.848 -10.821 -2.392 461 HA LEU 57 HA LEU 57 16.021 -10.753 -2.052 462 HB2 LEU 57 2HB LEU 57 17.814 -12.275 -3.929 463 HB3 LEU 57 3HB LEU 57 16.056 -12.382 -3.980 464 HG LEU 57 HG LEU 57 16.748 -10.875 -5.689 465 HD11 LEU 57 1HD1 LEU 57 15.298 -9.180 -5.250 466 HD12 LEU 57 2HD1 LEU 57 15.933 -8.904 -3.628 467 HD13 LEU 57 3HD1 LEU 57 14.858 -10.268 -3.933 468 HD21 LEU 57 3HD2 LEU 57 18.026 -8.965 -3.811 469 HD22 LEU 57 1HD2 LEU 57 18.353 -9.271 -5.517 470 HD23 LEU 57 2HD2 LEU 57 18.950 -10.390 -4.291 471 H LEU 58 H LEU 58 15.242 -11.792 -0.297 472 HA LEU 58 HA LEU 58 16.215 -14.074 0.917 473 HB2 LEU 58 2HB LEU 58 13.717 -12.569 0.932 474 HB3 LEU 58 3HB LEU 58 13.497 -14.281 1.288 475 HG LEU 58 HG LEU 58 15.675 -13.118 2.817 476 HD11 LEU 58 1HD1 LEU 58 13.957 -11.191 2.451 477 HD12 LEU 58 2HD1 LEU 58 14.597 -11.514 4.062 478 HD13 LEU 58 3HD1 LEU 58 12.991 -12.093 3.618 479 HD21 LEU 58 3HD2 LEU 58 13.094 -14.442 3.643 480 HD22 LEU 58 1HD2 LEU 58 14.530 -14.213 4.643 481 HD23 LEU 58 2HD2 LEU 58 14.590 -15.290 3.247 482 H ASN 59 H ASN 59 13.321 -14.017 -1.172 483 HA ASN 59 HA ASN 59 13.930 -15.895 -3.017 484 HB2 ASN 59 2HB ASN 59 13.708 -17.129 -0.388 485 HB3 ASN 59 3HB ASN 59 12.592 -17.840 -1.550 486 HD21 ASN 59 1HD2 ASN 59 13.915 -17.802 -3.865 487 HD22 ASN 59 2HD2 ASN 59 15.364 -18.738 -3.769 488 H SER 60 H SER 60 12.276 -16.003 -4.410 489 HA SER 60 HA SER 60 9.614 -16.437 -3.913 490 HB2 SER 60 2HB SER 60 9.263 -14.504 -2.658 491 HB3 SER 60 3HB SER 60 10.380 -13.548 -3.632 492 HG SER 60 HG SER 60 8.145 -13.071 -4.027 493 H LEU 61 H LEU 61 12.050 -14.867 -5.818 494 HA LEU 61 HA LEU 61 10.457 -14.571 -8.180 495 HB2 LEU 61 2HB LEU 61 12.288 -13.610 -9.124 496 HB3 LEU 61 3HB LEU 61 12.687 -13.391 -7.421 497 HG LEU 61 HG LEU 61 13.723 -15.708 -9.037 498 HD11 LEU 61 1HD1 LEU 61 14.455 -12.915 -9.206 499 HD12 LEU 61 2HD1 LEU 61 14.983 -14.282 -10.186 500 HD13 LEU 61 3HD1 LEU 61 15.807 -13.915 -8.671 501 HD21 LEU 61 3HD2 LEU 61 15.459 -15.702 -7.276 502 HD22 LEU 61 1HD2 LEU 61 13.838 -16.004 -6.647 503 HD23 LEU 61 2HD2 LEU 61 14.579 -14.415 -6.450 504 H ARG 62 H ARG 62 10.085 -15.993 -9.767 505 HA ARG 62 HA ARG 62 11.597 -18.523 -9.738 506 HB2 ARG 62 2HB ARG 62 9.174 -18.629 -8.938 507 HB3 ARG 62 3HB ARG 62 8.720 -18.273 -10.599 508 HG2 ARG 62 2HG ARG 62 8.620 -20.537 -10.671 509 HG3 ARG 62 3HG ARG 62 10.321 -20.322 -11.089 510 HD2 ARG 62 2HD ARG 62 11.055 -21.121 -9.092 511 HD3 ARG 62 3HD ARG 62 9.657 -20.506 -8.210 512 HE ARG 62 HE ARG 62 8.937 -22.635 -9.954 513 HH11 ARG 62 1HH1 ARG 62 10.425 -21.932 -6.886 514 HH12 ARG 62 2HH1 ARG 62 10.014 -23.463 -6.188 515 HH21 ARG 62 1HH2 ARG 62 8.389 -24.654 -9.046 516 HH22 ARG 62 2HH2 ARG 62 8.856 -25.011 -7.418 517 H PHE 63 H PHE 63 12.583 -16.525 -11.244 518 HA PHE 63 HA PHE 63 11.706 -15.977 -13.749 519 HB2 PHE 63 2HB PHE 63 13.823 -15.280 -14.189 520 HB3 PHE 63 3HB PHE 63 14.051 -15.586 -12.471 521 HD1 PHE 63 HD2 PHE 63 15.257 -17.556 -11.706 522 HD2 PHE 63 HD1 PHE 63 14.802 -16.706 -15.852 523 HE1 PHE 63 HE2 PHE 63 17.042 -19.167 -12.229 524 HE2 PHE 63 HE1 PHE 63 16.586 -18.316 -16.381 525 HZ PHE 63 HZ PHE 63 17.709 -19.548 -14.569 526 H ASN 64 H ASN 64 10.759 -17.315 -15.143 527 HA ASN 64 HA ASN 64 12.078 -19.217 -16.628 528 HB2 ASN 64 2HB ASN 64 11.165 -20.251 -14.050 529 HB3 ASN 64 3HB ASN 64 10.545 -21.173 -15.416 530 HD21 ASN 64 1HD2 ASN 64 12.461 -21.277 -17.194 531 HD22 ASN 64 2HD2 ASN 64 13.906 -21.977 -16.557 532 H GLN 65 H GLN 65 9.050 -18.237 -15.171 533 HA GLN 65 HA GLN 65 7.696 -18.848 -17.714 534 HB2 GLN 65 2HB GLN 65 7.107 -20.035 -15.329 535 HB3 GLN 65 3HB GLN 65 5.995 -18.672 -15.318 536 HG2 GLN 65 2HG GLN 65 4.698 -19.557 -16.908 537 HG3 GLN 65 3HG GLN 65 6.072 -20.138 -17.848 538 HE21 GLN 65 1HE2 GLN 65 3.417 -21.245 -16.632 539 HE22 GLN 65 2HE2 GLN 65 3.901 -22.791 -16.032 540 H ALA 66 H ALA 66 5.239 -17.592 -16.745 541 HA ALA 66 HA ALA 66 5.504 -15.050 -17.776 542 HB1 ALA 66 1HB ALA 66 3.391 -16.433 -17.140 543 HB2 ALA 66 2HB ALA 66 3.502 -15.551 -15.616 544 HB3 ALA 66 3HB ALA 66 3.322 -14.670 -17.133 545 H ASP 67 H ASP 67 4.904 -13.000 -16.437 546 HA ASP 67 HA ASP 67 7.081 -12.216 -14.953 547 HB2 ASP 67 2HB ASP 67 5.847 -10.399 -15.598 548 HB3 ASP 67 3HB ASP 67 4.309 -11.194 -15.273 549 H TRP 68 H TRP 68 7.796 -12.593 -12.962 550 HA TRP 68 HA TRP 68 5.939 -13.822 -11.033 551 HB2 TRP 68 2HB TRP 68 8.359 -14.800 -11.993 552 HB3 TRP 68 3HB TRP 68 8.765 -14.145 -10.409 553 HD1 TRP 68 HD1 TRP 68 8.386 -15.742 -8.445 554 HE1 TRP 68 HE1 TRP 68 7.041 -17.902 -8.059 555 HE3 TRP 68 HE3 TRP 68 5.955 -15.998 -12.936 556 HZ2 TRP 68 HZ2 TRP 68 5.194 -19.503 -9.472 557 HZ3 TRP 68 HZ3 TRP 68 4.417 -17.876 -13.339 558 HH2 TRP 68 HH2 TRP 68 4.046 -19.591 -11.642 559 H THR 69 H THR 69 7.169 -13.576 -8.701 560 HA THR 69 HA THR 69 7.667 -10.689 -8.374 561 HB THR 69 HB THR 69 6.667 -11.382 -5.946 562 HG1 THR 69 HG1 THR 69 4.737 -12.618 -6.454 563 HG21 THR 69 3HG2 THR 69 4.748 -10.623 -8.112 564 HG22 THR 69 1HG2 THR 69 6.064 -9.530 -7.683 565 HG23 THR 69 2HG2 THR 69 4.880 -10.005 -6.465 566 H ILE 70 H ILE 70 9.190 -10.068 -6.852 567 HA ILE 70 HA ILE 70 10.695 -12.221 -5.531 568 HB ILE 70 HB ILE 70 11.985 -11.627 -7.485 569 HG12 ILE 70 2HG1 ILE 70 14.073 -11.056 -6.432 570 HG13 ILE 70 3HG1 ILE 70 13.241 -10.275 -5.091 571 HG21 ILE 70 1HG2 ILE 70 11.887 -9.588 -8.351 572 HG22 ILE 70 2HG2 ILE 70 11.010 -9.012 -6.934 573 HG23 ILE 70 3HG2 ILE 70 12.772 -8.962 -6.960 574 HD11 ILE 70 3HD1 ILE 70 13.050 -12.187 -3.984 575 HD12 ILE 70 1HD1 ILE 70 12.447 -13.041 -5.404 576 HD13 ILE 70 2HD1 ILE 70 14.184 -12.860 -5.155 577 H VAL 71 H VAL 71 11.212 -11.837 -3.460 578 HA VAL 71 HA VAL 71 10.380 -9.291 -2.302 579 HB VAL 71 HB VAL 71 10.851 -10.495 -0.111 580 HG11 VAL 71 1HG1 VAL 71 8.776 -11.911 -0.328 581 HG12 VAL 71 2HG1 VAL 71 8.599 -10.222 -0.808 582 HG13 VAL 71 3HG1 VAL 71 8.756 -11.477 -2.037 583 HG21 VAL 71 3HG2 VAL 71 10.601 -13.095 -1.457 584 HG22 VAL 71 1HG2 VAL 71 12.158 -12.294 -1.665 585 HG23 VAL 71 2HG2 VAL 71 11.550 -12.633 -0.044 586 H VAL 72 H VAL 72 11.753 -7.779 -1.606 587 HA VAL 72 HA VAL 72 14.608 -8.488 -1.388 588 HB VAL 72 HB VAL 72 13.621 -5.746 -2.139 589 HG11 VAL 72 1HG1 VAL 72 15.851 -5.342 -2.814 590 HG12 VAL 72 2HG1 VAL 72 15.953 -6.134 -1.241 591 HG13 VAL 72 3HG1 VAL 72 16.269 -7.052 -2.714 592 HG21 VAL 72 3HG2 VAL 72 12.952 -6.573 -4.102 593 HG22 VAL 72 1HG2 VAL 72 14.658 -6.864 -4.442 594 HG23 VAL 72 2HG2 VAL 72 13.662 -8.153 -3.767 595 H ARG 73 H ARG 73 15.515 -8.131 0.527 596 HA ARG 73 HA ARG 73 14.025 -6.561 2.505 597 HB2 ARG 73 2HB ARG 73 15.591 -7.687 4.141 598 HB3 ARG 73 3HB ARG 73 14.472 -8.752 3.300 599 HG2 ARG 73 2HG ARG 73 16.143 -9.965 2.506 600 HG3 ARG 73 3HG ARG 73 16.910 -8.535 1.811 601 HD2 ARG 73 2HD ARG 73 18.383 -9.684 3.400 602 HD3 ARG 73 3HD ARG 73 17.983 -8.052 3.936 603 HE ARG 73 HE ARG 73 16.900 -8.946 5.748 604 HH11 ARG 73 1HH1 ARG 73 17.505 -11.456 3.413 605 HH12 ARG 73 2HH1 ARG 73 17.016 -12.738 4.470 606 HH21 ARG 73 1HH2 ARG 73 16.254 -10.626 7.150 607 HH22 ARG 73 2HH2 ARG 73 16.304 -12.265 6.595 608 H LYS 74 H LYS 74 14.707 -4.608 3.069 609 HA LYS 74 HA LYS 74 17.246 -3.625 2.082 610 HB2 LYS 74 2HB LYS 74 14.992 -2.288 3.584 611 HB3 LYS 74 3HB LYS 74 16.454 -1.454 3.074 612 HG2 LYS 74 2HG LYS 74 15.729 -1.238 0.978 613 HG3 LYS 74 3HG LYS 74 15.158 -2.907 0.909 614 HD2 LYS 74 2HD LYS 74 13.327 -1.829 2.579 615 HD3 LYS 74 3HD LYS 74 13.707 -0.428 1.575 616 HE2 LYS 74 2HE LYS 74 11.822 -1.718 0.677 617 HE3 LYS 74 3HE LYS 74 13.194 -1.697 -0.430 618 HZ1 LYS 74 3HZ LYS 74 11.865 -3.914 0.548 619 HZ2 LYS 74 1HZ LYS 74 13.374 -3.918 1.312 620 HZ3 LYS 74 2HZ LYS 74 13.282 -3.895 -0.376 621 H LYS 75 H LYS 75 18.895 -2.737 3.366 622 HA LYS 75 HA LYS 75 18.851 -2.721 6.195 623 HB2 LYS 75 2HB LYS 75 19.342 -5.256 5.037 624 HB3 LYS 75 3HB LYS 75 20.882 -4.675 5.657 625 HG2 LYS 75 2HG LYS 75 18.902 -4.158 7.619 626 HG3 LYS 75 3HG LYS 75 18.719 -5.828 7.078 627 HD2 LYS 75 2HD LYS 75 20.989 -6.329 7.610 628 HD3 LYS 75 3HD LYS 75 21.360 -4.626 7.894 629 HE2 LYS 75 2HE LYS 75 19.424 -4.877 9.678 630 HE3 LYS 75 3HE LYS 75 19.900 -6.573 9.606 631 HZ1 LYS 75 3HZ LYS 75 22.003 -6.103 10.403 632 HZ2 LYS 75 1HZ LYS 75 21.039 -5.041 11.299 633 HZ3 LYS 75 2HZ LYS 75 21.928 -4.467 9.980 634 H ALA 76 H ALA 76 21.435 -2.925 6.887 635 HA ALA 76 HA ALA 76 22.656 -0.751 5.366 636 HB1 ALA 76 1HB ALA 76 24.330 -1.082 7.439 637 HB2 ALA 76 2HB ALA 76 22.870 -0.095 7.517 638 HB3 ALA 76 3HB ALA 76 22.852 -1.746 8.137 Start of MODEL 16 1 H1 MET 1 H MET 1 0.505 -2.212 0.196 2 HA MET 1 HA MET 1 1.121 -2.285 -2.045 3 HB2 MET 1 2HB MET 1 2.041 0.500 -1.416 4 HB3 MET 1 3HB MET 1 2.597 -0.304 -2.878 5 HG2 MET 1 2HG MET 1 0.707 0.166 -3.921 6 HG3 MET 1 3HG MET 1 -0.240 -0.586 -2.640 7 HE1 MET 1 3HE MET 1 -1.175 1.498 -4.436 8 HE2 MET 1 1HE MET 1 -1.671 2.983 -3.623 9 HE3 MET 1 2HE MET 1 -0.108 2.904 -4.436 10 H LYS 2 H LYS 2 3.813 -0.429 -0.672 11 HA LYS 2 HA LYS 2 6.051 -0.930 -0.620 12 HB2 LYS 2 2HB LYS 2 6.591 -2.695 0.926 13 HB3 LYS 2 3HB LYS 2 5.138 -1.881 1.492 14 HG2 LYS 2 2HG LYS 2 3.754 -3.674 0.733 15 HG3 LYS 2 3HG LYS 2 5.117 -4.448 -0.079 16 HD2 LYS 2 2HD LYS 2 6.213 -4.622 2.190 17 HD3 LYS 2 3HD LYS 2 4.668 -4.120 2.882 18 HE2 LYS 2 2HE LYS 2 5.051 -6.515 1.090 19 HE3 LYS 2 3HE LYS 2 4.998 -6.581 2.851 20 HZ1 LYS 2 3HZ LYS 2 2.747 -5.381 2.527 21 HZ2 LYS 2 1HZ LYS 2 2.838 -7.051 2.273 22 HZ3 LYS 2 2HZ LYS 2 2.828 -5.995 0.953 23 H ARG 3 H ARG 3 4.727 -1.757 -3.063 24 HA ARG 3 HA ARG 3 6.676 -3.763 -3.913 25 HB2 ARG 3 2HB ARG 3 5.109 -5.182 -4.944 26 HB3 ARG 3 3HB ARG 3 4.422 -4.839 -3.361 27 HG2 ARG 3 2HG ARG 3 3.399 -2.846 -4.994 28 HG3 ARG 3 3HG ARG 3 3.362 -4.301 -5.993 29 HD2 ARG 3 2HD ARG 3 1.797 -5.303 -4.707 30 HD3 ARG 3 3HD ARG 3 2.446 -4.631 -3.212 31 HE ARG 3 HE ARG 3 1.357 -2.475 -4.402 32 HH11 ARG 3 1HH1 ARG 3 0.139 -5.666 -3.729 33 HH12 ARG 3 2HH1 ARG 3 -1.504 -5.145 -3.557 34 HH21 ARG 3 1HH2 ARG 3 -0.803 -1.776 -4.179 35 HH22 ARG 3 2HH2 ARG 3 -2.039 -2.932 -3.815 36 H PHE 4 H PHE 4 7.141 -3.728 -6.160 37 HA PHE 4 HA PHE 4 6.173 -1.319 -7.554 38 HB2 PHE 4 2HB PHE 4 8.768 -1.775 -6.695 39 HB3 PHE 4 3HB PHE 4 8.814 -2.230 -8.395 40 HD1 PHE 4 HD2 PHE 4 7.043 0.462 -6.512 41 HD2 PHE 4 HD1 PHE 4 9.743 -0.548 -9.643 42 HE1 PHE 4 HE2 PHE 4 7.200 2.836 -7.137 43 HE2 PHE 4 HE1 PHE 4 9.905 1.825 -10.273 44 HZ PHE 4 HZ PHE 4 8.632 3.520 -9.020 45 H ASP 5 H ASP 5 5.050 -1.814 -9.306 46 HA ASP 5 HA ASP 5 5.291 -4.441 -10.513 47 HB2 ASP 5 2HB ASP 5 3.219 -2.526 -10.238 48 HB3 ASP 5 3HB ASP 5 3.517 -2.720 -11.963 49 H LEU 6 H LEU 6 6.977 -4.693 -11.844 50 HA LEU 6 HA LEU 6 7.617 -2.534 -13.732 51 HB2 LEU 6 2HB LEU 6 9.218 -4.798 -12.593 52 HB3 LEU 6 3HB LEU 6 9.729 -3.967 -14.061 53 HG LEU 6 HG LEU 6 10.940 -3.060 -12.208 54 HD11 LEU 6 1HD1 LEU 6 9.679 -1.561 -14.012 55 HD12 LEU 6 2HD1 LEU 6 10.683 -0.871 -12.737 56 HD13 LEU 6 3HD1 LEU 6 8.930 -0.915 -12.552 57 HD21 LEU 6 3HD2 LEU 6 8.956 -3.754 -10.612 58 HD22 LEU 6 1HD2 LEU 6 8.484 -2.072 -10.853 59 HD23 LEU 6 2HD2 LEU 6 10.070 -2.455 -10.184 60 H ARG 7 H ARG 7 5.751 -5.160 -13.661 61 HA ARG 7 HA ARG 7 6.416 -6.821 -15.747 62 HB2 ARG 7 2HB ARG 7 3.994 -6.108 -14.322 63 HB3 ARG 7 3HB ARG 7 3.659 -6.452 -16.014 64 HG2 ARG 7 2HG ARG 7 4.236 -8.649 -15.829 65 HG3 ARG 7 3HG ARG 7 5.383 -8.351 -14.522 66 HD2 ARG 7 2HD ARG 7 3.484 -9.553 -13.654 67 HD3 ARG 7 3HD ARG 7 3.480 -7.913 -13.005 68 HE ARG 7 HE ARG 7 1.461 -7.595 -14.008 69 HH11 ARG 7 1HH1 ARG 7 3.094 -10.210 -15.625 70 HH12 ARG 7 2HH1 ARG 7 1.755 -10.579 -16.661 71 HH21 ARG 7 1HH2 ARG 7 -0.309 -8.071 -15.366 72 HH22 ARG 7 2HH2 ARG 7 -0.180 -9.361 -16.513 73 HA PRO 8 HA PRO 8 4.213 -3.902 -18.895 74 HB2 PRO 8 2HB PRO 8 3.455 -1.448 -18.015 75 HB3 PRO 8 3HB PRO 8 2.408 -2.868 -17.919 76 HG2 PRO 8 2HG PRO 8 4.106 -1.620 -15.793 77 HG3 PRO 8 3HG PRO 8 2.450 -2.244 -15.679 78 HD2 PRO 8 2HD PRO 8 4.598 -3.651 -14.822 79 HD3 PRO 8 3HD PRO 8 3.152 -4.431 -15.494 80 H LEU 9 H LEU 9 6.631 -3.018 -16.686 81 HA LEU 9 HA LEU 9 7.658 -0.773 -18.178 82 HB2 LEU 9 2HB LEU 9 8.126 -2.003 -15.620 83 HB3 LEU 9 3HB LEU 9 9.652 -1.743 -16.463 84 HG LEU 9 HG LEU 9 8.272 0.662 -16.738 85 HD11 LEU 9 1HD1 LEU 9 8.260 0.446 -13.859 86 HD12 LEU 9 2HD1 LEU 9 7.110 -0.670 -14.593 87 HD13 LEU 9 3HD1 LEU 9 7.015 1.054 -14.950 88 HD21 LEU 9 3HD2 LEU 9 10.008 1.052 -14.648 89 HD22 LEU 9 1HD2 LEU 9 10.429 1.102 -16.360 90 HD23 LEU 9 2HD2 LEU 9 10.664 -0.383 -15.438 91 H LYS 10 H LYS 10 9.754 -0.727 -19.179 92 HA LYS 10 HA LYS 10 10.312 -3.195 -20.622 93 HB2 LYS 10 2HB LYS 10 11.555 -1.855 -22.154 94 HB3 LYS 10 3HB LYS 10 10.079 -0.973 -21.783 95 HG2 LYS 10 2HG LYS 10 11.350 0.392 -20.161 96 HG3 LYS 10 3HG LYS 10 12.822 -0.445 -20.661 97 HD2 LYS 10 2HD LYS 10 12.940 1.391 -22.019 98 HD3 LYS 10 3HD LYS 10 12.011 0.310 -23.061 99 HE2 LYS 10 2HE LYS 10 10.360 1.859 -21.217 100 HE3 LYS 10 3HE LYS 10 11.288 2.858 -22.335 101 HZ1 LYS 10 3HZ LYS 10 10.318 0.934 -23.949 102 HZ2 LYS 10 1HZ LYS 10 9.607 2.453 -23.727 103 HZ3 LYS 10 2HZ LYS 10 9.046 1.121 -22.849 104 H ALA 11 H ALA 11 12.591 -3.829 -20.992 105 HA ALA 11 HA ALA 11 13.944 -4.157 -18.509 106 HB1 ALA 11 1HB ALA 11 13.879 -5.707 -20.597 107 HB2 ALA 11 2HB ALA 11 15.250 -4.734 -21.133 108 HB3 ALA 11 3HB ALA 11 15.341 -5.624 -19.613 109 H GLY 12 H GLY 12 15.983 -3.388 -17.875 110 HA2 GLY 12 2HA GLY 12 17.923 -2.050 -18.102 111 HA3 GLY 12 3HA GLY 12 17.176 -1.244 -19.474 112 H ILE 13 H ILE 13 14.683 -0.652 -18.221 113 HA ILE 13 HA ILE 13 15.572 1.538 -16.486 114 HB ILE 13 HB ILE 13 12.914 1.184 -17.876 115 HG12 ILE 13 2HG1 ILE 13 15.201 3.026 -18.600 116 HG13 ILE 13 3HG1 ILE 13 14.875 1.496 -19.407 117 HG21 ILE 13 1HG2 ILE 13 12.616 2.558 -15.965 118 HG22 ILE 13 2HG2 ILE 13 14.101 3.450 -16.292 119 HG23 ILE 13 3HG2 ILE 13 12.707 3.638 -17.356 120 HD11 ILE 13 3HD1 ILE 13 13.125 3.938 -19.353 121 HD12 ILE 13 1HD1 ILE 13 13.980 3.255 -20.736 122 HD13 ILE 13 2HD1 ILE 13 12.630 2.380 -20.013 123 H PHE 14 H PHE 14 13.791 -1.402 -16.463 124 HA PHE 14 HA PHE 14 12.142 -0.881 -14.211 125 HB2 PHE 14 2HB PHE 14 11.500 -3.112 -14.339 126 HB3 PHE 14 3HB PHE 14 11.987 -2.773 -15.997 127 HD1 PHE 14 HD1 PHE 14 14.601 -3.200 -16.416 128 HD2 PHE 14 HD2 PHE 14 12.224 -5.080 -13.427 129 HE1 PHE 14 HE1 PHE 14 16.193 -5.075 -16.333 130 HE2 PHE 14 HE2 PHE 14 13.812 -6.956 -13.339 131 HZ PHE 14 HZ PHE 14 15.801 -6.955 -14.792 132 H GLU 15 H GLU 15 15.437 -1.935 -14.612 133 HA GLU 15 HA GLU 15 15.720 -2.758 -11.853 134 HB2 GLU 15 2HB GLU 15 17.028 -3.985 -13.415 135 HB3 GLU 15 3HB GLU 15 17.654 -2.517 -14.152 136 HG2 GLU 15 2HG GLU 15 18.247 -2.768 -11.301 137 HG3 GLU 15 3HG GLU 15 18.957 -4.030 -12.306 138 H ARG 16 H ARG 16 16.152 0.103 -13.737 139 HA ARG 16 HA ARG 16 17.885 1.404 -11.828 140 HB2 ARG 16 2HB ARG 16 16.794 2.003 -14.489 141 HB3 ARG 16 3HB ARG 16 16.930 3.404 -13.436 142 HG2 ARG 16 2HG ARG 16 19.176 3.413 -13.517 143 HG3 ARG 16 3HG ARG 16 19.289 1.652 -13.509 144 HD2 ARG 16 2HD ARG 16 19.512 1.587 -15.722 145 HD3 ARG 16 3HD ARG 16 18.082 2.593 -15.951 146 HE ARG 16 HE ARG 16 20.404 4.078 -15.152 147 HH11 ARG 16 1HH1 ARG 16 18.685 2.703 -17.849 148 HH12 ARG 16 2HH1 ARG 16 19.361 3.800 -19.007 149 HH21 ARG 16 1HH2 ARG 16 21.302 5.528 -16.667 150 HH22 ARG 16 2HH2 ARG 16 20.850 5.406 -18.334 151 H LEU 17 H LEU 17 14.484 1.602 -12.800 152 HA LEU 17 HA LEU 17 13.800 3.722 -11.054 153 HB2 LEU 17 2HB LEU 17 12.492 2.055 -12.961 154 HB3 LEU 17 3HB LEU 17 11.539 2.072 -11.479 155 HG LEU 17 HG LEU 17 10.722 3.766 -12.980 156 HD11 LEU 17 1HD1 LEU 17 10.750 5.638 -11.531 157 HD12 LEU 17 2HD1 LEU 17 12.303 5.169 -10.840 158 HD13 LEU 17 3HD1 LEU 17 10.863 4.207 -10.506 159 HD21 LEU 17 3HD2 LEU 17 13.427 4.056 -13.675 160 HD22 LEU 17 1HD2 LEU 17 12.928 5.596 -12.974 161 HD23 LEU 17 2HD2 LEU 17 12.041 4.921 -14.341 162 H GLU 18 H GLU 18 14.160 0.303 -10.619 163 HA GLU 18 HA GLU 18 12.574 -0.145 -8.379 164 HB2 GLU 18 2HB GLU 18 14.370 -1.627 -9.851 165 HB3 GLU 18 3HB GLU 18 15.160 -1.514 -8.284 166 HG2 GLU 18 2HG GLU 18 13.855 -3.110 -7.500 167 HG3 GLU 18 3HG GLU 18 12.431 -2.127 -7.837 168 H GLU 19 H GLU 19 15.619 1.504 -8.686 169 HA GLU 19 HA GLU 19 16.204 1.483 -5.867 170 HB2 GLU 19 2HB GLU 19 18.085 1.585 -7.318 171 HB3 GLU 19 3HB GLU 19 17.406 2.931 -8.221 172 HG2 GLU 19 2HG GLU 19 17.764 3.497 -5.384 173 HG3 GLU 19 3HG GLU 19 19.264 3.120 -6.229 174 H LEU 20 H LEU 20 14.501 3.533 -8.095 175 HA LEU 20 HA LEU 20 14.513 5.923 -6.604 176 HB2 LEU 20 2HB LEU 20 13.234 4.893 -8.959 177 HB3 LEU 20 3HB LEU 20 12.062 5.764 -7.972 178 HG LEU 20 HG LEU 20 14.136 7.524 -8.009 179 HD11 LEU 20 1HD1 LEU 20 15.221 5.890 -9.676 180 HD12 LEU 20 2HD1 LEU 20 15.191 7.607 -10.077 181 HD13 LEU 20 3HD1 LEU 20 14.032 6.506 -10.824 182 HD21 LEU 20 3HD2 LEU 20 12.796 8.575 -9.943 183 HD22 LEU 20 1HD2 LEU 20 11.983 8.310 -8.400 184 HD23 LEU 20 2HD2 LEU 20 11.713 7.197 -9.742 185 H ILE 21 H ILE 21 12.525 3.042 -6.446 186 HA ILE 21 HA ILE 21 10.725 4.250 -4.503 187 HB ILE 21 HB ILE 21 9.787 2.744 -6.199 188 HG12 ILE 21 2HG1 ILE 21 8.547 1.233 -4.622 189 HG13 ILE 21 3HG1 ILE 21 9.647 1.748 -3.348 190 HG21 ILE 21 1HG2 ILE 21 10.247 0.355 -6.147 191 HG22 ILE 21 2HG2 ILE 21 11.723 1.268 -6.452 192 HG23 ILE 21 3HG2 ILE 21 11.418 0.597 -4.851 193 HD11 ILE 21 3HD1 ILE 21 8.403 3.968 -4.761 194 HD12 ILE 21 1HD1 ILE 21 7.249 2.905 -3.956 195 HD13 ILE 21 2HD1 ILE 21 8.549 3.657 -3.031 196 H GLU 22 H GLU 22 13.353 1.928 -4.648 197 HA GLU 22 HA GLU 22 13.113 0.738 -2.150 198 HB2 GLU 22 2HB GLU 22 14.849 0.460 -4.173 199 HB3 GLU 22 3HB GLU 22 15.849 1.414 -3.087 200 HG2 GLU 22 2HG GLU 22 16.383 -0.449 -2.029 201 HG3 GLU 22 3HG GLU 22 14.708 -0.578 -1.495 202 H LYS 23 H LYS 23 14.170 3.926 -3.014 203 HA LYS 23 HA LYS 23 15.561 4.547 -0.621 204 HB2 LYS 23 2HB LYS 23 14.615 5.987 -2.997 205 HB3 LYS 23 3HB LYS 23 14.623 6.963 -1.534 206 HG2 LYS 23 2HG LYS 23 17.026 6.111 -1.224 207 HG3 LYS 23 3HG LYS 23 16.919 5.633 -2.920 208 HD2 LYS 23 2HD LYS 23 15.946 8.322 -2.553 209 HD3 LYS 23 3HD LYS 23 17.578 8.155 -1.903 210 HE2 LYS 23 2HE LYS 23 18.475 7.572 -3.958 211 HE3 LYS 23 3HE LYS 23 16.919 7.049 -4.602 212 HZ1 LYS 23 3HZ LYS 23 18.108 9.443 -5.079 213 HZ2 LYS 23 1HZ LYS 23 16.961 9.828 -3.896 214 HZ3 LYS 23 2HZ LYS 23 16.475 9.088 -5.338 215 H GLU 24 H GLU 24 12.195 4.748 -1.598 216 HA GLU 24 HA GLU 24 11.360 6.246 0.698 217 HB2 GLU 24 2HB GLU 24 10.235 5.677 -1.738 218 HB3 GLU 24 3HB GLU 24 9.317 4.634 -0.661 219 HG2 GLU 24 2HG GLU 24 9.534 7.200 0.542 220 HG3 GLU 24 3HG GLU 24 9.000 7.400 -1.125 221 H MET 25 H MET 25 11.454 2.841 -0.200 222 HA MET 25 HA MET 25 9.913 1.757 1.837 223 HB2 MET 25 2HB MET 25 12.156 0.766 0.151 224 HB3 MET 25 3HB MET 25 11.723 -0.186 1.565 225 HG2 MET 25 2HG MET 25 9.568 0.678 -0.292 226 HG3 MET 25 3HG MET 25 10.633 -0.641 -0.773 227 HE1 MET 25 3HE MET 25 7.256 -0.725 2.253 228 HE2 MET 25 1HE MET 25 8.231 0.713 1.949 229 HE3 MET 25 2HE MET 25 7.275 0.006 0.647 230 H GLN 26 H GLN 26 10.488 0.765 3.841 231 HA GLN 26 HA GLN 26 12.178 2.378 5.451 232 HB2 GLN 26 2HB GLN 26 10.304 0.187 5.840 233 HB3 GLN 26 3HB GLN 26 11.705 0.050 6.894 234 HG2 GLN 26 2HG GLN 26 10.828 1.550 8.253 235 HG3 GLN 26 3HG GLN 26 10.858 2.745 6.957 236 HE21 GLN 26 1HE2 GLN 26 8.924 1.258 9.134 237 HE22 GLN 26 2HE2 GLN 26 7.394 1.456 8.357 238 HA PRO 27 HA PRO 27 16.074 0.373 5.276 239 HB2 PRO 27 2HB PRO 27 16.877 0.389 7.869 240 HB3 PRO 27 3HB PRO 27 16.809 1.849 6.875 241 HG2 PRO 27 2HG PRO 27 14.845 0.840 8.897 242 HG3 PRO 27 3HG PRO 27 15.433 2.493 8.637 243 HD2 PRO 27 2HD PRO 27 13.034 1.639 7.716 244 HD3 PRO 27 3HD PRO 27 14.005 2.856 6.864 245 H ASN 28 H ASN 28 13.472 -1.078 6.836 246 HA ASN 28 HA ASN 28 14.799 -3.669 6.750 247 HB2 ASN 28 2HB ASN 28 14.660 -2.404 9.162 248 HB3 ASN 28 3HB ASN 28 13.152 -3.313 9.170 249 HD21 ASN 28 1HD2 ASN 28 13.685 -5.619 8.014 250 HD22 ASN 28 2HD2 ASN 28 14.937 -6.477 8.839 251 H GLU 29 H GLU 29 12.816 -2.457 5.096 252 HA GLU 29 HA GLU 29 10.435 -4.059 5.755 253 HB2 GLU 29 2HB GLU 29 10.775 -1.368 4.715 254 HB3 GLU 29 3HB GLU 29 9.745 -2.340 3.675 255 HG2 GLU 29 2HG GLU 29 9.287 -2.220 6.630 256 HG3 GLU 29 3HG GLU 29 8.659 -0.975 5.552 257 H VAL 30 H VAL 30 9.262 -4.963 3.869 258 HA VAL 30 HA VAL 30 11.183 -6.142 2.003 259 HB VAL 30 HB VAL 30 9.786 -7.717 3.215 260 HG11 VAL 30 1HG1 VAL 30 7.499 -6.170 2.014 261 HG12 VAL 30 2HG1 VAL 30 7.322 -7.771 2.734 262 HG13 VAL 30 3HG1 VAL 30 7.860 -6.413 3.723 263 HG21 VAL 30 3HG2 VAL 30 8.912 -8.987 1.337 264 HG22 VAL 30 1HG2 VAL 30 8.957 -7.547 0.320 265 HG23 VAL 30 2HG2 VAL 30 10.459 -8.255 0.913 266 H ALA 31 H ALA 31 10.941 -6.075 -0.217 267 HA ALA 31 HA ALA 31 8.826 -4.328 -1.276 268 HB1 ALA 31 1HB ALA 31 11.062 -3.155 -1.008 269 HB2 ALA 31 2HB ALA 31 11.651 -4.210 -2.294 270 HB3 ALA 31 3HB ALA 31 10.322 -3.094 -2.608 271 H ILE 32 H ILE 32 7.638 -5.551 -2.582 272 HA ILE 32 HA ILE 32 8.851 -7.783 -4.011 273 HB ILE 32 HB ILE 32 6.025 -6.958 -3.456 274 HG12 ILE 32 2HG1 ILE 32 6.722 -9.771 -3.258 275 HG13 ILE 32 3HG1 ILE 32 7.823 -8.768 -2.320 276 HG21 ILE 32 1HG2 ILE 32 5.762 -7.452 -5.711 277 HG22 ILE 32 2HG2 ILE 32 6.992 -8.714 -5.679 278 HG23 ILE 32 3HG2 ILE 32 5.423 -8.993 -4.924 279 HD11 ILE 32 3HD1 ILE 32 4.826 -8.849 -2.083 280 HD12 ILE 32 1HD1 ILE 32 5.998 -9.501 -0.939 281 HD13 ILE 32 2HD1 ILE 32 5.884 -7.758 -1.189 282 H PHE 33 H PHE 33 9.780 -7.314 -5.893 283 HA PHE 33 HA PHE 33 8.570 -5.262 -7.609 284 HB2 PHE 33 2HB PHE 33 11.302 -6.528 -7.876 285 HB3 PHE 33 3HB PHE 33 10.701 -5.111 -8.730 286 HD1 PHE 33 HD2 PHE 33 9.409 -3.657 -6.489 287 HD2 PHE 33 HD1 PHE 33 13.135 -5.703 -6.706 288 HE1 PHE 33 HE2 PHE 33 10.304 -2.208 -4.713 289 HE2 PHE 33 HE1 PHE 33 14.036 -4.258 -4.929 290 HZ PHE 33 HZ PHE 33 12.620 -2.507 -3.931 291 H MET 34 H MET 34 7.063 -6.193 -8.865 292 HA MET 34 HA MET 34 7.383 -8.857 -9.913 293 HB2 MET 34 2HB MET 34 5.204 -7.394 -9.296 294 HB3 MET 34 3HB MET 34 5.287 -7.083 -11.024 295 HG2 MET 34 2HG MET 34 4.090 -8.953 -11.211 296 HG3 MET 34 3HG MET 34 5.626 -9.775 -10.949 297 HE1 MET 34 3HE MET 34 2.408 -9.031 -7.745 298 HE2 MET 34 1HE MET 34 3.610 -7.780 -8.063 299 HE3 MET 34 2HE MET 34 2.496 -8.275 -9.337 300 H PHE 35 H PHE 35 8.204 -9.429 -11.824 301 HA PHE 35 HA PHE 35 8.424 -7.430 -13.952 302 HB2 PHE 35 2HB PHE 35 10.743 -7.914 -14.366 303 HB3 PHE 35 3HB PHE 35 10.575 -7.491 -12.665 304 HD1 PHE 35 HD1 PHE 35 10.030 -9.655 -11.140 305 HD2 PHE 35 HD2 PHE 35 12.135 -9.662 -14.840 306 HE1 PHE 35 HE1 PHE 35 11.129 -11.763 -10.507 307 HE2 PHE 35 HE2 PHE 35 13.236 -11.771 -14.214 308 HZ PHE 35 HZ PHE 35 12.733 -12.825 -12.045 309 H GLU 36 H GLU 36 8.313 -8.245 -16.018 310 HA GLU 36 HA GLU 36 8.147 -11.158 -16.327 311 HB2 GLU 36 2HB GLU 36 6.082 -11.115 -17.421 312 HB3 GLU 36 3HB GLU 36 5.856 -10.013 -16.071 313 HG2 GLU 36 2HG GLU 36 5.014 -8.656 -17.635 314 HG3 GLU 36 3HG GLU 36 6.707 -8.292 -17.964 315 H VAL 37 H VAL 37 9.826 -8.621 -17.140 316 HA VAL 37 HA VAL 37 10.525 -9.681 -19.751 317 HB VAL 37 HB VAL 37 9.728 -6.784 -19.421 318 HG11 VAL 37 1HG1 VAL 37 11.485 -6.722 -20.933 319 HG12 VAL 37 2HG1 VAL 37 11.077 -8.293 -21.627 320 HG13 VAL 37 3HG1 VAL 37 10.078 -6.883 -21.983 321 HG21 VAL 37 3HG2 VAL 37 8.422 -9.115 -20.794 322 HG22 VAL 37 1HG2 VAL 37 7.734 -8.009 -19.606 323 HG23 VAL 37 2HG2 VAL 37 8.069 -7.447 -21.244 324 H GLY 38 H GLY 38 12.566 -8.847 -20.554 325 HA2 GLY 38 2HA GLY 38 14.667 -7.867 -20.333 326 HA3 GLY 38 3HA GLY 38 14.163 -7.197 -18.788 327 H ASP 39 H ASP 39 16.639 -8.121 -18.844 328 HA ASP 39 HA ASP 39 17.072 -10.839 -18.386 329 HB2 ASP 39 2HB ASP 39 18.552 -8.416 -17.350 330 HB3 ASP 39 3HB ASP 39 19.128 -10.068 -17.153 331 H PHE 40 H PHE 40 17.232 -12.081 -16.514 332 HA PHE 40 HA PHE 40 15.501 -11.193 -14.347 333 HB2 PHE 40 2HB PHE 40 16.565 -13.827 -13.929 334 HB3 PHE 40 3HB PHE 40 14.902 -13.344 -14.246 335 HD1 PHE 40 HD1 PHE 40 18.008 -14.585 -15.712 336 HD2 PHE 40 HD2 PHE 40 13.986 -13.423 -16.481 337 HE1 PHE 40 HE1 PHE 40 18.124 -15.659 -17.923 338 HE2 PHE 40 HE2 PHE 40 14.095 -14.496 -18.692 339 HZ PHE 40 HZ PHE 40 16.165 -15.616 -19.416 340 H SER 41 H SER 41 18.842 -12.113 -14.927 341 HA SER 41 HA SER 41 19.681 -12.240 -12.241 342 HB2 SER 41 2HB SER 41 21.751 -12.626 -13.102 343 HB3 SER 41 3HB SER 41 20.864 -12.796 -14.617 344 HG SER 41 HG SER 41 22.673 -10.921 -13.887 345 H ASN 42 H ASN 42 18.744 -9.609 -14.158 346 HA ASN 42 HA ASN 42 20.384 -7.615 -12.897 347 HB2 ASN 42 2HB ASN 42 18.451 -7.723 -15.058 348 HB3 ASN 42 3HB ASN 42 18.171 -6.328 -14.021 349 HD21 ASN 42 1HD2 ASN 42 21.040 -8.039 -15.227 350 HD22 ASN 42 2HD2 ASN 42 21.833 -6.629 -15.834 351 H ILE 43 H ILE 43 17.367 -9.151 -12.229 352 HA ILE 43 HA ILE 43 15.965 -7.315 -10.756 353 HB ILE 43 HB ILE 43 16.260 -10.273 -10.536 354 HG12 ILE 43 2HG1 ILE 43 14.758 -9.087 -12.189 355 HG13 ILE 43 3HG1 ILE 43 13.957 -10.276 -11.167 356 HG21 ILE 43 1HG2 ILE 43 15.079 -8.487 -8.448 357 HG22 ILE 43 2HG2 ILE 43 14.420 -10.098 -8.725 358 HG23 ILE 43 3HG2 ILE 43 16.108 -9.905 -8.253 359 HD11 ILE 43 3HD1 ILE 43 12.580 -8.752 -10.337 360 HD12 ILE 43 1HD1 ILE 43 13.902 -7.638 -9.987 361 HD13 ILE 43 2HD1 ILE 43 13.173 -7.665 -11.593 362 HA PRO 44 HA PRO 44 18.493 -8.446 -6.792 363 HB2 PRO 44 2HB PRO 44 20.768 -9.886 -7.142 364 HB3 PRO 44 3HB PRO 44 19.191 -10.634 -6.867 365 HG2 PRO 44 2HG PRO 44 20.665 -10.213 -9.438 366 HG3 PRO 44 3HG PRO 44 19.771 -11.640 -8.882 367 HD2 PRO 44 2HD PRO 44 18.727 -9.858 -10.633 368 HD3 PRO 44 3HD PRO 44 17.728 -10.741 -9.460 369 H LYS 45 H LYS 45 19.997 -7.627 -9.805 370 HA LYS 45 HA LYS 45 22.317 -6.364 -8.751 371 HB2 LYS 45 2HB LYS 45 21.549 -7.110 -11.239 372 HB3 LYS 45 3HB LYS 45 21.230 -5.382 -11.320 373 HG2 LYS 45 2HG LYS 45 23.764 -5.658 -10.143 374 HG3 LYS 45 3HG LYS 45 23.719 -6.776 -11.508 375 HD2 LYS 45 2HD LYS 45 22.749 -4.794 -12.831 376 HD3 LYS 45 3HD LYS 45 23.336 -3.798 -11.497 377 HE2 LYS 45 2HE LYS 45 25.188 -3.717 -12.805 378 HE3 LYS 45 3HE LYS 45 25.547 -5.218 -11.952 379 HZ1 LYS 45 3HZ LYS 45 25.212 -6.447 -13.792 380 HZ2 LYS 45 1HZ LYS 45 25.567 -5.001 -14.595 381 HZ3 LYS 45 2HZ LYS 45 23.958 -5.472 -14.372 382 H SER 46 H SER 46 19.021 -5.400 -9.151 383 HA SER 46 HA SER 46 19.444 -2.584 -9.099 384 HB2 SER 46 2HB SER 46 16.881 -3.582 -8.036 385 HB3 SER 46 3HB SER 46 17.194 -2.434 -9.337 386 HG SER 46 HG SER 46 16.336 -4.248 -10.269 387 H ALA 47 H ALA 47 18.290 -4.867 -6.614 388 HA ALA 47 HA ALA 47 18.157 -3.077 -4.490 389 HB1 ALA 47 1HB ALA 47 17.818 -4.894 -3.143 390 HB2 ALA 47 2HB ALA 47 17.466 -5.606 -4.718 391 HB3 ALA 47 3HB ALA 47 19.037 -5.870 -3.962 392 H GLU 48 H GLU 48 20.907 -4.594 -5.971 393 HA GLU 48 HA GLU 48 22.720 -4.139 -3.803 394 HB2 GLU 48 2HB GLU 48 22.983 -5.876 -5.632 395 HB3 GLU 48 3HB GLU 48 23.440 -4.558 -6.703 396 HG2 GLU 48 2HG GLU 48 24.905 -4.716 -4.153 397 HG3 GLU 48 3HG GLU 48 25.194 -6.022 -5.301 398 H PHE 49 H PHE 49 21.620 -2.318 -6.557 399 HA PHE 49 HA PHE 49 23.666 -0.452 -6.817 400 HB2 PHE 49 2HB PHE 49 21.131 -0.820 -7.911 401 HB3 PHE 49 3HB PHE 49 21.039 0.755 -7.131 402 HD1 PHE 49 HD2 PHE 49 22.652 2.538 -7.779 403 HD2 PHE 49 HD1 PHE 49 22.342 -1.135 -9.908 404 HE1 PHE 49 HE2 PHE 49 23.816 3.554 -9.695 405 HE2 PHE 49 HE1 PHE 49 23.506 -0.125 -11.826 406 HZ PHE 49 HZ PHE 49 24.243 2.222 -11.722 407 H ILE 50 H ILE 50 21.289 -0.822 -4.340 408 HA ILE 50 HA ILE 50 21.479 1.851 -3.315 409 HB ILE 50 HB ILE 50 20.440 -0.630 -1.942 410 HG12 ILE 50 2HG1 ILE 50 19.279 -0.107 -4.079 411 HG13 ILE 50 3HG1 ILE 50 18.234 0.064 -2.673 412 HG21 ILE 50 1HG2 ILE 50 20.856 1.007 -0.295 413 HG22 ILE 50 2HG2 ILE 50 20.226 2.301 -1.313 414 HG23 ILE 50 3HG2 ILE 50 19.128 1.099 -0.636 415 HD11 ILE 50 3HD1 ILE 50 19.572 2.296 -4.182 416 HD12 ILE 50 1HD1 ILE 50 17.862 1.868 -4.230 417 HD13 ILE 50 2HD1 ILE 50 18.574 2.491 -2.741 418 H GLN 51 H GLN 51 22.520 -1.304 -2.005 419 HA GLN 51 HA GLN 51 24.979 -0.110 -1.039 420 HB2 GLN 51 2HB GLN 51 22.789 -0.230 0.676 421 HB3 GLN 51 3HB GLN 51 23.760 -1.628 1.118 422 HG2 GLN 51 2HG GLN 51 25.244 0.886 0.766 423 HG3 GLN 51 3HG GLN 51 24.115 0.844 2.120 424 HE21 GLN 51 1HE2 GLN 51 27.046 -0.413 0.791 425 HE22 GLN 51 2HE2 GLN 51 27.568 -1.267 2.199 426 H SER 52 H SER 52 26.597 -1.507 -1.277 427 HA SER 52 HA SER 52 26.348 -3.992 -2.444 428 HB2 SER 52 2HB SER 52 28.455 -2.578 -2.179 429 HB3 SER 52 3HB SER 52 28.609 -3.285 -0.570 430 HG SER 52 HG SER 52 29.531 -4.305 -2.735 431 H LYS 53 H LYS 53 26.329 -3.142 0.962 432 HA LYS 53 HA LYS 53 25.721 -5.955 1.599 433 HB2 LYS 53 2HB LYS 53 26.686 -5.520 3.847 434 HB3 LYS 53 3HB LYS 53 27.865 -5.387 2.549 435 HG2 LYS 53 2HG LYS 53 28.382 -3.335 3.186 436 HG3 LYS 53 3HG LYS 53 26.702 -2.824 3.005 437 HD2 LYS 53 2HD LYS 53 26.256 -3.041 5.222 438 HD3 LYS 53 3HD LYS 53 27.365 -4.399 5.423 439 HE2 LYS 53 2HE LYS 53 29.226 -2.668 5.060 440 HE3 LYS 53 3HE LYS 53 27.976 -1.461 5.360 441 HZ1 LYS 53 3HZ LYS 53 27.930 -3.503 7.337 442 HZ2 LYS 53 1HZ LYS 53 28.102 -1.831 7.529 443 HZ3 LYS 53 2HZ LYS 53 29.463 -2.794 7.247 444 H GLY 54 H GLY 54 23.694 -6.246 2.237 445 HA2 GLY 54 2HA GLY 54 22.259 -5.391 4.240 446 HA3 GLY 54 3HA GLY 54 22.185 -3.941 3.250 447 H HIS 55 H HIS 55 21.912 -5.015 0.724 448 HA HIS 55 HA HIS 55 19.139 -5.690 0.726 449 HB2 HIS 55 2HB HIS 55 19.290 -5.631 -1.669 450 HB3 HIS 55 3HB HIS 55 20.279 -4.316 -1.039 451 HD1 HIS 55 HD1 HIS 55 22.955 -5.037 -0.826 452 HD2 HIS 55 HD2 HIS 55 20.574 -7.126 -3.515 453 HE1 HIS 55 HE1 HIS 55 24.553 -6.129 -2.431 454 H GLU 56 H GLU 56 18.317 -7.641 1.042 455 HA GLU 56 HA GLU 56 19.773 -9.976 0.014 456 HB2 GLU 56 2HB GLU 56 19.590 -9.370 2.710 457 HB3 GLU 56 3HB GLU 56 18.293 -10.531 2.466 458 HG2 GLU 56 2HG GLU 56 20.852 -11.260 1.232 459 HG3 GLU 56 3HG GLU 56 20.865 -11.179 2.992 460 H LEU 57 H LEU 57 18.538 -11.062 -1.354 461 HA LEU 57 HA LEU 57 15.699 -10.589 -1.488 462 HB2 LEU 57 2HB LEU 57 17.535 -12.374 -3.073 463 HB3 LEU 57 3HB LEU 57 15.811 -12.205 -3.394 464 HG LEU 57 HG LEU 57 16.892 -10.844 -4.976 465 HD11 LEU 57 1HD1 LEU 57 15.104 -9.801 -3.221 466 HD12 LEU 57 2HD1 LEU 57 15.685 -8.979 -4.669 467 HD13 LEU 57 3HD1 LEU 57 16.422 -8.636 -3.104 468 HD21 LEU 57 3HD2 LEU 57 18.765 -9.568 -4.651 469 HD22 LEU 57 1HD2 LEU 57 19.040 -10.836 -3.456 470 HD23 LEU 57 2HD2 LEU 57 18.404 -9.271 -2.950 471 H LEU 58 H LEU 58 14.579 -11.503 0.147 472 HA LEU 58 HA LEU 58 15.126 -13.832 1.519 473 HB2 LEU 58 2HB LEU 58 12.955 -12.001 1.298 474 HB3 LEU 58 3HB LEU 58 12.309 -13.640 1.274 475 HG LEU 58 HG LEU 58 14.273 -13.198 3.391 476 HD11 LEU 58 1HD1 LEU 58 12.907 -10.972 3.045 477 HD12 LEU 58 2HD1 LEU 58 13.225 -11.613 4.657 478 HD13 LEU 58 3HD1 LEU 58 11.657 -11.879 3.896 479 HD21 LEU 58 3HD2 LEU 58 11.541 -13.941 4.087 480 HD22 LEU 58 1HD2 LEU 58 13.059 -14.788 4.385 481 HD23 LEU 58 2HD2 LEU 58 12.246 -14.960 2.830 482 H ASN 59 H ASN 59 13.209 -13.420 -1.433 483 HA ASN 59 HA ASN 59 13.393 -16.330 -1.849 484 HB2 ASN 59 2HB ASN 59 11.059 -15.246 -1.269 485 HB3 ASN 59 3HB ASN 59 11.089 -14.786 -2.968 486 HD21 ASN 59 1HD2 ASN 59 10.890 -16.342 -4.536 487 HD22 ASN 59 2HD2 ASN 59 10.443 -17.974 -4.187 488 H SER 60 H SER 60 15.027 -16.394 -3.304 489 HA SER 60 HA SER 60 15.761 -14.596 -5.216 490 HB2 SER 60 2HB SER 60 17.280 -16.274 -5.274 491 HB3 SER 60 3HB SER 60 16.081 -17.501 -4.867 492 HG SER 60 HG SER 60 17.052 -17.569 -7.053 493 H LEU 61 H LEU 61 15.041 -13.906 -7.144 494 HA LEU 61 HA LEU 61 12.421 -14.164 -7.942 495 HB2 LEU 61 2HB LEU 61 13.120 -13.270 -10.103 496 HB3 LEU 61 3HB LEU 61 13.878 -12.413 -8.763 497 HG LEU 61 HG LEU 61 15.432 -14.614 -9.997 498 HD11 LEU 61 1HD1 LEU 61 14.954 -11.974 -11.369 499 HD12 LEU 61 2HD1 LEU 61 14.523 -13.572 -11.976 500 HD13 LEU 61 3HD1 LEU 61 16.220 -13.126 -11.795 501 HD21 LEU 61 3HD2 LEU 61 16.642 -13.571 -8.356 502 HD22 LEU 61 1HD2 LEU 61 15.910 -11.996 -8.662 503 HD23 LEU 61 2HD2 LEU 61 17.138 -12.626 -9.761 504 H ARG 62 H ARG 62 11.253 -15.590 -9.089 505 HA ARG 62 HA ARG 62 12.574 -18.059 -9.917 506 HB2 ARG 62 2HB ARG 62 10.386 -17.832 -8.477 507 HB3 ARG 62 3HB ARG 62 9.613 -17.649 -10.046 508 HG2 ARG 62 2HG ARG 62 9.625 -19.839 -10.340 509 HG3 ARG 62 3HG ARG 62 11.378 -19.884 -10.146 510 HD2 ARG 62 2HD ARG 62 11.253 -20.391 -7.905 511 HD3 ARG 62 3HD ARG 62 9.656 -19.665 -7.723 512 HE ARG 62 HE ARG 62 9.575 -21.948 -9.416 513 HH11 ARG 62 1HH1 ARG 62 9.749 -20.962 -6.082 514 HH12 ARG 62 2HH1 ARG 62 9.006 -22.407 -5.480 515 HH21 ARG 62 1HH2 ARG 62 8.596 -23.855 -8.636 516 HH22 ARG 62 2HH2 ARG 62 8.351 -24.052 -6.934 517 H PHE 63 H PHE 63 13.378 -16.266 -11.639 518 HA PHE 63 HA PHE 63 11.843 -15.460 -13.766 519 HB2 PHE 63 2HB PHE 63 13.844 -15.240 -15.015 520 HB3 PHE 63 3HB PHE 63 14.313 -15.001 -13.335 521 HD1 PHE 63 HD2 PHE 63 14.843 -17.417 -12.148 522 HD2 PHE 63 HD1 PHE 63 15.342 -16.431 -16.259 523 HE1 PHE 63 HE2 PHE 63 16.531 -19.193 -12.366 524 HE2 PHE 63 HE1 PHE 63 17.031 -18.206 -16.483 525 HZ PHE 63 HZ PHE 63 17.628 -19.589 -14.535 526 H ASN 64 H ASN 64 12.946 -18.663 -12.995 527 HA ASN 64 HA ASN 64 12.838 -19.990 -15.389 528 HB2 ASN 64 2HB ASN 64 11.783 -20.971 -12.727 529 HB3 ASN 64 3HB ASN 64 12.176 -21.995 -14.105 530 HD21 ASN 64 1HD2 ASN 64 14.396 -22.029 -14.826 531 HD22 ASN 64 2HD2 ASN 64 15.664 -21.775 -13.681 532 H GLN 65 H GLN 65 10.210 -18.627 -13.580 533 HA GLN 65 HA GLN 65 8.281 -19.823 -15.453 534 HB2 GLN 65 2HB GLN 65 8.230 -19.522 -12.634 535 HB3 GLN 65 3HB GLN 65 6.995 -18.456 -13.291 536 HG2 GLN 65 2HG GLN 65 7.240 -21.429 -13.601 537 HG3 GLN 65 3HG GLN 65 5.934 -20.507 -12.858 538 HE21 GLN 65 1HE2 GLN 65 6.963 -22.072 -15.613 539 HE22 GLN 65 2HE2 GLN 65 5.806 -21.439 -16.729 540 H ALA 66 H ALA 66 6.184 -18.081 -15.157 541 HA ALA 66 HA ALA 66 7.026 -15.909 -16.835 542 HB1 ALA 66 1HB ALA 66 4.728 -15.414 -17.104 543 HB2 ALA 66 2HB ALA 66 4.852 -17.172 -17.050 544 HB3 ALA 66 3HB ALA 66 4.294 -16.284 -15.632 545 H ASP 67 H ASP 67 5.470 -13.794 -16.130 546 HA ASP 67 HA ASP 67 6.886 -12.181 -14.574 547 HB2 ASP 67 2HB ASP 67 4.903 -10.902 -14.057 548 HB3 ASP 67 3HB ASP 67 4.735 -11.571 -15.677 549 H TRP 68 H TRP 68 7.900 -12.624 -12.727 550 HA TRP 68 HA TRP 68 6.372 -13.923 -10.570 551 HB2 TRP 68 2HB TRP 68 8.689 -14.813 -11.651 552 HB3 TRP 68 3HB TRP 68 9.320 -13.798 -10.357 553 HD1 TRP 68 HD1 TRP 68 9.525 -14.937 -8.073 554 HE1 TRP 68 HE1 TRP 68 8.572 -17.066 -6.985 555 HE3 TRP 68 HE3 TRP 68 6.340 -16.395 -11.796 556 HZ2 TRP 68 HZ2 TRP 68 6.715 -19.095 -7.621 557 HZ3 TRP 68 HZ3 TRP 68 5.011 -18.441 -11.478 558 HH2 TRP 68 HH2 TRP 68 5.197 -19.762 -9.433 559 H THR 69 H THR 69 7.675 -13.356 -8.363 560 HA THR 69 HA THR 69 7.980 -10.429 -8.274 561 HB THR 69 HB THR 69 6.153 -10.230 -7.017 562 HG1 THR 69 HG1 THR 69 6.271 -10.978 -4.875 563 HG21 THR 69 3HG2 THR 69 4.732 -12.130 -6.442 564 HG22 THR 69 1HG2 THR 69 6.040 -13.244 -6.838 565 HG23 THR 69 2HG2 THR 69 5.303 -12.263 -8.105 566 H ILE 70 H ILE 70 9.709 -9.719 -7.181 567 HA ILE 70 HA ILE 70 11.241 -11.693 -5.621 568 HB ILE 70 HB ILE 70 12.475 -10.940 -7.562 569 HG12 ILE 70 2HG1 ILE 70 14.483 -10.046 -6.445 570 HG13 ILE 70 3HG1 ILE 70 13.516 -9.655 -5.027 571 HG21 ILE 70 1HG2 ILE 70 12.302 -8.882 -8.373 572 HG22 ILE 70 2HG2 ILE 70 11.222 -8.478 -7.040 573 HG23 ILE 70 3HG2 ILE 70 12.957 -8.203 -6.883 574 HD11 ILE 70 3HD1 ILE 70 13.813 -11.689 -4.224 575 HD12 ILE 70 1HD1 ILE 70 13.154 -12.407 -5.694 576 HD13 ILE 70 2HD1 ILE 70 14.875 -12.039 -5.587 577 H VAL 71 H VAL 71 11.285 -11.387 -3.503 578 HA VAL 71 HA VAL 71 10.459 -8.827 -2.389 579 HB VAL 71 HB VAL 71 10.467 -9.997 -0.219 580 HG11 VAL 71 1HG1 VAL 71 8.792 -11.898 -1.102 581 HG12 VAL 71 2HG1 VAL 71 8.360 -10.189 -1.022 582 HG13 VAL 71 3HG1 VAL 71 8.891 -10.895 -2.549 583 HG21 VAL 71 3HG2 VAL 71 10.766 -12.486 -0.248 584 HG22 VAL 71 1HG2 VAL 71 11.438 -12.321 -1.870 585 HG23 VAL 71 2HG2 VAL 71 12.246 -11.561 -0.500 586 H VAL 72 H VAL 72 11.824 -7.355 -1.624 587 HA VAL 72 HA VAL 72 14.596 -8.181 -1.047 588 HB VAL 72 HB VAL 72 13.861 -5.396 -1.901 589 HG11 VAL 72 1HG1 VAL 72 16.104 -5.044 -2.122 590 HG12 VAL 72 2HG1 VAL 72 16.131 -6.266 -0.848 591 HG13 VAL 72 3HG1 VAL 72 16.442 -6.728 -2.522 592 HG21 VAL 72 3HG2 VAL 72 14.938 -6.476 -4.148 593 HG22 VAL 72 1HG2 VAL 72 13.969 -7.823 -3.550 594 HG23 VAL 72 2HG2 VAL 72 13.209 -6.264 -3.872 595 H ARG 73 H ARG 73 15.253 -7.869 0.973 596 HA ARG 73 HA ARG 73 13.638 -6.156 2.724 597 HB2 ARG 73 2HB ARG 73 14.830 -7.375 4.570 598 HB3 ARG 73 3HB ARG 73 13.808 -8.386 3.557 599 HG2 ARG 73 2HG ARG 73 15.517 -9.695 3.047 600 HG3 ARG 73 3HG ARG 73 16.470 -8.316 2.497 601 HD2 ARG 73 2HD ARG 73 17.643 -9.449 4.276 602 HD3 ARG 73 3HD ARG 73 17.110 -7.865 4.836 603 HE ARG 73 HE ARG 73 15.842 -8.912 6.415 604 HH11 ARG 73 1HH1 ARG 73 16.581 -11.192 3.890 605 HH12 ARG 73 2HH1 ARG 73 15.870 -12.538 4.717 606 HH21 ARG 73 1HH2 ARG 73 14.903 -10.677 7.515 607 HH22 ARG 73 2HH2 ARG 73 14.916 -12.243 6.779 608 H LYS 74 H LYS 74 14.391 -4.150 2.889 609 HA LYS 74 HA LYS 74 17.008 -3.332 2.293 610 HB2 LYS 74 2HB LYS 74 14.609 -2.098 3.512 611 HB3 LYS 74 3HB LYS 74 16.145 -1.327 3.889 612 HG2 LYS 74 2HG LYS 74 16.417 -1.590 1.235 613 HG3 LYS 74 3HG LYS 74 14.661 -1.459 1.346 614 HD2 LYS 74 2HD LYS 74 15.142 0.756 1.243 615 HD3 LYS 74 3HD LYS 74 15.336 0.542 2.984 616 HE2 LYS 74 2HE LYS 74 17.802 -0.033 2.340 617 HE3 LYS 74 3HE LYS 74 17.415 0.842 0.860 618 HZ1 LYS 74 3HZ LYS 74 18.365 2.348 2.436 619 HZ2 LYS 74 1HZ LYS 74 17.259 1.891 3.632 620 HZ3 LYS 74 2HZ LYS 74 16.726 2.732 2.265 621 H LYS 75 H LYS 75 18.620 -2.431 3.724 622 HA LYS 75 HA LYS 75 18.597 -2.759 6.515 623 HB2 LYS 75 2HB LYS 75 19.010 -5.174 5.145 624 HB3 LYS 75 3HB LYS 75 20.601 -4.680 5.708 625 HG2 LYS 75 2HG LYS 75 18.529 -4.404 7.738 626 HG3 LYS 75 3HG LYS 75 18.738 -6.060 7.165 627 HD2 LYS 75 2HD LYS 75 20.652 -6.276 8.283 628 HD3 LYS 75 3HD LYS 75 21.292 -4.786 7.586 629 HE2 LYS 75 2HE LYS 75 21.268 -4.259 9.825 630 HE3 LYS 75 3HE LYS 75 19.698 -3.642 9.312 631 HZ1 LYS 75 3HZ LYS 75 20.165 -5.421 11.340 632 HZ2 LYS 75 1HZ LYS 75 19.554 -6.380 10.088 633 HZ3 LYS 75 2HZ LYS 75 18.663 -5.057 10.652 634 H ALA 76 H ALA 76 21.052 -2.848 7.319 635 HA ALA 76 HA ALA 76 22.951 -1.601 7.513 636 HB1 ALA 76 1HB ALA 76 23.577 -3.188 5.704 637 HB2 ALA 76 2HB ALA 76 23.119 -1.957 4.525 638 HB3 ALA 76 3HB ALA 76 24.450 -1.656 5.643 Start of MODEL 17 1 H1 MET 1 H MET 1 1.716 0.159 0.589 2 HA MET 1 HA MET 1 1.991 -0.042 -2.301 3 HB2 MET 1 2HB MET 1 2.246 2.504 -0.749 4 HB3 MET 1 3HB MET 1 3.284 2.240 -2.144 5 HG2 MET 1 2HG MET 1 1.169 1.768 -3.452 6 HG3 MET 1 3HG MET 1 0.290 2.404 -2.063 7 HE1 MET 1 3HE MET 1 0.007 4.415 -1.368 8 HE2 MET 1 1HE MET 1 0.764 5.932 -1.854 9 HE3 MET 1 2HE MET 1 -0.567 5.268 -2.802 10 H LYS 2 H LYS 2 3.097 -1.899 -0.973 11 HA LYS 2 HA LYS 2 5.879 -1.095 -0.426 12 HB2 LYS 2 2HB LYS 2 6.039 -3.121 0.978 13 HB3 LYS 2 3HB LYS 2 4.814 -2.000 1.558 14 HG2 LYS 2 2HG LYS 2 3.081 -3.377 0.478 15 HG3 LYS 2 3HG LYS 2 4.330 -4.522 -0.017 16 HD2 LYS 2 2HD LYS 2 4.897 -4.467 2.566 17 HD3 LYS 2 3HD LYS 2 3.206 -3.976 2.684 18 HE2 LYS 2 2HE LYS 2 3.049 -6.069 0.950 19 HE3 LYS 2 3HE LYS 2 4.380 -6.575 1.990 20 HZ1 LYS 2 3HZ LYS 2 3.034 -6.665 3.824 21 HZ2 LYS 2 1HZ LYS 2 1.938 -7.133 2.624 22 HZ3 LYS 2 2HZ LYS 2 1.916 -5.550 3.218 23 H ARG 3 H ARG 3 4.607 -1.781 -3.016 24 HA ARG 3 HA ARG 3 6.539 -3.826 -3.808 25 HB2 ARG 3 2HB ARG 3 4.967 -5.141 -5.004 26 HB3 ARG 3 3HB ARG 3 4.280 -4.893 -3.404 27 HG2 ARG 3 2HG ARG 3 3.342 -2.778 -4.990 28 HG3 ARG 3 3HG ARG 3 3.190 -4.240 -5.966 29 HD2 ARG 3 2HD ARG 3 1.195 -4.272 -4.835 30 HD3 ARG 3 3HD ARG 3 2.199 -5.239 -3.756 31 HE ARG 3 HE ARG 3 2.317 -2.510 -3.026 32 HH11 ARG 3 1HH1 ARG 3 0.208 -5.278 -2.934 33 HH12 ARG 3 2HH1 ARG 3 -0.644 -4.747 -1.522 34 HH21 ARG 3 1HH2 ARG 3 1.203 -1.799 -1.166 35 HH22 ARG 3 2HH2 ARG 3 -0.077 -2.767 -0.518 36 H PHE 4 H PHE 4 6.837 -3.909 -6.181 37 HA PHE 4 HA PHE 4 6.088 -1.409 -7.527 38 HB2 PHE 4 2HB PHE 4 8.632 -1.882 -6.546 39 HB3 PHE 4 3HB PHE 4 8.762 -2.344 -8.240 40 HD1 PHE 4 HD2 PHE 4 6.947 0.374 -6.436 41 HD2 PHE 4 HD1 PHE 4 9.739 -0.680 -9.471 42 HE1 PHE 4 HE2 PHE 4 7.156 2.744 -7.062 43 HE2 PHE 4 HE1 PHE 4 9.954 1.689 -10.100 44 HZ PHE 4 HZ PHE 4 8.660 3.404 -8.897 45 H ASP 5 H ASP 5 5.030 -1.891 -9.322 46 HA ASP 5 HA ASP 5 5.283 -4.508 -10.533 47 HB2 ASP 5 2HB ASP 5 3.306 -2.412 -10.478 48 HB3 ASP 5 3HB ASP 5 3.646 -2.873 -12.143 49 H LEU 6 H LEU 6 7.387 -4.480 -11.374 50 HA LEU 6 HA LEU 6 8.200 -2.434 -13.231 51 HB2 LEU 6 2HB LEU 6 9.404 -4.935 -12.143 52 HB3 LEU 6 3HB LEU 6 10.078 -4.231 -13.612 53 HG LEU 6 HG LEU 6 11.419 -3.410 -11.880 54 HD11 LEU 6 1HD1 LEU 6 10.086 -1.702 -13.465 55 HD12 LEU 6 2HD1 LEU 6 11.309 -1.196 -12.299 56 HD13 LEU 6 3HD1 LEU 6 9.599 -1.089 -11.884 57 HD21 LEU 6 3HD2 LEU 6 9.013 -2.522 -10.314 58 HD22 LEU 6 1HD2 LEU 6 10.688 -2.650 -9.779 59 HD23 LEU 6 2HD2 LEU 6 9.750 -4.110 -10.094 60 H ARG 7 H ARG 7 6.156 -5.019 -13.471 61 HA ARG 7 HA ARG 7 6.775 -6.362 -15.789 62 HB2 ARG 7 2HB ARG 7 4.349 -5.796 -14.270 63 HB3 ARG 7 3HB ARG 7 4.037 -5.990 -15.990 64 HG2 ARG 7 2HG ARG 7 4.441 -8.193 -15.943 65 HG3 ARG 7 3HG ARG 7 5.804 -8.022 -14.834 66 HD2 ARG 7 2HD ARG 7 4.476 -8.876 -13.261 67 HD3 ARG 7 3HD ARG 7 3.605 -7.343 -13.298 68 HE ARG 7 HE ARG 7 2.734 -9.872 -14.389 69 HH11 ARG 7 1HH1 ARG 7 2.325 -6.415 -14.390 70 HH12 ARG 7 2HH1 ARG 7 0.703 -6.476 -14.995 71 HH21 ARG 7 1HH2 ARG 7 0.599 -9.965 -15.186 72 HH22 ARG 7 2HH2 ARG 7 -0.279 -8.496 -15.446 73 HA PRO 8 HA PRO 8 4.553 -3.036 -18.474 74 HB2 PRO 8 2HB PRO 8 3.703 -0.771 -17.244 75 HB3 PRO 8 3HB PRO 8 2.702 -2.221 -17.384 76 HG2 PRO 8 2HG PRO 8 4.332 -1.259 -15.063 77 HG3 PRO 8 3HG PRO 8 2.696 -1.944 -15.075 78 HD2 PRO 8 2HD PRO 8 4.880 -3.398 -14.405 79 HD3 PRO 8 3HD PRO 8 3.469 -4.112 -15.212 80 H LEU 9 H LEU 9 6.975 -2.523 -16.204 81 HA LEU 9 HA LEU 9 7.940 -0.037 -17.367 82 HB2 LEU 9 2HB LEU 9 8.369 -1.518 -14.915 83 HB3 LEU 9 3HB LEU 9 9.890 -1.011 -15.646 84 HG LEU 9 HG LEU 9 8.333 1.274 -15.728 85 HD11 LEU 9 1HD1 LEU 9 6.641 0.792 -14.295 86 HD12 LEU 9 2HD1 LEU 9 7.851 1.291 -13.114 87 HD13 LEU 9 3HD1 LEU 9 7.574 -0.423 -13.422 88 HD21 LEU 9 3HD2 LEU 9 9.809 1.690 -13.534 89 HD22 LEU 9 1HD2 LEU 9 10.485 1.687 -15.163 90 HD23 LEU 9 2HD2 LEU 9 10.614 0.247 -14.152 91 H LYS 10 H LYS 10 7.832 -2.686 -18.817 92 HA LYS 10 HA LYS 10 9.155 -4.026 -20.128 93 HB2 LYS 10 2HB LYS 10 10.452 -2.802 -21.706 94 HB3 LYS 10 3HB LYS 10 9.086 -1.783 -21.274 95 HG2 LYS 10 2HG LYS 10 10.450 -0.414 -19.880 96 HG3 LYS 10 3HG LYS 10 11.814 -1.524 -20.034 97 HD2 LYS 10 2HD LYS 10 12.470 -0.075 -21.635 98 HD3 LYS 10 3HD LYS 10 11.334 -0.983 -22.635 99 HE2 LYS 10 2HE LYS 10 10.161 1.208 -21.057 100 HE3 LYS 10 3HE LYS 10 11.286 1.707 -22.319 101 HZ1 LYS 10 3HZ LYS 10 8.619 0.828 -22.580 102 HZ2 LYS 10 1HZ LYS 10 9.634 -0.223 -23.432 103 HZ3 LYS 10 2HZ LYS 10 9.656 1.433 -23.771 104 H ALA 11 H ALA 11 11.854 -3.842 -20.842 105 HA ALA 11 HA ALA 11 13.155 -4.506 -18.283 106 HB1 ALA 11 1HB ALA 11 12.826 -6.400 -19.851 107 HB2 ALA 11 2HB ALA 11 13.859 -5.568 -21.014 108 HB3 ALA 11 3HB ALA 11 14.519 -6.091 -19.464 109 H GLY 12 H GLY 12 15.372 -3.956 -18.008 110 HA2 GLY 12 2HA GLY 12 17.385 -2.878 -18.714 111 HA3 GLY 12 3HA GLY 12 16.454 -2.004 -19.921 112 H ILE 13 H ILE 13 14.401 -0.967 -18.427 113 HA ILE 13 HA ILE 13 15.848 0.983 -16.787 114 HB ILE 13 HB ILE 13 12.976 1.274 -17.597 115 HG12 ILE 13 2HG1 ILE 13 15.397 1.923 -19.291 116 HG13 ILE 13 3HG1 ILE 13 14.158 0.728 -19.658 117 HG21 ILE 13 1HG2 ILE 13 14.898 3.520 -17.557 118 HG22 ILE 13 2HG2 ILE 13 13.219 3.452 -17.024 119 HG23 ILE 13 3HG2 ILE 13 14.495 2.790 -16.003 120 HD11 ILE 13 3HD1 ILE 13 14.190 3.584 -20.133 121 HD12 ILE 13 1HD1 ILE 13 13.186 2.325 -20.852 122 HD13 ILE 13 2HD1 ILE 13 12.723 3.051 -19.312 123 H PHE 14 H PHE 14 13.653 -1.628 -16.542 124 HA PHE 14 HA PHE 14 12.224 -0.914 -14.231 125 HB2 PHE 14 2HB PHE 14 11.517 -3.145 -14.137 126 HB3 PHE 14 3HB PHE 14 11.852 -2.895 -15.848 127 HD1 PHE 14 HD1 PHE 14 14.450 -3.387 -16.436 128 HD2 PHE 14 HD2 PHE 14 12.218 -5.133 -13.260 129 HE1 PHE 14 HE1 PHE 14 15.988 -5.308 -16.416 130 HE2 PHE 14 HE2 PHE 14 13.752 -7.056 -13.235 131 HZ PHE 14 HZ PHE 14 15.641 -7.145 -14.813 132 H GLU 15 H GLU 15 15.435 -2.208 -14.692 133 HA GLU 15 HA GLU 15 15.816 -2.864 -11.913 134 HB2 GLU 15 2HB GLU 15 17.004 -4.155 -13.576 135 HB3 GLU 15 3HB GLU 15 17.744 -2.702 -14.233 136 HG2 GLU 15 2HG GLU 15 18.270 -3.038 -11.398 137 HG3 GLU 15 3HG GLU 15 18.847 -4.392 -12.367 138 H ARG 16 H ARG 16 15.953 -0.039 -13.775 139 HA ARG 16 HA ARG 16 17.877 1.289 -12.032 140 HB2 ARG 16 2HB ARG 16 16.681 1.832 -14.674 141 HB3 ARG 16 3HB ARG 16 16.955 3.250 -13.672 142 HG2 ARG 16 2HG ARG 16 19.172 3.161 -13.941 143 HG3 ARG 16 3HG ARG 16 19.220 1.405 -13.766 144 HD2 ARG 16 2HD ARG 16 19.322 1.121 -15.970 145 HD3 ARG 16 3HD ARG 16 17.914 2.153 -16.221 146 HE ARG 16 HE ARG 16 20.645 2.863 -16.611 147 HH11 ARG 16 1HH1 ARG 16 17.540 4.117 -15.660 148 HH12 ARG 16 2HH1 ARG 16 17.901 5.740 -16.145 149 HH21 ARG 16 1HH2 ARG 16 21.132 4.996 -17.254 150 HH22 ARG 16 2HH2 ARG 16 19.944 6.239 -17.052 151 H LEU 17 H LEU 17 14.441 1.227 -12.725 152 HA LEU 17 HA LEU 17 13.814 3.514 -11.115 153 HB2 LEU 17 2HB LEU 17 12.443 1.758 -12.900 154 HB3 LEU 17 3HB LEU 17 11.544 1.852 -11.387 155 HG LEU 17 HG LEU 17 10.672 3.473 -12.931 156 HD11 LEU 17 1HD1 LEU 17 10.725 5.386 -11.572 157 HD12 LEU 17 2HD1 LEU 17 12.347 5.027 -10.982 158 HD13 LEU 17 3HD1 LEU 17 10.984 4.032 -10.471 159 HD21 LEU 17 3HD2 LEU 17 12.961 3.601 -14.153 160 HD22 LEU 17 1HD2 LEU 17 13.289 4.915 -13.023 161 HD23 LEU 17 2HD2 LEU 17 11.911 5.019 -14.120 162 H GLU 18 H GLU 18 14.115 0.084 -10.588 163 HA GLU 18 HA GLU 18 12.649 -0.242 -8.253 164 HB2 GLU 18 2HB GLU 18 14.468 -1.769 -9.749 165 HB3 GLU 18 3HB GLU 18 15.126 -1.722 -8.120 166 HG2 GLU 18 2HG GLU 18 13.555 -3.082 -7.321 167 HG3 GLU 18 3HG GLU 18 12.264 -2.250 -8.186 168 H GLU 19 H GLU 19 15.708 1.321 -8.773 169 HA GLU 19 HA GLU 19 16.452 1.368 -5.993 170 HB2 GLU 19 2HB GLU 19 18.242 1.395 -7.565 171 HB3 GLU 19 3HB GLU 19 17.539 2.745 -8.445 172 HG2 GLU 19 2HG GLU 19 18.090 3.329 -5.639 173 HG3 GLU 19 3HG GLU 19 19.522 2.923 -6.582 174 H LEU 20 H LEU 20 14.599 3.348 -8.142 175 HA LEU 20 HA LEU 20 14.738 5.754 -6.612 176 HB2 LEU 20 2HB LEU 20 13.479 4.836 -9.041 177 HB3 LEU 20 3HB LEU 20 12.356 5.786 -8.070 178 HG LEU 20 HG LEU 20 14.537 7.390 -8.023 179 HD11 LEU 20 1HD1 LEU 20 15.947 6.221 -9.464 180 HD12 LEU 20 2HD1 LEU 20 15.221 7.456 -10.492 181 HD13 LEU 20 3HD1 LEU 20 14.632 5.796 -10.560 182 HD21 LEU 20 3HD2 LEU 20 12.279 8.096 -8.538 183 HD22 LEU 20 1HD2 LEU 20 12.361 7.300 -10.110 184 HD23 LEU 20 2HD2 LEU 20 13.390 8.692 -9.772 185 H ILE 21 H ILE 21 12.713 2.913 -6.577 186 HA ILE 21 HA ILE 21 10.796 4.114 -4.755 187 HB ILE 21 HB ILE 21 9.993 2.547 -6.464 188 HG12 ILE 21 2HG1 ILE 21 8.709 1.031 -4.916 189 HG13 ILE 21 3HG1 ILE 21 9.711 1.626 -3.597 190 HG21 ILE 21 1HG2 ILE 21 11.602 0.477 -4.973 191 HG22 ILE 21 2HG2 ILE 21 10.504 0.168 -6.317 192 HG23 ILE 21 3HG2 ILE 21 11.970 1.112 -6.576 193 HD11 ILE 21 3HD1 ILE 21 8.464 3.740 -5.174 194 HD12 ILE 21 1HD1 ILE 21 7.319 2.673 -4.363 195 HD13 ILE 21 2HD1 ILE 21 8.550 3.520 -3.426 196 H GLU 22 H GLU 22 13.488 1.866 -4.684 197 HA GLU 22 HA GLU 22 13.131 0.716 -2.183 198 HB2 GLU 22 2HB GLU 22 15.105 0.686 -4.127 199 HB3 GLU 22 3HB GLU 22 15.918 1.379 -2.731 200 HG2 GLU 22 2HG GLU 22 16.105 -0.609 -1.786 201 HG3 GLU 22 3HG GLU 22 14.369 -0.883 -1.914 202 H LYS 23 H LYS 23 14.095 3.931 -3.034 203 HA LYS 23 HA LYS 23 15.345 4.660 -0.603 204 HB2 LYS 23 2HB LYS 23 14.391 6.013 -3.021 205 HB3 LYS 23 3HB LYS 23 14.264 7.000 -1.571 206 HG2 LYS 23 2HG LYS 23 16.655 6.577 -1.118 207 HG3 LYS 23 3HG LYS 23 16.755 5.692 -2.642 208 HD2 LYS 23 2HD LYS 23 15.770 8.528 -2.510 209 HD3 LYS 23 3HD LYS 23 17.486 8.142 -2.652 210 HE2 LYS 23 2HE LYS 23 17.136 8.116 -4.858 211 HE3 LYS 23 3HE LYS 23 16.339 6.566 -4.590 212 HZ1 LYS 23 3HZ LYS 23 14.323 7.446 -4.955 213 HZ2 LYS 23 1HZ LYS 23 15.176 8.661 -5.766 214 HZ3 LYS 23 2HZ LYS 23 14.677 8.901 -4.167 215 H GLU 24 H GLU 24 12.004 4.616 -1.673 216 HA GLU 24 HA GLU 24 10.998 6.082 0.573 217 HB2 GLU 24 2HB GLU 24 9.984 5.406 -1.876 218 HB3 GLU 24 3HB GLU 24 9.130 4.290 -0.821 219 HG2 GLU 24 2HG GLU 24 9.188 7.011 0.207 220 HG3 GLU 24 3HG GLU 24 8.403 6.876 -1.365 221 H MET 25 H MET 25 11.162 2.655 -0.319 222 HA MET 25 HA MET 25 9.730 1.555 1.776 223 HB2 MET 25 2HB MET 25 12.215 0.434 0.468 224 HB3 MET 25 3HB MET 25 11.053 -0.487 1.414 225 HG2 MET 25 2HG MET 25 10.475 0.934 -1.175 226 HG3 MET 25 3HG MET 25 10.735 -0.798 -0.983 227 HE1 MET 25 3HE MET 25 9.611 -1.965 0.970 228 HE2 MET 25 1HE MET 25 8.549 -1.046 2.036 229 HE3 MET 25 2HE MET 25 7.862 -2.153 0.847 230 H GLN 26 H GLN 26 10.199 0.905 3.851 231 HA GLN 26 HA GLN 26 11.961 2.463 5.356 232 HB2 GLN 26 2HB GLN 26 10.133 0.255 5.835 233 HB3 GLN 26 3HB GLN 26 11.559 0.156 6.859 234 HG2 GLN 26 2HG GLN 26 10.567 1.584 8.225 235 HG3 GLN 26 3HG GLN 26 10.798 2.820 6.989 236 HE21 GLN 26 1HE2 GLN 26 8.563 1.011 8.761 237 HE22 GLN 26 2HE2 GLN 26 7.129 1.521 7.944 238 HA PRO 27 HA PRO 27 15.892 0.530 5.156 239 HB2 PRO 27 2HB PRO 27 16.744 0.628 7.731 240 HB3 PRO 27 3HB PRO 27 16.628 2.060 6.703 241 HG2 PRO 27 2HG PRO 27 14.723 1.066 8.787 242 HG3 PRO 27 3HG PRO 27 15.273 2.722 8.474 243 HD2 PRO 27 2HD PRO 27 12.875 1.799 7.622 244 HD3 PRO 27 3HD PRO 27 13.805 3.013 6.721 245 H ASN 28 H ASN 28 13.346 -0.937 6.780 246 HA ASN 28 HA ASN 28 14.705 -3.505 6.718 247 HB2 ASN 28 2HB ASN 28 14.676 -2.198 9.105 248 HB3 ASN 28 3HB ASN 28 13.169 -3.103 9.206 249 HD21 ASN 28 1HD2 ASN 28 15.258 -3.578 10.924 250 HD22 ASN 28 2HD2 ASN 28 15.922 -5.141 10.602 251 H GLU 29 H GLU 29 12.656 -2.394 5.107 252 HA GLU 29 HA GLU 29 10.311 -3.977 5.927 253 HB2 GLU 29 2HB GLU 29 10.590 -1.325 4.777 254 HB3 GLU 29 3HB GLU 29 9.532 -2.341 3.808 255 HG2 GLU 29 2HG GLU 29 9.178 -2.109 6.771 256 HG3 GLU 29 3HG GLU 29 8.492 -0.921 5.664 257 H VAL 30 H VAL 30 9.046 -4.896 4.075 258 HA VAL 30 HA VAL 30 10.902 -6.196 2.225 259 HB VAL 30 HB VAL 30 8.397 -6.968 3.515 260 HG11 VAL 30 1HG1 VAL 30 7.682 -8.433 1.621 261 HG12 VAL 30 2HG1 VAL 30 7.421 -6.709 1.348 262 HG13 VAL 30 3HG1 VAL 30 8.781 -7.529 0.579 263 HG21 VAL 30 3HG2 VAL 30 9.442 -9.258 2.770 264 HG22 VAL 30 1HG2 VAL 30 10.860 -8.261 2.445 265 HG23 VAL 30 2HG2 VAL 30 10.173 -8.316 4.069 266 H ALA 31 H ALA 31 10.685 -6.138 0.017 267 HA ALA 31 HA ALA 31 8.568 -4.425 -1.091 268 HB1 ALA 31 1HB ALA 31 11.372 -4.290 -2.143 269 HB2 ALA 31 2HB ALA 31 10.042 -3.155 -2.377 270 HB3 ALA 31 3HB ALA 31 10.841 -3.266 -0.809 271 H ILE 32 H ILE 32 7.449 -5.516 -2.555 272 HA ILE 32 HA ILE 32 8.679 -7.822 -3.874 273 HB ILE 32 HB ILE 32 5.807 -6.973 -3.552 274 HG12 ILE 32 2HG1 ILE 32 6.691 -9.697 -2.866 275 HG13 ILE 32 3HG1 ILE 32 7.432 -8.424 -1.902 276 HG21 ILE 32 1HG2 ILE 32 5.555 -7.859 -5.621 277 HG22 ILE 32 2HG2 ILE 32 7.033 -8.814 -5.512 278 HG23 ILE 32 3HG2 ILE 32 5.565 -9.370 -4.710 279 HD11 ILE 32 3HD1 ILE 32 4.635 -7.925 -2.102 280 HD12 ILE 32 1HD1 ILE 32 4.895 -9.593 -1.592 281 HD13 ILE 32 2HD1 ILE 32 5.607 -8.267 -0.671 282 H PHE 33 H PHE 33 9.607 -7.429 -5.768 283 HA PHE 33 HA PHE 33 8.409 -5.408 -7.539 284 HB2 PHE 33 2HB PHE 33 11.205 -6.537 -7.710 285 HB3 PHE 33 3HB PHE 33 10.565 -5.131 -8.554 286 HD1 PHE 33 HD2 PHE 33 9.131 -3.814 -6.294 287 HD2 PHE 33 HD1 PHE 33 12.979 -5.621 -6.503 288 HE1 PHE 33 HE2 PHE 33 9.908 -2.364 -4.465 289 HE2 PHE 33 HE1 PHE 33 13.762 -4.174 -4.674 290 HZ PHE 33 HZ PHE 33 12.226 -2.542 -3.653 291 H MET 34 H MET 34 7.042 -6.386 -8.899 292 HA MET 34 HA MET 34 7.555 -9.058 -9.882 293 HB2 MET 34 2HB MET 34 5.271 -7.341 -9.614 294 HB3 MET 34 3HB MET 34 5.387 -7.897 -11.278 295 HG2 MET 34 2HG MET 34 5.486 -10.215 -10.479 296 HG3 MET 34 3HG MET 34 5.316 -9.636 -8.823 297 HE1 MET 34 3HE MET 34 2.158 -8.745 -8.057 298 HE2 MET 34 1HE MET 34 3.675 -7.879 -8.306 299 HE3 MET 34 2HE MET 34 2.253 -7.459 -9.261 300 H PHE 35 H PHE 35 8.313 -9.609 -11.845 301 HA PHE 35 HA PHE 35 8.575 -7.534 -13.898 302 HB2 PHE 35 2HB PHE 35 10.882 -8.131 -14.350 303 HB3 PHE 35 3HB PHE 35 10.723 -7.671 -12.659 304 HD1 PHE 35 HD1 PHE 35 10.154 -9.746 -11.065 305 HD2 PHE 35 HD2 PHE 35 12.154 -9.974 -14.815 306 HE1 PHE 35 HE1 PHE 35 11.174 -11.880 -10.387 307 HE2 PHE 35 HE2 PHE 35 13.176 -12.109 -14.144 308 HZ PHE 35 HZ PHE 35 12.686 -13.065 -11.928 309 H GLU 36 H GLU 36 8.062 -8.221 -15.886 310 HA GLU 36 HA GLU 36 7.674 -11.114 -16.265 311 HB2 GLU 36 2HB GLU 36 5.961 -10.591 -17.874 312 HB3 GLU 36 3HB GLU 36 5.630 -9.704 -16.393 313 HG2 GLU 36 2HG GLU 36 5.529 -7.834 -17.558 314 HG3 GLU 36 3HG GLU 36 7.224 -8.032 -18.002 315 H VAL 37 H VAL 37 9.884 -8.868 -16.905 316 HA VAL 37 HA VAL 37 10.760 -10.228 -19.338 317 HB VAL 37 HB VAL 37 11.132 -7.285 -19.350 318 HG11 VAL 37 1HG1 VAL 37 11.607 -7.634 -21.506 319 HG12 VAL 37 2HG1 VAL 37 11.657 -9.347 -21.084 320 HG13 VAL 37 3HG1 VAL 37 10.182 -8.644 -21.749 321 HG21 VAL 37 3HG2 VAL 37 8.845 -7.242 -18.787 322 HG22 VAL 37 1HG2 VAL 37 8.894 -7.080 -20.543 323 HG23 VAL 37 2HG2 VAL 37 8.483 -8.631 -19.812 324 H GLY 38 H GLY 38 12.889 -8.340 -19.817 325 HA2 GLY 38 2HA GLY 38 15.080 -8.025 -19.210 326 HA3 GLY 38 3HA GLY 38 14.464 -7.786 -17.581 327 H ASP 39 H ASP 39 16.856 -8.854 -17.648 328 HA ASP 39 HA ASP 39 16.695 -11.754 -17.715 329 HB2 ASP 39 2HB ASP 39 18.704 -10.139 -18.398 330 HB3 ASP 39 3HB ASP 39 19.118 -10.350 -16.699 331 H PHE 40 H PHE 40 17.573 -13.013 -15.866 332 HA PHE 40 HA PHE 40 16.224 -12.230 -13.452 333 HB2 PHE 40 2HB PHE 40 16.785 -14.413 -12.625 334 HB3 PHE 40 3HB PHE 40 16.313 -14.587 -14.313 335 HD1 PHE 40 HD2 PHE 40 19.121 -14.650 -11.954 336 HD2 PHE 40 HD1 PHE 40 17.883 -15.287 -15.975 337 HE1 PHE 40 HE2 PHE 40 21.247 -15.797 -12.423 338 HE2 PHE 40 HE1 PHE 40 20.006 -16.437 -16.451 339 HZ PHE 40 HZ PHE 40 21.692 -16.692 -14.674 340 H SER 41 H SER 41 19.479 -12.187 -14.650 341 HA SER 41 HA SER 41 20.747 -11.910 -12.097 342 HB2 SER 41 2HB SER 41 22.735 -11.879 -13.255 343 HB3 SER 41 3HB SER 41 21.709 -12.645 -14.468 344 HG SER 41 HG SER 41 23.035 -10.328 -14.621 345 H ASN 42 H ASN 42 18.865 -9.857 -13.936 346 HA ASN 42 HA ASN 42 20.238 -7.408 -13.190 347 HB2 ASN 42 2HB ASN 42 18.054 -8.154 -15.023 348 HB3 ASN 42 3HB ASN 42 17.847 -6.597 -14.227 349 HD21 ASN 42 1HD2 ASN 42 19.878 -5.214 -14.250 350 HD22 ASN 42 2HD2 ASN 42 20.734 -5.147 -15.749 351 H ILE 43 H ILE 43 17.500 -9.327 -12.191 352 HA ILE 43 HA ILE 43 16.037 -7.524 -10.698 353 HB ILE 43 HB ILE 43 16.499 -10.456 -10.494 354 HG12 ILE 43 2HG1 ILE 43 14.816 -9.465 -12.025 355 HG13 ILE 43 3HG1 ILE 43 14.093 -10.532 -10.826 356 HG21 ILE 43 1HG2 ILE 43 14.852 -10.430 -8.530 357 HG22 ILE 43 2HG2 ILE 43 16.541 -10.050 -8.196 358 HG23 ILE 43 3HG2 ILE 43 15.352 -8.753 -8.309 359 HD11 ILE 43 3HD1 ILE 43 12.718 -8.911 -10.241 360 HD12 ILE 43 1HD1 ILE 43 14.093 -7.926 -9.743 361 HD13 ILE 43 2HD1 ILE 43 13.486 -7.822 -11.396 362 HA PRO 44 HA PRO 44 18.854 -8.455 -6.876 363 HB2 PRO 44 2HB PRO 44 21.200 -9.735 -7.355 364 HB3 PRO 44 3HB PRO 44 19.697 -10.589 -6.985 365 HG2 PRO 44 2HG PRO 44 20.986 -10.086 -9.640 366 HG3 PRO 44 3HG PRO 44 20.227 -11.567 -9.027 367 HD2 PRO 44 2HD PRO 44 18.961 -9.874 -10.720 368 HD3 PRO 44 3HD PRO 44 18.097 -10.817 -9.488 369 H LYS 45 H LYS 45 20.068 -7.512 -9.970 370 HA LYS 45 HA LYS 45 22.375 -6.103 -9.072 371 HB2 LYS 45 2HB LYS 45 21.550 -6.910 -11.495 372 HB3 LYS 45 3HB LYS 45 21.003 -5.240 -11.560 373 HG2 LYS 45 2HG LYS 45 23.635 -5.194 -10.558 374 HG3 LYS 45 3HG LYS 45 23.625 -6.292 -11.940 375 HD2 LYS 45 2HD LYS 45 22.307 -4.424 -13.133 376 HD3 LYS 45 3HD LYS 45 22.895 -3.384 -11.833 377 HE2 LYS 45 2HE LYS 45 24.520 -3.098 -13.447 378 HE3 LYS 45 3HE LYS 45 25.217 -4.374 -12.451 379 HZ1 LYS 45 3HZ LYS 45 24.930 -4.497 -15.122 380 HZ2 LYS 45 1HZ LYS 45 23.551 -5.329 -14.603 381 HZ3 LYS 45 2HZ LYS 45 25.085 -5.845 -14.111 382 H SER 46 H SER 46 18.995 -5.346 -9.314 383 HA SER 46 HA SER 46 19.272 -2.508 -9.200 384 HB2 SER 46 2HB SER 46 16.767 -3.533 -8.116 385 HB3 SER 46 3HB SER 46 17.047 -2.519 -9.532 386 HG SER 46 HG SER 46 16.151 -4.561 -10.078 387 H ALA 47 H ALA 47 18.402 -4.968 -6.778 388 HA ALA 47 HA ALA 47 18.152 -3.250 -4.589 389 HB1 ALA 47 1HB ALA 47 17.479 -5.690 -4.750 390 HB2 ALA 47 2HB ALA 47 19.163 -6.073 -4.392 391 HB3 ALA 47 3HB ALA 47 18.198 -5.170 -3.225 392 H GLU 48 H GLU 48 20.959 -4.428 -6.223 393 HA GLU 48 HA GLU 48 22.794 -3.967 -4.067 394 HB2 GLU 48 2HB GLU 48 23.131 -5.578 -6.004 395 HB3 GLU 48 3HB GLU 48 23.473 -4.169 -6.998 396 HG2 GLU 48 2HG GLU 48 25.009 -4.256 -4.519 397 HG3 GLU 48 3HG GLU 48 25.316 -5.614 -5.601 398 H PHE 49 H PHE 49 21.506 -2.109 -6.720 399 HA PHE 49 HA PHE 49 23.389 -0.072 -6.905 400 HB2 PHE 49 2HB PHE 49 20.823 -0.581 -7.936 401 HB3 PHE 49 3HB PHE 49 20.717 0.992 -7.152 402 HD1 PHE 49 HD2 PHE 49 22.247 2.821 -7.857 403 HD2 PHE 49 HD1 PHE 49 21.981 -0.864 -9.971 404 HE1 PHE 49 HE2 PHE 49 23.313 3.869 -9.811 405 HE2 PHE 49 HE1 PHE 49 23.048 0.178 -11.928 406 HZ PHE 49 HZ PHE 49 23.715 2.547 -11.850 407 H ILE 50 H ILE 50 21.073 -0.746 -4.431 408 HA ILE 50 HA ILE 50 21.095 1.885 -3.274 409 HB ILE 50 HB ILE 50 20.202 -0.713 -2.020 410 HG12 ILE 50 2HG1 ILE 50 19.031 -0.185 -4.153 411 HG13 ILE 50 3HG1 ILE 50 17.965 -0.148 -2.752 412 HG21 ILE 50 1HG2 ILE 50 20.208 2.092 -1.149 413 HG22 ILE 50 2HG2 ILE 50 18.681 1.241 -0.922 414 HG23 ILE 50 3HG2 ILE 50 20.159 0.606 -0.200 415 HD11 ILE 50 3HD1 ILE 50 19.218 2.318 -3.917 416 HD12 ILE 50 1HD1 ILE 50 17.651 1.693 -4.429 417 HD13 ILE 50 2HD1 ILE 50 17.891 2.211 -2.760 418 H GLN 51 H GLN 51 22.757 -1.169 -2.698 419 HA GLN 51 HA GLN 51 25.024 0.010 -1.571 420 HB2 GLN 51 2HB GLN 51 22.950 0.016 0.252 421 HB3 GLN 51 3HB GLN 51 23.848 -1.434 0.680 422 HG2 GLN 51 2HG GLN 51 24.866 1.390 0.570 423 HG3 GLN 51 3HG GLN 51 24.688 0.359 1.988 424 HE21 GLN 51 1HE2 GLN 51 26.345 -0.885 2.587 425 HE22 GLN 51 2HE2 GLN 51 27.804 -1.097 1.687 426 H SER 52 H SER 52 26.659 -1.416 -1.641 427 HA SER 52 HA SER 52 26.421 -3.892 -2.827 428 HB2 SER 52 2HB SER 52 28.535 -2.491 -2.416 429 HB3 SER 52 3HB SER 52 28.607 -3.281 -0.841 430 HG SER 52 HG SER 52 28.350 -5.284 -2.288 431 H LYS 53 H LYS 53 26.147 -3.037 0.550 432 HA LYS 53 HA LYS 53 25.356 -5.809 1.130 433 HB2 LYS 53 2HB LYS 53 26.405 -5.518 3.402 434 HB3 LYS 53 3HB LYS 53 27.542 -5.638 2.065 435 HG2 LYS 53 2HG LYS 53 28.227 -3.476 2.268 436 HG3 LYS 53 3HG LYS 53 26.678 -2.928 2.913 437 HD2 LYS 53 2HD LYS 53 27.823 -2.855 4.859 438 HD3 LYS 53 3HD LYS 53 27.462 -4.582 4.894 439 HE2 LYS 53 2HE LYS 53 29.633 -5.044 4.862 440 HE3 LYS 53 3HE LYS 53 29.800 -4.194 3.326 441 HZ1 LYS 53 3HZ LYS 53 31.276 -3.189 4.859 442 HZ2 LYS 53 1HZ LYS 53 30.083 -3.062 6.052 443 HZ3 LYS 53 2HZ LYS 53 29.990 -2.108 4.659 444 H GLY 54 H GLY 54 23.479 -6.007 2.201 445 HA2 GLY 54 2HA GLY 54 22.200 -4.989 4.156 446 HA3 GLY 54 3HA GLY 54 22.235 -3.522 3.190 447 H HIS 55 H HIS 55 21.990 -5.594 0.832 448 HA HIS 55 HA HIS 55 19.051 -5.660 0.936 449 HB2 HIS 55 2HB HIS 55 19.088 -5.641 -1.500 450 HB3 HIS 55 3HB HIS 55 20.022 -4.285 -0.873 451 HD1 HIS 55 HD1 HIS 55 22.716 -4.728 -0.844 452 HD2 HIS 55 HD2 HIS 55 20.422 -7.171 -3.300 453 HE1 HIS 55 HE1 HIS 55 24.332 -5.742 -2.483 454 H GLU 56 H GLU 56 18.187 -7.585 1.299 455 HA GLU 56 HA GLU 56 19.523 -9.960 0.185 456 HB2 GLU 56 2HB GLU 56 19.459 -9.438 2.844 457 HB3 GLU 56 3HB GLU 56 17.958 -10.335 2.664 458 HG2 GLU 56 2HG GLU 56 20.285 -11.536 1.341 459 HG3 GLU 56 3HG GLU 56 20.378 -11.456 3.100 460 H LEU 57 H LEU 57 18.271 -10.973 -1.223 461 HA LEU 57 HA LEU 57 15.488 -10.350 -1.483 462 HB2 LEU 57 2HB LEU 57 17.260 -12.347 -2.874 463 HB3 LEU 57 3HB LEU 57 15.564 -12.096 -3.282 464 HG LEU 57 HG LEU 57 16.778 -10.897 -4.892 465 HD11 LEU 57 1HD1 LEU 57 16.393 -8.572 -3.133 466 HD12 LEU 57 2HD1 LEU 57 15.000 -9.641 -3.294 467 HD13 LEU 57 3HD1 LEU 57 15.725 -8.917 -4.729 468 HD21 LEU 57 3HD2 LEU 57 18.738 -9.776 -4.584 469 HD22 LEU 57 1HD2 LEU 57 18.864 -10.938 -3.263 470 HD23 LEU 57 2HD2 LEU 57 18.332 -9.288 -2.937 471 H LEU 58 H LEU 58 14.210 -11.080 0.124 472 HA LEU 58 HA LEU 58 14.519 -13.380 1.636 473 HB2 LEU 58 2HB LEU 58 12.544 -11.363 1.278 474 HB3 LEU 58 3HB LEU 58 11.739 -12.931 1.290 475 HG LEU 58 HG LEU 58 13.694 -12.414 3.455 476 HD11 LEU 58 1HD1 LEU 58 12.489 -10.875 4.621 477 HD12 LEU 58 2HD1 LEU 58 10.964 -11.322 3.857 478 HD13 LEU 58 3HD1 LEU 58 12.131 -10.332 2.981 479 HD21 LEU 58 3HD2 LEU 58 12.722 -14.369 3.960 480 HD22 LEU 58 1HD2 LEU 58 11.336 -14.061 2.914 481 HD23 LEU 58 2HD2 LEU 58 11.384 -13.376 4.539 482 H ASN 59 H ASN 59 12.572 -12.925 -1.306 483 HA ASN 59 HA ASN 59 12.450 -15.857 -1.569 484 HB2 ASN 59 2HB ASN 59 10.276 -14.454 -1.271 485 HB3 ASN 59 3HB ASN 59 10.535 -14.004 -2.954 486 HD21 ASN 59 1HD2 ASN 59 10.252 -16.798 -0.812 487 HD22 ASN 59 2HD2 ASN 59 9.525 -17.842 -1.981 488 H SER 60 H SER 60 14.287 -16.169 -2.778 489 HA SER 60 HA SER 60 15.353 -14.670 -4.790 490 HB2 SER 60 2HB SER 60 16.708 -16.447 -5.127 491 HB3 SER 60 3HB SER 60 15.836 -17.180 -3.781 492 HG SER 60 HG SER 60 14.437 -18.140 -5.304 493 H LEU 61 H LEU 61 14.678 -13.967 -6.698 494 HA LEU 61 HA LEU 61 12.173 -14.345 -7.758 495 HB2 LEU 61 2HB LEU 61 13.068 -13.481 -9.866 496 HB3 LEU 61 3HB LEU 61 13.627 -12.555 -8.475 497 HG LEU 61 HG LEU 61 15.424 -14.703 -9.419 498 HD11 LEU 61 1HD1 LEU 61 16.279 -12.820 -11.079 499 HD12 LEU 61 2HD1 LEU 61 14.559 -12.437 -11.124 500 HD13 LEU 61 3HD1 LEU 61 15.114 -14.049 -11.573 501 HD21 LEU 61 3HD2 LEU 61 16.824 -13.546 -8.146 502 HD22 LEU 61 1HD2 LEU 61 15.531 -12.404 -7.781 503 HD23 LEU 61 2HD2 LEU 61 16.598 -12.117 -9.156 504 H ARG 62 H ARG 62 11.209 -15.742 -9.156 505 HA ARG 62 HA ARG 62 12.718 -18.180 -9.794 506 HB2 ARG 62 2HB ARG 62 10.440 -18.080 -8.455 507 HB3 ARG 62 3HB ARG 62 9.750 -18.012 -10.071 508 HG2 ARG 62 2HG ARG 62 10.103 -20.180 -10.424 509 HG3 ARG 62 3HG ARG 62 11.751 -20.100 -9.798 510 HD2 ARG 62 2HD ARG 62 11.129 -20.699 -7.700 511 HD3 ARG 62 3HD ARG 62 9.568 -19.888 -7.816 512 HE ARG 62 HE ARG 62 9.444 -22.043 -9.535 513 HH11 ARG 62 1HH1 ARG 62 9.933 -21.524 -6.127 514 HH12 ARG 62 2HH1 ARG 62 9.226 -23.036 -5.663 515 HH21 ARG 62 1HH2 ARG 62 8.511 -24.037 -8.936 516 HH22 ARG 62 2HH2 ARG 62 8.418 -24.465 -7.261 517 H PHE 63 H PHE 63 13.654 -16.786 -11.572 518 HA PHE 63 HA PHE 63 12.027 -16.029 -13.773 519 HB2 PHE 63 2HB PHE 63 14.008 -15.399 -14.842 520 HB3 PHE 63 3HB PHE 63 14.403 -15.216 -13.136 521 HD1 PHE 63 HD2 PHE 63 15.815 -16.901 -12.008 522 HD2 PHE 63 HD1 PHE 63 15.124 -16.982 -16.208 523 HE1 PHE 63 HE2 PHE 63 17.746 -18.398 -12.294 524 HE2 PHE 63 HE1 PHE 63 17.054 -18.480 -16.500 525 HZ PHE 63 HZ PHE 63 18.369 -19.189 -14.542 526 H ASN 64 H ASN 64 11.204 -17.226 -15.356 527 HA ASN 64 HA ASN 64 12.537 -19.534 -16.404 528 HB2 ASN 64 2HB ASN 64 10.212 -19.846 -14.546 529 HB3 ASN 64 3HB ASN 64 10.369 -20.952 -15.908 530 HD21 ASN 64 1HD2 ASN 64 12.593 -21.930 -16.138 531 HD22 ASN 64 2HD2 ASN 64 13.358 -22.458 -14.681 532 H GLN 65 H GLN 65 9.460 -17.791 -16.139 533 HA GLN 65 HA GLN 65 9.343 -17.328 -18.944 534 HB2 GLN 65 2HB GLN 65 7.911 -19.650 -17.828 535 HB3 GLN 65 3HB GLN 65 6.936 -18.595 -18.843 536 HG2 GLN 65 2HG GLN 65 9.322 -18.944 -20.239 537 HG3 GLN 65 3HG GLN 65 8.927 -20.533 -19.585 538 HE21 GLN 65 1HE2 GLN 65 8.339 -21.485 -21.474 539 HE22 GLN 65 2HE2 GLN 65 6.956 -21.016 -22.397 540 H ALA 66 H ALA 66 6.615 -17.947 -16.778 541 HA ALA 66 HA ALA 66 5.382 -15.472 -17.311 542 HB1 ALA 66 1HB ALA 66 4.642 -17.823 -16.076 543 HB2 ALA 66 2HB ALA 66 4.609 -16.642 -14.766 544 HB3 ALA 66 3HB ALA 66 3.655 -16.369 -16.224 545 H ASP 67 H ASP 67 5.173 -13.606 -16.072 546 HA ASP 67 HA ASP 67 7.445 -12.651 -14.790 547 HB2 ASP 67 2HB ASP 67 6.308 -10.688 -14.595 548 HB3 ASP 67 3HB ASP 67 5.187 -11.495 -15.689 549 H TRP 68 H TRP 68 8.236 -12.797 -12.786 550 HA TRP 68 HA TRP 68 6.566 -14.115 -10.750 551 HB2 TRP 68 2HB TRP 68 8.962 -14.974 -11.708 552 HB3 TRP 68 3HB TRP 68 9.485 -14.018 -10.324 553 HD1 TRP 68 HD1 TRP 68 9.469 -15.232 -8.065 554 HE1 TRP 68 HE1 TRP 68 8.445 -17.412 -7.159 555 HE3 TRP 68 HE3 TRP 68 6.681 -16.573 -12.135 556 HZ2 TRP 68 HZ2 TRP 68 6.688 -19.434 -8.051 557 HZ3 TRP 68 HZ3 TRP 68 5.357 -18.645 -12.027 558 HH2 TRP 68 HH2 TRP 68 5.363 -20.044 -10.027 559 H THR 69 H THR 69 7.738 -13.600 -8.456 560 HA THR 69 HA THR 69 7.954 -10.665 -8.290 561 HB THR 69 HB THR 69 6.547 -10.530 -6.465 562 HG1 THR 69 HG1 THR 69 6.019 -12.426 -5.192 563 HG21 THR 69 3HG2 THR 69 5.165 -12.949 -7.471 564 HG22 THR 69 1HG2 THR 69 5.515 -11.687 -8.651 565 HG23 THR 69 2HG2 THR 69 4.551 -11.315 -7.222 566 H ILE 70 H ILE 70 9.554 -9.853 -7.037 567 HA ILE 70 HA ILE 70 11.219 -11.792 -5.568 568 HB ILE 70 HB ILE 70 12.436 -10.993 -7.491 569 HG12 ILE 70 2HG1 ILE 70 14.390 -10.005 -6.380 570 HG13 ILE 70 3HG1 ILE 70 13.399 -9.600 -4.983 571 HG21 ILE 70 1HG2 ILE 70 12.786 -8.232 -6.871 572 HG22 ILE 70 2HG2 ILE 70 12.131 -8.965 -8.334 573 HG23 ILE 70 3HG2 ILE 70 11.061 -8.581 -6.986 574 HD11 ILE 70 3HD1 ILE 70 13.306 -12.422 -5.716 575 HD12 ILE 70 1HD1 ILE 70 14.908 -11.848 -5.253 576 HD13 ILE 70 2HD1 ILE 70 13.548 -11.660 -4.144 577 H VAL 71 H VAL 71 11.197 -11.502 -3.448 578 HA VAL 71 HA VAL 71 10.299 -8.969 -2.330 579 HB VAL 71 HB VAL 71 11.106 -11.344 -0.686 580 HG11 VAL 71 1HG1 VAL 71 10.540 -9.188 0.396 581 HG12 VAL 71 2HG1 VAL 71 8.929 -9.291 -0.318 582 HG13 VAL 71 3HG1 VAL 71 9.455 -10.502 0.852 583 HG21 VAL 71 3HG2 VAL 71 9.686 -12.284 -2.392 584 HG22 VAL 71 1HG2 VAL 71 8.779 -12.173 -0.884 585 HG23 VAL 71 2HG2 VAL 71 8.502 -10.997 -2.168 586 H VAL 72 H VAL 72 11.629 -7.462 -1.578 587 HA VAL 72 HA VAL 72 14.406 -8.229 -0.948 588 HB VAL 72 HB VAL 72 13.617 -5.464 -1.822 589 HG11 VAL 72 1HG1 VAL 72 15.852 -5.050 -1.993 590 HG12 VAL 72 2HG1 VAL 72 15.889 -6.272 -0.720 591 HG13 VAL 72 3HG1 VAL 72 16.245 -6.722 -2.389 592 HG21 VAL 72 3HG2 VAL 72 14.775 -6.534 -4.039 593 HG22 VAL 72 1HG2 VAL 72 13.811 -7.891 -3.456 594 HG23 VAL 72 2HG2 VAL 72 13.038 -6.345 -3.807 595 H ARG 73 H ARG 73 15.126 -7.781 1.036 596 HA ARG 73 HA ARG 73 13.429 -6.115 2.768 597 HB2 ARG 73 2HB ARG 73 14.525 -7.332 4.650 598 HB3 ARG 73 3HB ARG 73 13.588 -8.370 3.584 599 HG2 ARG 73 2HG ARG 73 15.356 -9.643 3.203 600 HG3 ARG 73 3HG ARG 73 16.290 -8.249 2.658 601 HD2 ARG 73 2HD ARG 73 17.384 -8.069 4.611 602 HD3 ARG 73 3HD ARG 73 15.936 -8.401 5.561 603 HE ARG 73 HE ARG 73 17.942 -10.286 4.742 604 HH11 ARG 73 1HH1 ARG 73 14.616 -9.881 5.686 605 HH12 ARG 73 2HH1 ARG 73 14.437 -11.514 6.237 606 HH21 ARG 73 1HH2 ARG 73 17.719 -12.439 5.464 607 HH22 ARG 73 2HH2 ARG 73 16.203 -12.968 6.111 608 H LYS 74 H LYS 74 14.194 -4.112 2.927 609 HA LYS 74 HA LYS 74 16.817 -3.304 2.374 610 HB2 LYS 74 2HB LYS 74 14.406 -2.070 3.551 611 HB3 LYS 74 3HB LYS 74 15.930 -1.317 3.999 612 HG2 LYS 74 2HG LYS 74 16.326 -1.489 1.373 613 HG3 LYS 74 3HG LYS 74 14.562 -1.429 1.379 614 HD2 LYS 74 2HD LYS 74 14.660 0.774 1.652 615 HD3 LYS 74 3HD LYS 74 15.471 0.531 3.202 616 HE2 LYS 74 2HE LYS 74 17.558 0.166 1.582 617 HE3 LYS 74 3HE LYS 74 16.596 1.220 0.546 618 HZ1 LYS 74 3HZ LYS 74 16.900 2.042 3.323 619 HZ2 LYS 74 1HZ LYS 74 16.878 2.976 1.913 620 HZ3 LYS 74 2HZ LYS 74 18.282 2.143 2.354 621 H LYS 75 H LYS 75 18.413 -2.401 3.829 622 HA LYS 75 HA LYS 75 18.343 -2.836 6.625 623 HB2 LYS 75 2HB LYS 75 18.895 -5.147 5.167 624 HB3 LYS 75 3HB LYS 75 20.474 -4.578 5.692 625 HG2 LYS 75 2HG LYS 75 18.320 -4.646 7.721 626 HG3 LYS 75 3HG LYS 75 18.968 -6.191 7.167 627 HD2 LYS 75 2HD LYS 75 21.129 -4.384 7.652 628 HD3 LYS 75 3HD LYS 75 20.072 -4.416 9.065 629 HE2 LYS 75 2HE LYS 75 20.168 -6.980 8.794 630 HE3 LYS 75 3HE LYS 75 21.572 -6.669 7.775 631 HZ1 LYS 75 3HZ LYS 75 21.562 -5.318 10.342 632 HZ2 LYS 75 1HZ LYS 75 22.827 -6.096 9.531 633 HZ3 LYS 75 2HZ LYS 75 21.703 -7.002 10.413 634 H ALA 76 H ALA 76 20.289 -2.443 3.720 635 HA ALA 76 HA ALA 76 22.679 -1.561 4.765 636 HB1 ALA 76 1HB ALA 76 21.829 0.019 2.468 637 HB2 ALA 76 2HB ALA 76 23.188 -1.092 2.641 638 HB3 ALA 76 3HB ALA 76 21.583 -1.714 2.254 Start of MODEL 18 1 H1 MET 1 H MET 1 0.445 -0.963 -0.267 2 HA MET 1 HA MET 1 1.763 -0.191 -1.977 3 HB2 MET 1 2HB MET 1 1.682 2.087 -0.009 4 HB3 MET 1 3HB MET 1 2.433 2.252 -1.591 5 HG2 MET 1 2HG MET 1 0.453 2.226 -2.692 6 HG3 MET 1 3HG MET 1 -0.319 1.174 -1.508 7 HE1 MET 1 3HE MET 1 -2.426 2.204 -1.379 8 HE2 MET 1 1HE MET 1 -2.071 2.207 0.349 9 HE3 MET 1 2HE MET 1 -2.796 3.628 -0.404 10 H LYS 2 H LYS 2 3.365 -1.907 -1.194 11 HA LYS 2 HA LYS 2 5.953 -0.585 -0.824 12 HB2 LYS 2 2HB LYS 2 6.616 -2.514 0.691 13 HB3 LYS 2 3HB LYS 2 5.523 -1.322 1.382 14 HG2 LYS 2 2HG LYS 2 3.628 -2.827 0.901 15 HG3 LYS 2 3HG LYS 2 4.773 -4.034 0.309 16 HD2 LYS 2 2HD LYS 2 5.894 -3.701 2.642 17 HD3 LYS 2 3HD LYS 2 4.317 -3.052 3.097 18 HE2 LYS 2 2HE LYS 2 4.187 -5.572 1.616 19 HE3 LYS 2 3HE LYS 2 5.026 -5.694 3.161 20 HZ1 LYS 2 3HZ LYS 2 3.061 -4.588 4.177 21 HZ2 LYS 2 1HZ LYS 2 2.736 -6.120 3.537 22 HZ3 LYS 2 2HZ LYS 2 2.260 -4.734 2.694 23 H ARG 3 H ARG 3 4.785 -1.552 -3.204 24 HA ARG 3 HA ARG 3 6.753 -3.601 -3.901 25 HB2 ARG 3 2HB ARG 3 5.133 -4.924 -5.125 26 HB3 ARG 3 3HB ARG 3 4.627 -4.778 -3.447 27 HG2 ARG 3 2HG ARG 3 3.535 -2.707 -5.196 28 HG3 ARG 3 3HG ARG 3 3.040 -4.348 -5.617 29 HD2 ARG 3 2HD ARG 3 2.934 -3.496 -2.764 30 HD3 ARG 3 3HD ARG 3 1.686 -2.922 -3.869 31 HE ARG 3 HE ARG 3 1.975 -5.568 -2.822 32 HH11 ARG 3 1HH1 ARG 3 0.807 -3.708 -5.523 33 HH12 ARG 3 2HH1 ARG 3 -0.362 -4.893 -6.001 34 HH21 ARG 3 1HH2 ARG 3 0.438 -7.136 -3.441 35 HH22 ARG 3 2HH2 ARG 3 -0.572 -6.842 -4.816 36 H PHE 4 H PHE 4 7.005 -3.824 -6.279 37 HA PHE 4 HA PHE 4 6.227 -1.402 -7.746 38 HB2 PHE 4 2HB PHE 4 8.814 -1.894 -6.805 39 HB3 PHE 4 3HB PHE 4 8.870 -2.312 -8.514 40 HD1 PHE 4 HD2 PHE 4 7.147 0.358 -6.553 41 HD2 PHE 4 HD1 PHE 4 9.780 -0.616 -9.752 42 HE1 PHE 4 HE2 PHE 4 7.328 2.743 -7.126 43 HE2 PHE 4 HE1 PHE 4 9.967 1.768 -10.329 44 HZ PHE 4 HZ PHE 4 8.739 3.452 -9.016 45 H ASP 5 H ASP 5 5.161 -1.970 -9.511 46 HA ASP 5 HA ASP 5 5.496 -4.644 -10.616 47 HB2 ASP 5 2HB ASP 5 3.336 -2.786 -10.415 48 HB3 ASP 5 3HB ASP 5 3.617 -3.128 -12.120 49 H LEU 6 H LEU 6 7.329 -4.710 -11.817 50 HA LEU 6 HA LEU 6 7.848 -2.589 -13.757 51 HB2 LEU 6 2HB LEU 6 9.457 -4.913 -12.744 52 HB3 LEU 6 3HB LEU 6 9.956 -3.978 -14.152 53 HG LEU 6 HG LEU 6 11.176 -3.189 -12.258 54 HD11 LEU 6 1HD1 LEU 6 10.814 -0.931 -12.494 55 HD12 LEU 6 2HD1 LEU 6 9.059 -1.102 -12.509 56 HD13 LEU 6 3HD1 LEU 6 10.001 -1.562 -13.927 57 HD21 LEU 6 3HD2 LEU 6 9.478 -4.063 -10.594 58 HD22 LEU 6 1HD2 LEU 6 8.587 -2.565 -10.860 59 HD23 LEU 6 2HD2 LEU 6 10.225 -2.512 -10.207 60 H ARG 7 H ARG 7 5.907 -5.123 -13.761 61 HA ARG 7 HA ARG 7 6.526 -6.789 -15.860 62 HB2 ARG 7 2HB ARG 7 4.186 -6.103 -14.375 63 HB3 ARG 7 3HB ARG 7 3.760 -6.163 -16.080 64 HG2 ARG 7 2HG ARG 7 4.386 -8.411 -16.274 65 HG3 ARG 7 3HG ARG 7 5.284 -8.378 -14.755 66 HD2 ARG 7 2HD ARG 7 3.327 -9.501 -14.194 67 HD3 ARG 7 3HD ARG 7 3.009 -7.847 -13.673 68 HE ARG 7 HE ARG 7 1.293 -7.779 -15.167 69 HH11 ARG 7 1HH1 ARG 7 3.520 -10.264 -16.159 70 HH12 ARG 7 2HH1 ARG 7 2.531 -10.808 -17.474 71 HH21 ARG 7 1HH2 ARG 7 -0.018 -8.485 -16.895 72 HH22 ARG 7 2HH2 ARG 7 0.520 -9.794 -17.893 73 HA PRO 8 HA PRO 8 4.491 -3.736 -18.995 74 HB2 PRO 8 2HB PRO 8 3.826 -1.265 -18.091 75 HB3 PRO 8 3HB PRO 8 2.718 -2.641 -18.028 76 HG2 PRO 8 2HG PRO 8 4.439 -1.493 -15.864 77 HG3 PRO 8 3HG PRO 8 2.757 -2.048 -15.780 78 HD2 PRO 8 2HD PRO 8 4.833 -3.556 -14.915 79 HD3 PRO 8 3HD PRO 8 3.364 -4.265 -15.616 80 H LEU 9 H LEU 9 6.888 -2.931 -16.713 81 HA LEU 9 HA LEU 9 8.038 -0.740 -18.192 82 HB2 LEU 9 2HB LEU 9 8.385 -1.959 -15.616 83 HB3 LEU 9 3HB LEU 9 9.946 -1.789 -16.417 84 HG LEU 9 HG LEU 9 8.651 0.677 -16.742 85 HD11 LEU 9 1HD1 LEU 9 7.958 -0.632 -14.190 86 HD12 LEU 9 2HD1 LEU 9 7.125 0.642 -15.080 87 HD13 LEU 9 3HD1 LEU 9 8.531 1.033 -14.089 88 HD21 LEU 9 3HD2 LEU 9 10.591 1.475 -15.894 89 HD22 LEU 9 1HD2 LEU 9 11.111 -0.192 -16.140 90 HD23 LEU 9 2HD2 LEU 9 10.596 0.343 -14.540 91 H LYS 10 H LYS 10 10.061 -0.763 -19.254 92 HA LYS 10 HA LYS 10 10.628 -3.302 -20.566 93 HB2 LYS 10 2HB LYS 10 11.816 -2.040 -22.198 94 HB3 LYS 10 3HB LYS 10 10.344 -1.145 -21.843 95 HG2 LYS 10 2HG LYS 10 11.630 0.329 -20.349 96 HG3 LYS 10 3HG LYS 10 13.101 -0.543 -20.789 97 HD2 LYS 10 2HD LYS 10 13.141 1.299 -22.206 98 HD3 LYS 10 3HD LYS 10 12.438 0.036 -23.220 99 HE2 LYS 10 2HE LYS 10 10.403 1.430 -21.718 100 HE3 LYS 10 3HE LYS 10 11.370 2.554 -22.671 101 HZ1 LYS 10 3HZ LYS 10 10.809 1.464 -24.646 102 HZ2 LYS 10 1HZ LYS 10 9.354 1.539 -23.785 103 HZ3 LYS 10 2HZ LYS 10 10.228 0.092 -23.846 104 H ALA 11 H ALA 11 12.877 -3.981 -20.896 105 HA ALA 11 HA ALA 11 14.280 -4.136 -18.437 106 HB1 ALA 11 1HB ALA 11 16.094 -5.136 -20.031 107 HB2 ALA 11 2HB ALA 11 14.593 -6.012 -19.730 108 HB3 ALA 11 3HB ALA 11 14.791 -5.086 -21.218 109 H GLY 12 H GLY 12 16.209 -3.213 -17.786 110 HA2 GLY 12 2HA GLY 12 18.184 -1.904 -18.210 111 HA3 GLY 12 3HA GLY 12 17.320 -1.099 -19.510 112 H ILE 13 H ILE 13 14.936 -0.488 -18.176 113 HA ILE 13 HA ILE 13 15.903 1.623 -16.384 114 HB ILE 13 HB ILE 13 13.161 1.406 -17.621 115 HG12 ILE 13 2HG1 ILE 13 15.584 2.906 -18.638 116 HG13 ILE 13 3HG1 ILE 13 14.865 1.486 -19.390 117 HG21 ILE 13 1HG2 ILE 13 14.063 4.067 -17.132 118 HG22 ILE 13 2HG2 ILE 13 12.686 3.216 -16.432 119 HG23 ILE 13 3HG2 ILE 13 14.271 3.110 -15.666 120 HD11 ILE 13 3HD1 ILE 13 13.910 4.295 -19.330 121 HD12 ILE 13 1HD1 ILE 13 13.956 3.140 -20.662 122 HD13 ILE 13 2HD1 ILE 13 12.718 2.998 -19.413 123 H PHE 14 H PHE 14 13.836 -1.178 -16.507 124 HA PHE 14 HA PHE 14 12.282 -0.755 -14.225 125 HB2 PHE 14 2HB PHE 14 11.723 -3.030 -14.333 126 HB3 PHE 14 3HB PHE 14 12.118 -2.619 -15.999 127 HD1 PHE 14 HD1 PHE 14 14.806 -2.862 -16.436 128 HD2 PHE 14 HD2 PHE 14 12.477 -5.070 -13.640 129 HE1 PHE 14 HE1 PHE 14 16.467 -4.677 -16.491 130 HE2 PHE 14 HE2 PHE 14 14.135 -6.888 -13.690 131 HZ PHE 14 HZ PHE 14 16.133 -6.692 -15.116 132 H GLU 15 H GLU 15 15.607 -1.695 -14.576 133 HA GLU 15 HA GLU 15 15.868 -2.576 -11.833 134 HB2 GLU 15 2HB GLU 15 17.245 -3.702 -13.426 135 HB3 GLU 15 3HB GLU 15 17.855 -2.183 -14.068 136 HG2 GLU 15 2HG GLU 15 18.367 -2.497 -11.223 137 HG3 GLU 15 3HG GLU 15 19.094 -3.768 -12.203 138 H ARG 16 H ARG 16 16.338 0.329 -13.679 139 HA ARG 16 HA ARG 16 17.933 1.647 -11.675 140 HB2 ARG 16 2HB ARG 16 16.855 2.310 -14.346 141 HB3 ARG 16 3HB ARG 16 17.048 3.668 -13.247 142 HG2 ARG 16 2HG ARG 16 19.307 3.563 -13.290 143 HG3 ARG 16 3HG ARG 16 19.332 1.808 -13.473 144 HD2 ARG 16 2HD ARG 16 19.809 2.140 -15.621 145 HD3 ARG 16 3HD ARG 16 18.159 2.733 -15.813 146 HE ARG 16 HE ARG 16 18.972 4.876 -15.959 147 HH11 ARG 16 1HH1 ARG 16 21.486 2.746 -14.834 148 HH12 ARG 16 2HH1 ARG 16 22.740 3.931 -14.992 149 HH21 ARG 16 1HH2 ARG 16 20.615 6.444 -16.172 150 HH22 ARG 16 2HH2 ARG 16 22.244 6.034 -15.752 151 H LEU 17 H LEU 17 14.554 1.668 -12.702 152 HA LEU 17 HA LEU 17 13.734 3.778 -10.991 153 HB2 LEU 17 2HB LEU 17 12.564 2.120 -12.955 154 HB3 LEU 17 3HB LEU 17 11.597 1.948 -11.492 155 HG LEU 17 HG LEU 17 10.701 3.664 -12.986 156 HD11 LEU 17 1HD1 LEU 17 9.957 4.516 -11.079 157 HD12 LEU 17 2HD1 LEU 17 11.363 5.580 -11.062 158 HD13 LEU 17 3HD1 LEU 17 11.422 4.027 -10.228 159 HD21 LEU 17 3HD2 LEU 17 12.710 4.405 -14.081 160 HD22 LEU 17 1HD2 LEU 17 13.372 4.995 -12.557 161 HD23 LEU 17 2HD2 LEU 17 11.962 5.781 -13.269 162 H GLU 18 H GLU 18 14.253 0.382 -10.533 163 HA GLU 18 HA GLU 18 12.644 -0.103 -8.304 164 HB2 GLU 18 2HB GLU 18 14.511 -1.536 -9.768 165 HB3 GLU 18 3HB GLU 18 15.231 -1.441 -8.168 166 HG2 GLU 18 2HG GLU 18 13.900 -3.046 -7.445 167 HG3 GLU 18 3HG GLU 18 12.480 -2.095 -7.878 168 H GLU 19 H GLU 19 15.595 1.676 -8.618 169 HA GLU 19 HA GLU 19 16.214 1.638 -5.800 170 HB2 GLU 19 2HB GLU 19 18.075 1.806 -7.284 171 HB3 GLU 19 3HB GLU 19 17.352 3.160 -8.142 172 HG2 GLU 19 2HG GLU 19 17.729 3.657 -5.295 173 HG3 GLU 19 3HG GLU 19 19.229 3.340 -6.166 174 H LEU 20 H LEU 20 14.424 3.636 -8.003 175 HA LEU 20 HA LEU 20 14.364 6.011 -6.478 176 HB2 LEU 20 2HB LEU 20 13.078 4.952 -8.843 177 HB3 LEU 20 3HB LEU 20 11.953 5.887 -7.860 178 HG LEU 20 HG LEU 20 14.120 7.548 -7.965 179 HD11 LEU 20 1HD1 LEU 20 14.065 5.863 -10.427 180 HD12 LEU 20 2HD1 LEU 20 15.443 6.493 -9.525 181 HD13 LEU 20 3HD1 LEU 20 14.489 7.571 -10.544 182 HD21 LEU 20 3HD2 LEU 20 11.667 7.354 -9.694 183 HD22 LEU 20 1HD2 LEU 20 12.780 8.720 -9.767 184 HD23 LEU 20 2HD2 LEU 20 11.926 8.358 -8.267 185 H ILE 21 H ILE 21 12.568 3.034 -6.306 186 HA ILE 21 HA ILE 21 10.601 4.139 -4.476 187 HB ILE 21 HB ILE 21 9.835 2.480 -6.076 188 HG12 ILE 21 2HG1 ILE 21 8.715 0.941 -4.527 189 HG13 ILE 21 3HG1 ILE 21 9.867 1.359 -3.264 190 HG21 ILE 21 1HG2 ILE 21 11.852 1.226 -6.431 191 HG22 ILE 21 2HG2 ILE 21 11.846 0.661 -4.762 192 HG23 ILE 21 3HG2 ILE 21 10.593 0.122 -5.879 193 HD11 ILE 21 3HD1 ILE 21 8.038 3.359 -4.558 194 HD12 ILE 21 1HD1 ILE 21 7.631 2.463 -3.095 195 HD13 ILE 21 2HD1 ILE 21 9.011 3.562 -3.101 196 H GLU 22 H GLU 22 13.524 2.235 -4.394 197 HA GLU 22 HA GLU 22 13.308 1.095 -1.857 198 HB2 GLU 22 2HB GLU 22 15.335 1.418 -3.839 199 HB3 GLU 22 3HB GLU 22 16.017 1.860 -2.280 200 HG2 GLU 22 2HG GLU 22 16.438 -0.444 -2.606 201 HG3 GLU 22 3HG GLU 22 15.173 -0.313 -1.385 202 H LYS 23 H LYS 23 14.014 4.353 -2.833 203 HA LYS 23 HA LYS 23 15.204 5.261 -0.434 204 HB2 LYS 23 2HB LYS 23 14.109 6.464 -2.882 205 HB3 LYS 23 3HB LYS 23 13.974 7.485 -1.456 206 HG2 LYS 23 2HG LYS 23 16.197 7.833 -1.326 207 HG3 LYS 23 3HG LYS 23 16.595 6.207 -1.885 208 HD2 LYS 23 2HD LYS 23 17.313 7.614 -3.615 209 HD3 LYS 23 3HD LYS 23 15.761 6.987 -4.175 210 HE2 LYS 23 2HE LYS 23 15.600 9.469 -2.615 211 HE3 LYS 23 3HE LYS 23 16.459 9.616 -4.148 212 HZ1 LYS 23 3HZ LYS 23 14.581 9.369 -5.310 213 HZ2 LYS 23 1HZ LYS 23 13.791 9.766 -3.868 214 HZ3 LYS 23 2HZ LYS 23 13.982 8.144 -4.307 215 H GLU 24 H GLU 24 11.878 4.884 -1.469 216 HA GLU 24 HA GLU 24 10.807 6.316 0.796 217 HB2 GLU 24 2HB GLU 24 9.833 5.568 -1.706 218 HB3 GLU 24 3HB GLU 24 8.921 4.582 -0.571 219 HG2 GLU 24 2HG GLU 24 8.960 7.164 0.512 220 HG3 GLU 24 3HG GLU 24 8.633 7.358 -1.210 221 H MET 25 H MET 25 11.096 2.937 -0.228 222 HA MET 25 HA MET 25 9.674 1.695 1.787 223 HB2 MET 25 2HB MET 25 12.161 0.824 0.320 224 HB3 MET 25 3HB MET 25 11.307 -0.225 1.444 225 HG2 MET 25 2HG MET 25 9.634 1.018 -0.624 226 HG3 MET 25 3HG MET 25 10.843 -0.123 -1.211 227 HE1 MET 25 3HE MET 25 8.041 -1.430 2.195 228 HE2 MET 25 1HE MET 25 9.583 -0.595 2.393 229 HE3 MET 25 2HE MET 25 8.196 0.262 1.720 230 H GLN 26 H GLN 26 10.231 0.802 3.801 231 HA GLN 26 HA GLN 26 11.925 2.434 5.395 232 HB2 GLN 26 2HB GLN 26 10.020 0.274 5.812 233 HB3 GLN 26 3HB GLN 26 11.413 0.139 6.878 234 HG2 GLN 26 2HG GLN 26 10.929 2.696 7.274 235 HG3 GLN 26 3HG GLN 26 9.310 2.231 6.753 236 HE21 GLN 26 1HE2 GLN 26 11.654 2.093 9.253 237 HE22 GLN 26 2HE2 GLN 26 10.689 1.259 10.418 238 HA PRO 27 HA PRO 27 15.796 0.378 5.272 239 HB2 PRO 27 2HB PRO 27 16.595 0.453 7.865 240 HB3 PRO 27 3HB PRO 27 16.547 1.887 6.833 241 HG2 PRO 27 2HG PRO 27 14.567 0.956 8.877 242 HG3 PRO 27 3HG PRO 27 15.176 2.594 8.574 243 HD2 PRO 27 2HD PRO 27 12.768 1.746 7.672 244 HD3 PRO 27 3HD PRO 27 13.756 2.929 6.790 245 H ASN 28 H ASN 28 13.179 -0.990 6.897 246 HA ASN 28 HA ASN 28 14.487 -3.599 6.893 247 HB2 ASN 28 2HB ASN 28 14.354 -2.291 9.253 248 HB3 ASN 28 3HB ASN 28 12.783 -3.088 9.263 249 HD21 ASN 28 1HD2 ASN 28 13.358 -5.441 7.988 250 HD22 ASN 28 2HD2 ASN 28 14.455 -6.367 8.950 251 H GLU 29 H GLU 29 12.531 -2.391 5.173 252 HA GLU 29 HA GLU 29 10.138 -3.982 5.810 253 HB2 GLU 29 2HB GLU 29 10.508 -1.314 4.716 254 HB3 GLU 29 3HB GLU 29 9.486 -2.307 3.687 255 HG2 GLU 29 2HG GLU 29 8.992 -2.113 6.632 256 HG3 GLU 29 3HG GLU 29 8.384 -0.891 5.517 257 H VAL 30 H VAL 30 8.988 -4.880 3.887 258 HA VAL 30 HA VAL 30 10.943 -6.136 2.111 259 HB VAL 30 HB VAL 30 9.118 -7.397 3.486 260 HG11 VAL 30 1HG1 VAL 30 6.985 -7.569 2.603 261 HG12 VAL 30 2HG1 VAL 30 7.344 -5.854 2.392 262 HG13 VAL 30 3HG1 VAL 30 7.478 -6.959 1.024 263 HG21 VAL 30 3HG2 VAL 30 9.895 -9.083 2.266 264 HG22 VAL 30 1HG2 VAL 30 8.886 -8.590 0.905 265 HG23 VAL 30 2HG2 VAL 30 10.510 -7.926 1.085 266 H ALA 31 H ALA 31 10.794 -6.090 -0.116 267 HA ALA 31 HA ALA 31 8.772 -4.293 -1.274 268 HB1 ALA 31 1HB ALA 31 10.324 -3.083 -2.501 269 HB2 ALA 31 2HB ALA 31 11.134 -3.293 -0.948 270 HB3 ALA 31 3HB ALA 31 11.577 -4.311 -2.318 271 H ILE 32 H ILE 32 7.582 -5.436 -2.643 272 HA ILE 32 HA ILE 32 8.726 -7.771 -3.970 273 HB ILE 32 HB ILE 32 5.901 -6.780 -3.661 274 HG12 ILE 32 2HG1 ILE 32 6.486 -9.553 -3.011 275 HG13 ILE 32 3HG1 ILE 32 7.520 -8.444 -2.117 276 HG21 ILE 32 1HG2 ILE 32 5.560 -7.640 -5.718 277 HG22 ILE 32 2HG2 ILE 32 7.030 -8.610 -5.673 278 HG23 ILE 32 3HG2 ILE 32 5.577 -9.175 -4.850 279 HD11 ILE 32 3HD1 ILE 32 5.019 -9.219 -1.378 280 HD12 ILE 32 1HD1 ILE 32 5.848 -7.771 -0.808 281 HD13 ILE 32 2HD1 ILE 32 4.710 -7.664 -2.151 282 H PHE 33 H PHE 33 9.747 -7.373 -5.822 283 HA PHE 33 HA PHE 33 8.654 -5.332 -7.634 284 HB2 PHE 33 2HB PHE 33 11.390 -6.611 -7.737 285 HB3 PHE 33 3HB PHE 33 10.840 -5.204 -8.641 286 HD1 PHE 33 HD2 PHE 33 9.406 -3.790 -6.405 287 HD2 PHE 33 HD1 PHE 33 13.208 -5.698 -6.573 288 HE1 PHE 33 HE2 PHE 33 10.220 -2.319 -4.609 289 HE2 PHE 33 HE1 PHE 33 14.027 -4.230 -4.776 290 HZ PHE 33 HZ PHE 33 12.533 -2.537 -3.792 291 H MET 34 H MET 34 7.216 -6.281 -8.953 292 HA MET 34 HA MET 34 7.568 -8.973 -9.911 293 HB2 MET 34 2HB MET 34 5.473 -6.886 -10.081 294 HB3 MET 34 3HB MET 34 5.534 -8.034 -11.412 295 HG2 MET 34 2HG MET 34 5.739 -9.552 -9.065 296 HG3 MET 34 3HG MET 34 4.474 -8.361 -8.776 297 HE1 MET 34 3HE MET 34 4.524 -10.226 -12.778 298 HE2 MET 34 1HE MET 34 5.922 -9.980 -11.731 299 HE3 MET 34 2HE MET 34 5.082 -11.531 -11.730 300 H PHE 35 H PHE 35 8.396 -9.623 -11.807 301 HA PHE 35 HA PHE 35 8.931 -7.605 -13.874 302 HB2 PHE 35 2HB PHE 35 11.156 -8.463 -14.245 303 HB3 PHE 35 3HB PHE 35 10.996 -8.043 -12.543 304 HD1 PHE 35 HD1 PHE 35 10.351 -9.979 -10.944 305 HD2 PHE 35 HD2 PHE 35 11.968 -10.538 -14.842 306 HE1 PHE 35 HE1 PHE 35 11.072 -12.246 -10.316 307 HE2 PHE 35 HE2 PHE 35 12.691 -12.806 -14.220 308 HZ PHE 35 HZ PHE 35 12.242 -13.663 -11.955 309 H GLU 36 H GLU 36 8.762 -8.303 -15.977 310 HA GLU 36 HA GLU 36 8.020 -11.123 -16.382 311 HB2 GLU 36 2HB GLU 36 6.291 -10.462 -17.947 312 HB3 GLU 36 3HB GLU 36 6.006 -9.692 -16.392 313 HG2 GLU 36 2HG GLU 36 5.652 -7.907 -17.731 314 HG3 GLU 36 3HG GLU 36 7.395 -7.742 -17.527 315 H VAL 37 H VAL 37 10.290 -8.940 -16.994 316 HA VAL 37 HA VAL 37 10.616 -9.402 -19.844 317 HB VAL 37 HB VAL 37 12.617 -8.038 -18.061 318 HG11 VAL 37 1HG1 VAL 37 13.622 -8.131 -20.091 319 HG12 VAL 37 2HG1 VAL 37 12.094 -8.247 -20.966 320 HG13 VAL 37 3HG1 VAL 37 12.651 -6.685 -20.363 321 HG21 VAL 37 3HG2 VAL 37 10.024 -6.971 -19.130 322 HG22 VAL 37 1HG2 VAL 37 10.678 -6.861 -17.496 323 HG23 VAL 37 2HG2 VAL 37 11.392 -5.909 -18.798 324 H GLY 38 H GLY 38 12.728 -10.162 -20.682 325 HA2 GLY 38 2HA GLY 38 13.397 -12.680 -19.526 326 HA3 GLY 38 3HA GLY 38 14.178 -11.935 -20.913 327 H ASP 39 H ASP 39 14.394 -9.591 -18.736 328 HA ASP 39 HA ASP 39 17.111 -10.333 -18.010 329 HB2 ASP 39 2HB ASP 39 15.537 -7.778 -17.962 330 HB3 ASP 39 3HB ASP 39 17.029 -7.915 -17.036 331 H PHE 40 H PHE 40 16.586 -11.971 -16.471 332 HA PHE 40 HA PHE 40 15.234 -11.115 -14.032 333 HB2 PHE 40 2HB PHE 40 16.234 -13.767 -13.790 334 HB3 PHE 40 3HB PHE 40 14.562 -13.244 -13.962 335 HD1 PHE 40 HD2 PHE 40 13.486 -13.217 -16.149 336 HD2 PHE 40 HD1 PHE 40 17.470 -14.631 -15.652 337 HE1 PHE 40 HE2 PHE 40 13.380 -14.286 -18.363 338 HE2 PHE 40 HE1 PHE 40 17.370 -15.700 -17.865 339 HZ PHE 40 HZ PHE 40 15.323 -15.530 -19.223 340 H SER 41 H SER 41 18.405 -11.718 -15.262 341 HA SER 41 HA SER 41 19.714 -12.112 -12.764 342 HB2 SER 41 2HB SER 41 21.650 -12.279 -13.986 343 HB3 SER 41 3HB SER 41 20.487 -12.544 -15.286 344 HG SER 41 HG SER 41 22.305 -10.784 -15.345 345 H ASN 42 H ASN 42 18.473 -9.366 -14.362 346 HA ASN 42 HA ASN 42 20.245 -7.457 -13.118 347 HB2 ASN 42 2HB ASN 42 18.092 -7.399 -15.104 348 HB3 ASN 42 3HB ASN 42 18.067 -6.021 -14.009 349 HD21 ASN 42 1HD2 ASN 42 20.731 -7.906 -15.386 350 HD22 ASN 42 2HD2 ASN 42 21.523 -6.563 -16.132 351 H ILE 43 H ILE 43 17.256 -9.014 -12.371 352 HA ILE 43 HA ILE 43 15.943 -7.287 -10.714 353 HB ILE 43 HB ILE 43 16.282 -10.245 -10.676 354 HG12 ILE 43 2HG1 ILE 43 14.645 -9.086 -12.150 355 HG13 ILE 43 3HG1 ILE 43 13.886 -10.211 -11.029 356 HG21 ILE 43 1HG2 ILE 43 16.323 -9.996 -8.366 357 HG22 ILE 43 2HG2 ILE 43 15.240 -8.605 -8.399 358 HG23 ILE 43 3HG2 ILE 43 14.608 -10.221 -8.713 359 HD11 ILE 43 3HD1 ILE 43 13.333 -7.471 -11.423 360 HD12 ILE 43 1HD1 ILE 43 12.573 -8.595 -10.298 361 HD13 ILE 43 2HD1 ILE 43 13.982 -7.660 -9.794 362 HA PRO 44 HA PRO 44 18.735 -8.561 -6.977 363 HB2 PRO 44 2HB PRO 44 21.006 -9.938 -7.540 364 HB3 PRO 44 3HB PRO 44 19.461 -10.729 -7.203 365 HG2 PRO 44 2HG PRO 44 20.761 -10.157 -9.839 366 HG3 PRO 44 3HG PRO 44 19.927 -11.625 -9.298 367 HD2 PRO 44 2HD PRO 44 18.744 -9.781 -10.889 368 HD3 PRO 44 3HD PRO 44 17.838 -10.739 -9.701 369 H LYS 45 H LYS 45 19.903 -7.450 -10.009 370 HA LYS 45 HA LYS 45 22.290 -6.200 -9.007 371 HB2 LYS 45 2HB LYS 45 21.486 -6.938 -11.487 372 HB3 LYS 45 3HB LYS 45 21.109 -5.221 -11.534 373 HG2 LYS 45 2HG LYS 45 23.674 -5.410 -10.425 374 HG3 LYS 45 3HG LYS 45 23.643 -6.537 -11.783 375 HD2 LYS 45 2HD LYS 45 22.569 -4.596 -13.092 376 HD3 LYS 45 3HD LYS 45 23.160 -3.575 -11.779 377 HE2 LYS 45 2HE LYS 45 25.211 -5.384 -12.712 378 HE3 LYS 45 3HE LYS 45 24.572 -4.408 -14.033 379 HZ1 LYS 45 3HZ LYS 45 25.316 -3.129 -11.488 380 HZ2 LYS 45 1HZ LYS 45 25.253 -2.461 -13.041 381 HZ3 LYS 45 2HZ LYS 45 26.514 -3.507 -12.621 382 H SER 46 H SER 46 18.952 -5.335 -9.366 383 HA SER 46 HA SER 46 19.260 -2.517 -9.285 384 HB2 SER 46 2HB SER 46 16.783 -3.564 -8.109 385 HB3 SER 46 3HB SER 46 17.010 -2.481 -9.482 386 HG SER 46 HG SER 46 16.573 -5.163 -9.447 387 H ALA 47 H ALA 47 18.273 -4.832 -6.758 388 HA ALA 47 HA ALA 47 18.211 -3.019 -4.636 389 HB1 ALA 47 1HB ALA 47 17.441 -5.510 -4.806 390 HB2 ALA 47 2HB ALA 47 19.053 -5.844 -4.171 391 HB3 ALA 47 3HB ALA 47 17.935 -4.836 -3.252 392 H GLU 48 H GLU 48 20.883 -4.534 -6.234 393 HA GLU 48 HA GLU 48 22.783 -4.139 -4.128 394 HB2 GLU 48 2HB GLU 48 22.959 -5.843 -5.999 395 HB3 GLU 48 3HB GLU 48 23.386 -4.509 -7.061 396 HG2 GLU 48 2HG GLU 48 24.965 -4.629 -4.605 397 HG3 GLU 48 3HG GLU 48 25.148 -6.033 -5.654 398 H PHE 49 H PHE 49 21.551 -2.235 -6.753 399 HA PHE 49 HA PHE 49 23.617 -0.386 -7.073 400 HB2 PHE 49 2HB PHE 49 21.044 -0.717 -8.082 401 HB3 PHE 49 3HB PHE 49 20.986 0.839 -7.261 402 HD1 PHE 49 HD2 PHE 49 22.640 2.612 -7.901 403 HD2 PHE 49 HD1 PHE 49 22.121 -0.965 -10.150 404 HE1 PHE 49 HE2 PHE 49 23.737 3.671 -9.832 405 HE2 PHE 49 HE1 PHE 49 23.218 0.088 -12.084 406 HZ PHE 49 HZ PHE 49 24.027 2.409 -11.927 407 H ILE 50 H ILE 50 21.338 -0.797 -4.514 408 HA ILE 50 HA ILE 50 21.593 1.855 -3.441 409 HB ILE 50 HB ILE 50 20.560 -0.642 -2.091 410 HG12 ILE 50 2HG1 ILE 50 19.335 -0.059 -4.172 411 HG13 ILE 50 3HG1 ILE 50 18.342 0.110 -2.729 412 HG21 ILE 50 1HG2 ILE 50 20.521 2.264 -1.368 413 HG22 ILE 50 2HG2 ILE 50 19.283 1.162 -0.767 414 HG23 ILE 50 3HG2 ILE 50 20.980 0.877 -0.381 415 HD11 ILE 50 3HD1 ILE 50 18.641 2.509 -2.773 416 HD12 ILE 50 1HD1 ILE 50 19.711 2.369 -4.168 417 HD13 ILE 50 2HD1 ILE 50 18.007 1.938 -4.317 418 H GLN 51 H GLN 51 22.395 -1.253 -1.894 419 HA GLN 51 HA GLN 51 25.010 -0.199 -1.138 420 HB2 GLN 51 2HB GLN 51 23.232 0.293 0.659 421 HB3 GLN 51 3HB GLN 51 23.250 -1.440 0.962 422 HG2 GLN 51 2HG GLN 51 24.689 -0.193 2.505 423 HG3 GLN 51 3HG GLN 51 25.585 -1.363 1.538 424 HE21 GLN 51 1HE2 GLN 51 24.452 1.952 0.969 425 HE22 GLN 51 2HE2 GLN 51 25.996 2.585 0.521 426 H SER 52 H SER 52 26.544 -1.699 -1.319 427 HA SER 52 HA SER 52 26.132 -4.202 -2.397 428 HB2 SER 52 2HB SER 52 28.324 -2.902 -2.182 429 HB3 SER 52 3HB SER 52 28.451 -3.591 -0.564 430 HG SER 52 HG SER 52 28.529 -4.887 -3.062 431 H LYS 53 H LYS 53 26.157 -3.229 0.969 432 HA LYS 53 HA LYS 53 25.455 -5.991 1.721 433 HB2 LYS 53 2HB LYS 53 27.133 -3.934 3.107 434 HB3 LYS 53 3HB LYS 53 26.270 -5.133 4.061 435 HG2 LYS 53 2HG LYS 53 27.945 -6.536 3.729 436 HG3 LYS 53 3HG LYS 53 27.553 -6.550 2.008 437 HD2 LYS 53 2HD LYS 53 29.240 -5.123 1.474 438 HD3 LYS 53 3HD LYS 53 29.130 -4.250 3.004 439 HE2 LYS 53 2HE LYS 53 30.480 -5.751 4.110 440 HE3 LYS 53 3HE LYS 53 30.095 -7.071 3.007 441 HZ1 LYS 53 3HZ LYS 53 32.028 -6.629 2.038 442 HZ2 LYS 53 1HZ LYS 53 32.225 -5.178 2.887 443 HZ3 LYS 53 2HZ LYS 53 31.340 -5.202 1.445 444 H GLY 54 H GLY 54 23.348 -6.140 2.118 445 HA2 GLY 54 2HA GLY 54 21.898 -5.171 4.116 446 HA3 GLY 54 3HA GLY 54 21.867 -3.794 3.023 447 H HIS 55 H HIS 55 21.606 -4.958 0.575 448 HA HIS 55 HA HIS 55 18.842 -5.677 0.579 449 HB2 HIS 55 2HB HIS 55 19.022 -5.711 -1.823 450 HB3 HIS 55 3HB HIS 55 19.943 -4.336 -1.221 451 HD1 HIS 55 HD1 HIS 55 22.640 -4.897 -0.970 452 HD2 HIS 55 HD2 HIS 55 20.405 -7.245 -3.569 453 HE1 HIS 55 HE1 HIS 55 24.312 -5.980 -2.505 454 H GLU 56 H GLU 56 18.052 -7.632 0.949 455 HA GLU 56 HA GLU 56 19.555 -9.971 0.001 456 HB2 GLU 56 2HB GLU 56 19.364 -9.291 2.672 457 HB3 GLU 56 3HB GLU 56 18.066 -10.460 2.468 458 HG2 GLU 56 2HG GLU 56 20.623 -11.230 1.256 459 HG3 GLU 56 3HG GLU 56 20.637 -11.091 3.013 460 H LEU 57 H LEU 57 18.347 -11.124 -1.337 461 HA LEU 57 HA LEU 57 15.499 -10.706 -1.495 462 HB2 LEU 57 2HB LEU 57 17.390 -12.473 -3.033 463 HB3 LEU 57 3HB LEU 57 15.659 -12.384 -3.354 464 HG LEU 57 HG LEU 57 16.691 -11.026 -4.976 465 HD11 LEU 57 1HD1 LEU 57 15.524 -9.090 -4.706 466 HD12 LEU 57 2HD1 LEU 57 16.035 -8.881 -3.031 467 HD13 LEU 57 3HD1 LEU 57 14.779 -10.054 -3.430 468 HD21 LEU 57 3HD2 LEU 57 18.094 -9.251 -3.071 469 HD22 LEU 57 1HD2 LEU 57 18.542 -9.751 -4.702 470 HD23 LEU 57 2HD2 LEU 57 18.800 -10.845 -3.343 471 H LEU 58 H LEU 58 14.340 -11.621 0.098 472 HA LEU 58 HA LEU 58 14.914 -13.848 1.600 473 HB2 LEU 58 2HB LEU 58 12.646 -12.178 1.130 474 HB3 LEU 58 3HB LEU 58 12.117 -13.858 1.187 475 HG LEU 58 HG LEU 58 13.577 -13.861 3.398 476 HD11 LEU 58 1HD1 LEU 58 13.340 -11.048 2.691 477 HD12 LEU 58 2HD1 LEU 58 14.384 -11.838 3.873 478 HD13 LEU 58 3HD1 LEU 58 12.729 -11.411 4.305 479 HD21 LEU 58 3HD2 LEU 58 11.321 -14.482 3.502 480 HD22 LEU 58 1HD2 LEU 58 10.766 -12.887 2.994 481 HD23 LEU 58 2HD2 LEU 58 11.452 -13.110 4.603 482 H ASN 59 H ASN 59 13.186 -13.703 -1.489 483 HA ASN 59 HA ASN 59 13.634 -16.595 -1.777 484 HB2 ASN 59 2HB ASN 59 11.179 -15.710 -1.260 485 HB3 ASN 59 3HB ASN 59 11.187 -15.401 -2.994 486 HD21 ASN 59 1HD2 ASN 59 10.097 -17.498 -0.891 487 HD22 ASN 59 2HD2 ASN 59 10.251 -18.980 -1.766 488 H SER 60 H SER 60 14.996 -16.870 -3.408 489 HA SER 60 HA SER 60 15.785 -15.021 -5.279 490 HB2 SER 60 2HB SER 60 17.223 -16.760 -5.441 491 HB3 SER 60 3HB SER 60 15.990 -17.941 -5.001 492 HG SER 60 HG SER 60 16.979 -17.623 -7.349 493 H LEU 61 H LEU 61 15.001 -14.219 -7.129 494 HA LEU 61 HA LEU 61 12.349 -14.381 -7.848 495 HB2 LEU 61 2HB LEU 61 13.033 -13.450 -10.028 496 HB3 LEU 61 3HB LEU 61 13.752 -12.613 -8.654 497 HG LEU 61 HG LEU 61 15.361 -14.751 -9.934 498 HD11 LEU 61 1HD1 LEU 61 15.048 -12.028 -11.185 499 HD12 LEU 61 2HD1 LEU 61 14.361 -13.516 -11.836 500 HD13 LEU 61 3HD1 LEU 61 16.111 -13.330 -11.718 501 HD21 LEU 61 3HD2 LEU 61 15.734 -12.338 -8.311 502 HD22 LEU 61 1HD2 LEU 61 16.926 -12.555 -9.593 503 HD23 LEU 61 2HD2 LEU 61 16.690 -13.819 -8.386 504 H ARG 62 H ARG 62 11.119 -15.854 -8.815 505 HA ARG 62 HA ARG 62 12.380 -18.237 -9.918 506 HB2 ARG 62 2HB ARG 62 10.293 -18.053 -8.285 507 HB3 ARG 62 3HB ARG 62 9.419 -17.916 -9.804 508 HG2 ARG 62 2HG ARG 62 9.346 -20.153 -9.666 509 HG3 ARG 62 3HG ARG 62 10.976 -20.052 -10.335 510 HD2 ARG 62 2HD ARG 62 11.781 -21.037 -8.517 511 HD3 ARG 62 3HD ARG 62 11.171 -19.710 -7.529 512 HE ARG 62 HE ARG 62 8.991 -21.278 -7.904 513 HH11 ARG 62 1HH1 ARG 62 12.221 -21.873 -6.748 514 HH12 ARG 62 2HH1 ARG 62 11.747 -23.165 -5.696 515 HH21 ARG 62 1HH2 ARG 62 8.354 -22.978 -6.522 516 HH22 ARG 62 2HH2 ARG 62 9.547 -23.794 -5.569 517 H PHE 63 H PHE 63 13.012 -16.373 -11.624 518 HA PHE 63 HA PHE 63 11.251 -15.506 -13.560 519 HB2 PHE 63 2HB PHE 63 13.115 -14.722 -14.535 520 HB3 PHE 63 3HB PHE 63 14.005 -15.470 -13.213 521 HD1 PHE 63 HD2 PHE 63 12.459 -16.490 -16.456 522 HD2 PHE 63 HD1 PHE 63 15.770 -16.800 -13.798 523 HE1 PHE 63 HE2 PHE 63 13.610 -17.952 -18.066 524 HE2 PHE 63 HE1 PHE 63 16.926 -18.262 -15.405 525 HZ PHE 63 HZ PHE 63 15.846 -18.841 -17.541 526 H ASN 64 H ASN 64 12.656 -18.675 -13.122 527 HA ASN 64 HA ASN 64 12.444 -19.944 -15.477 528 HB2 ASN 64 2HB ASN 64 11.553 -20.880 -12.754 529 HB3 ASN 64 3HB ASN 64 11.527 -21.945 -14.156 530 HD21 ASN 64 1HD2 ASN 64 13.027 -23.239 -12.940 531 HD22 ASN 64 2HD2 ASN 64 14.707 -22.836 -12.947 532 H GLN 65 H GLN 65 9.733 -18.915 -13.482 533 HA GLN 65 HA GLN 65 7.862 -19.910 -15.514 534 HB2 GLN 65 2HB GLN 65 7.497 -19.081 -12.641 535 HB3 GLN 65 3HB GLN 65 6.134 -19.311 -13.728 536 HG2 GLN 65 2HG GLN 65 6.172 -21.396 -12.909 537 HG3 GLN 65 3HG GLN 65 7.433 -21.629 -14.118 538 HE21 GLN 65 1HE2 GLN 65 9.513 -21.951 -13.479 539 HE22 GLN 65 2HE2 GLN 65 9.989 -22.140 -11.829 540 H ALA 66 H ALA 66 5.838 -18.426 -15.696 541 HA ALA 66 HA ALA 66 6.510 -16.132 -17.060 542 HB1 ALA 66 1HB ALA 66 4.210 -15.569 -17.071 543 HB2 ALA 66 2HB ALA 66 4.292 -17.331 -17.061 544 HB3 ALA 66 3HB ALA 66 3.913 -16.458 -15.576 545 H ASP 67 H ASP 67 5.692 -13.865 -16.451 546 HA ASP 67 HA ASP 67 7.209 -12.498 -14.831 547 HB2 ASP 67 2HB ASP 67 5.412 -10.916 -14.341 548 HB3 ASP 67 3HB ASP 67 5.286 -11.496 -15.999 549 H TRP 68 H TRP 68 8.040 -12.890 -12.897 550 HA TRP 68 HA TRP 68 6.292 -14.025 -10.815 551 HB2 TRP 68 2HB TRP 68 8.605 -15.092 -11.728 552 HB3 TRP 68 3HB TRP 68 9.225 -14.086 -10.421 553 HD1 TRP 68 HD1 TRP 68 9.245 -15.201 -8.118 554 HE1 TRP 68 HE1 TRP 68 8.077 -17.224 -7.038 555 HE3 TRP 68 HE3 TRP 68 6.129 -16.486 -11.962 556 HZ2 TRP 68 HZ2 TRP 68 6.097 -19.115 -7.725 557 HZ3 TRP 68 HZ3 TRP 68 4.630 -18.415 -11.670 558 HH2 TRP 68 HH2 TRP 68 4.616 -19.701 -9.594 559 H THR 69 H THR 69 7.488 -13.495 -8.540 560 HA THR 69 HA THR 69 7.896 -10.576 -8.485 561 HB THR 69 HB THR 69 6.457 -10.262 -6.727 562 HG1 THR 69 HG1 THR 69 5.944 -11.899 -5.225 563 HG21 THR 69 3HG2 THR 69 5.030 -12.726 -7.585 564 HG22 THR 69 1HG2 THR 69 5.369 -11.502 -8.807 565 HG23 THR 69 2HG2 THR 69 4.423 -11.084 -7.378 566 H ILE 70 H ILE 70 9.440 -9.789 -7.100 567 HA ILE 70 HA ILE 70 10.993 -11.789 -5.592 568 HB ILE 70 HB ILE 70 12.291 -11.145 -7.519 569 HG12 ILE 70 2HG1 ILE 70 14.288 -10.260 -6.415 570 HG13 ILE 70 3HG1 ILE 70 13.310 -9.697 -5.064 571 HG21 ILE 70 1HG2 ILE 70 11.090 -8.605 -7.081 572 HG22 ILE 70 2HG2 ILE 70 12.842 -8.408 -7.052 573 HG23 ILE 70 3HG2 ILE 70 12.061 -9.145 -8.450 574 HD11 ILE 70 3HD1 ILE 70 13.350 -11.688 -4.086 575 HD12 ILE 70 1HD1 ILE 70 12.959 -12.528 -5.586 576 HD13 ILE 70 2HD1 ILE 70 14.631 -12.097 -5.226 577 H VAL 71 H VAL 71 11.040 -11.410 -3.485 578 HA VAL 71 HA VAL 71 10.256 -8.791 -2.473 579 HB VAL 71 HB VAL 71 10.280 -9.937 -0.241 580 HG11 VAL 71 1HG1 VAL 71 8.390 -11.662 -1.183 581 HG12 VAL 71 2HG1 VAL 71 8.127 -9.945 -0.870 582 HG13 VAL 71 3HG1 VAL 71 8.505 -10.497 -2.502 583 HG21 VAL 71 3HG2 VAL 71 10.698 -12.430 -1.887 584 HG22 VAL 71 1HG2 VAL 71 11.917 -11.686 -0.851 585 HG23 VAL 71 2HG2 VAL 71 10.442 -12.346 -0.144 586 H VAL 72 H VAL 72 11.599 -7.379 -1.525 587 HA VAL 72 HA VAL 72 14.362 -8.255 -0.983 588 HB VAL 72 HB VAL 72 13.684 -5.438 -1.773 589 HG11 VAL 72 1HG1 VAL 72 15.939 -5.134 -2.008 590 HG12 VAL 72 2HG1 VAL 72 15.926 -6.349 -0.728 591 HG13 VAL 72 3HG1 VAL 72 16.239 -6.828 -2.396 592 HG21 VAL 72 3HG2 VAL 72 12.978 -6.307 -3.741 593 HG22 VAL 72 1HG2 VAL 72 14.710 -6.408 -4.055 594 HG23 VAL 72 2HG2 VAL 72 13.831 -7.832 -3.499 595 H ARG 73 H ARG 73 15.007 -8.003 1.048 596 HA ARG 73 HA ARG 73 13.399 -6.319 2.832 597 HB2 ARG 73 2HB ARG 73 14.639 -7.585 4.644 598 HB3 ARG 73 3HB ARG 73 13.541 -8.536 3.654 599 HG2 ARG 73 2HG ARG 73 15.177 -9.863 2.950 600 HG3 ARG 73 3HG ARG 73 16.224 -8.496 2.565 601 HD2 ARG 73 2HD ARG 73 17.199 -9.971 4.276 602 HD3 ARG 73 3HD ARG 73 16.921 -8.337 4.877 603 HE ARG 73 HE ARG 73 14.674 -9.826 5.523 604 HH11 ARG 73 1HH1 ARG 73 18.075 -9.831 6.264 605 HH12 ARG 73 2HH1 ARG 73 17.864 -10.522 7.839 606 HH21 ARG 73 1HH2 ARG 73 14.382 -10.737 7.594 607 HH22 ARG 73 2HH2 ARG 73 15.763 -11.038 8.594 608 H LYS 74 H LYS 74 14.156 -4.320 3.057 609 HA LYS 74 HA LYS 74 16.804 -3.524 2.508 610 HB2 LYS 74 2HB LYS 74 14.378 -2.258 3.643 611 HB3 LYS 74 3HB LYS 74 15.911 -1.495 4.045 612 HG2 LYS 74 2HG LYS 74 16.231 -1.813 1.395 613 HG3 LYS 74 3HG LYS 74 14.477 -1.635 1.479 614 HD2 LYS 74 2HD LYS 74 14.956 0.568 1.400 615 HD3 LYS 74 3HD LYS 74 15.254 0.361 3.127 616 HE2 LYS 74 2HE LYS 74 17.620 -0.379 1.768 617 HE3 LYS 74 3HE LYS 74 17.072 1.144 1.069 618 HZ1 LYS 74 3HZ LYS 74 17.463 0.646 3.971 619 HZ2 LYS 74 1HZ LYS 74 17.012 2.114 3.261 620 HZ3 LYS 74 2HZ LYS 74 18.549 1.472 2.971 621 H LYS 75 H LYS 75 18.368 -2.624 3.992 622 HA LYS 75 HA LYS 75 18.239 -2.935 6.783 623 HB2 LYS 75 2HB LYS 75 18.665 -5.363 5.459 624 HB3 LYS 75 3HB LYS 75 20.254 -4.879 6.037 625 HG2 LYS 75 2HG LYS 75 18.136 -4.573 8.024 626 HG3 LYS 75 3HG LYS 75 18.389 -6.236 7.489 627 HD2 LYS 75 2HD LYS 75 19.894 -6.094 9.224 628 HD3 LYS 75 3HD LYS 75 20.915 -5.652 7.854 629 HE2 LYS 75 2HE LYS 75 21.072 -3.476 8.499 630 HE3 LYS 75 3HE LYS 75 19.466 -3.461 9.225 631 HZ1 LYS 75 3HZ LYS 75 20.254 -4.431 11.168 632 HZ2 LYS 75 1HZ LYS 75 21.477 -3.334 10.765 633 HZ3 LYS 75 2HZ LYS 75 21.682 -4.983 10.448 634 H ALA 76 H ALA 76 20.260 -2.862 3.904 635 HA ALA 76 HA ALA 76 22.218 -1.802 3.420 636 HB1 ALA 76 1HB ALA 76 21.975 0.241 5.498 637 HB2 ALA 76 2HB ALA 76 22.072 0.409 3.744 638 HB3 ALA 76 3HB ALA 76 20.527 0.043 4.511 Start of MODEL 19 1 H1 MET 1 H MET 1 1.753 0.755 0.314 2 HA MET 1 HA MET 1 1.891 -0.249 -2.445 3 HB2 MET 1 2HB MET 1 2.919 2.018 -3.027 4 HB3 MET 1 3HB MET 1 1.179 1.968 -2.781 5 HG2 MET 1 2HG MET 1 1.384 2.931 -0.610 6 HG3 MET 1 3HG MET 1 3.140 2.788 -0.657 7 HE1 MET 1 3HE MET 1 4.637 4.858 -2.649 8 HE2 MET 1 1HE MET 1 4.209 5.995 -1.371 9 HE3 MET 1 2HE MET 1 4.507 4.301 -0.980 10 H LYS 2 H LYS 2 3.277 -1.782 -1.120 11 HA LYS 2 HA LYS 2 5.996 -0.683 -0.825 12 HB2 LYS 2 2HB LYS 2 6.336 -2.777 0.629 13 HB3 LYS 2 3HB LYS 2 5.400 -1.450 1.304 14 HG2 LYS 2 2HG LYS 2 3.329 -2.637 0.671 15 HG3 LYS 2 3HG LYS 2 4.312 -3.990 0.108 16 HD2 LYS 2 2HD LYS 2 5.326 -3.738 2.563 17 HD3 LYS 2 3HD LYS 2 3.715 -3.085 2.868 18 HE2 LYS 2 2HE LYS 2 2.976 -5.240 1.532 19 HE3 LYS 2 3HE LYS 2 4.542 -5.835 2.082 20 HZ1 LYS 2 3HZ LYS 2 3.575 -6.317 4.000 21 HZ2 LYS 2 1HZ LYS 2 2.129 -5.572 3.536 22 HZ3 LYS 2 2HZ LYS 2 3.346 -4.664 4.280 23 H ARG 3 H ARG 3 4.712 -1.666 -3.278 24 HA ARG 3 HA ARG 3 6.744 -3.649 -3.980 25 HB2 ARG 3 2HB ARG 3 5.141 -5.048 -5.161 26 HB3 ARG 3 3HB ARG 3 4.698 -4.920 -3.464 27 HG2 ARG 3 2HG ARG 3 3.451 -2.920 -5.207 28 HG3 ARG 3 3HG ARG 3 2.989 -4.591 -5.539 29 HD2 ARG 3 2HD ARG 3 3.016 -4.061 -2.702 30 HD3 ARG 3 3HD ARG 3 1.974 -2.918 -3.549 31 HE ARG 3 HE ARG 3 1.468 -5.554 -4.439 32 HH11 ARG 3 1HH1 ARG 3 0.954 -3.436 -1.724 33 HH12 ARG 3 2HH1 ARG 3 -0.493 -4.237 -1.207 34 HH21 ARG 3 1HH2 ARG 3 -0.436 -6.616 -3.768 35 HH22 ARG 3 2HH2 ARG 3 -1.282 -6.046 -2.370 36 H PHE 4 H PHE 4 7.092 -3.831 -6.301 37 HA PHE 4 HA PHE 4 6.154 -1.480 -7.803 38 HB2 PHE 4 2HB PHE 4 8.755 -1.860 -6.912 39 HB3 PHE 4 3HB PHE 4 8.809 -2.389 -8.590 40 HD1 PHE 4 HD2 PHE 4 6.961 0.351 -6.861 41 HD2 PHE 4 HD1 PHE 4 9.754 -0.744 -9.880 42 HE1 PHE 4 HE2 PHE 4 7.086 2.697 -7.591 43 HE2 PHE 4 HE1 PHE 4 9.884 1.600 -10.615 44 HZ PHE 4 HZ PHE 4 8.548 3.324 -9.471 45 H ASP 5 H ASP 5 5.023 -2.108 -9.506 46 HA ASP 5 HA ASP 5 5.414 -4.776 -10.613 47 HB2 ASP 5 2HB ASP 5 3.190 -3.003 -10.323 48 HB3 ASP 5 3HB ASP 5 3.407 -3.354 -12.036 49 H LEU 6 H LEU 6 7.308 -4.633 -11.782 50 HA LEU 6 HA LEU 6 7.652 -2.536 -13.751 51 HB2 LEU 6 2HB LEU 6 9.312 -4.888 -12.896 52 HB3 LEU 6 3HB LEU 6 9.740 -3.902 -14.293 53 HG LEU 6 HG LEU 6 11.050 -3.170 -12.441 54 HD11 LEU 6 1HD1 LEU 6 8.976 -1.055 -12.401 55 HD12 LEU 6 2HD1 LEU 6 9.656 -1.500 -13.966 56 HD13 LEU 6 3HD1 LEU 6 10.715 -0.937 -12.673 57 HD21 LEU 6 3HD2 LEU 6 10.238 -2.637 -10.312 58 HD22 LEU 6 1HD2 LEU 6 9.394 -4.124 -10.743 59 HD23 LEU 6 2HD2 LEU 6 8.565 -2.572 -10.867 60 H ARG 7 H ARG 7 5.740 -5.107 -13.728 61 HA ARG 7 HA ARG 7 6.253 -6.688 -15.915 62 HB2 ARG 7 2HB ARG 7 3.963 -6.027 -14.310 63 HB3 ARG 7 3HB ARG 7 3.484 -6.134 -15.999 64 HG2 ARG 7 2HG ARG 7 4.001 -8.366 -16.149 65 HG3 ARG 7 3HG ARG 7 5.168 -8.293 -14.827 66 HD2 ARG 7 2HD ARG 7 3.504 -9.294 -13.676 67 HD3 ARG 7 3HD ARG 7 2.927 -7.638 -13.498 68 HE ARG 7 HE ARG 7 1.789 -8.494 -15.819 69 HH11 ARG 7 1HH1 ARG 7 1.855 -9.679 -12.546 70 HH12 ARG 7 2HH1 ARG 7 0.291 -10.418 -12.645 71 HH21 ARG 7 1HH2 ARG 7 -0.271 -9.463 -15.961 72 HH22 ARG 7 2HH2 ARG 7 -0.917 -10.295 -14.587 73 HA PRO 8 HA PRO 8 4.027 -3.545 -18.825 74 HB2 PRO 8 2HB PRO 8 3.417 -1.104 -17.803 75 HB3 PRO 8 3HB PRO 8 2.315 -2.484 -17.719 76 HG2 PRO 8 2HG PRO 8 4.162 -1.404 -15.625 77 HG3 PRO 8 3HG PRO 8 2.488 -1.964 -15.459 78 HD2 PRO 8 2HD PRO 8 4.611 -3.496 -14.769 79 HD3 PRO 8 3HD PRO 8 3.103 -4.185 -15.403 80 H LEU 9 H LEU 9 6.587 -2.876 -16.709 81 HA LEU 9 HA LEU 9 7.638 -0.610 -18.158 82 HB2 LEU 9 2HB LEU 9 8.101 -1.863 -15.645 83 HB3 LEU 9 3HB LEU 9 9.626 -1.808 -16.528 84 HG LEU 9 HG LEU 9 8.517 0.749 -16.790 85 HD11 LEU 9 1HD1 LEU 9 8.544 1.094 -14.126 86 HD12 LEU 9 2HD1 LEU 9 7.818 -0.510 -14.218 87 HD13 LEU 9 3HD1 LEU 9 7.071 0.845 -15.063 88 HD21 LEU 9 3HD2 LEU 9 10.520 0.260 -14.672 89 HD22 LEU 9 1HD2 LEU 9 10.548 1.390 -16.026 90 HD23 LEU 9 2HD2 LEU 9 10.924 -0.313 -16.292 91 H LYS 10 H LYS 10 9.926 -0.696 -18.974 92 HA LYS 10 HA LYS 10 10.258 -3.119 -20.597 93 HB2 LYS 10 2HB LYS 10 11.481 -1.793 -22.153 94 HB3 LYS 10 3HB LYS 10 10.051 -0.869 -21.713 95 HG2 LYS 10 2HG LYS 10 11.431 0.421 -20.113 96 HG3 LYS 10 3HG LYS 10 12.853 -0.450 -20.694 97 HD2 LYS 10 2HD LYS 10 12.982 1.388 -22.037 98 HD3 LYS 10 3HD LYS 10 11.932 0.385 -23.041 99 HE2 LYS 10 2HE LYS 10 10.527 2.011 -21.045 100 HE3 LYS 10 3HE LYS 10 11.387 2.942 -22.270 101 HZ1 LYS 10 3HZ LYS 10 10.042 0.863 -23.559 102 HZ2 LYS 10 1HZ LYS 10 9.745 2.524 -23.671 103 HZ3 LYS 10 2HZ LYS 10 8.939 1.598 -22.508 104 H ALA 11 H ALA 11 12.469 -3.869 -21.014 105 HA ALA 11 HA ALA 11 13.901 -4.252 -18.594 106 HB1 ALA 11 1HB ALA 11 13.731 -5.805 -20.637 107 HB2 ALA 11 2HB ALA 11 15.044 -4.833 -21.303 108 HB3 ALA 11 3HB ALA 11 15.273 -5.705 -19.787 109 H GLY 12 H GLY 12 15.992 -3.565 -18.023 110 HA2 GLY 12 2HA GLY 12 17.958 -2.280 -18.275 111 HA3 GLY 12 3HA GLY 12 17.209 -1.443 -19.627 112 H ILE 13 H ILE 13 14.780 -0.731 -18.369 113 HA ILE 13 HA ILE 13 15.776 1.381 -16.595 114 HB ILE 13 HB ILE 13 13.099 1.209 -17.981 115 HG12 ILE 13 2HG1 ILE 13 15.509 2.869 -18.744 116 HG13 ILE 13 3HG1 ILE 13 15.054 1.366 -19.539 117 HG21 ILE 13 1HG2 ILE 13 13.710 3.855 -17.429 118 HG22 ILE 13 2HG2 ILE 13 12.554 2.840 -16.568 119 HG23 ILE 13 3HG2 ILE 13 14.211 2.982 -15.982 120 HD11 ILE 13 3HD1 ILE 13 12.770 2.587 -19.875 121 HD12 ILE 13 1HD1 ILE 13 13.748 4.035 -19.637 122 HD13 ILE 13 2HD1 ILE 13 14.134 2.916 -20.944 123 H PHE 14 H PHE 14 13.928 -1.492 -16.591 124 HA PHE 14 HA PHE 14 12.226 -0.925 -14.388 125 HB2 PHE 14 2HB PHE 14 11.547 -3.142 -14.522 126 HB3 PHE 14 3HB PHE 14 12.098 -2.834 -16.165 127 HD1 PHE 14 HD1 PHE 14 14.647 -3.380 -16.580 128 HD2 PHE 14 HD2 PHE 14 12.273 -5.044 -13.464 129 HE1 PHE 14 HE1 PHE 14 16.200 -5.281 -16.417 130 HE2 PHE 14 HE2 PHE 14 13.823 -6.947 -13.294 131 HZ PHE 14 HZ PHE 14 15.790 -7.067 -14.771 132 H GLU 15 H GLU 15 15.498 -2.114 -14.698 133 HA GLU 15 HA GLU 15 15.698 -2.881 -11.922 134 HB2 GLU 15 2HB GLU 15 17.007 -4.152 -13.462 135 HB3 GLU 15 3HB GLU 15 17.711 -2.700 -14.160 136 HG2 GLU 15 2HG GLU 15 18.190 -2.963 -11.297 137 HG3 GLU 15 3HG GLU 15 18.867 -4.279 -12.255 138 H ARG 16 H ARG 16 16.207 -0.047 -13.813 139 HA ARG 16 HA ARG 16 17.938 1.234 -11.884 140 HB2 ARG 16 2HB ARG 16 16.845 1.888 -14.555 141 HB3 ARG 16 3HB ARG 16 17.153 3.256 -13.494 142 HG2 ARG 16 2HG ARG 16 19.391 3.027 -13.622 143 HG3 ARG 16 3HG ARG 16 19.315 1.265 -13.689 144 HD2 ARG 16 2HD ARG 16 19.583 1.324 -15.891 145 HD3 ARG 16 3HD ARG 16 18.126 2.305 -16.053 146 HE ARG 16 HE ARG 16 20.206 3.991 -15.279 147 HH11 ARG 16 1HH1 ARG 16 19.309 2.005 -17.994 148 HH12 ARG 16 2HH1 ARG 16 20.136 2.991 -19.155 149 HH21 ARG 16 1HH2 ARG 16 21.298 5.297 -16.797 150 HH22 ARG 16 2HH2 ARG 16 21.267 4.862 -18.473 151 H LEU 17 H LEU 17 14.558 1.449 -12.907 152 HA LEU 17 HA LEU 17 13.874 3.622 -11.222 153 HB2 LEU 17 2HB LEU 17 12.589 1.976 -13.139 154 HB3 LEU 17 3HB LEU 17 11.617 1.944 -11.669 155 HG LEU 17 HG LEU 17 10.820 3.658 -13.188 156 HD11 LEU 17 1HD1 LEU 17 10.606 5.384 -11.642 157 HD12 LEU 17 2HD1 LEU 17 12.214 5.114 -10.971 158 HD13 LEU 17 3HD1 LEU 17 10.917 3.966 -10.641 159 HD21 LEU 17 3HD2 LEU 17 13.163 3.987 -14.193 160 HD22 LEU 17 1HD2 LEU 17 13.414 5.127 -12.870 161 HD23 LEU 17 2HD2 LEU 17 12.116 5.399 -14.034 162 H GLU 18 H GLU 18 14.211 0.216 -10.701 163 HA GLU 18 HA GLU 18 12.577 -0.183 -8.488 164 HB2 GLU 18 2HB GLU 18 14.391 -1.701 -9.885 165 HB3 GLU 18 3HB GLU 18 15.173 -1.536 -8.319 166 HG2 GLU 18 2HG GLU 18 13.851 -3.080 -7.458 167 HG3 GLU 18 3HG GLU 18 12.422 -2.153 -7.912 168 H GLU 19 H GLU 19 15.613 1.481 -8.765 169 HA GLU 19 HA GLU 19 16.160 1.514 -5.942 170 HB2 GLU 19 2HB GLU 19 18.050 1.640 -7.384 171 HB3 GLU 19 3HB GLU 19 17.354 2.972 -8.295 172 HG2 GLU 19 2HG GLU 19 17.672 3.556 -5.459 173 HG3 GLU 19 3HG GLU 19 19.189 3.192 -6.279 174 H LEU 20 H LEU 20 14.435 3.502 -8.208 175 HA LEU 20 HA LEU 20 14.373 5.894 -6.703 176 HB2 LEU 20 2HB LEU 20 13.203 4.868 -9.119 177 HB3 LEU 20 3HB LEU 20 11.989 5.729 -8.174 178 HG LEU 20 HG LEU 20 14.048 7.500 -8.117 179 HD11 LEU 20 1HD1 LEU 20 15.430 6.166 -9.604 180 HD12 LEU 20 2HD1 LEU 20 14.932 7.660 -10.396 181 HD13 LEU 20 3HD1 LEU 20 14.140 6.139 -10.807 182 HD21 LEU 20 3HD2 LEU 20 12.029 7.358 -10.346 183 HD22 LEU 20 1HD2 LEU 20 12.761 8.797 -9.637 184 HD23 LEU 20 2HD2 LEU 20 11.626 7.830 -8.695 185 H ILE 21 H ILE 21 12.447 2.974 -6.641 186 HA ILE 21 HA ILE 21 10.524 4.133 -4.790 187 HB ILE 21 HB ILE 21 9.718 2.590 -6.523 188 HG12 ILE 21 2HG1 ILE 21 8.443 1.054 -4.998 189 HG13 ILE 21 3HG1 ILE 21 9.462 1.608 -3.674 190 HG21 ILE 21 1HG2 ILE 21 11.336 0.498 -5.075 191 HG22 ILE 21 2HG2 ILE 21 10.245 0.217 -6.430 192 HG23 ILE 21 3HG2 ILE 21 11.710 1.170 -6.661 193 HD11 ILE 21 3HD1 ILE 21 7.075 2.674 -4.298 194 HD12 ILE 21 1HD1 ILE 21 8.366 3.554 -3.480 195 HD13 ILE 21 2HD1 ILE 21 8.145 3.728 -5.222 196 H GLU 22 H GLU 22 13.231 1.900 -4.795 197 HA GLU 22 HA GLU 22 12.908 0.708 -2.307 198 HB2 GLU 22 2HB GLU 22 14.773 0.538 -4.255 199 HB3 GLU 22 3HB GLU 22 15.671 1.457 -3.055 200 HG2 GLU 22 2HG GLU 22 16.146 -0.432 -2.018 201 HG3 GLU 22 3HG GLU 22 14.432 -0.637 -1.663 202 H LYS 23 H LYS 23 13.862 3.934 -3.125 203 HA LYS 23 HA LYS 23 15.153 4.629 -0.707 204 HB2 LYS 23 2HB LYS 23 14.180 6.004 -3.094 205 HB3 LYS 23 3HB LYS 23 14.023 6.975 -1.636 206 HG2 LYS 23 2HG LYS 23 16.598 5.748 -1.663 207 HG3 LYS 23 3HG LYS 23 16.317 6.552 -3.209 208 HD2 LYS 23 2HD LYS 23 15.631 8.589 -1.931 209 HD3 LYS 23 3HD LYS 23 16.142 7.768 -0.454 210 HE2 LYS 23 2HE LYS 23 18.097 7.830 -2.669 211 HE3 LYS 23 3HE LYS 23 17.745 9.375 -1.895 212 HZ1 LYS 23 3HZ LYS 23 18.101 7.930 0.255 213 HZ2 LYS 23 1HZ LYS 23 19.407 8.632 -0.559 214 HZ3 LYS 23 2HZ LYS 23 19.045 6.997 -0.795 215 H GLU 24 H GLU 24 11.789 4.670 -1.737 216 HA GLU 24 HA GLU 24 10.834 6.065 0.569 217 HB2 GLU 24 2HB GLU 24 9.775 5.475 -1.880 218 HB3 GLU 24 3HB GLU 24 8.928 4.331 -0.849 219 HG2 GLU 24 2HG GLU 24 9.011 6.995 0.294 220 HG3 GLU 24 3HG GLU 24 8.243 6.962 -1.292 221 H MET 25 H MET 25 11.087 2.674 -0.381 222 HA MET 25 HA MET 25 9.616 1.473 1.624 223 HB2 MET 25 2HB MET 25 12.226 0.455 0.489 224 HB3 MET 25 3HB MET 25 10.977 -0.511 1.263 225 HG2 MET 25 2HG MET 25 10.702 0.996 -1.327 226 HG3 MET 25 3HG MET 25 10.905 -0.745 -1.149 227 HE1 MET 25 3HE MET 25 8.127 -2.317 -0.131 228 HE2 MET 25 1HE MET 25 9.594 -1.843 0.727 229 HE3 MET 25 2HE MET 25 8.017 -1.326 1.325 230 H GLN 26 H GLN 26 10.054 0.732 3.694 231 HA GLN 26 HA GLN 26 11.714 2.360 5.290 232 HB2 GLN 26 2HB GLN 26 9.840 0.173 5.692 233 HB3 GLN 26 3HB GLN 26 11.208 0.074 6.792 234 HG2 GLN 26 2HG GLN 26 10.567 2.705 6.975 235 HG3 GLN 26 3HG GLN 26 8.985 1.975 6.709 236 HE21 GLN 26 1HE2 GLN 26 8.297 0.313 8.174 237 HE22 GLN 26 2HE2 GLN 26 8.880 0.300 9.799 238 HA PRO 27 HA PRO 27 15.626 0.377 5.309 239 HB2 PRO 27 2HB PRO 27 16.343 0.481 7.925 240 HB3 PRO 27 3HB PRO 27 16.298 1.909 6.884 241 HG2 PRO 27 2HG PRO 27 14.275 0.950 8.871 242 HG3 PRO 27 3HG PRO 27 14.861 2.598 8.578 243 HD2 PRO 27 2HD PRO 27 12.499 1.698 7.607 244 HD3 PRO 27 3HD PRO 27 13.490 2.895 6.749 245 H ASN 28 H ASN 28 12.985 -1.037 6.849 246 HA ASN 28 HA ASN 28 14.338 -3.619 6.896 247 HB2 ASN 28 2HB ASN 28 14.120 -2.299 9.248 248 HB3 ASN 28 3HB ASN 28 12.575 -3.145 9.225 249 HD21 ASN 28 1HD2 ASN 28 12.777 -5.514 8.594 250 HD22 ASN 28 2HD2 ASN 28 14.065 -6.390 9.342 251 H GLU 29 H GLU 29 12.401 -2.452 5.129 252 HA GLU 29 HA GLU 29 10.030 -4.097 5.715 253 HB2 GLU 29 2HB GLU 29 10.360 -1.410 4.627 254 HB3 GLU 29 3HB GLU 29 9.343 -2.426 3.614 255 HG2 GLU 29 2HG GLU 29 8.877 -2.221 6.563 256 HG3 GLU 29 3HG GLU 29 8.235 -1.019 5.445 257 H VAL 30 H VAL 30 8.933 -4.996 3.760 258 HA VAL 30 HA VAL 30 10.946 -6.185 2.004 259 HB VAL 30 HB VAL 30 9.134 -7.509 3.326 260 HG11 VAL 30 1HG1 VAL 30 7.012 -7.710 2.414 261 HG12 VAL 30 2HG1 VAL 30 7.336 -5.983 2.254 262 HG13 VAL 30 3HG1 VAL 30 7.508 -7.047 0.857 263 HG21 VAL 30 3HG2 VAL 30 9.881 -7.958 0.449 264 HG22 VAL 30 1HG2 VAL 30 10.598 -8.671 1.894 265 HG23 VAL 30 2HG2 VAL 30 8.977 -9.146 1.387 266 H ALA 31 H ALA 31 10.832 -6.119 -0.226 267 HA ALA 31 HA ALA 31 8.810 -4.325 -1.391 268 HB1 ALA 31 1HB ALA 31 11.116 -3.279 -1.051 269 HB2 ALA 31 2HB ALA 31 11.655 -4.349 -2.346 270 HB3 ALA 31 3HB ALA 31 10.394 -3.155 -2.656 271 H ILE 32 H ILE 32 7.615 -5.504 -2.729 272 HA ILE 32 HA ILE 32 8.780 -7.807 -4.089 273 HB ILE 32 HB ILE 32 5.953 -6.858 -3.713 274 HG12 ILE 32 2HG1 ILE 32 6.597 -9.654 -3.204 275 HG13 ILE 32 3HG1 ILE 32 7.609 -8.559 -2.267 276 HG21 ILE 32 1HG2 ILE 32 7.043 -8.700 -5.771 277 HG22 ILE 32 2HG2 ILE 32 5.516 -9.126 -5.001 278 HG23 ILE 32 3HG2 ILE 32 5.674 -7.591 -5.854 279 HD11 ILE 32 3HD1 ILE 32 5.186 -9.435 -1.488 280 HD12 ILE 32 1HD1 ILE 32 5.912 -7.920 -0.951 281 HD13 ILE 32 2HD1 ILE 32 4.745 -7.919 -2.273 282 H PHE 33 H PHE 33 9.798 -7.363 -5.934 283 HA PHE 33 HA PHE 33 8.671 -5.324 -7.723 284 HB2 PHE 33 2HB PHE 33 11.413 -6.591 -7.845 285 HB3 PHE 33 3HB PHE 33 10.851 -5.194 -8.758 286 HD1 PHE 33 HD2 PHE 33 9.448 -3.708 -6.596 287 HD2 PHE 33 HD1 PHE 33 13.198 -5.720 -6.628 288 HE1 PHE 33 HE2 PHE 33 10.259 -2.217 -4.814 289 HE2 PHE 33 HE1 PHE 33 14.015 -4.233 -4.846 290 HZ PHE 33 HZ PHE 33 12.545 -2.478 -3.937 291 H MET 34 H MET 34 7.223 -6.269 -9.035 292 HA MET 34 HA MET 34 7.612 -8.945 -10.043 293 HB2 MET 34 2HB MET 34 5.373 -7.850 -9.424 294 HB3 MET 34 3HB MET 34 5.501 -7.005 -10.961 295 HG2 MET 34 2HG MET 34 4.679 -8.754 -12.024 296 HG3 MET 34 3HG MET 34 5.979 -9.771 -11.407 297 HE1 MET 34 3HE MET 34 2.069 -9.032 -9.088 298 HE2 MET 34 1HE MET 34 3.519 -8.083 -8.760 299 HE3 MET 34 2HE MET 34 2.737 -7.981 -10.337 300 H PHE 35 H PHE 35 8.521 -9.501 -11.915 301 HA PHE 35 HA PHE 35 8.821 -7.461 -14.008 302 HB2 PHE 35 2HB PHE 35 11.111 -8.112 -14.418 303 HB3 PHE 35 3HB PHE 35 10.944 -7.684 -12.719 304 HD1 PHE 35 HD1 PHE 35 10.338 -9.746 -11.154 305 HD2 PHE 35 HD2 PHE 35 12.280 -10.013 -14.932 306 HE1 PHE 35 HE1 PHE 35 11.281 -11.925 -10.511 307 HE2 PHE 35 HE2 PHE 35 13.226 -12.193 -14.295 308 HZ PHE 35 HZ PHE 35 12.726 -13.153 -12.083 309 H GLU 36 H GLU 36 8.170 -8.137 -15.943 310 HA GLU 36 HA GLU 36 7.874 -11.038 -16.370 311 HB2 GLU 36 2HB GLU 36 5.979 -10.606 -17.754 312 HB3 GLU 36 3HB GLU 36 5.755 -9.693 -16.269 313 HG2 GLU 36 2HG GLU 36 5.353 -7.927 -17.541 314 HG3 GLU 36 3HG GLU 36 7.069 -7.929 -17.945 315 H VAL 37 H VAL 37 9.888 -8.648 -17.107 316 HA VAL 37 HA VAL 37 10.645 -9.879 -19.641 317 HB VAL 37 HB VAL 37 10.765 -6.911 -19.608 318 HG11 VAL 37 1HG1 VAL 37 11.195 -7.201 -21.774 319 HG12 VAL 37 2HG1 VAL 37 11.298 -8.930 -21.433 320 HG13 VAL 37 3HG1 VAL 37 9.779 -8.228 -21.991 321 HG21 VAL 37 3HG2 VAL 37 8.528 -7.090 -18.899 322 HG22 VAL 37 1HG2 VAL 37 8.443 -6.896 -20.650 323 HG23 VAL 37 2HG2 VAL 37 8.227 -8.490 -19.928 324 H GLY 38 H GLY 38 12.653 -8.099 -20.355 325 HA2 GLY 38 2HA GLY 38 14.876 -7.698 -19.944 326 HA3 GLY 38 3HA GLY 38 14.353 -7.221 -18.336 327 H ASP 39 H ASP 39 16.738 -8.241 -18.320 328 HA ASP 39 HA ASP 39 16.904 -11.074 -18.217 329 HB2 ASP 39 2HB ASP 39 18.681 -8.828 -17.319 330 HB3 ASP 39 3HB ASP 39 19.055 -10.488 -16.865 331 H PHE 40 H PHE 40 17.299 -12.383 -16.329 332 HA PHE 40 HA PHE 40 15.568 -11.606 -14.122 333 HB2 PHE 40 2HB PHE 40 16.768 -14.190 -13.759 334 HB3 PHE 40 3HB PHE 40 15.077 -13.786 -14.038 335 HD1 PHE 40 HD1 PHE 40 18.214 -14.845 -15.581 336 HD2 PHE 40 HD2 PHE 40 14.123 -13.885 -16.255 337 HE1 PHE 40 HE1 PHE 40 18.342 -15.881 -17.809 338 HE2 PHE 40 HE2 PHE 40 14.244 -14.920 -18.484 339 HZ PHE 40 HZ PHE 40 16.355 -15.920 -19.263 340 H SER 41 H SER 41 18.942 -12.254 -14.788 341 HA SER 41 HA SER 41 19.799 -12.360 -12.078 342 HB2 SER 41 2HB SER 41 21.848 -12.782 -12.950 343 HB3 SER 41 3HB SER 41 20.972 -12.946 -14.472 344 HG SER 41 HG SER 41 21.642 -10.988 -15.092 345 H ASN 42 H ASN 42 18.722 -9.827 -14.011 346 HA ASN 42 HA ASN 42 20.362 -7.753 -12.865 347 HB2 ASN 42 2HB ASN 42 18.380 -7.971 -14.981 348 HB3 ASN 42 3HB ASN 42 18.122 -6.536 -13.994 349 HD21 ASN 42 1HD2 ASN 42 19.023 -6.801 -16.764 350 HD22 ASN 42 2HD2 ASN 42 20.546 -5.989 -16.844 351 H ILE 43 H ILE 43 17.394 -9.337 -12.099 352 HA ILE 43 HA ILE 43 15.965 -7.489 -10.670 353 HB ILE 43 HB ILE 43 16.382 -10.426 -10.246 354 HG12 ILE 43 2HG1 ILE 43 14.943 -9.457 -12.096 355 HG13 ILE 43 3HG1 ILE 43 14.141 -10.608 -11.033 356 HG21 ILE 43 1HG2 ILE 43 14.373 -10.115 -8.597 357 HG22 ILE 43 2HG2 ILE 43 16.032 -9.925 -8.032 358 HG23 ILE 43 3HG2 ILE 43 15.056 -8.502 -8.395 359 HD11 ILE 43 3HD1 ILE 43 12.681 -9.089 -10.299 360 HD12 ILE 43 1HD1 ILE 43 13.901 -7.821 -10.185 361 HD13 ILE 43 2HD1 ILE 43 13.151 -8.187 -11.739 362 HA PRO 44 HA PRO 44 18.623 -8.410 -6.729 363 HB2 PRO 44 2HB PRO 44 20.973 -9.715 -7.112 364 HB3 PRO 44 3HB PRO 44 19.452 -10.553 -6.785 365 HG2 PRO 44 2HG PRO 44 20.835 -10.089 -9.399 366 HG3 PRO 44 3HG PRO 44 20.044 -11.558 -8.797 367 HD2 PRO 44 2HD PRO 44 18.851 -9.874 -10.551 368 HD3 PRO 44 3HD PRO 44 17.937 -10.795 -9.339 369 H LYS 45 H LYS 45 19.984 -7.540 -9.791 370 HA LYS 45 HA LYS 45 22.251 -6.120 -8.812 371 HB2 LYS 45 2HB LYS 45 21.506 -6.973 -11.262 372 HB3 LYS 45 3HB LYS 45 21.037 -5.282 -11.381 373 HG2 LYS 45 2HG LYS 45 23.611 -5.319 -10.250 374 HG3 LYS 45 3HG LYS 45 23.630 -6.457 -11.600 375 HD2 LYS 45 2HD LYS 45 22.463 -4.580 -12.920 376 HD3 LYS 45 3HD LYS 45 23.003 -3.521 -11.615 377 HE2 LYS 45 2HE LYS 45 25.320 -4.667 -12.078 378 HE3 LYS 45 3HE LYS 45 24.601 -5.005 -13.652 379 HZ1 LYS 45 3HZ LYS 45 25.882 -2.734 -13.019 380 HZ2 LYS 45 1HZ LYS 45 24.275 -2.283 -12.743 381 HZ3 LYS 45 2HZ LYS 45 24.741 -2.870 -14.259 382 H SER 46 H SER 46 18.892 -5.366 -9.196 383 HA SER 46 HA SER 46 19.134 -2.534 -9.205 384 HB2 SER 46 2HB SER 46 16.667 -3.660 -8.050 385 HB3 SER 46 3HB SER 46 16.875 -2.537 -9.394 386 HG SER 46 HG SER 46 16.141 -4.391 -10.299 387 H ALA 47 H ALA 47 18.228 -4.834 -6.637 388 HA ALA 47 HA ALA 47 18.045 -2.975 -4.558 389 HB1 ALA 47 1HB ALA 47 17.447 -5.544 -4.715 390 HB2 ALA 47 2HB ALA 47 19.029 -5.712 -3.952 391 HB3 ALA 47 3HB ALA 47 17.768 -4.762 -3.167 392 H GLU 48 H GLU 48 20.804 -4.405 -6.087 393 HA GLU 48 HA GLU 48 22.659 -3.877 -3.973 394 HB2 GLU 48 2HB GLU 48 22.938 -5.602 -5.811 395 HB3 GLU 48 3HB GLU 48 23.310 -4.268 -6.893 396 HG2 GLU 48 2HG GLU 48 24.900 -4.096 -4.507 397 HG3 GLU 48 3HG GLU 48 25.075 -5.681 -5.259 398 H PHE 49 H PHE 49 21.369 -2.079 -6.646 399 HA PHE 49 HA PHE 49 23.343 -0.141 -6.988 400 HB2 PHE 49 2HB PHE 49 20.769 -0.597 -7.968 401 HB3 PHE 49 3HB PHE 49 20.674 0.981 -7.194 402 HD1 PHE 49 HD2 PHE 49 22.190 2.805 -7.933 403 HD2 PHE 49 HD1 PHE 49 21.914 -0.901 -10.009 404 HE1 PHE 49 HE2 PHE 49 23.239 3.835 -9.905 405 HE2 PHE 49 HE1 PHE 49 22.964 0.124 -11.984 406 HZ PHE 49 HZ PHE 49 23.626 2.495 -11.935 407 H ILE 50 H ILE 50 21.125 -0.635 -4.400 408 HA ILE 50 HA ILE 50 21.252 2.047 -3.371 409 HB ILE 50 HB ILE 50 20.344 -0.468 -1.968 410 HG12 ILE 50 2HG1 ILE 50 19.099 0.005 -4.072 411 HG13 ILE 50 3HG1 ILE 50 18.094 0.130 -2.633 412 HG21 ILE 50 1HG2 ILE 50 20.659 1.096 -0.289 413 HG22 ILE 50 2HG2 ILE 50 20.181 2.446 -1.317 414 HG23 ILE 50 3HG2 ILE 50 18.962 1.325 -0.711 415 HD11 ILE 50 3HD1 ILE 50 18.214 2.534 -2.711 416 HD12 ILE 50 1HD1 ILE 50 19.328 2.463 -4.076 417 HD13 ILE 50 2HD1 ILE 50 17.663 1.911 -4.266 418 H GLN 51 H GLN 51 22.210 -1.007 -1.805 419 HA GLN 51 HA GLN 51 24.755 0.208 -1.036 420 HB2 GLN 51 2HB GLN 51 22.934 0.513 0.764 421 HB3 GLN 51 3HB GLN 51 23.094 -1.219 1.025 422 HG2 GLN 51 2HG GLN 51 24.423 0.110 2.602 423 HG3 GLN 51 3HG GLN 51 25.411 -0.967 1.616 424 HE21 GLN 51 1HE2 GLN 51 24.463 2.344 2.177 425 HE22 GLN 51 2HE2 GLN 51 25.782 3.072 1.332 426 H SER 52 H SER 52 26.399 -1.170 -1.235 427 HA SER 52 HA SER 52 26.185 -3.663 -2.391 428 HB2 SER 52 2HB SER 52 28.273 -2.211 -2.102 429 HB3 SER 52 3HB SER 52 28.430 -2.946 -0.507 430 HG SER 52 HG SER 52 29.403 -3.918 -2.647 431 H LYS 53 H LYS 53 26.093 -2.794 1.002 432 HA LYS 53 HA LYS 53 25.517 -5.611 1.648 433 HB2 LYS 53 2HB LYS 53 27.679 -4.217 2.566 434 HB3 LYS 53 3HB LYS 53 26.509 -3.922 3.846 435 HG2 LYS 53 2HG LYS 53 27.294 -5.842 4.684 436 HG3 LYS 53 3HG LYS 53 26.222 -6.592 3.499 437 HD2 LYS 53 2HD LYS 53 27.935 -7.346 2.259 438 HD3 LYS 53 3HD LYS 53 28.841 -5.840 2.428 439 HE2 LYS 53 2HE LYS 53 28.742 -7.204 4.947 440 HE3 LYS 53 3HE LYS 53 29.321 -8.306 3.699 441 HZ1 LYS 53 3HZ LYS 53 30.509 -5.699 3.537 442 HZ2 LYS 53 1HZ LYS 53 31.245 -7.223 3.551 443 HZ3 LYS 53 2HZ LYS 53 30.828 -6.471 5.008 444 H GLY 54 H GLY 54 23.451 -5.857 2.171 445 HA2 GLY 54 2HA GLY 54 22.035 -4.984 4.223 446 HA3 GLY 54 3HA GLY 54 21.936 -3.572 3.182 447 H HIS 55 H HIS 55 21.669 -4.734 0.698 448 HA HIS 55 HA HIS 55 18.908 -5.458 0.736 449 HB2 HIS 55 2HB HIS 55 19.064 -5.506 -1.672 450 HB3 HIS 55 3HB HIS 55 19.973 -4.118 -1.080 451 HD1 HIS 55 HD1 HIS 55 22.674 -4.614 -0.876 452 HD2 HIS 55 HD2 HIS 55 20.455 -7.058 -3.398 453 HE1 HIS 55 HE1 HIS 55 24.348 -5.687 -2.415 454 H GLU 56 H GLU 56 18.127 -7.414 1.122 455 HA GLU 56 HA GLU 56 19.647 -9.753 0.192 456 HB2 GLU 56 2HB GLU 56 19.369 -9.065 2.855 457 HB3 GLU 56 3HB GLU 56 18.084 -10.241 2.612 458 HG2 GLU 56 2HG GLU 56 20.687 -10.997 1.487 459 HG3 GLU 56 3HG GLU 56 20.637 -10.859 3.244 460 H LEU 57 H LEU 57 18.490 -11.050 -1.066 461 HA LEU 57 HA LEU 57 15.633 -10.606 -1.328 462 HB2 LEU 57 2HB LEU 57 17.573 -12.329 -2.857 463 HB3 LEU 57 3HB LEU 57 15.849 -12.241 -3.212 464 HG LEU 57 HG LEU 57 16.901 -10.850 -4.790 465 HD11 LEU 57 1HD1 LEU 57 16.290 -8.644 -2.958 466 HD12 LEU 57 2HD1 LEU 57 15.031 -9.872 -3.082 467 HD13 LEU 57 3HD1 LEU 57 15.599 -9.044 -4.531 468 HD21 LEU 57 3HD2 LEU 57 18.275 -9.089 -2.862 469 HD22 LEU 57 1HD2 LEU 57 18.764 -9.616 -4.473 470 HD23 LEU 57 2HD2 LEU 57 18.977 -10.691 -3.090 471 H LEU 58 H LEU 58 14.522 -11.545 0.301 472 HA LEU 58 HA LEU 58 15.138 -13.848 1.694 473 HB2 LEU 58 2HB LEU 58 12.878 -12.107 1.405 474 HB3 LEU 58 3HB LEU 58 12.333 -13.782 1.480 475 HG LEU 58 HG LEU 58 14.246 -13.361 3.550 476 HD11 LEU 58 1HD1 LEU 58 13.618 -11.488 4.653 477 HD12 LEU 58 2HD1 LEU 58 11.959 -11.559 4.062 478 HD13 LEU 58 3HD1 LEU 58 13.240 -10.945 3.018 479 HD21 LEU 58 3HD2 LEU 58 11.325 -13.562 4.067 480 HD22 LEU 58 1HD2 LEU 58 12.671 -14.409 4.829 481 HD23 LEU 58 2HD2 LEU 58 12.122 -14.890 3.223 482 H ASN 59 H ASN 59 13.293 -13.499 -1.303 483 HA ASN 59 HA ASN 59 13.558 -16.402 -1.704 484 HB2 ASN 59 2HB ASN 59 11.178 -15.380 -1.129 485 HB3 ASN 59 3HB ASN 59 11.193 -14.982 -2.845 486 HD21 ASN 59 1HD2 ASN 59 9.982 -17.107 -0.835 487 HD22 ASN 59 2HD2 ASN 59 10.019 -18.546 -1.789 488 H SER 60 H SER 60 15.255 -16.301 -3.115 489 HA SER 60 HA SER 60 15.852 -14.487 -5.050 490 HB2 SER 60 2HB SER 60 17.498 -16.042 -5.079 491 HB3 SER 60 3HB SER 60 16.395 -17.354 -4.665 492 HG SER 60 HG SER 60 17.068 -16.315 -7.184 493 H LEU 61 H LEU 61 15.118 -13.896 -7.010 494 HA LEU 61 HA LEU 61 12.534 -14.309 -7.826 495 HB2 LEU 61 2HB LEU 61 13.192 -13.459 -10.001 496 HB3 LEU 61 3HB LEU 61 13.964 -12.546 -8.707 497 HG LEU 61 HG LEU 61 15.586 -14.745 -9.782 498 HD11 LEU 61 1HD1 LEU 61 16.185 -13.566 -11.827 499 HD12 LEU 61 2HD1 LEU 61 14.946 -12.354 -11.505 500 HD13 LEU 61 3HD1 LEU 61 14.482 -14.023 -11.838 501 HD21 LEU 61 3HD2 LEU 61 16.908 -13.455 -8.500 502 HD22 LEU 61 1HD2 LEU 61 15.886 -12.030 -8.696 503 HD23 LEU 61 2HD2 LEU 61 17.041 -12.467 -9.956 504 H ARG 62 H ARG 62 11.430 -15.835 -8.904 505 HA ARG 62 HA ARG 62 12.867 -18.271 -9.642 506 HB2 ARG 62 2HB ARG 62 9.891 -17.783 -9.427 507 HB3 ARG 62 3HB ARG 62 10.673 -19.340 -9.666 508 HG2 ARG 62 2HG ARG 62 11.778 -19.070 -7.466 509 HG3 ARG 62 3HG ARG 62 10.857 -17.583 -7.229 510 HD2 ARG 62 2HD ARG 62 9.196 -18.800 -6.398 511 HD3 ARG 62 3HD ARG 62 8.996 -19.543 -7.984 512 HE ARG 62 HE ARG 62 10.313 -20.692 -5.668 513 HH11 ARG 62 1HH1 ARG 62 9.692 -20.876 -9.089 514 HH12 ARG 62 2HH1 ARG 62 10.089 -22.559 -9.202 515 HH21 ARG 62 1HH2 ARG 62 10.839 -22.907 -5.805 516 HH22 ARG 62 2HH2 ARG 62 10.741 -23.713 -7.334 517 H PHE 63 H PHE 63 13.678 -16.833 -11.508 518 HA PHE 63 HA PHE 63 11.994 -16.116 -13.631 519 HB2 PHE 63 2HB PHE 63 13.952 -15.767 -14.897 520 HB3 PHE 63 3HB PHE 63 14.439 -15.457 -13.234 521 HD1 PHE 63 HD2 PHE 63 15.080 -17.893 -12.041 522 HD2 PHE 63 HD1 PHE 63 15.589 -16.785 -16.120 523 HE1 PHE 63 HE2 PHE 63 16.885 -19.550 -12.262 524 HE2 PHE 63 HE1 PHE 63 17.395 -18.441 -16.347 525 HZ PHE 63 HZ PHE 63 18.046 -19.825 -14.417 526 H ASN 64 H ASN 64 13.167 -17.333 -15.881 527 HA ASN 64 HA ASN 64 12.999 -19.145 -17.252 528 HB2 ASN 64 2HB ASN 64 13.555 -20.288 -14.648 529 HB3 ASN 64 3HB ASN 64 12.516 -21.350 -15.594 530 HD21 ASN 64 1HD2 ASN 64 14.216 -22.856 -15.713 531 HD22 ASN 64 2HD2 ASN 64 15.537 -22.629 -16.802 532 H GLN 65 H GLN 65 10.629 -17.915 -15.439 533 HA GLN 65 HA GLN 65 8.581 -19.461 -16.846 534 HB2 GLN 65 2HB GLN 65 9.051 -19.618 -14.046 535 HB3 GLN 65 3HB GLN 65 7.540 -18.750 -14.285 536 HG2 GLN 65 2HG GLN 65 7.577 -21.004 -16.020 537 HG3 GLN 65 3HG GLN 65 8.008 -21.530 -14.394 538 HE21 GLN 65 1HE2 GLN 65 6.539 -21.096 -12.678 539 HE22 GLN 65 2HE2 GLN 65 4.854 -20.891 -12.996 540 H ALA 66 H ALA 66 6.344 -18.219 -15.845 541 HA ALA 66 HA ALA 66 6.301 -15.808 -17.299 542 HB1 ALA 66 1HB ALA 66 4.075 -15.524 -15.948 543 HB2 ALA 66 2HB ALA 66 4.226 -16.780 -17.176 544 HB3 ALA 66 3HB ALA 66 4.397 -17.191 -15.470 545 H ASP 67 H ASP 67 5.398 -13.733 -16.242 546 HA ASP 67 HA ASP 67 7.309 -12.453 -14.804 547 HB2 ASP 67 2HB ASP 67 5.798 -10.711 -14.470 548 HB3 ASP 67 3HB ASP 67 5.106 -11.555 -15.852 549 H TRP 68 H TRP 68 8.161 -12.696 -12.856 550 HA TRP 68 HA TRP 68 6.536 -13.985 -10.764 551 HB2 TRP 68 2HB TRP 68 8.856 -14.932 -11.745 552 HB3 TRP 68 3HB TRP 68 9.488 -13.886 -10.476 553 HD1 TRP 68 HD1 TRP 68 9.669 -14.973 -8.167 554 HE1 TRP 68 HE1 TRP 68 8.658 -17.043 -7.019 555 HE3 TRP 68 HE3 TRP 68 6.451 -16.455 -11.853 556 HZ2 TRP 68 HZ2 TRP 68 6.749 -19.040 -7.599 557 HZ3 TRP 68 HZ3 TRP 68 5.069 -18.455 -11.478 558 HH2 TRP 68 HH2 TRP 68 5.216 -19.720 -9.395 559 H THR 69 H THR 69 7.756 -13.434 -8.506 560 HA THR 69 HA THR 69 8.082 -10.510 -8.402 561 HB THR 69 HB THR 69 6.424 -10.207 -6.923 562 HG1 THR 69 HG1 THR 69 6.077 -11.833 -5.190 563 HG21 THR 69 3HG2 THR 69 4.564 -11.628 -7.157 564 HG22 THR 69 1HG2 THR 69 5.574 -13.051 -7.406 565 HG23 THR 69 2HG2 THR 69 5.461 -11.818 -8.662 566 H ILE 70 H ILE 70 9.748 -9.795 -7.205 567 HA ILE 70 HA ILE 70 11.226 -11.788 -5.616 568 HB ILE 70 HB ILE 70 12.536 -11.030 -7.503 569 HG12 ILE 70 2HG1 ILE 70 14.505 -10.179 -6.319 570 HG13 ILE 70 3HG1 ILE 70 13.498 -9.721 -4.950 571 HG21 ILE 70 1HG2 ILE 70 12.377 -8.974 -8.319 572 HG22 ILE 70 2HG2 ILE 70 11.270 -8.563 -7.010 573 HG23 ILE 70 3HG2 ILE 70 13.002 -8.299 -6.814 574 HD11 ILE 70 3HD1 ILE 70 14.817 -12.154 -5.392 575 HD12 ILE 70 1HD1 ILE 70 13.722 -11.735 -4.075 576 HD13 ILE 70 2HD1 ILE 70 13.091 -12.483 -5.543 577 H VAL 71 H VAL 71 11.256 -11.485 -3.496 578 HA VAL 71 HA VAL 71 10.358 -8.943 -2.392 579 HB VAL 71 HB VAL 71 10.426 -10.163 -0.205 580 HG11 VAL 71 1HG1 VAL 71 8.580 -11.863 -0.994 581 HG12 VAL 71 2HG1 VAL 71 8.297 -10.122 -1.052 582 HG13 VAL 71 3HG1 VAL 71 8.747 -10.993 -2.519 583 HG21 VAL 71 3HG2 VAL 71 11.465 -12.117 -0.005 584 HG22 VAL 71 1HG2 VAL 71 10.456 -12.818 -1.270 585 HG23 VAL 71 2HG2 VAL 71 11.959 -11.997 -1.694 586 H VAL 72 H VAL 72 11.703 -7.441 -1.662 587 HA VAL 72 HA VAL 72 14.467 -8.231 -1.004 588 HB VAL 72 HB VAL 72 13.692 -5.458 -1.865 589 HG11 VAL 72 1HG1 VAL 72 15.931 -5.050 -2.027 590 HG12 VAL 72 2HG1 VAL 72 15.952 -6.265 -0.747 591 HG13 VAL 72 3HG1 VAL 72 16.323 -6.726 -2.409 592 HG21 VAL 72 3HG2 VAL 72 13.145 -6.304 -3.868 593 HG22 VAL 72 1HG2 VAL 72 14.880 -6.547 -4.071 594 HG23 VAL 72 2HG2 VAL 72 13.863 -7.874 -3.508 595 H ARG 73 H ARG 73 15.092 -7.910 1.025 596 HA ARG 73 HA ARG 73 13.408 -6.251 2.762 597 HB2 ARG 73 2HB ARG 73 14.584 -7.446 4.621 598 HB3 ARG 73 3HB ARG 73 13.643 -8.495 3.568 599 HG2 ARG 73 2HG ARG 73 15.428 -9.706 3.061 600 HG3 ARG 73 3HG ARG 73 16.355 -8.269 2.627 601 HD2 ARG 73 2HD ARG 73 17.411 -9.526 4.449 602 HD3 ARG 73 3HD ARG 73 16.931 -7.907 4.957 603 HE ARG 73 HE ARG 73 14.824 -9.530 5.630 604 HH11 ARG 73 1HH1 ARG 73 18.222 -9.401 6.376 605 HH12 ARG 73 2HH1 ARG 73 18.036 -10.103 7.949 606 HH21 ARG 73 1HH2 ARG 73 14.567 -10.455 7.699 607 HH22 ARG 73 2HH2 ARG 73 15.957 -10.703 8.700 608 H LYS 74 H LYS 74 14.096 -4.235 3.017 609 HA LYS 74 HA LYS 74 16.717 -3.352 2.454 610 HB2 LYS 74 2HB LYS 74 14.268 -2.151 3.641 611 HB3 LYS 74 3HB LYS 74 15.792 -1.325 3.932 612 HG2 LYS 74 2HG LYS 74 15.130 -2.123 1.147 613 HG3 LYS 74 3HG LYS 74 14.285 -0.745 1.858 614 HD2 LYS 74 2HD LYS 74 17.280 -0.989 1.927 615 HD3 LYS 74 3HD LYS 74 16.432 -0.263 0.560 616 HE2 LYS 74 2HE LYS 74 16.269 0.640 3.435 617 HE3 LYS 74 3HE LYS 74 17.179 1.435 2.151 618 HZ1 LYS 74 3HZ LYS 74 14.965 1.620 0.967 619 HZ2 LYS 74 1HZ LYS 74 15.182 2.612 2.321 620 HZ3 LYS 74 2HZ LYS 74 14.244 1.210 2.441 621 H LYS 75 H LYS 75 18.247 -2.388 3.936 622 HA LYS 75 HA LYS 75 18.129 -2.682 6.726 623 HB2 LYS 75 2HB LYS 75 18.610 -5.112 5.437 624 HB3 LYS 75 3HB LYS 75 20.195 -4.580 5.983 625 HG2 LYS 75 2HG LYS 75 17.953 -4.435 7.918 626 HG3 LYS 75 3HG LYS 75 18.588 -6.029 7.505 627 HD2 LYS 75 2HD LYS 75 20.899 -4.763 7.925 628 HD3 LYS 75 3HD LYS 75 19.865 -3.790 8.973 629 HE2 LYS 75 2HE LYS 75 19.700 -5.420 10.493 630 HE3 LYS 75 3HE LYS 75 19.402 -6.649 9.265 631 HZ1 LYS 75 3HZ LYS 75 21.945 -6.317 8.836 632 HZ2 LYS 75 1HZ LYS 75 21.403 -7.334 10.075 633 HZ3 LYS 75 2HZ LYS 75 21.939 -5.772 10.438 634 H ALA 76 H ALA 76 20.133 -2.561 3.841 635 HA ALA 76 HA ALA 76 22.055 -1.443 3.342 636 HB1 ALA 76 1HB ALA 76 22.087 0.791 3.893 637 HB2 ALA 76 2HB ALA 76 20.389 0.393 4.158 638 HB3 ALA 76 3HB ALA 76 21.492 0.507 5.530 Start of MODEL 20 1 H1 MET 1 H MET 1 1.808 0.000 0.855 2 HA MET 1 HA MET 1 1.718 -0.802 -1.861 3 HB2 MET 1 2HB MET 1 2.643 1.392 -2.768 4 HB3 MET 1 3HB MET 1 0.921 1.347 -2.418 5 HG2 MET 1 2HG MET 1 2.514 2.240 -0.156 6 HG3 MET 1 3HG MET 1 2.697 3.262 -1.580 7 HE1 MET 1 3HE MET 1 1.745 4.325 1.036 8 HE2 MET 1 1HE MET 1 0.018 4.631 1.224 9 HE3 MET 1 2HE MET 1 0.683 3.050 1.634 10 H LYS 2 H LYS 2 3.310 -2.218 -1.115 11 HA LYS 2 HA LYS 2 5.944 -0.970 -0.698 12 HB2 LYS 2 2HB LYS 2 6.463 -3.034 0.713 13 HB3 LYS 2 3HB LYS 2 5.409 -1.823 1.431 14 HG2 LYS 2 2HG LYS 2 3.457 -3.188 0.789 15 HG3 LYS 2 3HG LYS 2 4.558 -4.422 0.171 16 HD2 LYS 2 2HD LYS 2 5.599 -4.356 2.531 17 HD3 LYS 2 3HD LYS 2 4.105 -3.541 3.003 18 HE2 LYS 2 2HE LYS 2 2.918 -5.512 1.855 19 HE3 LYS 2 3HE LYS 2 4.482 -6.321 1.937 20 HZ1 LYS 2 3HZ LYS 2 4.020 -6.869 4.016 21 HZ2 LYS 2 1HZ LYS 2 2.555 -6.026 3.961 22 HZ3 LYS 2 2HZ LYS 2 3.967 -5.235 4.449 23 H ARG 3 H ARG 3 4.728 -1.881 -3.161 24 HA ARG 3 HA ARG 3 6.783 -3.813 -3.934 25 HB2 ARG 3 2HB ARG 3 5.139 -5.098 -5.269 26 HB3 ARG 3 3HB ARG 3 4.833 -5.191 -3.540 27 HG2 ARG 3 2HG ARG 3 3.410 -3.028 -4.910 28 HG3 ARG 3 3HG ARG 3 2.958 -4.655 -5.422 29 HD2 ARG 3 2HD ARG 3 3.178 -4.607 -2.579 30 HD3 ARG 3 3HD ARG 3 2.162 -3.260 -3.094 31 HE ARG 3 HE ARG 3 1.466 -6.008 -3.108 32 HH11 ARG 3 1HH1 ARG 3 1.061 -3.053 -4.904 33 HH12 ARG 3 2HH1 ARG 3 -0.458 -3.525 -5.590 34 HH21 ARG 3 1HH2 ARG 3 -0.534 -6.641 -4.004 35 HH22 ARG 3 2HH2 ARG 3 -1.365 -5.565 -5.076 36 H PHE 4 H PHE 4 7.007 -3.965 -6.324 37 HA PHE 4 HA PHE 4 6.106 -1.534 -7.706 38 HB2 PHE 4 2HB PHE 4 8.716 -1.931 -6.823 39 HB3 PHE 4 3HB PHE 4 8.772 -2.358 -8.530 40 HD1 PHE 4 HD2 PHE 4 6.964 0.261 -6.578 41 HD2 PHE 4 HD1 PHE 4 9.621 -0.638 -9.780 42 HE1 PHE 4 HE2 PHE 4 7.056 2.648 -7.168 43 HE2 PHE 4 HE1 PHE 4 9.718 1.747 -10.374 44 HZ PHE 4 HZ PHE 4 8.434 3.394 -9.068 45 H ASP 5 H ASP 5 5.018 -2.087 -9.461 46 HA ASP 5 HA ASP 5 5.406 -4.717 -10.648 47 HB2 ASP 5 2HB ASP 5 3.205 -2.921 -10.361 48 HB3 ASP 5 3HB ASP 5 3.468 -3.203 -12.080 49 H LEU 6 H LEU 6 7.145 -4.778 -11.953 50 HA LEU 6 HA LEU 6 7.588 -2.578 -13.837 51 HB2 LEU 6 2HB LEU 6 9.306 -4.830 -12.849 52 HB3 LEU 6 3HB LEU 6 9.743 -3.896 -14.278 53 HG LEU 6 HG LEU 6 10.965 -3.045 -12.406 54 HD11 LEU 6 1HD1 LEU 6 9.579 -1.501 -14.085 55 HD12 LEU 6 2HD1 LEU 6 10.611 -0.848 -12.813 56 HD13 LEU 6 3HD1 LEU 6 8.869 -0.966 -12.561 57 HD21 LEU 6 3HD2 LEU 6 9.038 -3.910 -10.812 58 HD22 LEU 6 1HD2 LEU 6 8.522 -2.227 -10.929 59 HD23 LEU 6 2HD2 LEU 6 10.134 -2.616 -10.327 60 H ARG 7 H ARG 7 5.758 -5.193 -13.835 61 HA ARG 7 HA ARG 7 6.418 -6.806 -15.965 62 HB2 ARG 7 2HB ARG 7 4.057 -6.220 -14.445 63 HB3 ARG 7 3HB ARG 7 3.630 -6.355 -16.146 64 HG2 ARG 7 2HG ARG 7 4.327 -8.566 -16.276 65 HG3 ARG 7 3HG ARG 7 5.320 -8.438 -14.822 66 HD2 ARG 7 2HD ARG 7 3.475 -9.649 -14.096 67 HD3 ARG 7 3HD ARG 7 3.090 -7.999 -13.607 68 HE ARG 7 HE ARG 7 1.281 -8.086 -14.985 69 HH11 ARG 7 1HH1 ARG 7 3.591 -10.465 -16.048 70 HH12 ARG 7 2HH1 ARG 7 2.556 -11.111 -17.278 71 HH21 ARG 7 1HH2 ARG 7 -0.091 -8.928 -16.602 72 HH22 ARG 7 2HH2 ARG 7 0.462 -10.235 -17.593 73 HA PRO 8 HA PRO 8 4.169 -3.819 -19.017 74 HB2 PRO 8 2HB PRO 8 3.408 -1.392 -18.067 75 HB3 PRO 8 3HB PRO 8 2.368 -2.820 -17.997 76 HG2 PRO 8 2HG PRO 8 4.082 -1.618 -15.857 77 HG3 PRO 8 3HG PRO 8 2.430 -2.253 -15.743 78 HD2 PRO 8 2HD PRO 8 4.594 -3.670 -14.943 79 HD3 PRO 8 3HD PRO 8 3.145 -4.441 -15.620 80 H LEU 9 H LEU 9 6.603 -2.978 -16.809 81 HA LEU 9 HA LEU 9 7.611 -0.712 -18.300 82 HB2 LEU 9 2HB LEU 9 8.159 -2.005 -15.743 83 HB3 LEU 9 3HB LEU 9 9.616 -1.482 -16.586 84 HG LEU 9 HG LEU 9 7.910 0.709 -16.726 85 HD11 LEU 9 1HD1 LEU 9 6.663 0.879 -14.887 86 HD12 LEU 9 2HD1 LEU 9 7.952 0.268 -13.852 87 HD13 LEU 9 3HD1 LEU 9 6.897 -0.859 -14.705 88 HD21 LEU 9 3HD2 LEU 9 9.997 1.411 -16.330 89 HD22 LEU 9 1HD2 LEU 9 10.423 -0.055 -15.448 90 HD23 LEU 9 2HD2 LEU 9 9.574 1.253 -14.624 91 H LYS 10 H LYS 10 9.483 -0.658 -19.528 92 HA LYS 10 HA LYS 10 10.179 -3.152 -20.807 93 HB2 LYS 10 2HB LYS 10 11.347 -1.836 -22.405 94 HB3 LYS 10 3HB LYS 10 9.872 -0.958 -22.021 95 HG2 LYS 10 2HG LYS 10 11.153 0.482 -20.492 96 HG3 LYS 10 3HG LYS 10 12.627 -0.373 -20.954 97 HD2 LYS 10 2HD LYS 10 12.659 1.507 -22.321 98 HD3 LYS 10 3HD LYS 10 11.965 0.267 -23.369 99 HE2 LYS 10 2HE LYS 10 9.705 1.091 -22.752 100 HE3 LYS 10 3HE LYS 10 10.467 2.390 -21.836 101 HZ1 LYS 10 3HZ LYS 10 9.758 3.023 -24.112 102 HZ2 LYS 10 1HZ LYS 10 10.901 1.942 -24.737 103 HZ3 LYS 10 2HZ LYS 10 11.406 3.272 -23.822 104 H ALA 11 H ALA 11 12.443 -3.785 -21.151 105 HA ALA 11 HA ALA 11 13.843 -3.943 -18.677 106 HB1 ALA 11 1HB ALA 11 14.611 -4.799 -21.462 107 HB2 ALA 11 2HB ALA 11 15.561 -5.150 -20.018 108 HB3 ALA 11 3HB ALA 11 13.932 -5.804 -20.181 109 H GLY 12 H GLY 12 15.825 -3.060 -18.084 110 HA2 GLY 12 2HA GLY 12 17.797 -1.765 -18.573 111 HA3 GLY 12 3HA GLY 12 16.888 -0.937 -19.829 112 H ILE 13 H ILE 13 14.569 -0.305 -18.416 113 HA ILE 13 HA ILE 13 15.621 1.759 -16.618 114 HB ILE 13 HB ILE 13 12.842 1.614 -17.778 115 HG12 ILE 13 2HG1 ILE 13 15.266 3.075 -18.851 116 HG13 ILE 13 3HG1 ILE 13 14.492 1.681 -19.598 117 HG21 ILE 13 1HG2 ILE 13 13.242 3.036 -15.765 118 HG22 ILE 13 2HG2 ILE 13 14.384 3.977 -16.724 119 HG23 ILE 13 3HG2 ILE 13 12.681 3.922 -17.183 120 HD11 ILE 13 3HD1 ILE 13 13.810 3.658 -20.748 121 HD12 ILE 13 1HD1 ILE 13 12.430 3.032 -19.845 122 HD13 ILE 13 2HD1 ILE 13 13.323 4.427 -19.237 123 H PHE 14 H PHE 14 13.523 -1.014 -16.724 124 HA PHE 14 HA PHE 14 12.028 -0.601 -14.399 125 HB2 PHE 14 2HB PHE 14 11.433 -2.866 -14.528 126 HB3 PHE 14 3HB PHE 14 11.794 -2.436 -16.196 127 HD1 PHE 14 HD1 PHE 14 14.487 -2.695 -16.673 128 HD2 PHE 14 HD2 PHE 14 12.153 -4.942 -13.912 129 HE1 PHE 14 HE1 PHE 14 16.119 -4.532 -16.794 130 HE2 PHE 14 HE2 PHE 14 13.782 -6.782 -14.028 131 HZ PHE 14 HZ PHE 14 15.768 -6.579 -15.470 132 H GLU 15 H GLU 15 15.336 -1.532 -14.844 133 HA GLU 15 HA GLU 15 15.656 -2.484 -12.129 134 HB2 GLU 15 2HB GLU 15 16.976 -3.561 -13.830 135 HB3 GLU 15 3HB GLU 15 17.627 -2.020 -14.369 136 HG2 GLU 15 2HG GLU 15 18.131 -2.487 -11.557 137 HG3 GLU 15 3HG GLU 15 18.787 -3.768 -12.576 138 H ARG 16 H ARG 16 16.005 0.472 -13.888 139 HA ARG 16 HA ARG 16 17.673 1.736 -11.892 140 HB2 ARG 16 2HB ARG 16 16.634 2.414 -14.558 141 HB3 ARG 16 3HB ARG 16 16.727 3.776 -13.449 142 HG2 ARG 16 2HG ARG 16 18.985 3.787 -13.431 143 HG3 ARG 16 3HG ARG 16 19.104 2.033 -13.588 144 HD2 ARG 16 2HD ARG 16 19.543 2.282 -15.749 145 HD3 ARG 16 3HD ARG 16 17.944 2.993 -15.971 146 HE ARG 16 HE ARG 16 18.924 5.054 -16.138 147 HH11 ARG 16 1HH1 ARG 16 21.209 2.813 -14.767 148 HH12 ARG 16 2HH1 ARG 16 22.538 3.922 -14.839 149 HH21 ARG 16 1HH2 ARG 16 20.666 6.523 -16.238 150 HH22 ARG 16 2HH2 ARG 16 22.228 6.032 -15.675 151 H LEU 17 H LEU 17 14.282 1.635 -12.785 152 HA LEU 17 HA LEU 17 13.481 3.772 -11.064 153 HB2 LEU 17 2HB LEU 17 12.279 2.095 -13.022 154 HB3 LEU 17 3HB LEU 17 11.318 1.999 -11.547 155 HG LEU 17 HG LEU 17 10.463 3.697 -13.085 156 HD11 LEU 17 1HD1 LEU 17 10.835 5.698 -11.401 157 HD12 LEU 17 2HD1 LEU 17 11.515 4.414 -10.402 158 HD13 LEU 17 3HD1 LEU 17 9.851 4.298 -10.974 159 HD21 LEU 17 3HD2 LEU 17 11.770 5.120 -14.183 160 HD22 LEU 17 1HD2 LEU 17 13.158 4.254 -13.526 161 HD23 LEU 17 2HD2 LEU 17 12.528 5.672 -12.689 162 H GLU 18 H GLU 18 14.018 0.371 -10.682 163 HA GLU 18 HA GLU 18 12.437 -0.164 -8.443 164 HB2 GLU 18 2HB GLU 18 14.210 -1.595 -9.970 165 HB3 GLU 18 3HB GLU 18 15.064 -1.475 -8.438 166 HG2 GLU 18 2HG GLU 18 13.797 -3.050 -7.549 167 HG3 GLU 18 3HG GLU 18 12.330 -2.163 -7.958 168 H GLU 19 H GLU 19 15.466 1.524 -8.752 169 HA GLU 19 HA GLU 19 16.031 1.485 -5.921 170 HB2 GLU 19 2HB GLU 19 17.925 1.531 -7.376 171 HB3 GLU 19 3HB GLU 19 17.296 2.917 -8.255 172 HG2 GLU 19 2HG GLU 19 17.642 3.421 -5.408 173 HG3 GLU 19 3HG GLU 19 19.140 2.996 -6.234 174 H LEU 20 H LEU 20 14.382 3.538 -8.179 175 HA LEU 20 HA LEU 20 14.435 5.952 -6.737 176 HB2 LEU 20 2HB LEU 20 13.173 4.920 -9.075 177 HB3 LEU 20 3HB LEU 20 11.959 5.738 -8.094 178 HG LEU 20 HG LEU 20 13.969 7.574 -8.098 179 HD11 LEU 20 1HD1 LEU 20 14.124 5.996 -10.640 180 HD12 LEU 20 2HD1 LEU 20 15.431 6.578 -9.610 181 HD13 LEU 20 3HD1 LEU 20 14.519 7.714 -10.604 182 HD21 LEU 20 3HD2 LEU 20 12.017 8.559 -8.596 183 HD22 LEU 20 1HD2 LEU 20 11.431 7.168 -9.508 184 HD23 LEU 20 2HD2 LEU 20 12.518 8.329 -10.272 185 H ILE 21 H ILE 21 12.330 3.140 -6.559 186 HA ILE 21 HA ILE 21 10.595 4.406 -4.607 187 HB ILE 21 HB ILE 21 9.624 2.878 -6.267 188 HG12 ILE 21 2HG1 ILE 21 8.299 1.505 -4.696 189 HG13 ILE 21 3HG1 ILE 21 9.467 1.849 -3.424 190 HG21 ILE 21 1HG2 ILE 21 10.040 0.480 -6.150 191 HG22 ILE 21 2HG2 ILE 21 11.527 1.361 -6.495 192 HG23 ILE 21 3HG2 ILE 21 11.228 0.739 -4.872 193 HD11 ILE 21 3HD1 ILE 21 8.398 4.241 -4.698 194 HD12 ILE 21 1HD1 ILE 21 7.176 3.248 -3.903 195 HD13 ILE 21 2HD1 ILE 21 8.565 3.837 -2.989 196 H GLU 22 H GLU 22 13.194 2.055 -4.713 197 HA GLU 22 HA GLU 22 12.949 0.909 -2.196 198 HB2 GLU 22 2HB GLU 22 14.720 0.666 -4.239 199 HB3 GLU 22 3HB GLU 22 15.705 1.523 -3.061 200 HG2 GLU 22 2HG GLU 22 16.040 -0.334 -1.912 201 HG3 GLU 22 3HG GLU 22 14.306 -0.614 -1.772 202 H LYS 23 H LYS 23 13.996 4.082 -3.106 203 HA LYS 23 HA LYS 23 15.440 4.757 -0.774 204 HB2 LYS 23 2HB LYS 23 14.427 6.118 -3.133 205 HB3 LYS 23 3HB LYS 23 14.280 7.119 -1.694 206 HG2 LYS 23 2HG LYS 23 16.658 6.839 -1.244 207 HG3 LYS 23 3HG LYS 23 16.812 5.810 -2.670 208 HD2 LYS 23 2HD LYS 23 16.320 7.613 -4.132 209 HD3 LYS 23 3HD LYS 23 15.793 8.641 -2.797 210 HE2 LYS 23 2HE LYS 23 17.911 9.456 -3.233 211 HE3 LYS 23 3HE LYS 23 18.215 8.313 -1.926 212 HZ1 LYS 23 3HZ LYS 23 19.758 8.214 -3.906 213 HZ2 LYS 23 1HZ LYS 23 18.467 7.545 -4.772 214 HZ3 LYS 23 2HZ LYS 23 19.078 6.745 -3.414 215 H GLU 24 H GLU 24 12.023 5.009 -1.632 216 HA GLU 24 HA GLU 24 11.280 6.395 0.755 217 HB2 GLU 24 2HB GLU 24 10.061 5.911 -1.655 218 HB3 GLU 24 3HB GLU 24 9.182 4.834 -0.579 219 HG2 GLU 24 2HG GLU 24 9.514 7.439 0.608 220 HG3 GLU 24 3HG GLU 24 8.742 7.548 -0.973 221 H MET 25 H MET 25 11.323 3.023 -0.269 222 HA MET 25 HA MET 25 9.853 1.840 1.743 223 HB2 MET 25 2HB MET 25 12.390 0.770 0.493 224 HB3 MET 25 3HB MET 25 11.178 -0.183 1.338 225 HG2 MET 25 2HG MET 25 10.749 1.348 -1.217 226 HG3 MET 25 3HG MET 25 10.970 -0.394 -1.076 227 HE1 MET 25 3HE MET 25 8.057 -1.799 0.530 228 HE2 MET 25 1HE MET 25 9.761 -1.519 0.888 229 HE3 MET 25 2HE MET 25 8.516 -0.681 1.815 230 H GLN 26 H GLN 26 10.269 1.102 3.803 231 HA GLN 26 HA GLN 26 11.988 2.616 5.413 232 HB2 GLN 26 2HB GLN 26 10.132 0.403 5.768 233 HB3 GLN 26 3HB GLN 26 11.520 0.279 6.841 234 HG2 GLN 26 2HG GLN 26 10.825 2.915 7.079 235 HG3 GLN 26 3HG GLN 26 9.263 2.118 6.898 236 HE21 GLN 26 1HE2 GLN 26 10.978 3.360 9.170 237 HE22 GLN 26 2HE2 GLN 26 10.787 2.221 10.454 238 HA PRO 27 HA PRO 27 15.906 0.653 5.263 239 HB2 PRO 27 2HB PRO 27 16.693 0.696 7.861 240 HB3 PRO 27 3HB PRO 27 16.616 2.148 6.856 241 HG2 PRO 27 2HG PRO 27 14.650 1.133 8.873 242 HG3 PRO 27 3HG PRO 27 15.223 2.790 8.604 243 HD2 PRO 27 2HD PRO 27 12.838 1.905 7.675 244 HD3 PRO 27 3HD PRO 27 13.802 3.126 6.821 245 H ASN 28 H ASN 28 13.313 -0.809 6.836 246 HA ASN 28 HA ASN 28 14.671 -3.388 6.779 247 HB2 ASN 28 2HB ASN 28 14.493 -2.108 9.175 248 HB3 ASN 28 3HB ASN 28 12.985 -3.018 9.173 249 HD21 ASN 28 1HD2 ASN 28 15.244 -3.377 10.896 250 HD22 ASN 28 2HD2 ASN 28 15.824 -4.984 10.641 251 H GLU 29 H GLU 29 12.693 -2.211 5.088 252 HA GLU 29 HA GLU 29 10.306 -3.802 5.743 253 HB2 GLU 29 2HB GLU 29 10.671 -1.154 4.644 254 HB3 GLU 29 3HB GLU 29 9.727 -2.153 3.548 255 HG2 GLU 29 2HG GLU 29 9.032 -2.073 6.447 256 HG3 GLU 29 3HG GLU 29 8.544 -0.752 5.386 257 H VAL 30 H VAL 30 9.146 -4.689 3.791 258 HA VAL 30 HA VAL 30 11.114 -6.008 2.066 259 HB VAL 30 HB VAL 30 9.670 -7.525 3.270 260 HG11 VAL 30 1HG1 VAL 30 7.396 -6.027 1.974 261 HG12 VAL 30 2HG1 VAL 30 7.227 -7.542 2.865 262 HG13 VAL 30 3HG1 VAL 30 7.782 -6.086 3.694 263 HG21 VAL 30 3HG2 VAL 30 10.341 -8.034 0.912 264 HG22 VAL 30 1HG2 VAL 30 8.880 -8.860 1.454 265 HG23 VAL 30 2HG2 VAL 30 8.757 -7.453 0.398 266 H ALA 31 H ALA 31 10.964 -6.008 -0.159 267 HA ALA 31 HA ALA 31 8.927 -4.251 -1.353 268 HB1 ALA 31 1HB ALA 31 10.455 -3.034 -2.569 269 HB2 ALA 31 2HB ALA 31 11.334 -3.284 -1.060 270 HB3 ALA 31 3HB ALA 31 11.694 -4.284 -2.467 271 H ILE 32 H ILE 32 7.719 -5.473 -2.639 272 HA ILE 32 HA ILE 32 8.874 -7.815 -3.941 273 HB ILE 32 HB ILE 32 6.008 -6.868 -3.812 274 HG12 ILE 32 2HG1 ILE 32 6.726 -9.407 -2.545 275 HG13 ILE 32 3HG1 ILE 32 7.539 -8.022 -1.824 276 HG21 ILE 32 1HG2 ILE 32 6.068 -9.574 -4.448 277 HG22 ILE 32 2HG2 ILE 32 5.655 -8.241 -5.525 278 HG23 ILE 32 3HG2 ILE 32 7.310 -8.845 -5.466 279 HD11 ILE 32 3HD1 ILE 32 5.709 -7.567 -0.680 280 HD12 ILE 32 1HD1 ILE 32 4.828 -7.320 -2.187 281 HD13 ILE 32 2HD1 ILE 32 4.878 -8.920 -1.446 282 H PHE 33 H PHE 33 9.878 -7.407 -5.804 283 HA PHE 33 HA PHE 33 8.703 -5.446 -7.650 284 HB2 PHE 33 2HB PHE 33 11.471 -6.660 -7.733 285 HB3 PHE 33 3HB PHE 33 10.877 -5.320 -8.708 286 HD1 PHE 33 HD2 PHE 33 9.437 -3.779 -6.600 287 HD2 PHE 33 HD1 PHE 33 13.244 -5.681 -6.576 288 HE1 PHE 33 HE2 PHE 33 10.216 -2.190 -4.891 289 HE2 PHE 33 HE1 PHE 33 14.030 -4.096 -4.866 290 HZ PHE 33 HZ PHE 33 12.515 -2.346 -4.022 291 H MET 34 H MET 34 7.377 -6.343 -9.084 292 HA MET 34 HA MET 34 7.704 -9.093 -9.918 293 HB2 MET 34 2HB MET 34 5.506 -7.599 -9.542 294 HB3 MET 34 3HB MET 34 5.731 -7.331 -11.265 295 HG2 MET 34 2HG MET 34 5.590 -9.672 -11.718 296 HG3 MET 34 3HG MET 34 5.592 -10.052 -9.997 297 HE1 MET 34 3HE MET 34 2.988 -10.065 -8.541 298 HE2 MET 34 1HE MET 34 4.026 -8.641 -8.480 299 HE3 MET 34 2HE MET 34 2.301 -8.461 -8.799 300 H PHE 35 H PHE 35 8.521 -9.805 -11.803 301 HA PHE 35 HA PHE 35 9.083 -7.863 -13.927 302 HB2 PHE 35 2HB PHE 35 11.340 -8.695 -14.222 303 HB3 PHE 35 3HB PHE 35 11.138 -8.154 -12.559 304 HD1 PHE 35 HD1 PHE 35 10.426 -10.026 -10.864 305 HD2 PHE 35 HD2 PHE 35 12.305 -10.742 -14.616 306 HE1 PHE 35 HE1 PHE 35 11.194 -12.220 -10.057 307 HE2 PHE 35 HE2 PHE 35 13.075 -12.937 -13.815 308 HZ PHE 35 HZ PHE 35 12.520 -13.679 -11.533 309 H GLU 36 H GLU 36 8.395 -8.565 -15.834 310 HA GLU 36 HA GLU 36 7.764 -11.414 -16.131 311 HB2 GLU 36 2HB GLU 36 6.303 -10.742 -17.957 312 HB3 GLU 36 3HB GLU 36 5.930 -9.819 -16.509 313 HG2 GLU 36 2HG GLU 36 6.099 -7.978 -17.717 314 HG3 GLU 36 3HG GLU 36 7.824 -8.299 -17.878 315 H VAL 37 H VAL 37 10.039 -9.100 -17.071 316 HA VAL 37 HA VAL 37 10.675 -10.168 -19.655 317 HB VAL 37 HB VAL 37 12.502 -8.490 -17.946 318 HG11 VAL 37 1HG1 VAL 37 13.798 -8.825 -19.741 319 HG12 VAL 37 2HG1 VAL 37 12.450 -9.400 -20.724 320 HG13 VAL 37 3HG1 VAL 37 12.735 -7.669 -20.542 321 HG21 VAL 37 3HG2 VAL 37 10.778 -7.028 -17.888 322 HG22 VAL 37 1HG2 VAL 37 11.312 -6.672 -19.531 323 HG23 VAL 37 2HG2 VAL 37 9.960 -7.772 -19.261 324 H GLY 38 H GLY 38 12.624 -11.273 -20.227 325 HA2 GLY 38 2HA GLY 38 13.251 -13.418 -18.466 326 HA3 GLY 38 3HA GLY 38 14.030 -13.080 -20.004 327 H ASP 39 H ASP 39 14.389 -10.260 -18.571 328 HA ASP 39 HA ASP 39 17.122 -10.696 -17.916 329 HB2 ASP 39 2HB ASP 39 15.286 -8.403 -18.073 330 HB3 ASP 39 3HB ASP 39 16.556 -8.234 -16.864 331 H PHE 40 H PHE 40 17.021 -12.306 -16.277 332 HA PHE 40 HA PHE 40 15.802 -11.599 -13.736 333 HB2 PHE 40 2HB PHE 40 16.288 -13.829 -13.042 334 HB3 PHE 40 3HB PHE 40 15.726 -13.932 -14.708 335 HD1 PHE 40 HD1 PHE 40 17.242 -14.525 -16.499 336 HD2 PHE 40 HD2 PHE 40 18.581 -14.302 -12.466 337 HE1 PHE 40 HE1 PHE 40 19.288 -15.745 -17.115 338 HE2 PHE 40 HE2 PHE 40 20.630 -15.521 -13.075 339 HZ PHE 40 HZ PHE 40 20.986 -16.243 -15.402 340 H SER 41 H SER 41 18.897 -11.553 -15.259 341 HA SER 41 HA SER 41 20.473 -11.524 -12.878 342 HB2 SER 41 2HB SER 41 21.879 -12.077 -14.575 343 HB3 SER 41 3HB SER 41 20.941 -11.188 -15.775 344 HG SER 41 HG SER 41 23.162 -10.431 -14.443 345 H ASN 42 H ASN 42 18.543 -9.213 -14.470 346 HA ASN 42 HA ASN 42 19.980 -6.906 -13.476 347 HB2 ASN 42 2HB ASN 42 17.741 -7.402 -15.308 348 HB3 ASN 42 3HB ASN 42 17.531 -5.971 -14.303 349 HD21 ASN 42 1HD2 ASN 42 17.997 -6.238 -17.185 350 HD22 ASN 42 2HD2 ASN 42 19.412 -5.304 -17.519 351 H ILE 43 H ILE 43 17.355 -8.941 -12.494 352 HA ILE 43 HA ILE 43 15.906 -7.319 -10.797 353 HB ILE 43 HB ILE 43 16.516 -10.230 -10.824 354 HG12 ILE 43 2HG1 ILE 43 14.693 -9.228 -12.175 355 HG13 ILE 43 3HG1 ILE 43 14.098 -10.405 -11.009 356 HG21 ILE 43 1HG2 ILE 43 16.680 -10.006 -8.514 357 HG22 ILE 43 2HG2 ILE 43 15.465 -8.731 -8.454 358 HG23 ILE 43 3HG2 ILE 43 14.979 -10.397 -8.763 359 HD11 ILE 43 3HD1 ILE 43 14.047 -7.887 -9.745 360 HD12 ILE 43 1HD1 ILE 43 13.350 -7.685 -11.352 361 HD13 ILE 43 2HD1 ILE 43 12.686 -8.890 -10.247 362 HA PRO 44 HA PRO 44 18.973 -8.347 -7.203 363 HB2 PRO 44 2HB PRO 44 21.330 -9.511 -7.880 364 HB3 PRO 44 3HB PRO 44 19.880 -10.440 -7.479 365 HG2 PRO 44 2HG PRO 44 21.001 -9.742 -10.166 366 HG3 PRO 44 3HG PRO 44 20.329 -11.282 -9.600 367 HD2 PRO 44 2HD PRO 44 18.914 -9.546 -11.122 368 HD3 PRO 44 3HD PRO 44 18.152 -10.587 -9.901 369 H LYS 45 H LYS 45 19.956 -7.171 -10.292 370 HA LYS 45 HA LYS 45 22.253 -5.712 -9.403 371 HB2 LYS 45 2HB LYS 45 21.439 -6.491 -11.831 372 HB3 LYS 45 3HB LYS 45 20.781 -4.860 -11.842 373 HG2 LYS 45 2HG LYS 45 23.402 -4.617 -10.889 374 HG3 LYS 45 3HG LYS 45 23.479 -5.739 -12.249 375 HD2 LYS 45 2HD LYS 45 22.005 -3.997 -13.466 376 HD3 LYS 45 3HD LYS 45 22.537 -2.893 -12.196 377 HE2 LYS 45 2HE LYS 45 24.383 -4.477 -13.978 378 HE3 LYS 45 3HE LYS 45 23.925 -2.798 -14.254 379 HZ1 LYS 45 3HZ LYS 45 25.604 -2.227 -12.949 380 HZ2 LYS 45 1HZ LYS 45 25.920 -3.837 -12.537 381 HZ3 LYS 45 2HZ LYS 45 24.804 -2.938 -11.639 382 H SER 46 H SER 46 18.832 -5.053 -9.715 383 HA SER 46 HA SER 46 18.984 -2.233 -9.472 384 HB2 SER 46 2HB SER 46 16.554 -3.482 -8.395 385 HB3 SER 46 3HB SER 46 16.736 -2.307 -9.697 386 HG SER 46 HG SER 46 16.642 -3.875 -11.086 387 H ALA 47 H ALA 47 18.080 -4.728 -7.088 388 HA ALA 47 HA ALA 47 17.923 -3.019 -4.878 389 HB1 ALA 47 1HB ALA 47 18.801 -5.864 -4.593 390 HB2 ALA 47 2HB ALA 47 17.715 -4.920 -3.573 391 HB3 ALA 47 3HB ALA 47 17.172 -5.482 -5.154 392 H GLU 48 H GLU 48 20.652 -4.361 -6.519 393 HA GLU 48 HA GLU 48 22.510 -4.054 -4.358 394 HB2 GLU 48 2HB GLU 48 22.749 -5.641 -6.327 395 HB3 GLU 48 3HB GLU 48 23.174 -4.237 -7.295 396 HG2 GLU 48 2HG GLU 48 24.760 -4.235 -4.929 397 HG3 GLU 48 3HG GLU 48 24.852 -5.826 -5.683 398 H PHE 49 H PHE 49 21.247 -2.021 -6.860 399 HA PHE 49 HA PHE 49 23.268 -0.115 -7.086 400 HB2 PHE 49 2HB PHE 49 20.687 -0.426 -8.073 401 HB3 PHE 49 3HB PHE 49 20.607 1.066 -7.141 402 HD1 PHE 49 HD2 PHE 49 22.223 2.914 -7.671 403 HD2 PHE 49 HD1 PHE 49 21.720 -0.491 -10.174 404 HE1 PHE 49 HE2 PHE 49 23.263 4.136 -9.536 405 HE2 PHE 49 HE1 PHE 49 22.759 0.725 -12.044 406 HZ PHE 49 HZ PHE 49 23.531 3.042 -11.726 407 H ILE 50 H ILE 50 21.089 -0.758 -4.500 408 HA ILE 50 HA ILE 50 21.342 1.834 -3.263 409 HB ILE 50 HB ILE 50 20.314 -0.721 -2.028 410 HG12 ILE 50 2HG1 ILE 50 19.105 -0.123 -4.115 411 HG13 ILE 50 3HG1 ILE 50 18.090 -0.006 -2.682 412 HG21 ILE 50 1HG2 ILE 50 20.237 0.521 -0.183 413 HG22 ILE 50 2HG2 ILE 50 20.660 1.984 -1.071 414 HG23 ILE 50 3HG2 ILE 50 18.976 1.469 -0.971 415 HD11 ILE 50 3HD1 ILE 50 19.393 2.284 -4.134 416 HD12 ILE 50 1HD1 ILE 50 17.683 1.853 -4.167 417 HD13 ILE 50 2HD1 ILE 50 18.421 2.422 -2.669 418 H GLN 51 H GLN 51 22.134 -1.394 -1.974 419 HA GLN 51 HA GLN 51 24.735 -0.381 -1.102 420 HB2 GLN 51 2HB GLN 51 22.582 -0.573 0.650 421 HB3 GLN 51 3HB GLN 51 23.511 -2.035 0.952 422 HG2 GLN 51 2HG GLN 51 24.742 -0.790 2.315 423 HG3 GLN 51 3HG GLN 51 25.448 -0.096 0.856 424 HE21 GLN 51 1HE2 GLN 51 24.077 1.729 -0.092 425 HE22 GLN 51 2HE2 GLN 51 23.490 2.895 1.039 426 H SER 52 H SER 52 26.312 -1.807 -1.450 427 HA SER 52 HA SER 52 25.967 -4.175 -2.826 428 HB2 SER 52 2HB SER 52 28.301 -4.724 -2.117 429 HB3 SER 52 3HB SER 52 28.126 -3.086 -2.745 430 HG SER 52 HG SER 52 27.737 -2.684 -0.299 431 H LYS 53 H LYS 53 25.917 -3.595 0.620 432 HA LYS 53 HA LYS 53 25.183 -6.416 1.027 433 HB2 LYS 53 2HB LYS 53 27.532 -5.621 1.864 434 HB3 LYS 53 3HB LYS 53 26.611 -4.869 3.161 435 HG2 LYS 53 2HG LYS 53 26.809 -6.815 4.217 436 HG3 LYS 53 3HG LYS 53 25.588 -7.415 3.091 437 HD2 LYS 53 2HD LYS 53 27.094 -8.609 1.888 438 HD3 LYS 53 3HD LYS 53 28.382 -7.425 2.124 439 HE2 LYS 53 2HE LYS 53 27.959 -8.411 4.661 440 HE3 LYS 53 3HE LYS 53 27.745 -9.833 3.640 441 HZ1 LYS 53 3HZ LYS 53 29.973 -8.578 2.652 442 HZ2 LYS 53 1HZ LYS 53 29.945 -9.974 3.609 443 HZ3 LYS 53 2HZ LYS 53 30.140 -8.457 4.331 444 H GLY 54 H GLY 54 23.356 -4.342 0.555 445 HA2 GLY 54 2HA GLY 54 22.087 -4.126 3.215 446 HA3 GLY 54 3HA GLY 54 22.043 -2.807 2.054 447 H HIS 55 H HIS 55 21.832 -5.315 0.090 448 HA HIS 55 HA HIS 55 18.893 -5.414 0.260 449 HB2 HIS 55 2HB HIS 55 18.846 -5.715 -2.137 450 HB3 HIS 55 3HB HIS 55 19.829 -4.303 -1.764 451 HD1 HIS 55 HD1 HIS 55 22.545 -4.962 -1.623 452 HD2 HIS 55 HD2 HIS 55 20.039 -7.366 -3.904 453 HE1 HIS 55 HE1 HIS 55 24.059 -6.206 -3.199 454 H GLU 56 H GLU 56 18.089 -7.290 0.905 455 HA GLU 56 HA GLU 56 19.522 -9.760 0.180 456 HB2 GLU 56 2HB GLU 56 19.179 -8.775 2.756 457 HB3 GLU 56 3HB GLU 56 17.921 -9.992 2.598 458 HG2 GLU 56 2HG GLU 56 20.565 -10.812 1.628 459 HG3 GLU 56 3HG GLU 56 20.464 -10.497 3.359 460 H LEU 57 H LEU 57 18.350 -11.032 -1.079 461 HA LEU 57 HA LEU 57 15.503 -10.594 -1.363 462 HB2 LEU 57 2HB LEU 57 17.398 -12.487 -2.742 463 HB3 LEU 57 3HB LEU 57 15.687 -12.331 -3.134 464 HG LEU 57 HG LEU 57 16.803 -11.097 -4.781 465 HD11 LEU 57 1HD1 LEU 57 15.689 -9.148 -4.617 466 HD12 LEU 57 2HD1 LEU 57 16.363 -8.769 -3.033 467 HD13 LEU 57 3HD1 LEU 57 15.010 -9.892 -3.169 468 HD21 LEU 57 3HD2 LEU 57 18.330 -9.344 -2.959 469 HD22 LEU 57 1HD2 LEU 57 18.754 -9.980 -4.549 470 HD23 LEU 57 2HD2 LEU 57 18.908 -11.003 -3.120 471 H LEU 58 H LEU 58 14.335 -11.405 0.286 472 HA LEU 58 HA LEU 58 14.909 -13.603 1.866 473 HB2 LEU 58 2HB LEU 58 12.741 -11.816 1.497 474 HB3 LEU 58 3HB LEU 58 12.085 -13.452 1.518 475 HG LEU 58 HG LEU 58 13.974 -12.667 3.680 476 HD11 LEU 58 1HD1 LEU 58 11.706 -11.108 3.091 477 HD12 LEU 58 2HD1 LEU 58 12.716 -11.057 4.536 478 HD13 LEU 58 3HD1 LEU 58 11.294 -12.100 4.491 479 HD21 LEU 58 3HD2 LEU 58 13.327 -14.832 3.991 480 HD22 LEU 58 1HD2 LEU 58 11.751 -14.588 3.236 481 HD23 LEU 58 2HD2 LEU 58 12.041 -14.015 4.879 482 H ASN 59 H ASN 59 12.905 -13.469 -1.069 483 HA ASN 59 HA ASN 59 13.161 -16.399 -1.260 484 HB2 ASN 59 2HB ASN 59 10.820 -15.329 -0.839 485 HB3 ASN 59 3HB ASN 59 10.903 -14.892 -2.542 486 HD21 ASN 59 1HD2 ASN 59 11.274 -16.650 -4.073 487 HD22 ASN 59 2HD2 ASN 59 10.607 -18.206 -3.726 488 H SER 60 H SER 60 14.427 -17.004 -2.875 489 HA SER 60 HA SER 60 15.560 -15.371 -4.783 490 HB2 SER 60 2HB SER 60 16.706 -17.324 -4.823 491 HB3 SER 60 3HB SER 60 15.284 -18.276 -4.395 492 HG SER 60 HG SER 60 16.346 -17.709 -6.861 493 H LEU 61 H LEU 61 15.070 -14.721 -6.826 494 HA LEU 61 HA LEU 61 12.329 -14.636 -7.576 495 HB2 LEU 61 2HB LEU 61 13.170 -13.534 -9.626 496 HB3 LEU 61 3HB LEU 61 13.755 -12.801 -8.134 497 HG LEU 61 HG LEU 61 15.547 -14.812 -9.318 498 HD11 LEU 61 1HD1 LEU 61 14.689 -12.373 -10.805 499 HD12 LEU 61 2HD1 LEU 61 15.078 -13.983 -11.409 500 HD13 LEU 61 3HD1 LEU 61 16.370 -12.900 -10.891 501 HD21 LEU 61 3HD2 LEU 61 15.657 -12.644 -7.515 502 HD22 LEU 61 1HD2 LEU 61 16.680 -12.227 -8.890 503 HD23 LEU 61 2HD2 LEU 61 16.963 -13.725 -8.002 504 H ARG 62 H ARG 62 11.180 -15.916 -8.887 505 HA ARG 62 HA ARG 62 12.537 -18.223 -10.070 506 HB2 ARG 62 2HB ARG 62 10.376 -18.244 -8.546 507 HB3 ARG 62 3HB ARG 62 9.566 -17.922 -10.073 508 HG2 ARG 62 2HG ARG 62 9.483 -20.219 -9.944 509 HG3 ARG 62 3HG ARG 62 10.920 -19.955 -10.935 510 HD2 ARG 62 2HD ARG 62 12.260 -20.880 -9.408 511 HD3 ARG 62 3HD ARG 62 11.520 -19.967 -8.094 512 HE ARG 62 HE ARG 62 10.985 -22.673 -8.809 513 HH11 ARG 62 1HH1 ARG 62 9.546 -19.792 -7.488 514 HH12 ARG 62 2HH1 ARG 62 8.338 -20.650 -6.589 515 HH21 ARG 62 1HH2 ARG 62 9.400 -23.814 -7.630 516 HH22 ARG 62 2HH2 ARG 62 8.257 -22.938 -6.670 517 H PHE 63 H PHE 63 13.381 -16.575 -11.690 518 HA PHE 63 HA PHE 63 11.639 -15.452 -13.616 519 HB2 PHE 63 2HB PHE 63 13.602 -14.897 -14.852 520 HB3 PHE 63 3HB PHE 63 14.021 -14.745 -13.149 521 HD1 PHE 63 HD2 PHE 63 15.309 -16.606 -12.050 522 HD2 PHE 63 HD1 PHE 63 14.775 -16.348 -16.265 523 HE1 PHE 63 HE2 PHE 63 17.207 -18.135 -12.381 524 HE2 PHE 63 HE1 PHE 63 16.672 -17.878 -16.602 525 HZ PHE 63 HZ PHE 63 17.892 -18.773 -14.659 526 H ASN 64 H ASN 64 12.877 -18.619 -13.157 527 HA ASN 64 HA ASN 64 12.992 -19.663 -15.708 528 HB2 ASN 64 2HB ASN 64 12.223 -20.845 -13.059 529 HB3 ASN 64 3HB ASN 64 12.116 -21.818 -14.522 530 HD21 ASN 64 1HD2 ASN 64 14.297 -19.914 -12.530 531 HD22 ASN 64 2HD2 ASN 64 15.741 -20.738 -13.000 532 H GLN 65 H GLN 65 10.202 -18.787 -13.813 533 HA GLN 65 HA GLN 65 8.430 -19.874 -15.892 534 HB2 GLN 65 2HB GLN 65 8.283 -19.985 -13.097 535 HB3 GLN 65 3HB GLN 65 7.053 -18.823 -13.576 536 HG2 GLN 65 2HG GLN 65 6.092 -21.022 -13.435 537 HG3 GLN 65 3HG GLN 65 6.105 -20.484 -15.113 538 HE21 GLN 65 1HE2 GLN 65 5.796 -22.846 -15.411 539 HE22 GLN 65 2HE2 GLN 65 7.209 -23.831 -15.534 540 H ALA 66 H ALA 66 6.198 -18.343 -15.509 541 HA ALA 66 HA ALA 66 6.717 -16.078 -17.071 542 HB1 ALA 66 1HB ALA 66 4.482 -17.436 -16.383 543 HB2 ALA 66 2HB ALA 66 4.289 -15.974 -15.416 544 HB3 ALA 66 3HB ALA 66 4.481 -15.854 -17.165 545 H ASP 67 H ASP 67 5.395 -13.946 -16.027 546 HA ASP 67 HA ASP 67 7.290 -12.556 -14.613 547 HB2 ASP 67 2HB ASP 67 5.581 -10.913 -14.123 548 HB3 ASP 67 3HB ASP 67 5.314 -11.551 -15.743 549 H TRP 68 H TRP 68 8.159 -12.972 -12.701 550 HA TRP 68 HA TRP 68 6.461 -14.129 -10.595 551 HB2 TRP 68 2HB TRP 68 8.840 -15.067 -11.545 552 HB3 TRP 68 3HB TRP 68 9.378 -14.100 -10.174 553 HD1 TRP 68 HD1 TRP 68 9.411 -15.342 -7.940 554 HE1 TRP 68 HE1 TRP 68 8.296 -17.456 -6.986 555 HE3 TRP 68 HE3 TRP 68 6.400 -16.528 -11.898 556 HZ2 TRP 68 HZ2 TRP 68 6.392 -19.373 -7.803 557 HZ3 TRP 68 HZ3 TRP 68 4.962 -18.518 -11.731 558 HH2 TRP 68 HH2 TRP 68 4.960 -19.910 -9.725 559 H THR 69 H THR 69 7.684 -13.569 -8.331 560 HA THR 69 HA THR 69 8.008 -10.641 -8.267 561 HB THR 69 HB THR 69 6.951 -11.001 -5.851 562 HG1 THR 69 HG1 THR 69 5.348 -12.591 -5.911 563 HG21 THR 69 3HG2 THR 69 5.049 -10.943 -8.168 564 HG22 THR 69 1HG2 THR 69 6.172 -9.611 -7.893 565 HG23 THR 69 2HG2 THR 69 4.989 -10.037 -6.656 566 H ILE 70 H ILE 70 9.611 -9.855 -6.994 567 HA ILE 70 HA ILE 70 11.144 -11.811 -5.408 568 HB ILE 70 HB ILE 70 12.442 -11.226 -7.352 569 HG12 ILE 70 2HG1 ILE 70 14.440 -10.302 -6.278 570 HG13 ILE 70 3HG1 ILE 70 13.461 -9.706 -4.941 571 HG21 ILE 70 1HG2 ILE 70 11.234 -8.682 -7.006 572 HG22 ILE 70 2HG2 ILE 70 12.984 -8.471 -6.958 573 HG23 ILE 70 3HG2 ILE 70 12.228 -9.255 -8.345 574 HD11 ILE 70 3HD1 ILE 70 14.792 -12.103 -5.040 575 HD12 ILE 70 1HD1 ILE 70 13.509 -11.672 -3.911 576 HD13 ILE 70 2HD1 ILE 70 13.123 -12.553 -5.390 577 H VAL 71 H VAL 71 11.164 -11.379 -3.312 578 HA VAL 71 HA VAL 71 10.399 -8.731 -2.369 579 HB VAL 71 HB VAL 71 10.446 -9.827 -0.104 580 HG11 VAL 71 1HG1 VAL 71 8.479 -11.462 -0.831 581 HG12 VAL 71 2HG1 VAL 71 8.300 -9.707 -0.849 582 HG13 VAL 71 3HG1 VAL 71 8.653 -10.573 -2.344 583 HG21 VAL 71 3HG2 VAL 71 10.581 -12.230 0.042 584 HG22 VAL 71 1HG2 VAL 71 10.786 -12.360 -1.705 585 HG23 VAL 71 2HG2 VAL 71 12.048 -11.617 -0.722 586 H VAL 72 H VAL 72 11.760 -7.284 -1.522 587 HA VAL 72 HA VAL 72 14.515 -8.151 -0.930 588 HB VAL 72 HB VAL 72 13.756 -5.408 -1.925 589 HG11 VAL 72 1HG1 VAL 72 15.983 -4.920 -1.954 590 HG12 VAL 72 2HG1 VAL 72 15.961 -6.064 -0.611 591 HG13 VAL 72 3HG1 VAL 72 16.461 -6.597 -2.216 592 HG21 VAL 72 3HG2 VAL 72 15.190 -6.731 -3.923 593 HG22 VAL 72 1HG2 VAL 72 13.958 -7.877 -3.395 594 HG23 VAL 72 2HG2 VAL 72 13.488 -6.274 -3.958 595 H ARG 73 H ARG 73 15.170 -7.812 1.086 596 HA ARG 73 HA ARG 73 13.564 -6.059 2.804 597 HB2 ARG 73 2HB ARG 73 14.749 -7.250 4.672 598 HB3 ARG 73 3HB ARG 73 13.732 -8.278 3.672 599 HG2 ARG 73 2HG ARG 73 15.445 -9.570 3.107 600 HG3 ARG 73 3HG ARG 73 16.443 -8.179 2.677 601 HD2 ARG 73 2HD ARG 73 17.570 -9.292 4.435 602 HD3 ARG 73 3HD ARG 73 16.842 -7.852 5.144 603 HE ARG 73 HE ARG 73 15.587 -9.209 6.480 604 HH11 ARG 73 1HH1 ARG 73 16.735 -11.066 3.768 605 HH12 ARG 73 2HH1 ARG 73 16.122 -12.570 4.371 606 HH21 ARG 73 1HH2 ARG 73 14.775 -11.183 7.285 607 HH22 ARG 73 2HH2 ARG 73 15.007 -12.635 6.371 608 H LYS 74 H LYS 74 14.321 -4.052 2.934 609 HA LYS 74 HA LYS 74 16.976 -3.289 2.362 610 HB2 LYS 74 2HB LYS 74 14.578 -1.938 3.512 611 HB3 LYS 74 3HB LYS 74 16.140 -1.151 3.693 612 HG2 LYS 74 2HG LYS 74 16.306 -1.621 1.111 613 HG3 LYS 74 3HG LYS 74 14.546 -1.666 1.239 614 HD2 LYS 74 2HD LYS 74 15.090 0.571 0.723 615 HD3 LYS 74 3HD LYS 74 14.721 0.559 2.449 616 HE2 LYS 74 2HE LYS 74 16.716 1.893 1.952 617 HE3 LYS 74 3HE LYS 74 17.093 0.508 2.976 618 HZ1 LYS 74 3HZ LYS 74 18.697 0.889 1.143 619 HZ2 LYS 74 1HZ LYS 74 17.470 0.533 0.033 620 HZ3 LYS 74 2HZ LYS 74 17.996 -0.651 1.121 621 H LYS 75 H LYS 75 18.571 -2.404 3.778 622 HA LYS 75 HA LYS 75 18.451 -2.434 6.569 623 HB2 LYS 75 2HB LYS 75 18.762 -5.032 5.430 624 HB3 LYS 75 3HB LYS 75 20.273 -4.595 6.218 625 HG2 LYS 75 2HG LYS 75 18.461 -3.850 8.099 626 HG3 LYS 75 3HG LYS 75 17.661 -5.246 7.372 627 HD2 LYS 75 2HD LYS 75 18.972 -6.576 8.578 628 HD3 LYS 75 3HD LYS 75 20.369 -5.951 7.698 629 HE2 LYS 75 2HE LYS 75 20.932 -5.521 9.902 630 HE3 LYS 75 3HE LYS 75 20.238 -3.986 9.381 631 HZ1 LYS 75 3HZ LYS 75 18.677 -4.154 10.926 632 HZ2 LYS 75 1HZ LYS 75 19.458 -5.525 11.536 633 HZ3 LYS 75 2HZ LYS 75 18.220 -5.694 10.397 634 H ALA 76 H ALA 76 20.875 -2.714 7.466 635 HA ALA 76 HA ALA 76 22.381 -0.692 6.095 636 HB1 ALA 76 1HB ALA 76 23.394 -2.307 8.411 637 HB2 ALA 76 2HB ALA 76 23.773 -0.642 7.971 638 HB3 ALA 76 3HB ALA 76 22.185 -1.041 8.625
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