NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
21973 | 2ipa | 15028 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 H1 MET 1 -23.219 -10.629 -8.154 2 2H MET 1 H2 MET 1 -22.995 -12.158 -7.628 3 3H MET 1 H3 MET 1 -24.460 -11.415 -7.428 4 HA MET 1 HA MET 1 -24.732 -12.932 -9.147 5 1HB MET 1 2HB MET 1 -25.669 -10.588 -9.499 6 2HB MET 1 3HB MET 1 -24.292 -10.268 -10.554 7 1HG MET 1 2HG MET 1 -26.208 -10.955 -11.881 8 2HG MET 1 3HG MET 1 -24.948 -12.174 -11.992 9 1HE MET 1 1HE MET 1 -28.526 -11.247 -10.780 10 2HE MET 1 2HE MET 1 -29.013 -12.639 -9.790 11 3HE MET 1 3HE MET 1 -27.787 -11.509 -9.182 12 H ALA 2 H ALA 2 -21.922 -10.778 -10.076 13 HA ALA 2 HA ALA 2 -20.302 -13.127 -10.519 14 1HB ALA 2 1HB ALA 2 -20.758 -11.077 -12.753 15 2HB ALA 2 2HB ALA 2 -19.557 -12.384 -12.771 16 3HB ALA 2 3HB ALA 2 -21.283 -12.776 -12.798 17 H ILE 3 H ILE 3 -17.993 -12.236 -10.948 18 HA ILE 3 HA ILE 3 -17.480 -9.716 -9.467 19 HB ILE 3 HB ILE 3 -15.717 -11.931 -10.570 20 1HG1 ILE 3 2HG1 ILE 3 -14.802 -11.990 -8.310 21 2HG1 ILE 3 3HG1 ILE 3 -15.728 -10.571 -7.836 22 1HG2 ILE 3 1HG2 ILE 3 -14.807 -9.172 -9.655 23 2HG2 ILE 3 2HG2 ILE 3 -13.736 -10.583 -9.859 24 3HG2 ILE 3 3HG2 ILE 3 -14.548 -9.891 -11.255 25 1HD1 ILE 3 1HD1 ILE 3 -16.950 -13.262 -8.561 26 2HD1 ILE 3 2HD1 ILE 3 -16.618 -12.676 -6.919 27 3HD1 ILE 3 3HD1 ILE 3 -17.806 -11.835 -7.906 28 H VAL 4 H VAL 4 -18.388 -8.169 -10.700 29 HA VAL 4 HA VAL 4 -18.089 -8.008 -13.600 30 HB VAL 4 HB VAL 4 -19.032 -5.957 -11.553 31 1HG1 VAL 4 1HG1 VAL 4 -19.527 -6.127 -14.555 32 2HG1 VAL 4 2HG1 VAL 4 -20.373 -5.028 -13.447 33 3HG1 VAL 4 3HG1 VAL 4 -18.647 -4.844 -13.681 34 1HG2 VAL 4 1HG2 VAL 4 -20.458 -7.934 -11.329 35 2HG2 VAL 4 2HG2 VAL 4 -21.352 -6.679 -12.171 36 3HG2 VAL 4 3HG2 VAL 4 -20.656 -8.029 -13.093 37 H LYS 5 H LYS 5 -16.965 -5.954 -14.504 38 HA LYS 5 HA LYS 5 -14.594 -5.138 -12.893 39 1HB LYS 5 2HB LYS 5 -13.938 -6.842 -14.564 40 2HB LYS 5 3HB LYS 5 -14.651 -5.856 -15.851 41 1HG LYS 5 2HG LYS 5 -13.003 -4.078 -15.455 42 2HG LYS 5 3HG LYS 5 -12.392 -4.919 -14.022 43 1HD LYS 5 2HD LYS 5 -10.870 -5.232 -15.893 44 2HD LYS 5 3HD LYS 5 -11.589 -6.779 -15.424 45 1HE LYS 5 2HE LYS 5 -13.216 -6.581 -17.310 46 2HE LYS 5 3HE LYS 5 -12.489 -5.037 -17.770 47 1HZ LYS 5 1HZ LYS 5 -11.097 -7.655 -17.784 48 2HZ LYS 5 2HZ LYS 5 -11.632 -6.858 -19.098 49 3HZ LYS 5 3HZ LYS 5 -10.418 -6.228 -18.213 50 H ALA 6 H ALA 6 -14.077 -2.959 -13.137 51 HA ALA 6 HA ALA 6 -16.037 -1.275 -14.640 52 1HB ALA 6 1HB ALA 6 -14.935 -0.999 -11.819 53 2HB ALA 6 2HB ALA 6 -15.649 0.364 -12.699 54 3HB ALA 6 3HB ALA 6 -16.629 -1.056 -12.363 55 H THR 7 H THR 7 -15.101 1.060 -14.649 56 HA THR 7 HA THR 7 -12.310 1.416 -14.983 57 HB THR 7 HB THR 7 -12.680 0.147 -17.029 58 HG1 THR 7 1HG THR 7 -11.673 1.508 -18.324 59 1HG2 THR 7 1HG2 THR 7 -14.807 2.205 -17.742 60 2HG2 THR 7 2HG2 THR 7 -14.092 1.046 -18.881 61 3HG2 THR 7 3HG2 THR 7 -15.022 0.454 -17.506 62 H ASP 8 H ASP 8 -12.474 3.675 -16.539 63 HA ASP 8 HA ASP 8 -12.522 5.585 -14.689 64 1HB ASP 8 2HB ASP 8 -11.518 5.871 -16.832 65 2HB ASP 8 3HB ASP 8 -13.083 5.821 -17.649 66 H GLN 9 H GLN 9 -15.448 4.776 -16.524 67 HA GLN 9 HA GLN 9 -17.048 6.551 -14.722 68 1HB GLN 9 2HB GLN 9 -17.191 6.253 -17.743 69 2HB GLN 9 3HB GLN 9 -18.537 6.895 -16.794 70 1HG GLN 9 2HG GLN 9 -17.346 8.817 -16.118 71 2HG GLN 9 3HG GLN 9 -15.785 8.114 -16.494 72 1HE2 GLN 9 2HE2 GLN 9 -14.823 8.780 -18.347 73 2HE2 GLN 9 1HE2 GLN 9 -15.665 9.452 -19.740 74 H SER 10 H SER 10 -16.788 3.466 -16.509 75 HA SER 10 HA SER 10 -19.421 2.612 -16.094 76 1HB SER 10 2HB SER 10 -16.969 0.833 -16.219 77 2HB SER 10 3HB SER 10 -18.633 0.439 -16.691 78 HG SER 10 HG SER 10 -17.472 0.976 -18.536 79 H PHE 11 H PHE 11 -16.868 2.949 -13.718 80 HA PHE 11 HA PHE 11 -17.730 1.186 -11.676 81 1HB PHE 11 3HB PHE 11 -15.762 2.634 -11.534 82 2HB PHE 11 2HB PHE 11 -16.760 4.074 -11.557 83 HD1 PHE 11 HD1 PHE 11 -18.240 4.636 -9.572 84 HD2 PHE 11 HD2 PHE 11 -15.310 1.469 -9.460 85 HE1 PHE 11 HE1 PHE 11 -18.314 4.651 -7.102 86 HE2 PHE 11 HE2 PHE 11 -15.347 1.544 -6.986 87 HZ PHE 11 HZ PHE 11 -16.862 3.110 -5.803 88 H SER 12 H SER 12 -18.882 4.559 -12.356 89 HA SER 12 HA SER 12 -20.916 4.533 -10.428 90 1HB SER 12 2HB SER 12 -20.840 6.157 -12.997 91 2HB SER 12 3HB SER 12 -21.581 6.602 -11.446 92 HG SER 12 HG SER 12 -19.521 7.584 -11.752 93 H ALA 13 H ALA 13 -21.019 3.753 -13.939 94 HA ALA 13 HA ALA 13 -23.811 3.397 -14.145 95 1HB ALA 13 1HB ALA 13 -21.627 1.938 -15.690 96 2HB ALA 13 2HB ALA 13 -23.316 2.148 -16.184 97 3HB ALA 13 3HB ALA 13 -22.253 3.564 -16.078 98 H GLU 14 H GLU 14 -21.411 1.297 -12.635 99 HA GLU 14 HA GLU 14 -23.316 -0.969 -12.572 100 1HB GLU 14 2HB GLU 14 -20.358 -0.705 -11.926 101 2HB GLU 14 3HB GLU 14 -21.281 -2.163 -11.602 102 1HG GLU 14 2HG GLU 14 -20.921 -0.906 -14.358 103 2HG GLU 14 3HG GLU 14 -20.004 -2.268 -13.727 104 H THR 15 H THR 15 -22.211 1.642 -10.469 105 HA THR 15 HA THR 15 -23.037 0.104 -8.079 106 HB THR 15 HB THR 15 -21.772 1.825 -6.853 107 HG1 THR 15 1HG THR 15 -20.394 3.166 -8.146 108 1HG2 THR 15 1HG2 THR 15 -20.261 0.307 -9.017 109 2HG2 THR 15 2HG2 THR 15 -19.471 1.194 -7.702 110 3HG2 THR 15 3HG2 THR 15 -20.544 -0.155 -7.329 111 H SER 16 H SER 16 -24.271 2.693 -10.055 112 HA SER 16 HA SER 16 -25.548 4.232 -8.124 113 1HB SER 16 2HB SER 16 -26.243 3.668 -11.015 114 2HB SER 16 3HB SER 16 -27.101 4.864 -10.027 115 HG SER 16 HG SER 16 -25.348 5.768 -11.210 116 H GLU 17 H GLU 17 -26.388 0.944 -8.668 117 HA GLU 17 HA GLU 17 -28.998 1.348 -7.333 118 1HB GLU 17 2HB GLU 17 -28.580 -0.258 -9.897 119 2HB GLU 17 3HB GLU 17 -30.020 -0.328 -8.877 120 1HG GLU 17 2HG GLU 17 -30.397 2.113 -9.273 121 2HG GLU 17 3HG GLU 17 -29.024 2.125 -10.386 122 H GLY 18 H GLY 18 -29.709 -0.593 -6.236 123 1HA GLY 18 2HA GLY 18 -29.451 -2.555 -5.068 124 2HA GLY 18 3HA GLY 18 -28.137 -3.002 -6.162 125 H VAL 19 H VAL 19 -27.040 -3.847 -4.298 126 HA VAL 19 HA VAL 19 -25.491 -1.794 -2.820 127 HB VAL 19 HB VAL 19 -26.269 -4.542 -1.759 128 1HG1 VAL 19 1HG1 VAL 19 -24.768 -2.210 -0.474 129 2HG1 VAL 19 2HG1 VAL 19 -25.251 -3.697 0.357 130 3HG1 VAL 19 3HG1 VAL 19 -24.077 -3.771 -0.950 131 1HG2 VAL 19 1HG2 VAL 19 -28.272 -3.201 -1.677 132 2HG2 VAL 19 2HG2 VAL 19 -27.604 -3.220 -0.049 133 3HG2 VAL 19 3HG2 VAL 19 -27.384 -1.795 -1.072 134 H VAL 20 H VAL 20 -23.302 -2.077 -3.093 135 HA VAL 20 HA VAL 20 -22.454 -4.264 -4.899 136 HB VAL 20 HB VAL 20 -22.159 -1.289 -5.530 137 1HG1 VAL 20 1HG1 VAL 20 -21.603 -3.841 -7.094 138 2HG1 VAL 20 2HG1 VAL 20 -21.582 -2.219 -7.811 139 3HG1 VAL 20 3HG1 VAL 20 -20.420 -2.637 -6.544 140 1HG2 VAL 20 1HG2 VAL 20 -24.509 -1.684 -5.798 141 2HG2 VAL 20 2HG2 VAL 20 -23.818 -1.780 -7.411 142 3HG2 VAL 20 3HG2 VAL 20 -24.238 -3.265 -6.561 143 H LEU 21 H LEU 21 -20.362 -4.834 -4.605 144 HA LEU 21 HA LEU 21 -18.764 -3.318 -2.585 145 1HB LEU 21 2HB LEU 21 -19.538 -5.621 -1.985 146 2HB LEU 21 3HB LEU 21 -18.713 -6.248 -3.409 147 HG LEU 21 HG LEU 21 -16.523 -5.433 -2.448 148 1HD1 LEU 21 1HD1 LEU 21 -18.338 -4.708 -0.102 149 2HD1 LEU 21 2HD1 LEU 21 -16.592 -4.931 0.069 150 3HD1 LEU 21 3HD1 LEU 21 -17.207 -3.646 -0.977 151 1HD2 LEU 21 1HD2 LEU 21 -17.335 -7.761 -2.155 152 2HD2 LEU 21 2HD2 LEU 21 -16.367 -7.220 -0.781 153 3HD2 LEU 21 3HD2 LEU 21 -18.138 -7.290 -0.641 154 H ALA 22 H ALA 22 -17.476 -1.947 -3.792 155 HA ALA 22 HA ALA 22 -16.257 -2.919 -6.306 156 1HB ALA 22 1HB ALA 22 -16.093 -0.231 -4.896 157 2HB ALA 22 2HB ALA 22 -15.362 -0.648 -6.460 158 3HB ALA 22 3HB ALA 22 -17.131 -0.621 -6.287 159 H ASP 23 H ASP 23 -14.134 -3.533 -6.380 160 HA ASP 23 HA ASP 23 -12.403 -3.335 -3.951 161 1HB ASP 23 2HB ASP 23 -13.276 -5.572 -4.005 162 2HB ASP 23 3HB ASP 23 -13.051 -5.692 -5.739 163 H PHE 24 H PHE 24 -10.141 -3.349 -4.422 164 HA PHE 24 HA PHE 24 -9.397 -2.455 -7.168 165 1HB PHE 24 2HB PHE 24 -8.815 -1.160 -4.482 166 2HB PHE 24 3HB PHE 24 -8.018 -0.722 -5.975 167 HD1 PHE 24 HD1 PHE 24 -8.969 0.909 -7.412 168 HD2 PHE 24 HD2 PHE 24 -11.451 -0.863 -4.375 169 HE1 PHE 24 HE1 PHE 24 -10.759 2.550 -7.913 170 HE2 PHE 24 HE2 PHE 24 -13.260 0.709 -4.948 171 HZ PHE 24 HZ PHE 24 -12.901 2.467 -6.676 172 H TRP 25 H TRP 25 -7.731 -3.672 -7.886 173 HA TRP 25 HA TRP 25 -5.816 -4.943 -6.009 174 1HB TRP 25 2HB TRP 25 -6.249 -7.107 -6.803 175 2HB TRP 25 3HB TRP 25 -7.862 -6.468 -6.558 176 HD1 TRP 25 HD1 TRP 25 -8.906 -5.347 -9.011 177 HE1 TRP 25 HE1 TRP 25 -8.781 -6.261 -11.389 178 HE3 TRP 25 HE3 TRP 25 -5.033 -8.643 -8.398 179 HZ2 TRP 25 HZ2 TRP 25 -7.101 -8.090 -12.889 180 HZ3 TRP 25 HZ3 TRP 25 -4.130 -9.884 -10.338 181 HH2 TRP 25 HH2 TRP 25 -5.151 -9.613 -12.589 182 H ALA 26 H ALA 26 -3.807 -5.557 -7.168 183 HA ALA 26 HA ALA 26 -3.619 -5.454 -10.010 184 1HB ALA 26 1HB ALA 26 -2.539 -3.120 -8.407 185 2HB ALA 26 2HB ALA 26 -1.858 -3.528 -9.993 186 3HB ALA 26 3HB ALA 26 -3.550 -3.057 -9.862 187 HA PRO 27 HA PRO 27 -0.172 -8.034 -9.202 188 1HB PRO 27 2HB PRO 27 1.562 -6.182 -10.854 189 2HB PRO 27 3HB PRO 27 1.488 -7.973 -10.886 190 1HG PRO 27 2HG PRO 27 0.153 -6.550 -12.752 191 2HG PRO 27 3HG PRO 27 -0.662 -7.933 -11.949 192 1HD PRO 27 2HD PRO 27 -0.947 -4.986 -11.378 193 2HD PRO 27 3HD PRO 27 -2.212 -6.248 -11.469 194 H TRP 28 H TRP 28 0.281 -4.667 -8.316 195 HA TRP 28 HA TRP 28 2.853 -4.576 -7.351 196 1HB TRP 28 2HB TRP 28 0.485 -3.246 -6.001 197 2HB TRP 28 3HB TRP 28 2.145 -2.688 -6.023 198 HD1 TRP 28 HD1 TRP 28 -1.036 -1.988 -7.510 199 HE1 TRP 28 HE1 TRP 28 -0.910 -0.611 -9.664 200 HE3 TRP 28 HE3 TRP 28 3.989 -2.351 -8.323 201 HZ2 TRP 28 HZ2 TRP 28 1.197 0.413 -11.390 202 HZ3 TRP 28 HZ3 TRP 28 5.052 -1.078 -10.168 203 HH2 TRP 28 HH2 TRP 28 3.669 0.305 -11.703 204 H CYS 29 H CYS 29 0.192 -6.339 -5.790 205 HA CYS 29 HA CYS 29 1.823 -6.607 -3.309 206 1HB CYS 29 2HB CYS 29 -0.277 -4.846 -3.556 207 2HB CYS 29 3HB CYS 29 -1.122 -6.278 -3.010 208 H GLY 30 H GLY 30 1.167 -8.368 -1.922 209 1HA GLY 30 2HA GLY 30 0.488 -10.807 -3.298 210 2HA GLY 30 3HA GLY 30 0.725 -10.582 -1.559 211 HA PRO 31 HA PRO 31 -3.643 -10.318 -0.587 212 1HB PRO 31 2HB PRO 31 -3.639 -7.305 -0.833 213 2HB PRO 31 3HB PRO 31 -4.512 -8.329 0.358 214 1HG PRO 31 2HG PRO 31 -2.159 -7.203 1.059 215 2HG PRO 31 3HG PRO 31 -2.448 -8.933 1.443 216 1HD PRO 31 2HD PRO 31 -0.855 -7.742 -0.816 217 2HD PRO 31 3HD PRO 31 -0.469 -9.164 0.195 218 H SER 32 H SER 32 -2.797 -8.259 -3.437 219 HA SER 32 HA SER 32 -5.249 -8.107 -4.690 220 1HB SER 32 2HB SER 32 -2.606 -8.752 -6.040 221 2HB SER 32 3HB SER 32 -3.955 -7.807 -6.688 222 HG SER 32 HG SER 32 -2.246 -6.531 -5.932 223 H LYS 33 H LYS 33 -3.263 -11.007 -4.227 224 HA LYS 33 HA LYS 33 -5.019 -12.557 -6.073 225 1HB LYS 33 2HB LYS 33 -2.301 -13.386 -4.987 226 2HB LYS 33 3HB LYS 33 -3.260 -14.165 -6.236 227 1HG LYS 33 2HG LYS 33 -1.859 -13.102 -7.638 228 2HG LYS 33 3HG LYS 33 -2.985 -11.757 -7.442 229 1HD LYS 33 2HD LYS 33 -1.485 -10.844 -5.627 230 2HD LYS 33 3HD LYS 33 -0.394 -12.214 -5.879 231 1HE LYS 33 2HE LYS 33 -0.067 -11.482 -8.254 232 2HE LYS 33 3HE LYS 33 -1.108 -10.084 -7.944 233 1HZ LYS 33 1HZ LYS 33 1.478 -10.652 -6.606 234 2HZ LYS 33 2HZ LYS 33 1.211 -9.453 -7.681 235 3HZ LYS 33 3HZ LYS 33 0.487 -9.405 -6.214 236 H MET 34 H MET 34 -5.191 -11.721 -2.982 237 HA MET 34 HA MET 34 -6.058 -14.439 -2.061 238 1HB MET 34 2HB MET 34 -5.066 -12.133 -0.337 239 2HB MET 34 3HB MET 34 -5.655 -13.700 0.225 240 1HG MET 34 2HG MET 34 -3.801 -14.783 -1.118 241 2HG MET 34 3HG MET 34 -3.132 -13.174 -1.388 242 1HE MET 34 1HE MET 34 -3.568 -11.698 1.465 243 2HE MET 34 2HE MET 34 -2.029 -12.103 2.249 244 3HE MET 34 3HE MET 34 -2.048 -11.659 0.532 245 H ILE 35 H ILE 35 -6.698 -10.871 -1.947 246 HA ILE 35 HA ILE 35 -9.347 -11.154 -0.973 247 HB ILE 35 HB ILE 35 -7.784 -9.077 -1.125 248 1HG1 ILE 35 2HG1 ILE 35 -9.789 -7.511 -1.287 249 2HG1 ILE 35 3HG1 ILE 35 -10.780 -8.944 -1.577 250 1HG2 ILE 35 1HG2 ILE 35 -9.190 -8.661 -3.785 251 2HG2 ILE 35 2HG2 ILE 35 -8.075 -7.563 -2.966 252 3HG2 ILE 35 3HG2 ILE 35 -7.473 -9.097 -3.601 253 1HD1 ILE 35 1HD1 ILE 35 -8.999 -8.449 0.862 254 2HD1 ILE 35 2HD1 ILE 35 -10.754 -8.237 0.812 255 3HD1 ILE 35 3HD1 ILE 35 -10.062 -9.858 0.636 256 H ALA 36 H ALA 36 -7.943 -11.388 -4.245 257 HA ALA 36 HA ALA 36 -10.319 -11.303 -5.720 258 1HB ALA 36 1HB ALA 36 -7.690 -12.723 -6.324 259 2HB ALA 36 2HB ALA 36 -9.010 -12.497 -7.485 260 3HB ALA 36 3HB ALA 36 -8.172 -11.092 -6.789 261 HA PRO 37 HA PRO 37 -10.977 -15.995 -5.461 262 1HB PRO 37 2HB PRO 37 -9.721 -17.504 -3.502 263 2HB PRO 37 3HB PRO 37 -9.164 -17.340 -5.195 264 1HG PRO 37 2HG PRO 37 -8.220 -15.817 -2.762 265 2HG PRO 37 3HG PRO 37 -7.233 -16.560 -4.058 266 1HD PRO 37 2HD PRO 37 -7.779 -13.911 -4.100 267 2HD PRO 37 3HD PRO 37 -7.803 -14.868 -5.604 268 H VAL 38 H VAL 38 -10.235 -14.295 -2.345 269 HA VAL 38 HA VAL 38 -12.413 -15.365 -0.877 270 HB VAL 38 HB VAL 38 -10.755 -12.847 -0.753 271 1HG1 VAL 38 1HG1 VAL 38 -13.208 -13.394 0.904 272 2HG1 VAL 38 2HG1 VAL 38 -11.882 -12.331 1.461 273 3HG1 VAL 38 3HG1 VAL 38 -12.788 -11.932 -0.002 274 1HG2 VAL 38 1HG2 VAL 38 -9.845 -15.026 0.056 275 2HG2 VAL 38 2HG2 VAL 38 -9.992 -13.829 1.347 276 3HG2 VAL 38 3HG2 VAL 38 -11.187 -15.139 1.210 277 H LEU 39 H LEU 39 -12.350 -12.627 -3.230 278 HA LEU 39 HA LEU 39 -15.100 -11.918 -2.770 279 1HB LEU 39 2HB LEU 39 -13.139 -11.391 -5.026 280 2HB LEU 39 3HB LEU 39 -14.788 -10.793 -5.073 281 HG LEU 39 HG LEU 39 -12.966 -10.178 -2.710 282 1HD1 LEU 39 1HD1 LEU 39 -13.310 -8.498 -5.228 283 2HD1 LEU 39 2HD1 LEU 39 -12.392 -8.079 -3.758 284 3HD1 LEU 39 3HD1 LEU 39 -11.848 -9.410 -4.776 285 1HD2 LEU 39 1HD2 LEU 39 -15.319 -9.721 -2.286 286 2HD2 LEU 39 2HD2 LEU 39 -14.450 -8.192 -2.497 287 3HD2 LEU 39 3HD2 LEU 39 -15.452 -8.813 -3.805 288 H GLU 40 H GLU 40 -13.510 -14.183 -5.087 289 HA GLU 40 HA GLU 40 -15.979 -14.796 -6.467 290 1HB GLU 40 2HB GLU 40 -13.368 -16.336 -6.184 291 2HB GLU 40 3HB GLU 40 -14.729 -16.855 -7.191 292 1HG GLU 40 2HG GLU 40 -14.614 -14.715 -8.456 293 2HG GLU 40 3HG GLU 40 -13.215 -14.223 -7.504 294 H GLU 41 H GLU 41 -14.389 -16.133 -3.562 295 HA GLU 41 HA GLU 41 -16.310 -18.215 -3.076 296 1HB GLU 41 2HB GLU 41 -14.321 -16.731 -1.331 297 2HB GLU 41 3HB GLU 41 -15.338 -18.012 -0.698 298 1HG GLU 41 2HG GLU 41 -13.608 -18.535 -3.140 299 2HG GLU 41 3HG GLU 41 -12.909 -18.522 -1.526 300 H LEU 42 H LEU 42 -16.324 -14.736 -2.489 301 HA LEU 42 HA LEU 42 -18.545 -14.793 -0.614 302 1HB LEU 42 2HB LEU 42 -16.829 -12.993 -0.648 303 2HB LEU 42 3HB LEU 42 -17.331 -12.542 -2.271 304 HG LEU 42 HG LEU 42 -19.569 -11.890 -1.432 305 1HD1 LEU 42 1HD1 LEU 42 -18.335 -12.503 1.289 306 2HD1 LEU 42 2HD1 LEU 42 -19.859 -11.622 1.021 307 3HD1 LEU 42 3HD1 LEU 42 -19.741 -13.323 0.564 308 1HD2 LEU 42 1HD2 LEU 42 -17.739 -10.225 -1.615 309 2HD2 LEU 42 2HD2 LEU 42 -18.805 -9.856 -0.256 310 3HD2 LEU 42 3HD2 LEU 42 -17.220 -10.604 0.037 311 H ASP 43 H ASP 43 -18.148 -14.044 -4.112 312 HA ASP 43 HA ASP 43 -20.860 -13.439 -4.625 313 1HB ASP 43 2HB ASP 43 -19.117 -12.917 -6.216 314 2HB ASP 43 3HB ASP 43 -18.749 -14.629 -6.457 315 H GLN 44 H GLN 44 -19.166 -16.642 -4.811 316 HA GLN 44 HA GLN 44 -21.564 -17.929 -5.726 317 1HB GLN 44 2HB GLN 44 -20.380 -19.988 -5.571 318 2HB GLN 44 3HB GLN 44 -19.321 -18.744 -6.220 319 1HG GLN 44 2HG GLN 44 -18.406 -18.505 -3.808 320 2HG GLN 44 3HG GLN 44 -19.260 -20.006 -3.453 321 1HE2 GLN 44 2HE2 GLN 44 -16.761 -18.510 -5.515 322 2HE2 GLN 44 1HE2 GLN 44 -15.916 -19.999 -5.923 323 H GLU 45 H GLU 45 -20.886 -16.747 -2.599 324 HA GLU 45 HA GLU 45 -22.693 -18.744 -1.316 325 1HB GLU 45 2HB GLU 45 -20.695 -18.344 -0.097 326 2HB GLU 45 3HB GLU 45 -20.888 -16.584 -0.168 327 1HG GLU 45 2HG GLU 45 -22.840 -16.645 1.246 328 2HG GLU 45 3HG GLU 45 -22.934 -18.406 1.163 329 H MET 46 H MET 46 -22.355 -15.173 -1.830 330 HA MET 46 HA MET 46 -25.289 -14.918 -1.344 331 1HB MET 46 2HB MET 46 -24.838 -13.008 0.152 332 2HB MET 46 3HB MET 46 -24.282 -14.554 0.771 333 1HG MET 46 2HG MET 46 -21.971 -14.009 0.142 334 2HG MET 46 3HG MET 46 -22.490 -12.447 -0.503 335 1HE MET 46 1HE MET 46 -24.356 -11.037 1.392 336 2HE MET 46 2HE MET 46 -23.258 -10.313 2.589 337 3HE MET 46 3HE MET 46 -22.805 -10.340 0.872 338 H GLY 47 H GLY 47 -23.275 -14.593 -3.742 339 1HA GLY 47 2HA GLY 47 -23.632 -11.967 -4.755 340 2HA GLY 47 3HA GLY 47 -23.393 -13.463 -5.677 341 H ASP 48 H ASP 48 -25.960 -14.535 -4.224 342 HA ASP 48 HA ASP 48 -27.998 -13.868 -6.067 343 1HB ASP 48 2HB ASP 48 -28.099 -15.839 -4.664 344 2HB ASP 48 3HB ASP 48 -28.080 -14.860 -3.198 345 H LYS 49 H LYS 49 -26.825 -12.065 -3.238 346 HA LYS 49 HA LYS 49 -29.078 -10.127 -3.593 347 1HB LYS 49 2HB LYS 49 -27.425 -10.170 -1.101 348 2HB LYS 49 3HB LYS 49 -29.052 -9.594 -1.367 349 1HG LYS 49 2HG LYS 49 -29.430 -11.367 -0.008 350 2HG LYS 49 3HG LYS 49 -29.691 -12.134 -1.577 351 1HD LYS 49 2HD LYS 49 -27.539 -13.264 -1.440 352 2HD LYS 49 3HD LYS 49 -26.984 -12.172 -0.174 353 1HE LYS 49 2HE LYS 49 -27.427 -14.294 0.831 354 2HE LYS 49 3HE LYS 49 -28.598 -13.117 1.421 355 1HZ LYS 49 1HZ LYS 49 -29.134 -15.160 -0.666 356 2HZ LYS 49 2HZ LYS 49 -29.642 -15.217 0.880 357 3HZ LYS 49 3HZ LYS 49 -30.226 -14.072 -0.119 358 H LEU 50 H LEU 50 -25.742 -10.519 -4.193 359 HA LEU 50 HA LEU 50 -25.125 -7.640 -3.676 360 1HB LEU 50 2HB LEU 50 -24.265 -9.069 -1.870 361 2HB LEU 50 3HB LEU 50 -23.544 -10.170 -3.042 362 HG LEU 50 HG LEU 50 -21.973 -8.393 -3.777 363 1HD1 LEU 50 1HD1 LEU 50 -23.205 -6.768 -1.501 364 2HD1 LEU 50 2HD1 LEU 50 -21.736 -6.338 -2.417 365 3HD1 LEU 50 3HD1 LEU 50 -23.287 -6.376 -3.228 366 1HD2 LEU 50 1HD2 LEU 50 -21.314 -9.993 -2.040 367 2HD2 LEU 50 2HD2 LEU 50 -20.562 -8.412 -1.781 368 3HD2 LEU 50 3HD2 LEU 50 -21.953 -8.908 -0.785 369 H LYS 51 H LYS 51 -24.010 -6.614 -5.289 370 HA LYS 51 HA LYS 51 -22.888 -8.245 -7.530 371 1HB LYS 51 2HB LYS 51 -24.384 -6.456 -8.235 372 2HB LYS 51 3HB LYS 51 -23.494 -5.275 -7.271 373 1HG LYS 51 2HG LYS 51 -21.477 -5.634 -8.686 374 2HG LYS 51 3HG LYS 51 -22.360 -6.811 -9.661 375 1HD LYS 51 2HD LYS 51 -23.097 -3.867 -9.325 376 2HD LYS 51 3HD LYS 51 -22.173 -4.532 -10.678 377 1HE LYS 51 2HE LYS 51 -24.091 -5.979 -11.294 378 2HE LYS 51 3HE LYS 51 -25.032 -5.310 -9.953 379 1HZ LYS 51 1HZ LYS 51 -23.982 -3.782 -12.266 380 2HZ LYS 51 2HZ LYS 51 -25.551 -4.189 -12.016 381 3HZ LYS 51 3HZ LYS 51 -24.811 -3.122 -11.009 382 H ILE 52 H ILE 52 -20.641 -8.105 -7.932 383 HA ILE 52 HA ILE 52 -18.999 -6.579 -5.982 384 HB ILE 52 HB ILE 52 -18.514 -9.377 -7.095 385 1HG1 ILE 52 2HG1 ILE 52 -18.918 -8.367 -4.238 386 2HG1 ILE 52 3HG1 ILE 52 -20.038 -9.358 -5.169 387 1HG2 ILE 52 1HG2 ILE 52 -16.656 -7.598 -5.451 388 2HG2 ILE 52 2HG2 ILE 52 -16.355 -9.302 -5.882 389 3HG2 ILE 52 3HG2 ILE 52 -16.415 -8.094 -7.141 390 1HD1 ILE 52 1HD1 ILE 52 -17.373 -10.193 -4.011 391 2HD1 ILE 52 2HD1 ILE 52 -18.985 -10.855 -3.702 392 3HD1 ILE 52 3HD1 ILE 52 -18.197 -11.134 -5.267 393 H VAL 53 H VAL 53 -17.322 -5.444 -7.021 394 HA VAL 53 HA VAL 53 -17.098 -5.712 -9.955 395 HB VAL 53 HB VAL 53 -17.390 -2.999 -8.613 396 1HG1 VAL 53 1HG1 VAL 53 -17.583 -3.923 -11.520 397 2HG1 VAL 53 2HG1 VAL 53 -17.873 -2.271 -10.945 398 3HG1 VAL 53 3HG1 VAL 53 -16.261 -2.982 -10.790 399 1HG2 VAL 53 1HG2 VAL 53 -19.565 -4.090 -8.313 400 2HG2 VAL 53 2HG2 VAL 53 -19.670 -2.807 -9.516 401 3HG2 VAL 53 3HG2 VAL 53 -19.629 -4.503 -10.033 402 H LYS 54 H LYS 54 -14.943 -5.158 -10.669 403 HA LYS 54 HA LYS 54 -13.045 -4.423 -8.484 404 1HB LYS 54 2HB LYS 54 -12.683 -6.474 -10.694 405 2HB LYS 54 3HB LYS 54 -11.381 -5.861 -9.665 406 1HG LYS 54 2HG LYS 54 -12.628 -6.665 -7.641 407 2HG LYS 54 3HG LYS 54 -13.869 -7.335 -8.693 408 1HD LYS 54 2HD LYS 54 -12.476 -9.166 -8.137 409 2HD LYS 54 3HD LYS 54 -12.017 -8.718 -9.792 410 1HE LYS 54 2HE LYS 54 -10.187 -7.255 -8.640 411 2HE LYS 54 3HE LYS 54 -10.555 -8.152 -7.175 412 1HZ LYS 54 1HZ LYS 54 -9.593 -9.308 -9.739 413 2HZ LYS 54 2HZ LYS 54 -8.725 -9.160 -8.368 414 3HZ LYS 54 3HZ LYS 54 -9.994 -10.201 -8.430 415 H ILE 55 H ILE 55 -11.379 -3.090 -8.967 416 HA ILE 55 HA ILE 55 -11.119 -1.991 -11.731 417 HB ILE 55 HB ILE 55 -10.610 -0.724 -9.008 418 1HG1 ILE 55 2HG1 ILE 55 -12.975 -0.583 -9.879 419 2HG1 ILE 55 3HG1 ILE 55 -12.195 0.949 -9.531 420 1HG2 ILE 55 1HG2 ILE 55 -9.780 0.307 -11.752 421 2HG2 ILE 55 2HG2 ILE 55 -9.781 1.285 -10.266 422 3HG2 ILE 55 3HG2 ILE 55 -8.727 -0.126 -10.412 423 1HD1 ILE 55 1HD1 ILE 55 -12.474 -0.217 -12.321 424 2HD1 ILE 55 2HD1 ILE 55 -13.520 1.035 -11.610 425 3HD1 ILE 55 3HD1 ILE 55 -11.820 1.384 -11.916 426 H ASP 56 H ASP 56 -9.323 -2.787 -12.637 427 HA ASP 56 HA ASP 56 -7.095 -3.963 -11.120 428 1HB ASP 56 2HB ASP 56 -7.728 -4.883 -13.299 429 2HB ASP 56 3HB ASP 56 -7.496 -3.314 -14.064 430 H VAL 57 H VAL 57 -5.826 -2.473 -10.011 431 HA VAL 57 HA VAL 57 -5.739 0.272 -11.016 432 HB VAL 57 HB VAL 57 -4.671 0.909 -8.933 433 1HG1 VAL 57 1HG1 VAL 57 -7.293 -0.581 -8.589 434 2HG1 VAL 57 2HG1 VAL 57 -6.674 0.749 -7.583 435 3HG1 VAL 57 3HG1 VAL 57 -7.096 1.055 -9.272 436 1HG2 VAL 57 1HG2 VAL 57 -3.628 -1.149 -8.158 437 2HG2 VAL 57 2HG2 VAL 57 -4.810 -0.556 -6.980 438 3HG2 VAL 57 3HG2 VAL 57 -5.225 -1.930 -8.000 439 H ASP 58 H ASP 58 -4.558 -1.315 -12.773 440 HA ASP 58 HA ASP 58 -2.247 0.472 -12.990 441 1HB ASP 58 2HB ASP 58 -1.088 -1.603 -12.476 442 2HB ASP 58 3HB ASP 58 -2.049 -2.487 -13.666 443 H GLU 59 H GLU 59 -4.489 -1.893 -14.546 444 HA GLU 59 HA GLU 59 -4.294 -0.679 -17.158 445 1HB GLU 59 2HB GLU 59 -4.854 -3.044 -16.758 446 2HB GLU 59 3HB GLU 59 -6.352 -2.573 -15.945 447 1HG GLU 59 2HG GLU 59 -7.250 -1.645 -18.012 448 2HG GLU 59 3HG GLU 59 -5.708 -1.879 -18.837 449 H ASN 60 H ASN 60 -6.590 -0.347 -14.412 450 HA ASN 60 HA ASN 60 -8.089 1.776 -15.896 451 1HB ASN 60 2HB ASN 60 -9.129 -0.596 -14.296 452 2HB ASN 60 3HB ASN 60 -10.134 0.776 -14.730 453 1HD2 ASN 60 2HD2 ASN 60 -10.471 -2.053 -15.565 454 2HD2 ASN 60 1HD2 ASN 60 -10.383 -2.048 -17.306 455 H GLN 61 H GLN 61 -5.910 1.950 -13.816 456 HA GLN 61 HA GLN 61 -7.078 2.447 -11.293 457 1HB GLN 61 2HB GLN 61 -4.962 3.060 -10.552 458 2HB GLN 61 3HB GLN 61 -4.649 1.911 -11.848 459 1HG GLN 61 2HG GLN 61 -4.147 3.792 -13.396 460 2HG GLN 61 3HG GLN 61 -4.347 4.914 -12.041 461 1HE2 GLN 61 2HE2 GLN 61 -2.988 4.089 -9.930 462 2HE2 GLN 61 1HE2 GLN 61 -1.334 3.705 -10.289 463 H GLU 62 H GLU 62 -7.570 4.375 -13.982 464 HA GLU 62 HA GLU 62 -7.239 7.011 -13.016 465 1HB GLU 62 2HB GLU 62 -9.260 5.848 -14.982 466 2HB GLU 62 3HB GLU 62 -9.001 7.579 -14.710 467 1HG GLU 62 2HG GLU 62 -6.614 7.324 -15.373 468 2HG GLU 62 3HG GLU 62 -6.888 5.612 -15.699 469 H THR 63 H THR 63 -10.118 4.787 -12.716 470 HA THR 63 HA THR 63 -11.772 6.611 -11.362 471 HB THR 63 HB THR 63 -11.657 3.621 -10.815 472 HG1 THR 63 1HG THR 63 -13.074 3.561 -12.719 473 1HG2 THR 63 1HG2 THR 63 -14.033 5.511 -11.126 474 2HG2 THR 63 2HG2 THR 63 -14.060 3.799 -10.634 475 3HG2 THR 63 3HG2 THR 63 -13.347 5.002 -9.566 476 H ALA 64 H ALA 64 -9.209 4.452 -10.158 477 HA ALA 64 HA ALA 64 -9.798 4.756 -7.367 478 1HB ALA 64 1HB ALA 64 -7.171 4.012 -8.733 479 2HB ALA 64 2HB ALA 64 -7.644 3.648 -7.064 480 3HB ALA 64 3HB ALA 64 -8.485 2.879 -8.420 481 H GLY 65 H GLY 65 -7.288 6.235 -9.511 482 1HA GLY 65 2HA GLY 65 -6.176 8.003 -7.617 483 2HA GLY 65 3HA GLY 65 -6.177 8.226 -9.382 484 H LYS 66 H LYS 66 -8.934 8.477 -9.879 485 HA LYS 66 HA LYS 66 -9.480 11.189 -9.340 486 1HB LYS 66 2HB LYS 66 -10.380 9.806 -11.179 487 2HB LYS 66 3HB LYS 66 -11.375 8.902 -10.029 488 1HG LYS 66 2HG LYS 66 -12.525 11.117 -9.465 489 2HG LYS 66 3HG LYS 66 -11.639 11.824 -10.825 490 1HD LYS 66 2HD LYS 66 -13.651 9.529 -10.908 491 2HD LYS 66 3HD LYS 66 -13.881 11.168 -11.537 492 1HE LYS 66 2HE LYS 66 -12.047 10.777 -13.187 493 2HE LYS 66 3HE LYS 66 -11.842 9.136 -12.570 494 1HZ LYS 66 1HZ LYS 66 -14.274 10.152 -13.906 495 2HZ LYS 66 2HZ LYS 66 -13.136 9.130 -14.530 496 3HZ LYS 66 3HZ LYS 66 -14.084 8.617 -13.327 497 H TYR 67 H TYR 67 -10.803 8.224 -7.700 498 HA TYR 67 HA TYR 67 -12.332 9.809 -5.851 499 1HB TYR 67 2HB TYR 67 -12.324 7.157 -6.621 500 2HB TYR 67 3HB TYR 67 -11.624 7.039 -5.025 501 HD1 TYR 67 HD1 TYR 67 -13.393 9.480 -3.852 502 HD2 TYR 67 HD2 TYR 67 -14.281 5.906 -6.117 503 HE1 TYR 67 HE1 TYR 67 -15.701 9.534 -3.022 504 HE2 TYR 67 HE2 TYR 67 -16.599 5.952 -5.274 505 HH TYR 67 HH TYR 67 -18.179 7.141 -4.021 506 H GLY 68 H GLY 68 -8.993 8.767 -5.926 507 1HA GLY 68 2HA GLY 68 -7.314 9.671 -4.547 508 2HA GLY 68 3HA GLY 68 -8.486 9.986 -3.259 509 H VAL 69 H VAL 69 -8.580 6.872 -4.913 510 HA VAL 69 HA VAL 69 -7.478 5.428 -2.573 511 HB VAL 69 HB VAL 69 -8.623 4.565 -5.266 512 1HG1 VAL 69 1HG1 VAL 69 -7.495 2.861 -3.016 513 2HG1 VAL 69 2HG1 VAL 69 -8.532 2.233 -4.323 514 3HG1 VAL 69 3HG1 VAL 69 -6.954 2.916 -4.702 515 1HG2 VAL 69 1HG2 VAL 69 -10.370 5.334 -3.784 516 2HG2 VAL 69 2HG2 VAL 69 -10.437 3.573 -3.869 517 3HG2 VAL 69 3HG2 VAL 69 -9.730 4.372 -2.443 518 H MET 70 H MET 70 -5.340 4.561 -2.657 519 HA MET 70 HA MET 70 -3.858 4.653 -5.161 520 1HB MET 70 2HB MET 70 -1.960 5.974 -3.842 521 2HB MET 70 3HB MET 70 -3.158 6.715 -4.872 522 1HG MET 70 2HG MET 70 -4.483 7.468 -3.068 523 2HG MET 70 3HG MET 70 -3.546 6.549 -1.884 524 1HE MET 70 1HE MET 70 -0.509 7.079 -2.311 525 2HE MET 70 2HE MET 70 -0.473 8.471 -1.190 526 3HE MET 70 3HE MET 70 -1.574 7.107 -0.896 527 H SER 71 H SER 71 -4.805 2.634 -3.151 528 HA SER 71 HA SER 71 -2.261 1.531 -2.098 529 1HB SER 71 2HB SER 71 -4.013 1.459 0.003 530 2HB SER 71 3HB SER 71 -2.819 2.734 -0.271 531 HG SER 71 HG SER 71 -5.000 3.494 0.144 532 H ILE 72 H ILE 72 -2.494 -0.676 -1.211 533 HA ILE 72 HA ILE 72 -4.685 -2.139 -2.586 534 HB ILE 72 HB ILE 72 -1.826 -3.086 -2.320 535 1HG1 ILE 72 2HG1 ILE 72 -1.776 -1.030 -3.698 536 2HG1 ILE 72 3HG1 ILE 72 -1.304 -2.484 -4.553 537 1HG2 ILE 72 1HG2 ILE 72 -4.186 -4.004 -4.026 538 2HG2 ILE 72 2HG2 ILE 72 -2.525 -4.565 -4.243 539 3HG2 ILE 72 3HG2 ILE 72 -3.371 -4.902 -2.732 540 1HD1 ILE 72 1HD1 ILE 72 -4.066 -1.228 -4.772 541 2HD1 ILE 72 2HD1 ILE 72 -2.712 -0.934 -5.875 542 3HD1 ILE 72 3HD1 ILE 72 -3.407 -2.557 -5.756 543 HA PRO 73 HA PRO 73 -5.988 -3.706 -2.462 544 1HB PRO 73 2HB PRO 73 -7.967 -5.020 -1.204 545 2HB PRO 73 3HB PRO 73 -6.508 -5.868 -1.804 546 1HG PRO 73 2HG PRO 73 -7.144 -4.991 1.007 547 2HG PRO 73 3HG PRO 73 -6.421 -6.535 0.456 548 1HD PRO 73 2HD PRO 73 -4.983 -4.321 1.417 549 2HD PRO 73 3HD PRO 73 -4.289 -5.581 0.371 550 H THR 74 H THR 74 -8.127 -2.584 -2.553 551 HA THR 74 HA THR 74 -8.884 -1.063 -0.150 552 HB THR 74 HB THR 74 -8.440 0.228 -2.871 553 HG1 THR 74 1HG THR 74 -6.596 0.401 -1.855 554 1HG2 THR 74 1HG2 THR 74 -9.908 1.241 -0.412 555 2HG2 THR 74 2HG2 THR 74 -9.167 2.332 -1.575 556 3HG2 THR 74 3HG2 THR 74 -10.450 1.234 -2.103 557 H LEU 75 H LEU 75 -11.087 -0.616 -0.094 558 HA LEU 75 HA LEU 75 -12.870 -2.155 -1.887 559 1HB LEU 75 2HB LEU 75 -12.223 -2.528 1.043 560 2HB LEU 75 3HB LEU 75 -13.867 -2.839 0.504 561 HG LEU 75 HG LEU 75 -11.460 -4.210 -0.767 562 1HD1 LEU 75 1HD1 LEU 75 -13.128 -5.032 1.640 563 2HD1 LEU 75 2HD1 LEU 75 -12.081 -6.148 0.727 564 3HD1 LEU 75 3HD1 LEU 75 -11.375 -4.765 1.579 565 1HD2 LEU 75 1HD2 LEU 75 -13.596 -4.268 -2.050 566 2HD2 LEU 75 2HD2 LEU 75 -13.154 -5.871 -1.452 567 3HD2 LEU 75 3HD2 LEU 75 -14.424 -4.936 -0.637 568 H LEU 76 H LEU 76 -14.663 -0.956 -2.231 569 HA LEU 76 HA LEU 76 -15.361 1.264 -0.358 570 1HB LEU 76 2HB LEU 76 -15.670 1.376 -3.380 571 2HB LEU 76 3HB LEU 76 -16.043 2.639 -2.223 572 HG LEU 76 HG LEU 76 -13.255 1.631 -2.931 573 1HD1 LEU 76 1HD1 LEU 76 -14.610 4.280 -3.603 574 2HD1 LEU 76 2HD1 LEU 76 -12.984 3.759 -4.093 575 3HD1 LEU 76 3HD1 LEU 76 -14.409 2.931 -4.736 576 1HD2 LEU 76 1HD2 LEU 76 -13.273 2.473 -0.633 577 2HD2 LEU 76 2HD2 LEU 76 -12.382 3.552 -1.703 578 3HD2 LEU 76 3HD2 LEU 76 -14.026 3.991 -1.183 579 H VAL 77 H VAL 77 -17.294 0.658 0.512 580 HA VAL 77 HA VAL 77 -18.951 -1.347 -0.935 581 HB VAL 77 HB VAL 77 -19.440 -0.254 1.849 582 1HG1 VAL 77 1HG1 VAL 77 -20.116 -2.911 0.520 583 2HG1 VAL 77 2HG1 VAL 77 -20.587 -2.411 2.162 584 3HG1 VAL 77 3HG1 VAL 77 -21.242 -1.558 0.759 585 1HG2 VAL 77 1HG2 VAL 77 -17.158 -1.108 2.023 586 2HG2 VAL 77 2HG2 VAL 77 -18.267 -2.241 2.791 587 3HG2 VAL 77 3HG2 VAL 77 -17.613 -2.600 1.181 588 H LEU 78 H LEU 78 -20.756 -0.586 -2.015 589 HA LEU 78 HA LEU 78 -21.674 2.179 -1.410 590 1HB LEU 78 2HB LEU 78 -21.449 0.867 -4.164 591 2HB LEU 78 3HB LEU 78 -22.287 2.368 -3.814 592 HG LEU 78 HG LEU 78 -19.861 2.964 -2.736 593 1HD1 LEU 78 1HD1 LEU 78 -19.170 1.368 -5.232 594 2HD1 LEU 78 2HD1 LEU 78 -18.063 2.190 -4.106 595 3HD1 LEU 78 3HD1 LEU 78 -18.949 0.753 -3.589 596 1HD2 LEU 78 1HD2 LEU 78 -21.120 4.382 -4.303 597 2HD2 LEU 78 2HD2 LEU 78 -19.412 4.283 -4.754 598 3HD2 LEU 78 3HD2 LEU 78 -20.622 3.351 -5.656 599 H LYS 79 H LYS 79 -23.878 2.576 -1.771 600 HA LYS 79 HA LYS 79 -25.475 0.440 -2.892 601 1HB LYS 79 2HB LYS 79 -27.239 0.496 -1.211 602 2HB LYS 79 3HB LYS 79 -25.728 -0.138 -0.549 603 1HG LYS 79 2HG LYS 79 -25.308 2.156 0.450 604 2HG LYS 79 3HG LYS 79 -26.950 2.602 -0.028 605 1HD LYS 79 2HD LYS 79 -26.175 0.298 1.820 606 2HD LYS 79 3HD LYS 79 -26.800 1.870 2.340 607 1HE LYS 79 2HE LYS 79 -28.929 1.450 1.171 608 2HE LYS 79 3HE LYS 79 -28.323 -0.100 0.572 609 1HZ LYS 79 1HZ LYS 79 -28.722 0.554 3.432 610 2HZ LYS 79 2HZ LYS 79 -29.707 -0.375 2.528 611 3HZ LYS 79 3HZ LYS 79 -28.190 -0.890 2.848 612 H ASP 80 H ASP 80 -27.206 1.234 -3.975 613 HA ASP 80 HA ASP 80 -28.190 2.736 -5.358 614 1HB ASP 80 2HB ASP 80 -29.533 2.566 -3.275 615 2HB ASP 80 3HB ASP 80 -28.777 4.044 -2.686 616 H GLY 81 H GLY 81 -25.406 3.349 -5.303 617 1HA GLY 81 2HA GLY 81 -24.231 4.893 -6.497 618 2HA GLY 81 3HA GLY 81 -25.577 6.029 -6.405 619 H GLU 82 H GLU 82 -24.455 4.880 -3.239 620 HA GLU 82 HA GLU 82 -22.364 6.972 -3.154 621 1HB GLU 82 2HB GLU 82 -23.139 7.936 -1.112 622 2HB GLU 82 3HB GLU 82 -24.415 8.061 -2.317 623 1HG GLU 82 2HG GLU 82 -25.563 6.095 -1.264 624 2HG GLU 82 3HG GLU 82 -24.301 6.039 -0.031 625 H VAL 83 H VAL 83 -20.754 6.628 -1.573 626 HA VAL 83 HA VAL 83 -20.279 3.867 -0.812 627 HB VAL 83 HB VAL 83 -18.831 6.499 -0.341 628 1HG1 VAL 83 1HG1 VAL 83 -17.941 3.739 0.594 629 2HG1 VAL 83 2HG1 VAL 83 -16.915 5.186 0.554 630 3HG1 VAL 83 3HG1 VAL 83 -18.307 5.137 1.632 631 1HG2 VAL 83 1HG2 VAL 83 -18.725 5.448 -2.631 632 2HG2 VAL 83 2HG2 VAL 83 -17.148 5.552 -1.835 633 3HG2 VAL 83 3HG2 VAL 83 -18.008 4.004 -1.892 634 H VAL 84 H VAL 84 -20.471 2.974 1.194 635 HA VAL 84 HA VAL 84 -21.563 4.635 3.412 636 HB VAL 84 HB VAL 84 -23.061 2.747 4.001 637 1HG1 VAL 84 1HG1 VAL 84 -23.633 3.865 1.227 638 2HG1 VAL 84 2HG1 VAL 84 -24.803 3.330 2.454 639 3HG1 VAL 84 3HG1 VAL 84 -23.827 4.772 2.742 640 1HG2 VAL 84 1HG2 VAL 84 -21.950 0.901 2.755 641 2HG2 VAL 84 2HG2 VAL 84 -23.661 1.051 2.341 642 3HG2 VAL 84 3HG2 VAL 84 -22.433 1.650 1.215 643 H GLU 85 H GLU 85 -19.265 2.196 2.403 644 HA GLU 85 HA GLU 85 -18.051 2.403 5.029 645 1HB GLU 85 2HB GLU 85 -19.261 -0.153 4.038 646 2HB GLU 85 3HB GLU 85 -17.591 -0.291 4.557 647 1HG GLU 85 2HG GLU 85 -19.806 0.886 6.259 648 2HG GLU 85 3HG GLU 85 -19.305 -0.808 6.277 649 H THR 86 H THR 86 -15.804 1.767 4.915 650 HA THR 86 HA THR 86 -14.647 1.675 2.189 651 HB THR 86 HB THR 86 -13.519 3.645 4.169 652 HG1 THR 86 1HG THR 86 -14.902 5.249 3.596 653 1HG2 THR 86 1HG2 THR 86 -13.941 3.825 1.164 654 2HG2 THR 86 2HG2 THR 86 -12.900 4.866 2.154 655 3HG2 THR 86 3HG2 THR 86 -12.470 3.164 1.916 656 H SER 87 H SER 87 -12.627 0.620 2.184 657 HA SER 87 HA SER 87 -11.288 -0.010 4.730 658 1HB SER 87 2HB SER 87 -12.842 -1.941 3.022 659 2HB SER 87 3HB SER 87 -11.261 -2.480 3.618 660 HG SER 87 HG SER 87 -13.295 -1.329 5.241 661 H VAL 88 H VAL 88 -9.140 -0.253 4.447 662 HA VAL 88 HA VAL 88 -7.970 -0.105 1.720 663 HB VAL 88 HB VAL 88 -7.513 1.831 4.039 664 1HG1 VAL 88 1HG1 VAL 88 -6.126 1.597 1.347 665 2HG1 VAL 88 2HG1 VAL 88 -6.189 3.136 2.242 666 3HG1 VAL 88 3HG1 VAL 88 -5.422 1.756 2.982 667 1HG2 VAL 88 1HG2 VAL 88 -9.610 2.358 2.841 668 2HG2 VAL 88 2HG2 VAL 88 -8.388 3.565 2.495 669 3HG2 VAL 88 3HG2 VAL 88 -8.738 2.310 1.291 670 H GLY 89 H GLY 89 -8.209 -2.445 3.082 671 1HA GLY 89 2HA GLY 89 -5.549 -3.320 3.467 672 2HA GLY 89 3HA GLY 89 -6.326 -3.138 5.048 673 H PHE 90 H PHE 90 -5.484 -5.612 3.935 674 HA PHE 90 HA PHE 90 -7.471 -7.102 2.554 675 1HB PHE 90 2HB PHE 90 -5.177 -7.797 2.534 676 2HB PHE 90 3HB PHE 90 -5.068 -7.775 4.282 677 HD1 PHE 90 HD1 PHE 90 -5.304 -9.740 5.524 678 HD2 PHE 90 HD2 PHE 90 -6.827 -9.609 1.485 679 HE1 PHE 90 HE1 PHE 90 -5.821 -12.159 5.640 680 HE2 PHE 90 HE2 PHE 90 -7.367 -12.029 1.622 681 HZ PHE 90 HZ PHE 90 -6.857 -13.309 3.693 682 H LYS 91 H LYS 91 -8.939 -8.686 3.270 683 HA LYS 91 HA LYS 91 -9.471 -8.989 6.140 684 1HB LYS 91 2HB LYS 91 -11.267 -7.567 4.268 685 2HB LYS 91 3HB LYS 91 -12.002 -9.055 4.812 686 1HG LYS 91 2HG LYS 91 -12.769 -7.529 6.361 687 2HG LYS 91 3HG LYS 91 -11.479 -8.387 7.198 688 1HD LYS 91 2HD LYS 91 -11.305 -6.102 7.778 689 2HD LYS 91 3HD LYS 91 -9.942 -6.460 6.719 690 1HE LYS 91 2HE LYS 91 -11.215 -5.461 4.792 691 2HE LYS 91 3HE LYS 91 -12.559 -5.125 5.895 692 1HZ LYS 91 1HZ LYS 91 -9.886 -3.889 5.906 693 2HZ LYS 91 2HZ LYS 91 -11.366 -3.164 5.769 694 3HZ LYS 91 3HZ LYS 91 -10.894 -3.775 7.200 695 HA PRO 92 HA PRO 92 -9.961 -13.181 4.392 696 1HB PRO 92 2HB PRO 92 -11.019 -14.482 6.559 697 2HB PRO 92 3HB PRO 92 -9.296 -14.010 6.459 698 1HG PRO 92 2HG PRO 92 -11.554 -12.530 7.840 699 2HG PRO 92 3HG PRO 92 -9.938 -12.939 8.496 700 1HD PRO 92 2HD PRO 92 -10.484 -10.491 7.429 701 2HD PRO 92 3HD PRO 92 -8.888 -11.261 7.213 702 H LYS 93 H LYS 93 -11.834 -14.679 4.033 703 HA LYS 93 HA LYS 93 -13.987 -13.419 2.824 704 1HB LYS 93 2HB LYS 93 -13.442 -15.633 2.170 705 2HB LYS 93 3HB LYS 93 -13.481 -16.231 3.823 706 1HG LYS 93 2HG LYS 93 -15.314 -17.163 2.660 707 2HG LYS 93 3HG LYS 93 -15.937 -16.058 3.870 708 1HD LYS 93 2HD LYS 93 -16.240 -14.328 2.026 709 2HD LYS 93 3HD LYS 93 -15.783 -15.569 0.852 710 1HE LYS 93 2HE LYS 93 -18.034 -15.857 2.906 711 2HE LYS 93 3HE LYS 93 -18.307 -15.261 1.274 712 1HZ LYS 93 1HZ LYS 93 -17.126 -17.927 1.786 713 2HZ LYS 93 2HZ LYS 93 -18.732 -17.673 1.690 714 3HZ LYS 93 3HZ LYS 93 -17.798 -17.367 0.378 715 H GLU 94 H GLU 94 -14.122 -14.923 6.107 716 HA GLU 94 HA GLU 94 -16.895 -14.367 6.388 717 1HB GLU 94 2HB GLU 94 -14.721 -14.789 8.482 718 2HB GLU 94 3HB GLU 94 -16.448 -14.676 8.853 719 1HG GLU 94 2HG GLU 94 -16.901 -16.616 7.367 720 2HG GLU 94 3HG GLU 94 -15.176 -16.764 7.030 721 H ALA 95 H ALA 95 -14.018 -12.414 7.237 722 HA ALA 95 HA ALA 95 -15.535 -10.369 8.609 723 1HB ALA 95 1HB ALA 95 -12.767 -10.301 7.350 724 2HB ALA 95 2HB ALA 95 -13.435 -9.095 8.479 725 3HB ALA 95 3HB ALA 95 -13.134 -10.753 9.034 726 H LEU 96 H LEU 96 -14.379 -10.820 5.215 727 HA LEU 96 HA LEU 96 -15.226 -8.212 4.396 728 1HB LEU 96 2HB LEU 96 -13.573 -9.593 3.153 729 2HB LEU 96 3HB LEU 96 -14.853 -10.722 2.702 730 HG LEU 96 HG LEU 96 -15.987 -9.000 1.379 731 1HD1 LEU 96 1HD1 LEU 96 -13.872 -7.111 2.481 732 2HD1 LEU 96 2HD1 LEU 96 -14.860 -6.745 1.046 733 3HD1 LEU 96 3HD1 LEU 96 -15.644 -6.967 2.599 734 1HD2 LEU 96 1HD2 LEU 96 -14.257 -10.207 0.222 735 2HD2 LEU 96 2HD2 LEU 96 -14.169 -8.517 -0.285 736 3HD2 LEU 96 3HD2 LEU 96 -12.987 -9.143 0.873 737 H GLN 97 H GLN 97 -16.885 -11.424 4.400 738 HA GLN 97 HA GLN 97 -19.197 -10.419 3.070 739 1HB GLN 97 2HB GLN 97 -20.074 -12.438 3.266 740 2HB GLN 97 3HB GLN 97 -18.429 -12.905 3.629 741 1HG GLN 97 2HG GLN 97 -19.038 -12.912 6.064 742 2HG GLN 97 3HG GLN 97 -20.695 -12.480 5.626 743 1HE2 GLN 97 2HE2 GLN 97 -21.845 -14.025 4.077 744 2HE2 GLN 97 1HE2 GLN 97 -21.465 -15.735 4.205 745 H GLU 98 H GLU 98 -18.290 -10.530 6.548 746 HA GLU 98 HA GLU 98 -20.717 -9.472 7.555 747 1HB GLU 98 2HB GLU 98 -18.987 -10.520 8.933 748 2HB GLU 98 3HB GLU 98 -17.867 -9.197 8.592 749 1HG GLU 98 2HG GLU 98 -19.377 -7.601 9.730 750 2HG GLU 98 3HG GLU 98 -20.545 -8.895 10.013 751 H LEU 99 H LEU 99 -17.747 -7.810 6.381 752 HA LEU 99 HA LEU 99 -18.382 -5.198 7.045 753 1HB LEU 99 2HB LEU 99 -16.200 -5.860 6.199 754 2HB LEU 99 3HB LEU 99 -16.886 -6.253 4.625 755 HG LEU 99 HG LEU 99 -17.433 -3.888 4.216 756 1HD1 LEU 99 1HD1 LEU 99 -16.077 -3.391 6.906 757 2HD1 LEU 99 2HD1 LEU 99 -16.428 -2.132 5.704 758 3HD1 LEU 99 3HD1 LEU 99 -17.758 -3.004 6.461 759 1HD2 LEU 99 1HD2 LEU 99 -15.279 -4.797 3.465 760 2HD2 LEU 99 2HD2 LEU 99 -15.140 -3.091 3.897 761 3HD2 LEU 99 3HD2 LEU 99 -14.532 -4.333 5.011 762 H VAL 100 H VAL 100 -19.408 -6.968 4.072 763 HA VAL 100 HA VAL 100 -20.933 -4.608 3.217 764 HB VAL 100 HB VAL 100 -19.700 -5.902 1.602 765 1HG1 VAL 100 1HG1 VAL 100 -21.632 -8.209 2.066 766 2HG1 VAL 100 2HG1 VAL 100 -20.371 -8.097 0.819 767 3HG1 VAL 100 3HG1 VAL 100 -19.914 -8.188 2.514 768 1HG2 VAL 100 1HG2 VAL 100 -21.767 -4.630 0.967 769 2HG2 VAL 100 2HG2 VAL 100 -21.335 -5.950 -0.126 770 3HG2 VAL 100 3HG2 VAL 100 -22.671 -6.153 1.030 771 H ASN 101 H ASN 101 -21.640 -7.775 4.766 772 HA ASN 101 HA ASN 101 -24.437 -7.728 4.524 773 1HB ASN 101 2HB ASN 101 -23.187 -9.669 5.340 774 2HB ASN 101 3HB ASN 101 -22.755 -8.788 6.811 775 1HD2 ASN 101 2HD2 ASN 101 -24.129 -9.129 8.574 776 2HD2 ASN 101 1HD2 ASN 101 -25.769 -9.699 8.438 777 H LYS 102 H LYS 102 -22.374 -5.871 6.723 778 HA LYS 102 HA LYS 102 -24.264 -4.874 8.551 779 1HB LYS 102 2HB LYS 102 -21.782 -3.764 7.238 780 2HB LYS 102 3HB LYS 102 -22.722 -2.747 8.329 781 1HG LYS 102 2HG LYS 102 -22.189 -3.891 10.206 782 2HG LYS 102 3HG LYS 102 -22.017 -5.440 9.394 783 1HD LYS 102 2HD LYS 102 -19.902 -4.333 10.374 784 2HD LYS 102 3HD LYS 102 -19.839 -5.101 8.810 785 1HE LYS 102 2HE LYS 102 -18.528 -3.098 8.761 786 2HE LYS 102 3HE LYS 102 -19.883 -2.944 7.646 787 1HZ LYS 102 1HZ LYS 102 -19.870 -1.755 10.359 788 2HZ LYS 102 2HZ LYS 102 -19.370 -0.964 9.015 789 3HZ LYS 102 3HZ LYS 102 -20.933 -1.439 9.136 790 H HIS 103 H HIS 103 -24.027 -4.080 5.094 791 HA HIS 103 HA HIS 103 -26.019 -1.878 5.488 792 1HB HIS 103 2HB HIS 103 -23.646 -1.948 3.583 793 2HB HIS 103 3HB HIS 103 -24.841 -0.655 3.716 794 HD1 HIS 103 HD1 HIS 103 -24.746 0.823 6.056 795 HD2 HIS 103 HD2 HIS 103 -21.753 -2.083 5.494 796 HE1 HIS 103 HE1 HIS 103 -23.026 1.201 7.890 797 H LEU 104 H LEU 104 -25.101 -4.697 3.668 798 HA LEU 104 HA LEU 104 -26.928 -4.534 1.485 799 1HB LEU 104 2HB LEU 104 -25.082 -6.126 1.591 800 2HB LEU 104 3HB LEU 104 -25.739 -6.809 3.084 801 HG LEU 104 HG LEU 104 -27.674 -7.714 1.899 802 1HD1 LEU 104 1HD1 LEU 104 -26.357 -6.628 -0.637 803 2HD1 LEU 104 2HD1 LEU 104 -27.780 -7.684 -0.560 804 3HD1 LEU 104 3HD1 LEU 104 -27.884 -6.043 0.064 805 1HD2 LEU 104 1HD2 LEU 104 -25.540 -8.975 2.151 806 2HD2 LEU 104 2HD2 LEU 104 -26.442 -9.458 0.720 807 3HD2 LEU 104 3HD2 LEU 104 -25.023 -8.401 0.549 808 1H MET 1 H1 MET 1 9.529 27.539 -10.822 809 2H MET 1 H2 MET 1 9.404 29.163 -10.727 810 3H MET 1 H3 MET 1 8.741 28.374 -11.999 811 HA MET 1 HA MET 1 7.022 29.037 -10.462 812 1HB MET 1 2HB MET 1 7.553 26.035 -10.589 813 2HB MET 1 3HB MET 1 6.119 26.729 -9.840 814 1HG MET 1 2HG MET 1 6.897 27.029 -12.761 815 2HG MET 1 3HG MET 1 5.635 26.006 -12.087 816 1HE MET 1 1HE MET 1 3.527 26.763 -13.318 817 2HE MET 1 2HE MET 1 3.278 28.438 -13.854 818 3HE MET 1 3HE MET 1 4.705 27.534 -14.407 819 H GLU 2 H GLU 2 6.838 29.860 -8.440 820 HA GLU 2 HA GLU 2 8.507 28.929 -6.225 821 1HB GLU 2 2HB GLU 2 6.275 30.976 -6.485 822 2HB GLU 2 3HB GLU 2 6.974 30.499 -4.925 823 1HG GLU 2 2HG GLU 2 9.210 31.181 -5.669 824 2HG GLU 2 3HG GLU 2 8.572 31.620 -7.256 825 H ASN 3 H ASN 3 7.991 26.769 -6.135 826 HA ASN 3 HA ASN 3 7.261 25.415 -4.370 827 1HB ASN 3 2HB ASN 3 4.388 26.182 -4.980 828 2HB ASN 3 3HB ASN 3 4.934 24.961 -3.852 829 1HD2 ASN 3 2HD2 ASN 3 7.239 26.819 -2.753 830 2HD2 ASN 3 1HD2 ASN 3 6.326 27.881 -1.741 831 H LYS 4 H LYS 4 7.394 23.387 -4.991 832 HA LYS 4 HA LYS 4 5.907 22.262 -7.286 833 1HB LYS 4 2HB LYS 4 8.937 22.341 -6.910 834 2HB LYS 4 3HB LYS 4 8.143 21.083 -7.865 835 1HG LYS 4 2HG LYS 4 7.206 22.722 -9.396 836 2HG LYS 4 3HG LYS 4 7.850 24.066 -8.445 837 1HD LYS 4 2HD LYS 4 9.606 21.954 -9.760 838 2HD LYS 4 3HD LYS 4 9.159 23.498 -10.510 839 1HE LYS 4 2HE LYS 4 10.126 24.714 -8.550 840 2HE LYS 4 3HE LYS 4 10.664 23.177 -7.872 841 1HZ LYS 4 1HZ LYS 4 11.549 24.240 -10.495 842 2HZ LYS 4 2HZ LYS 4 12.413 24.336 -9.110 843 3HZ LYS 4 3HZ LYS 4 12.088 22.868 -9.778 844 H ILE 5 H ILE 5 4.847 20.607 -6.262 845 HA ILE 5 HA ILE 5 5.747 19.820 -3.595 846 HB ILE 5 HB ILE 5 3.270 19.085 -5.193 847 1HG1 ILE 5 2HG1 ILE 5 3.684 21.076 -2.927 848 2HG1 ILE 5 3HG1 ILE 5 3.359 21.470 -4.614 849 1HG2 ILE 5 1HG2 ILE 5 3.840 18.599 -2.227 850 2HG2 ILE 5 2HG2 ILE 5 2.367 18.145 -3.117 851 3HG2 ILE 5 3HG2 ILE 5 3.879 17.335 -3.472 852 1HD1 ILE 5 1HD1 ILE 5 1.447 20.191 -2.637 853 2HD1 ILE 5 2HD1 ILE 5 1.332 21.771 -3.419 854 3HD1 ILE 5 3HD1 ILE 5 1.132 20.298 -4.389 855 H ILE 6 H ILE 6 6.795 17.955 -3.110 856 HA ILE 6 HA ILE 6 6.850 15.696 -5.015 857 HB ILE 6 HB ILE 6 8.805 16.785 -5.612 858 1HG1 ILE 6 2HG1 ILE 6 9.002 14.309 -4.903 859 2HG1 ILE 6 3HG1 ILE 6 10.418 15.220 -5.334 860 1HG2 ILE 6 1HG2 ILE 6 9.401 17.371 -2.708 861 2HG2 ILE 6 2HG2 ILE 6 10.572 17.606 -4.030 862 3HG2 ILE 6 3HG2 ILE 6 9.072 18.527 -4.011 863 1HD1 ILE 6 1HD1 ILE 6 9.601 14.646 -2.449 864 2HD1 ILE 6 2HD1 ILE 6 10.798 13.749 -3.391 865 3HD1 ILE 6 3HD1 ILE 6 11.091 15.443 -2.989 866 H TYR 7 H TYR 7 7.113 13.682 -3.975 867 HA TYR 7 HA TYR 7 6.317 13.775 -1.106 868 1HB TYR 7 2HB TYR 7 4.720 13.279 -3.303 869 2HB TYR 7 3HB TYR 7 5.246 11.661 -2.913 870 HD1 TYR 7 HD1 TYR 7 4.444 10.554 -0.867 871 HD2 TYR 7 HD2 TYR 7 3.451 14.666 -1.707 872 HE1 TYR 7 HE1 TYR 7 2.645 10.463 0.816 873 HE2 TYR 7 HE2 TYR 7 1.661 14.580 -0.017 874 HH TYR 7 HH TYR 7 0.439 13.217 1.466 875 H PHE 8 H PHE 8 7.130 12.162 0.221 876 HA PHE 8 HA PHE 8 8.765 9.969 -0.985 877 1HB PHE 8 2HB PHE 8 8.640 10.945 1.894 878 2HB PHE 8 3HB PHE 8 9.614 9.613 1.297 879 HD1 PHE 8 HD1 PHE 8 11.361 10.182 -0.585 880 HD2 PHE 8 HD2 PHE 8 9.614 13.086 2.065 881 HE1 PHE 8 HE1 PHE 8 13.238 11.738 -1.058 882 HE2 PHE 8 HE2 PHE 8 11.530 14.592 1.667 883 HZ PHE 8 HZ PHE 8 13.334 13.946 0.103 884 H LEU 9 H LEU 9 8.045 7.881 -0.634 885 HA LEU 9 HA LEU 9 5.658 7.471 1.075 886 1HB LEU 9 2HB LEU 9 5.757 7.287 -1.803 887 2HB LEU 9 3HB LEU 9 5.664 5.650 -1.182 888 HG LEU 9 HG LEU 9 3.710 7.922 -0.627 889 1HD1 LEU 9 1HD2 LEU 9 3.497 6.950 -2.856 890 2HD1 LEU 9 2HD2 LEU 9 3.533 5.314 -2.198 891 3HD1 LEU 9 3HD2 LEU 9 2.145 6.382 -1.870 892 1HD2 LEU 9 1HD1 LEU 9 3.642 5.061 0.415 893 2HD2 LEU 9 2HD1 LEU 9 3.780 6.519 1.394 894 3HD2 LEU 9 3HD1 LEU 9 2.299 6.217 0.494 895 H SER 10 H SER 10 6.339 6.151 2.685 896 HA SER 10 HA SER 10 8.211 3.969 2.108 897 1HB SER 10 2HB SER 10 9.356 5.471 4.275 898 2HB SER 10 3HB SER 10 10.052 5.068 2.705 899 HG SER 10 HG SER 10 9.440 7.443 3.603 900 H THR 11 H THR 11 8.141 2.307 3.627 901 HA THR 11 HA THR 11 5.940 1.889 5.109 902 HB THR 11 HB THR 11 8.672 0.758 5.822 903 HG1 THR 11 1HG THR 11 7.985 -0.805 4.105 904 1HG2 THR 11 1HG2 THR 11 5.900 -0.523 5.781 905 2HG2 THR 11 2HG2 THR 11 7.431 -1.282 6.292 906 3HG2 THR 11 3HG2 THR 11 6.746 0.036 7.242 907 H GLY 12 H GLY 12 5.093 2.713 6.907 908 1HA GLY 12 2HA GLY 12 4.820 3.508 9.017 909 2HA GLY 12 3HA GLY 12 6.523 3.167 9.336 910 H ASN 13 H ASN 13 6.946 5.074 6.795 911 HA ASN 13 HA ASN 13 8.055 6.992 6.652 912 1HB ASN 13 2HB ASN 13 5.558 7.636 6.543 913 2HB ASN 13 3HB ASN 13 5.813 8.353 8.148 914 1HD2 ASN 13 2HD2 ASN 13 7.511 10.127 8.236 915 2HD2 ASN 13 1HD2 ASN 13 7.701 11.117 6.807 916 H SER 14 H SER 14 8.499 5.408 9.203 917 HA SER 14 HA SER 14 8.605 7.181 11.364 918 1HB SER 14 2HB SER 14 10.314 4.690 11.163 919 2HB SER 14 3HB SER 14 9.426 5.328 12.557 920 HG SER 14 HG SER 14 8.401 3.499 11.635 921 H ALA 15 H ALA 15 11.052 6.334 8.937 922 HA ALA 15 HA ALA 15 13.093 7.880 10.463 923 1HB ALA 15 1HB ALA 15 13.330 5.074 9.275 924 2HB ALA 15 2HB ALA 15 14.669 6.013 9.968 925 3HB ALA 15 3HB ALA 15 13.310 5.511 10.991 926 H ARG 16 H ARG 16 13.015 6.036 7.346 927 HA ARG 16 HA ARG 16 15.006 7.627 6.175 928 1HB ARG 16 2HB ARG 16 12.792 5.937 4.961 929 2HB ARG 16 3HB ARG 16 13.979 6.763 3.955 930 1HG ARG 16 2HG ARG 16 15.728 5.476 4.544 931 2HG ARG 16 3HG ARG 16 15.150 5.167 6.182 932 1HD ARG 16 2HD ARG 16 13.949 3.975 3.653 933 2HD ARG 16 3HD ARG 16 15.137 3.191 4.639 934 HE ARG 16 HE ARG 16 13.559 3.070 6.511 935 1HH1 ARG 16 1HH1 ARG 16 12.153 3.826 3.350 936 2HH1 ARG 16 2HH1 ARG 16 10.729 2.938 3.633 937 1HH2 ARG 16 1HH2 ARG 16 11.518 2.103 6.970 938 2HH2 ARG 16 2HH2 ARG 16 10.143 2.578 6.026 939 H SER 17 H SER 17 11.402 8.066 5.771 940 HA SER 17 HA SER 17 11.758 10.207 3.969 941 1HB SER 17 2HB SER 17 9.403 10.387 5.699 942 2HB SER 17 3HB SER 17 9.518 10.258 3.942 943 HG SER 17 HG SER 17 8.494 8.504 4.926 944 H GLN 18 H GLN 18 11.626 10.132 7.539 945 HA GLN 18 HA GLN 18 11.397 12.947 7.949 946 1HB GLN 18 2HB GLN 18 12.724 10.824 9.711 947 2HB GLN 18 3HB GLN 18 12.267 12.434 10.224 948 1HG GLN 18 2HG GLN 18 10.298 10.309 9.293 949 2HG GLN 18 3HG GLN 18 10.700 10.647 10.964 950 1HE2 GLN 18 2HE2 GLN 18 8.105 10.914 10.738 951 2HE2 GLN 18 1HE2 GLN 18 7.582 12.543 10.297 952 H MET 19 H MET 19 14.166 10.739 7.652 953 HA MET 19 HA MET 19 16.268 12.633 7.928 954 1HB MET 19 2HB MET 19 16.273 10.080 8.061 955 2HB MET 19 3HB MET 19 16.170 10.052 6.303 956 1HG MET 19 2HG MET 19 18.330 11.411 6.305 957 2HG MET 19 3HG MET 19 18.446 11.018 8.024 958 1HE MET 19 1HE MET 19 17.070 7.845 7.736 959 2HE MET 19 2HE MET 19 18.631 6.999 7.781 960 3HE MET 19 3HE MET 19 18.334 8.367 8.874 961 H ALA 20 H ALA 20 14.549 11.324 5.042 962 HA ALA 20 HA ALA 20 16.153 12.665 3.155 963 1HB ALA 20 1HB ALA 20 13.324 11.592 2.808 964 2HB ALA 20 2HB ALA 20 14.522 11.905 1.532 965 3HB ALA 20 3HB ALA 20 14.820 10.627 2.709 966 H GLU 21 H GLU 21 13.006 13.694 4.632 967 HA GLU 21 HA GLU 21 12.879 15.992 2.902 968 1HB GLU 21 2HB GLU 21 11.063 16.764 4.234 969 2HB GLU 21 3HB GLU 21 10.889 15.034 3.953 970 1HG GLU 21 2HG GLU 21 11.845 14.664 6.277 971 2HG GLU 21 3HG GLU 21 11.794 16.406 6.496 972 H GLY 22 H GLY 22 14.574 15.333 5.923 973 1HA GLY 22 2HA GLY 22 15.333 18.040 6.547 974 2HA GLY 22 3HA GLY 22 16.161 16.545 7.032 975 H TRP 23 H TRP 23 16.974 15.361 4.739 976 HA TRP 23 HA TRP 23 19.172 16.880 3.783 977 1HB TRP 23 2HB TRP 23 17.759 14.365 2.874 978 2HB TRP 23 3HB TRP 23 18.936 15.116 1.815 979 HD1 TRP 23 HD1 TRP 23 18.764 12.809 4.680 980 HE1 TRP 23 HE1 TRP 23 21.115 12.135 5.396 981 HE3 TRP 23 HE3 TRP 23 21.406 16.333 2.094 982 HZ2 TRP 23 HZ2 TRP 23 23.852 12.977 4.828 983 HZ3 TRP 23 HZ3 TRP 23 23.887 16.348 2.161 984 HH2 TRP 23 HH2 TRP 23 25.116 14.678 3.529 985 H ALA 24 H ALA 24 15.947 16.326 2.325 986 HA ALA 24 HA ALA 24 16.377 17.519 -0.146 987 1HB ALA 24 1HB ALA 24 13.857 17.529 1.578 988 2HB ALA 24 2HB ALA 24 13.904 17.919 -0.137 989 3HB ALA 24 3HB ALA 24 14.322 16.282 0.399 990 H LYS 25 H LYS 25 15.083 19.160 2.845 991 HA LYS 25 HA LYS 25 14.916 21.589 1.387 992 1HB LYS 25 2HB LYS 25 14.486 20.852 4.278 993 2HB LYS 25 3HB LYS 25 14.560 22.561 3.811 994 1HG LYS 25 2HG LYS 25 12.887 22.146 2.014 995 2HG LYS 25 3HG LYS 25 12.692 20.482 2.583 996 1HD LYS 25 2HD LYS 25 11.777 21.218 4.681 997 2HD LYS 25 3HD LYS 25 12.237 22.900 4.393 998 1HE LYS 25 2HE LYS 25 10.230 21.348 2.694 999 2HE LYS 25 3HE LYS 25 9.790 22.402 4.041 1000 1HZ LYS 25 1HZ LYS 25 11.186 23.304 1.581 1001 2HZ LYS 25 2HZ LYS 25 9.623 23.588 1.953 1002 3HZ LYS 25 3HZ LYS 25 10.799 24.261 2.853 1003 H GLN 26 H GLN 26 17.833 20.314 2.672 1004 HA GLN 26 HA GLN 26 18.966 23.013 2.927 1005 1HB GLN 26 2HB GLN 26 21.025 22.070 3.428 1006 2HB GLN 26 3HB GLN 26 19.813 21.254 4.383 1007 1HG GLN 26 2HG GLN 26 20.219 19.220 3.471 1008 2HG GLN 26 3HG GLN 26 20.447 19.836 1.848 1009 1HE2 GLN 26 2HE2 GLN 26 22.117 17.936 3.721 1010 2HE2 GLN 26 1HE2 GLN 26 23.724 18.588 3.575 1011 H TYR 27 H TYR 27 18.149 21.045 0.250 1012 HA TYR 27 HA TYR 27 19.915 22.703 -1.510 1013 1HB TYR 27 2HB TYR 27 19.557 19.725 -1.416 1014 2HB TYR 27 3HB TYR 27 19.584 20.471 -2.995 1015 HD1 TYR 27 HD1 TYR 27 21.552 21.526 -3.938 1016 HD2 TYR 27 HD2 TYR 27 21.618 19.819 0.016 1017 HE1 TYR 27 HE1 TYR 27 24.023 21.703 -3.906 1018 HE2 TYR 27 HE2 TYR 27 24.075 20.044 0.092 1019 HH TYR 27 HH TYR 27 25.990 20.764 -1.044 1020 H LEU 28 H LEU 28 16.735 21.337 -0.931 1021 HA LEU 28 HA LEU 28 15.636 22.561 -3.411 1022 1HB LEU 28 2HB LEU 28 14.430 20.543 -1.464 1023 2HB LEU 28 3HB LEU 28 13.645 21.196 -2.891 1024 HG LEU 28 HG LEU 28 16.105 19.400 -2.869 1025 1HD1 LEU 28 1HD1 LEU 28 13.242 18.868 -3.784 1026 2HD1 LEU 28 2HD1 LEU 28 14.610 17.733 -3.841 1027 3HD1 LEU 28 3HD1 LEU 28 13.974 18.266 -2.287 1028 1HD2 LEU 28 1HD2 LEU 28 16.199 20.897 -4.833 1029 2HD2 LEU 28 2HD2 LEU 28 15.780 19.246 -5.318 1030 3HD2 LEU 28 3HD2 LEU 28 14.517 20.482 -5.232 1031 H GLY 29 H GLY 29 15.583 24.697 -2.758 1032 1HA GLY 29 2HA GLY 29 14.869 25.591 -0.124 1033 2HA GLY 29 3HA GLY 29 15.044 26.577 -1.577 1034 H ASP 30 H ASP 30 13.187 27.713 -0.531 1035 HA ASP 30 HA ASP 30 10.593 26.693 -0.197 1036 1HB ASP 30 2HB ASP 30 11.398 28.854 0.645 1037 2HB ASP 30 3HB ASP 30 11.528 29.469 -1.003 1038 H GLU 31 H GLU 31 12.270 27.293 -3.146 1039 HA GLU 31 HA GLU 31 10.196 27.541 -5.048 1040 1HB GLU 31 2HB GLU 31 12.701 27.769 -5.339 1041 2HB GLU 31 3HB GLU 31 12.821 26.012 -5.260 1042 1HG GLU 31 2HG GLU 31 11.276 25.910 -7.269 1043 2HG GLU 31 3HG GLU 31 11.348 27.671 -7.352 1044 H TRP 32 H TRP 32 10.921 24.890 -2.906 1045 HA TRP 32 HA TRP 32 9.189 23.021 -4.446 1046 1HB TRP 32 2HB TRP 32 11.614 22.362 -2.755 1047 2HB TRP 32 3HB TRP 32 10.586 21.212 -3.593 1048 HD1 TRP 32 HD1 TRP 32 13.214 23.903 -4.293 1049 HE1 TRP 32 HE1 TRP 32 14.289 23.506 -6.577 1050 HE3 TRP 32 HE3 TRP 32 10.230 20.074 -5.909 1051 HZ2 TRP 32 HZ2 TRP 32 14.027 21.601 -8.755 1052 HZ3 TRP 32 HZ3 TRP 32 10.662 18.989 -8.097 1053 HH2 TRP 32 HH2 TRP 32 12.560 19.730 -9.519 1054 H LYS 33 H LYS 33 8.142 21.419 -3.041 1055 HA LYS 33 HA LYS 33 7.853 22.107 -0.173 1056 1HB LYS 33 2HB LYS 33 5.680 21.909 -2.284 1057 2HB LYS 33 3HB LYS 33 5.324 21.409 -0.639 1058 1HG LYS 33 2HG LYS 33 6.408 24.169 -1.359 1059 2HG LYS 33 3HG LYS 33 4.693 23.800 -1.282 1060 1HD LYS 33 2HD LYS 33 6.605 23.523 1.081 1061 2HD LYS 33 3HD LYS 33 5.562 24.911 0.761 1062 1HE LYS 33 2HE LYS 33 3.557 23.423 0.859 1063 2HE LYS 33 3HE LYS 33 4.600 22.057 1.267 1064 1HZ LYS 33 1HZ LYS 33 4.276 24.503 2.910 1065 2HZ LYS 33 2HZ LYS 33 3.621 23.050 3.235 1066 3HZ LYS 33 3HZ LYS 33 5.238 23.237 3.296 1067 H VAL 34 H VAL 34 7.851 20.218 1.029 1068 HA VAL 34 HA VAL 34 8.291 17.701 -0.516 1069 HB VAL 34 HB VAL 34 9.984 19.030 1.640 1070 1HG1 VAL 34 1HG1 VAL 34 10.331 16.288 0.356 1071 2HG1 VAL 34 2HG1 VAL 34 11.499 17.096 1.427 1072 3HG1 VAL 34 3HG1 VAL 34 9.921 16.612 2.056 1073 1HG2 VAL 34 1HG2 VAL 34 10.344 19.836 -0.762 1074 2HG2 VAL 34 2HG2 VAL 34 11.754 19.136 0.025 1075 3HG2 VAL 34 3HG2 VAL 34 10.845 18.182 -1.156 1076 H TYR 35 H TYR 35 7.129 16.049 0.293 1077 HA TYR 35 HA TYR 35 5.990 16.203 3.037 1078 1HB TYR 35 2HB TYR 35 4.585 16.635 0.536 1079 2HB TYR 35 3HB TYR 35 4.108 15.081 1.166 1080 HD1 TYR 35 HD1 TYR 35 4.745 18.536 2.564 1081 HD2 TYR 35 HD2 TYR 35 2.140 15.097 2.431 1082 HE1 TYR 35 HE1 TYR 35 3.139 19.700 4.042 1083 HE2 TYR 35 HE2 TYR 35 0.513 16.266 3.874 1084 HH TYR 35 HH TYR 35 0.014 18.227 5.039 1085 H SER 36 H SER 36 5.071 14.056 3.689 1086 HA SER 36 HA SER 36 6.537 11.742 2.553 1087 1HB SER 36 2HB SER 36 6.791 12.686 5.439 1088 2HB SER 36 3HB SER 36 7.720 11.429 4.614 1089 HG SER 36 HG SER 36 8.635 13.663 5.018 1090 H ALA 37 H ALA 37 5.367 9.805 2.962 1091 HA ALA 37 HA ALA 37 3.615 9.643 5.267 1092 1HB ALA 37 1HB ALA 37 2.335 9.183 2.554 1093 2HB ALA 37 2HB ALA 37 1.574 9.231 4.153 1094 3HB ALA 37 3HB ALA 37 2.171 10.728 3.439 1095 H GLY 38 H GLY 38 2.391 7.399 5.147 1096 1HA GLY 38 2HA GLY 38 3.380 5.289 3.530 1097 2HA GLY 38 3HA GLY 38 4.202 5.268 5.098 1098 H ILE 39 H ILE 39 2.797 3.139 4.604 1099 HA ILE 39 HA ILE 39 0.219 2.752 4.660 1100 HB ILE 39 HB ILE 39 1.536 0.873 4.596 1101 1HG1 ILE 39 2HG1 ILE 39 0.232 0.538 7.327 1102 2HG1 ILE 39 3HG1 ILE 39 -0.683 0.630 5.828 1103 1HG2 ILE 39 1HG2 ILE 39 2.652 1.406 7.381 1104 2HG2 ILE 39 2HG2 ILE 39 3.000 -0.004 6.379 1105 3HG2 ILE 39 3HG2 ILE 39 3.521 1.580 5.839 1106 1HD1 ILE 39 1HD1 ILE 39 1.315 -1.528 6.567 1107 2HD1 ILE 39 2HD1 ILE 39 -0.443 -1.670 6.465 1108 3HD1 ILE 39 3HD1 ILE 39 0.494 -1.392 4.987 1109 H GLU 40 H GLU 40 1.780 3.204 7.866 1110 HA GLU 40 HA GLU 40 -0.809 4.158 8.957 1111 1HB GLU 40 2HB GLU 40 -0.478 2.836 10.987 1112 2HB GLU 40 3HB GLU 40 -0.739 1.844 9.562 1113 1HG GLU 40 2HG GLU 40 1.625 1.253 9.449 1114 2HG GLU 40 3HG GLU 40 2.018 2.371 10.752 1115 H ALA 41 H ALA 41 1.385 5.582 7.918 1116 HA ALA 41 HA ALA 41 3.423 6.230 9.734 1117 1HB ALA 41 1HB ALA 41 2.200 7.611 7.331 1118 2HB ALA 41 2HB ALA 41 3.599 8.278 8.178 1119 3HB ALA 41 3HB ALA 41 3.697 6.664 7.416 1120 H HIS 42 H HIS 42 3.821 7.873 11.012 1121 HA HIS 42 HA HIS 42 2.965 10.165 11.844 1122 1HB HIS 42 2HB HIS 42 0.624 9.731 11.987 1123 2HB HIS 42 3HB HIS 42 0.881 8.236 12.900 1124 HD1 HIS 42 HD1 HIS 42 2.388 11.725 13.807 1125 HD2 HIS 42 HD2 HIS 42 -0.403 8.841 15.082 1126 HE1 HIS 42 HE1 HIS 42 1.631 12.441 16.126 1127 H GLY 43 H GLY 43 5.157 9.877 12.352 1128 1HA GLY 43 2HA GLY 43 5.842 9.323 15.003 1129 2HA GLY 43 3HA GLY 43 6.195 7.855 14.080 1130 H LEU 44 H LEU 44 8.125 9.456 15.371 1131 HA LEU 44 HA LEU 44 9.876 10.274 13.131 1132 1HB LEU 44 2HB LEU 44 8.916 12.367 13.925 1133 2HB LEU 44 3HB LEU 44 9.206 11.917 15.605 1134 HG LEU 44 HG LEU 44 11.665 12.033 15.235 1135 1HD1 LEU 44 1HD1 LEU 44 10.911 12.968 12.437 1136 2HD1 LEU 44 2HD1 LEU 44 12.521 13.123 13.158 1137 3HD1 LEU 44 3HD1 LEU 44 11.861 11.515 12.859 1138 1HD2 LEU 44 1HD2 LEU 44 10.414 14.005 16.032 1139 2HD2 LEU 44 2HD2 LEU 44 11.815 14.456 15.049 1140 3HD2 LEU 44 3HD2 LEU 44 10.188 14.540 14.353 1141 H ASN 45 H ASN 45 11.072 8.441 13.360 1142 HA ASN 45 HA ASN 45 11.739 7.198 15.858 1143 1HB ASN 45 2HB ASN 45 11.603 6.073 13.625 1144 2HB ASN 45 3HB ASN 45 13.064 6.923 13.121 1145 1HD2 ASN 45 2HD2 ASN 45 12.469 3.950 13.502 1146 2HD2 ASN 45 1HD2 ASN 45 13.717 3.406 14.590 1147 HA PRO 46 HA PRO 46 14.948 10.212 16.836 1148 1HB PRO 46 2HB PRO 46 16.367 8.805 18.766 1149 2HB PRO 46 3HB PRO 46 14.845 9.704 19.047 1150 1HG PRO 46 2HG PRO 46 15.193 6.744 18.499 1151 2HG PRO 46 3HG PRO 46 14.188 7.529 19.761 1152 1HD PRO 46 2HD PRO 46 13.092 6.662 17.460 1153 2HD PRO 46 3HD PRO 46 12.575 8.224 18.157 1154 H ASN 47 H ASN 47 15.630 6.945 15.630 1155 HA ASN 47 HA ASN 47 18.425 7.275 15.224 1156 1HB ASN 47 2HB ASN 47 18.361 5.360 14.110 1157 2HB ASN 47 3HB ASN 47 16.777 5.170 14.820 1158 1HD2 ASN 47 2HD2 ASN 47 18.611 5.410 11.889 1159 2HD2 ASN 47 1HD2 ASN 47 17.259 5.471 10.772 1160 H ALA 48 H ALA 48 15.618 8.434 13.296 1161 HA ALA 48 HA ALA 48 17.287 9.310 11.084 1162 1HB ALA 48 1HB ALA 48 14.430 10.032 11.880 1163 2HB ALA 48 2HB ALA 48 15.233 10.513 10.368 1164 3HB ALA 48 3HB ALA 48 14.967 8.797 10.708 1165 H VAL 49 H VAL 49 15.968 10.777 14.068 1166 HA VAL 49 HA VAL 49 16.809 13.441 13.530 1167 HB VAL 49 HB VAL 49 16.649 12.075 16.250 1168 1HG1 VAL 49 1HG1 VAL 49 16.381 15.003 15.439 1169 2HG1 VAL 49 2HG1 VAL 49 16.184 14.351 17.078 1170 3HG1 VAL 49 3HG1 VAL 49 17.765 14.280 16.291 1171 1HG2 VAL 49 1HG2 VAL 49 14.483 11.776 15.056 1172 2HG2 VAL 49 2HG2 VAL 49 14.337 12.922 16.387 1173 3HG2 VAL 49 3HG2 VAL 49 14.434 13.517 14.722 1174 H LYS 50 H LYS 50 18.516 10.740 15.257 1175 HA LYS 50 HA LYS 50 20.995 12.053 15.538 1176 1HB LYS 50 2HB LYS 50 20.426 9.943 16.654 1177 2HB LYS 50 3HB LYS 50 20.400 9.098 15.102 1178 1HG LYS 50 2HG LYS 50 22.823 9.583 14.795 1179 2HG LYS 50 3HG LYS 50 22.853 10.420 16.361 1180 1HD LYS 50 2HD LYS 50 22.247 8.307 17.508 1181 2HD LYS 50 3HD LYS 50 22.030 7.520 15.947 1182 1HE LYS 50 2HE LYS 50 24.128 6.763 16.283 1183 2HE LYS 50 3HE LYS 50 24.570 8.313 15.571 1184 1HZ LYS 50 1HZ LYS 50 24.450 7.693 18.471 1185 2HZ LYS 50 2HZ LYS 50 25.804 7.900 17.591 1186 3HZ LYS 50 3HZ LYS 50 24.814 9.170 17.867 1187 H ALA 51 H ALA 51 19.810 10.074 12.743 1188 HA ALA 51 HA ALA 51 22.148 10.199 11.222 1189 1HB ALA 51 1HB ALA 51 19.282 10.223 10.190 1190 2HB ALA 51 2HB ALA 51 20.719 9.711 9.299 1191 3HB ALA 51 3HB ALA 51 20.183 8.774 10.703 1192 H MET 52 H MET 52 19.503 12.667 11.426 1193 HA MET 52 HA MET 52 20.854 14.349 9.462 1194 1HB MET 52 2HB MET 52 18.589 14.986 11.393 1195 2HB MET 52 3HB MET 52 19.171 16.041 10.104 1196 1HG MET 52 2HG MET 52 17.765 13.388 9.829 1197 2HG MET 52 3HG MET 52 17.262 14.956 9.227 1198 1HE MET 52 1HE MET 52 20.200 15.888 7.788 1199 2HE MET 52 2HE MET 52 19.676 15.473 6.149 1200 3HE MET 52 3HE MET 52 18.532 16.241 7.271 1201 H LYS 53 H LYS 53 20.896 14.139 13.028 1202 HA LYS 53 HA LYS 53 22.437 16.520 13.407 1203 1HB LYS 53 2HB LYS 53 22.340 13.961 15.053 1204 2HB LYS 53 3HB LYS 53 23.143 15.434 15.568 1205 1HG LYS 53 2HG LYS 53 20.181 15.383 14.872 1206 2HG LYS 53 3HG LYS 53 20.786 14.988 16.478 1207 1HD LYS 53 2HD LYS 53 21.702 17.224 16.743 1208 2HD LYS 53 3HD LYS 53 21.297 17.637 15.058 1209 1HE LYS 53 2HE LYS 53 18.916 17.342 15.495 1210 2HE LYS 53 3HE LYS 53 19.230 16.794 17.142 1211 1HZ LYS 53 1HZ LYS 53 20.026 19.488 16.229 1212 2HZ LYS 53 2HZ LYS 53 18.542 19.187 16.833 1213 3HZ LYS 53 3HZ LYS 53 19.878 18.951 17.768 1214 H GLU 54 H GLU 54 23.421 13.238 12.323 1215 HA GLU 54 HA GLU 54 26.206 13.540 12.572 1216 1HB GLU 54 2HB GLU 54 24.731 12.257 10.238 1217 2HB GLU 54 3HB GLU 54 26.436 12.101 10.574 1218 1HG GLU 54 2HG GLU 54 25.954 10.947 12.708 1219 2HG GLU 54 3HG GLU 54 24.225 11.000 12.335 1220 H VAL 55 H VAL 55 24.015 15.245 10.390 1221 HA VAL 55 HA VAL 55 26.338 16.505 9.020 1222 HB VAL 55 HB VAL 55 24.894 16.690 7.020 1223 1HG1 VAL 55 1HG1 VAL 55 25.308 13.822 7.962 1224 2HG1 VAL 55 2HG1 VAL 55 25.194 14.400 6.286 1225 3HG1 VAL 55 3HG1 VAL 55 26.565 14.879 7.289 1226 1HG2 VAL 55 1HG2 VAL 55 22.653 16.451 8.118 1227 2HG2 VAL 55 2HG2 VAL 55 22.888 15.351 6.752 1228 3HG2 VAL 55 3HG2 VAL 55 23.006 14.732 8.409 1229 H GLY 56 H GLY 56 24.594 17.209 11.493 1230 1HA GLY 56 2HA GLY 56 24.145 19.187 12.509 1231 2HA GLY 56 3HA GLY 56 24.966 19.991 11.162 1232 H ILE 57 H ILE 57 21.986 17.993 10.905 1233 HA ILE 57 HA ILE 57 20.400 20.463 10.331 1234 HB ILE 57 HB ILE 57 20.278 17.728 9.013 1235 1HG1 ILE 57 2HG1 ILE 57 20.779 20.507 7.853 1236 2HG1 ILE 57 3HG1 ILE 57 22.024 19.300 8.159 1237 1HG2 ILE 57 1HG2 ILE 57 18.378 20.093 8.631 1238 2HG2 ILE 57 2HG2 ILE 57 18.336 18.574 7.718 1239 3HG2 ILE 57 3HG2 ILE 57 17.967 18.562 9.431 1240 1HD1 ILE 57 1HD1 ILE 57 19.795 19.049 6.111 1241 2HD1 ILE 57 2HD1 ILE 57 21.516 19.320 5.831 1242 3HD1 ILE 57 3HD1 ILE 57 20.980 17.775 6.508 1243 H ASP 58 H ASP 58 18.524 20.626 11.496 1244 HA ASP 58 HA ASP 58 18.064 18.593 13.626 1245 1HB ASP 58 2HB ASP 58 18.429 20.948 14.341 1246 2HB ASP 58 3HB ASP 58 17.050 21.457 13.363 1247 H ILE 59 H ILE 59 16.200 17.404 13.581 1248 HA ILE 59 HA ILE 59 13.947 18.313 11.888 1249 HB ILE 59 HB ILE 59 13.572 16.065 11.073 1250 1HG1 ILE 59 2HG1 ILE 59 16.315 15.194 12.015 1251 2HG1 ILE 59 3HG1 ILE 59 14.852 14.888 12.952 1252 1HG2 ILE 59 1HG2 ILE 59 16.388 16.912 10.298 1253 2HG2 ILE 59 2HG2 ILE 59 15.180 16.062 9.300 1254 3HG2 ILE 59 3HG2 ILE 59 14.920 17.744 9.756 1255 1HD1 ILE 59 1HD1 ILE 59 15.336 13.911 10.110 1256 2HD1 ILE 59 2HD1 ILE 59 15.304 12.941 11.590 1257 3HD1 ILE 59 3HD1 ILE 59 13.829 13.727 11.029 1258 H SER 60 H SER 60 14.745 17.978 14.960 1259 HA SER 60 HA SER 60 13.161 15.942 16.057 1260 1HB SER 60 2HB SER 60 13.913 18.612 17.295 1261 2HB SER 60 3HB SER 60 13.573 17.091 18.144 1262 HG SER 60 HG SER 60 15.837 17.553 17.849 1263 H ASN 61 H ASN 61 12.226 19.075 14.821 1264 HA ASN 61 HA ASN 61 9.676 19.295 16.189 1265 1HB ASN 61 2HB ASN 61 10.949 21.250 15.408 1266 2HB ASN 61 3HB ASN 61 10.870 20.672 13.744 1267 1HD2 ASN 61 2HD2 ASN 61 9.271 21.637 12.511 1268 2HD2 ASN 61 1HD2 ASN 61 7.802 22.322 13.150 1269 H GLN 62 H GLN 62 10.702 17.368 13.450 1270 HA GLN 62 HA GLN 62 8.465 17.875 11.749 1271 1HB GLN 62 2HB GLN 62 10.502 15.611 11.780 1272 2HB GLN 62 3HB GLN 62 9.264 15.824 10.531 1273 1HG GLN 62 2HG GLN 62 10.107 18.073 10.009 1274 2HG GLN 62 3HG GLN 62 11.390 17.879 11.207 1275 1HE2 GLN 62 2HE2 GLN 62 10.926 14.827 9.596 1276 2HE2 GLN 62 1HE2 GLN 62 12.306 15.034 8.523 1277 H THR 63 H THR 63 7.062 16.139 10.882 1278 HA THR 63 HA THR 63 5.825 14.374 12.905 1279 HB THR 63 HB THR 63 3.615 15.367 12.104 1280 HG1 THR 63 1HG THR 63 3.664 17.332 11.082 1281 1HG2 THR 63 1HG2 THR 63 5.405 17.396 13.513 1282 2HG2 THR 63 2HG2 THR 63 3.637 17.261 13.603 1283 3HG2 THR 63 3HG2 THR 63 4.654 15.993 14.304 1284 H SER 64 H SER 64 3.833 13.272 11.483 1285 HA SER 64 HA SER 64 4.202 13.181 8.681 1286 1HB SER 64 2HB SER 64 4.571 10.679 8.528 1287 2HB SER 64 3HB SER 64 5.965 11.646 9.001 1288 HG SER 64 HG SER 64 5.886 9.899 10.355 1289 H ASP 65 H ASP 65 2.532 11.467 7.792 1290 HA ASP 65 HA ASP 65 0.271 10.955 9.566 1291 1HB ASP 65 3HB ASP 65 0.085 13.375 8.685 1292 2HB ASP 65 2HB ASP 65 -0.051 12.679 7.071 1293 H ILE 66 H ILE 66 -1.393 9.703 8.206 1294 HA ILE 66 HA ILE 66 -0.066 7.672 6.641 1295 HB ILE 66 HB ILE 66 -2.317 6.819 6.168 1296 1HG1 ILE 66 2HG1 ILE 66 -3.444 9.069 7.884 1297 2HG1 ILE 66 3HG1 ILE 66 -3.483 9.087 6.119 1298 1HG2 ILE 66 1HG2 ILE 66 -1.911 7.487 9.112 1299 2HG2 ILE 66 2HG2 ILE 66 -2.779 6.089 8.433 1300 3HG2 ILE 66 3HG2 ILE 66 -1.037 6.243 8.200 1301 1HD1 ILE 66 1HD1 ILE 66 -4.813 6.999 7.890 1302 2HD1 ILE 66 2HD1 ILE 66 -5.606 8.285 6.966 1303 3HD1 ILE 66 3HD1 ILE 66 -4.776 6.971 6.109 1304 H ILE 67 H ILE 67 -0.758 7.084 4.445 1305 HA ILE 67 HA ILE 67 -0.012 8.955 2.553 1306 HB ILE 67 HB ILE 67 -0.582 7.389 0.945 1307 1HG1 ILE 67 2HG1 ILE 67 -2.614 6.196 2.874 1308 2HG1 ILE 67 3HG1 ILE 67 -2.935 7.002 1.335 1309 1HG2 ILE 67 1HG2 ILE 67 -0.068 5.634 3.367 1310 2HG2 ILE 67 2HG2 ILE 67 0.444 5.372 1.697 1311 3HG2 ILE 67 3HG2 ILE 67 1.161 6.692 2.623 1312 1HD1 ILE 67 1HD1 ILE 67 -1.655 4.275 1.704 1313 2HD1 ILE 67 2HD1 ILE 67 -3.244 4.668 1.037 1314 3HD1 ILE 67 3HD1 ILE 67 -1.780 5.123 0.143 1315 H ASP 68 H ASP 68 -0.970 10.679 1.515 1316 HA ASP 68 HA ASP 68 -3.908 10.991 1.830 1317 1HB ASP 68 2HB ASP 68 -2.753 12.149 3.692 1318 2HB ASP 68 3HB ASP 68 -1.948 13.190 2.512 1319 H SER 69 H SER 69 -4.403 10.692 -0.155 1320 HA SER 69 HA SER 69 -3.186 11.300 -2.501 1321 1HB SER 69 2HB SER 69 -6.187 11.399 -2.200 1322 2HB SER 69 3HB SER 69 -5.204 10.540 -3.402 1323 HG SER 69 HG SER 69 -6.093 9.074 -1.861 1324 H ASP 70 H ASP 70 -4.974 13.568 -0.409 1325 HA ASP 70 HA ASP 70 -5.647 15.484 -2.434 1326 1HB ASP 70 2HB ASP 70 -6.675 15.451 -0.194 1327 2HB ASP 70 3HB ASP 70 -5.121 15.873 0.533 1328 H ILE 71 H ILE 71 -2.629 14.702 -0.825 1329 HA ILE 71 HA ILE 71 -1.366 17.110 -2.052 1330 HB ILE 71 HB ILE 71 -0.253 15.528 0.276 1331 1HG1 ILE 71 2HG1 ILE 71 -0.832 17.882 1.445 1332 2HG1 ILE 71 3HG1 ILE 71 -2.156 17.864 0.286 1333 1HG2 ILE 71 1HG2 ILE 71 0.430 18.272 -0.887 1334 2HG2 ILE 71 2HG2 ILE 71 1.231 17.500 0.495 1335 3HG2 ILE 71 3HG2 ILE 71 1.390 16.797 -1.114 1336 1HD1 ILE 71 1HD1 ILE 71 -1.494 15.724 2.369 1337 2HD1 ILE 71 2HD1 ILE 71 -2.823 16.896 2.448 1338 3HD1 ILE 71 3HD1 ILE 71 -2.843 15.613 1.226 1339 H LEU 72 H LEU 72 -1.033 13.502 -1.549 1340 HA LEU 72 HA LEU 72 1.342 13.356 -3.082 1341 1HB LEU 72 2HB LEU 72 0.522 11.536 -1.641 1342 2HB LEU 72 3HB LEU 72 -0.738 11.144 -2.804 1343 HG LEU 72 HG LEU 72 2.171 11.282 -3.694 1344 1HD1 LEU 72 1HD1 LEU 72 1.109 8.630 -2.777 1345 2HD1 LEU 72 2HD1 LEU 72 2.766 9.182 -3.024 1346 3HD1 LEU 72 3HD1 LEU 72 1.865 9.723 -1.606 1347 1HD2 LEU 72 1HD2 LEU 72 0.746 10.869 -5.576 1348 2HD2 LEU 72 2HD2 LEU 72 1.350 9.284 -5.147 1349 3HD2 LEU 72 3HD2 LEU 72 -0.284 9.749 -4.659 1350 H ASN 73 H ASN 73 -2.106 13.036 -4.223 1351 HA ASN 73 HA ASN 73 -1.232 12.603 -6.930 1352 1HB ASN 73 2HB ASN 73 -3.343 12.202 -7.411 1353 2HB ASN 73 3HB ASN 73 -3.671 12.298 -5.694 1354 1HD2 ASN 73 2HD2 ASN 73 -4.396 14.504 -4.867 1355 2HD2 ASN 73 1HD2 ASN 73 -5.275 15.555 -5.966 1356 H ASN 74 H ASN 74 -1.306 15.446 -5.010 1357 HA ASN 74 HA ASN 74 -1.431 17.309 -7.296 1358 1HB ASN 74 2HB ASN 74 -1.587 17.522 -4.320 1359 2HB ASN 74 3HB ASN 74 -0.670 18.796 -5.085 1360 1HD2 ASN 74 2HD2 ASN 74 -3.715 18.166 -4.013 1361 2HD2 ASN 74 1HD2 ASN 74 -4.610 19.190 -5.117 1362 H ALA 75 H ALA 75 0.964 15.377 -5.727 1363 HA ALA 75 HA ALA 75 3.203 17.159 -6.005 1364 1HB ALA 75 1HB ALA 75 3.188 14.120 -5.936 1365 2HB ALA 75 2HB ALA 75 4.551 15.189 -5.581 1366 3HB ALA 75 3HB ALA 75 3.151 15.156 -4.492 1367 H ASP 76 H ASP 76 5.008 16.755 -7.492 1368 HA ASP 76 HA ASP 76 4.185 16.029 -10.262 1369 1HB ASP 76 2HB ASP 76 5.470 18.099 -9.898 1370 2HB ASP 76 3HB ASP 76 6.746 17.184 -9.091 1371 H LEU 77 H LEU 77 5.970 14.802 -7.492 1372 HA LEU 77 HA LEU 77 7.164 12.552 -9.026 1373 1HB LEU 77 2HB LEU 77 8.585 14.681 -8.946 1374 2HB LEU 77 3HB LEU 77 8.586 14.560 -7.210 1375 HG LEU 77 HG LEU 77 10.679 13.850 -8.022 1376 1HD1 LEU 77 1HD1 LEU 77 9.641 12.381 -6.201 1377 2HD1 LEU 77 2HD1 LEU 77 9.437 11.156 -7.483 1378 3HD1 LEU 77 3HD1 LEU 77 11.047 11.753 -7.079 1379 1HD2 LEU 77 1HD2 LEU 77 10.079 13.362 -10.319 1380 2HD2 LEU 77 2HD2 LEU 77 11.020 12.029 -9.628 1381 3HD2 LEU 77 3HD2 LEU 77 9.258 11.855 -9.822 1382 H VAL 78 H VAL 78 6.838 10.694 -7.839 1383 HA VAL 78 HA VAL 78 6.736 10.885 -4.859 1384 HB VAL 78 HB VAL 78 5.763 8.585 -6.586 1385 1HG1 VAL 78 1HG1 VAL 78 5.352 9.225 -3.627 1386 2HG1 VAL 78 2HG1 VAL 78 4.693 7.830 -4.508 1387 3HG1 VAL 78 3HG1 VAL 78 6.431 7.967 -4.273 1388 1HG2 VAL 78 1HG2 VAL 78 4.271 10.350 -7.070 1389 2HG2 VAL 78 2HG2 VAL 78 3.466 9.284 -5.936 1390 3HG2 VAL 78 3HG2 VAL 78 4.137 10.832 -5.356 1391 H VAL 79 H VAL 79 8.612 10.372 -3.978 1392 HA VAL 79 HA VAL 79 10.536 8.503 -5.222 1393 HB VAL 79 HB VAL 79 10.478 10.117 -2.624 1394 1HG1 VAL 79 1HG1 VAL 79 12.624 8.300 -3.749 1395 2HG1 VAL 79 2HG1 VAL 79 12.923 9.485 -2.469 1396 3HG1 VAL 79 3HG1 VAL 79 11.799 8.142 -2.205 1397 1HG2 VAL 79 1HG2 VAL 79 10.819 11.598 -4.489 1398 2HG2 VAL 79 2HG2 VAL 79 12.338 11.419 -3.627 1399 3HG2 VAL 79 3HG2 VAL 79 12.095 10.552 -5.157 1400 H THR 80 H THR 80 9.765 6.346 -5.033 1401 HA THR 80 HA THR 80 8.598 5.431 -2.491 1402 HB THR 80 HB THR 80 10.135 3.759 -4.478 1403 HG1 THR 80 1HG THR 80 8.507 3.619 -5.748 1404 1HG2 THR 80 1HG2 THR 80 7.908 3.097 -2.519 1405 2HG2 THR 80 2HG2 THR 80 8.621 1.959 -3.689 1406 3HG2 THR 80 3HG2 THR 80 9.617 2.626 -2.392 1407 H LEU 81 H LEU 81 9.825 5.287 -0.662 1408 HA LEU 81 HA LEU 81 12.786 5.570 -0.940 1409 1HB LEU 81 2HB LEU 81 11.316 7.542 -0.106 1410 2HB LEU 81 3HB LEU 81 11.079 6.558 1.318 1411 HG LEU 81 HG LEU 81 13.607 6.541 1.650 1412 1HD1 LEU 81 1HD1 LEU 81 13.574 8.774 -0.409 1413 2HD1 LEU 81 2HD1 LEU 81 14.947 8.240 0.566 1414 3HD1 LEU 81 3HD1 LEU 81 14.294 7.169 -0.677 1415 1HD2 LEU 81 1HD2 LEU 81 12.020 8.009 2.859 1416 2HD2 LEU 81 2HD2 LEU 81 13.612 8.751 2.623 1417 3HD2 LEU 81 3HD2 LEU 81 12.238 9.255 1.620 1418 H SER 82 H SER 82 11.354 3.025 -0.872 1419 HA SER 82 HA SER 82 12.852 1.815 1.348 1420 1HB SER 82 2HB SER 82 10.129 0.697 0.708 1421 2HB SER 82 3HB SER 82 11.102 0.498 2.165 1422 HG SER 82 HG SER 82 9.088 2.091 1.716 1423 H GLY 83 H GLY 83 13.110 -0.549 0.880 1424 1HA GLY 83 2HA GLY 83 12.485 -1.407 -1.911 1425 2HA GLY 83 3HA GLY 83 13.959 -1.925 -1.062 1426 H ASP 84 H ASP 84 10.460 -1.522 -0.255 1427 HA ASP 84 HA ASP 84 10.311 -4.166 1.060 1428 1HB ASP 84 2HB ASP 84 11.160 -2.690 2.818 1429 2HB ASP 84 3HB ASP 84 9.958 -1.459 2.414 1430 H ALA 85 H ALA 85 8.045 -4.657 1.649 1431 HA ALA 85 HA ALA 85 6.121 -3.376 -0.243 1432 1HB ALA 85 1HB ALA 85 6.372 -6.296 0.586 1433 2HB ALA 85 2HB ALA 85 5.199 -5.624 -0.563 1434 3HB ALA 85 3HB ALA 85 6.928 -5.605 -0.959 1435 H ALA 86 H ALA 86 6.674 -3.683 3.108 1436 HA ALA 86 HA ALA 86 3.959 -4.371 3.896 1437 1HB ALA 86 1HB ALA 86 6.209 -3.057 5.465 1438 2HB ALA 86 2HB ALA 86 4.691 -3.672 6.139 1439 3HB ALA 86 3HB ALA 86 5.851 -4.796 5.404 1440 H ASP 87 H ASP 87 5.353 -1.578 2.506 1441 HA ASP 87 HA ASP 87 3.935 0.465 3.827 1442 1HB ASP 87 2HB ASP 87 6.027 0.600 2.356 1443 2HB ASP 87 3HB ASP 87 4.951 0.532 0.972 1444 H LYS 88 H LYS 88 2.138 -1.777 2.723 1445 HA LYS 88 HA LYS 88 0.098 -2.050 1.812 1446 1HB LYS 88 2HB LYS 88 -0.201 0.160 3.192 1447 2HB LYS 88 3HB LYS 88 -0.329 0.935 1.610 1448 1HG LYS 88 2HG LYS 88 -2.184 -0.688 1.065 1449 2HG LYS 88 3HG LYS 88 -2.093 -1.296 2.719 1450 1HD LYS 88 2HD LYS 88 -2.648 1.583 1.883 1451 2HD LYS 88 3HD LYS 88 -3.882 0.392 2.271 1452 1HE LYS 88 2HE LYS 88 -1.749 1.397 4.219 1453 2HE LYS 88 3HE LYS 88 -3.362 2.080 4.079 1454 1HZ LYS 88 1HZ LYS 88 -2.780 -0.702 4.920 1455 2HZ LYS 88 2HZ LYS 88 -3.362 0.511 5.857 1456 3HZ LYS 88 3HZ LYS 88 -4.279 -0.107 4.653 1457 H CYS 89 H CYS 89 2.462 -1.756 0.104 1458 HA CYS 89 HA CYS 89 3.145 -1.501 -2.061 1459 1HB CYS 89 2HB CYS 89 0.506 -2.900 -2.490 1460 2HB CYS 89 3HB CYS 89 1.938 -3.046 -3.490 1461 HA PRO 90 HA PRO 90 -0.108 1.855 -2.911 1462 1HB PRO 90 2HB PRO 90 2.290 3.645 -3.221 1463 2HB PRO 90 3HB PRO 90 0.714 4.003 -2.446 1464 1HG PRO 90 2HG PRO 90 2.877 3.463 -0.907 1465 2HG PRO 90 3HG PRO 90 1.295 2.718 -0.505 1466 1HD PRO 90 2HD PRO 90 3.600 1.520 -2.084 1467 2HD PRO 90 3HD PRO 90 2.744 0.823 -0.695 1468 H MET 91 H MET 91 -0.723 2.771 -4.929 1469 HA MET 91 HA MET 91 0.852 1.689 -7.223 1470 1HB MET 91 2HB MET 91 -1.274 1.341 -8.351 1471 2HB MET 91 3HB MET 91 -1.131 0.464 -6.833 1472 1HG MET 91 2HG MET 91 -3.356 1.294 -7.102 1473 2HG MET 91 3HG MET 91 -2.611 2.066 -5.721 1474 1HE MET 91 1HE MET 91 -5.091 3.222 -6.258 1475 2HE MET 91 2HE MET 91 -5.274 4.534 -7.447 1476 3HE MET 91 3HE MET 91 -5.274 2.838 -7.978 1477 H THR 92 H THR 92 0.349 4.581 -5.886 1478 HA THR 92 HA THR 92 0.459 6.747 -6.575 1479 HB THR 92 HB THR 92 2.563 7.034 -7.916 1480 HG1 THR 92 1HG THR 92 2.311 5.049 -9.069 1481 1HG2 THR 92 1HG2 THR 92 2.675 5.069 -5.575 1482 2HG2 THR 92 2HG2 THR 92 3.980 6.126 -6.143 1483 3HG2 THR 92 3HG2 THR 92 2.524 6.832 -5.429 1484 HA PRO 93 HA PRO 93 -2.255 6.500 -10.177 1485 1HB PRO 93 2HB PRO 93 -3.564 8.948 -9.872 1486 2HB PRO 93 3HB PRO 93 -3.998 7.407 -9.069 1487 1HG PRO 93 2HG PRO 93 -2.306 9.668 -7.977 1488 2HG PRO 93 3HG PRO 93 -3.638 8.784 -7.162 1489 1HD PRO 93 2HD PRO 93 -1.062 8.156 -6.700 1490 2HD PRO 93 3HD PRO 93 -2.279 6.849 -6.869 1491 HA PRO 94 HA PRO 94 0.241 8.256 -13.113 1492 1HB PRO 94 2HB PRO 94 -1.333 8.551 -15.364 1493 2HB PRO 94 3HB PRO 94 -0.894 6.978 -14.637 1494 1HG PRO 94 2HG PRO 94 -3.432 8.584 -14.190 1495 2HG PRO 94 3HG PRO 94 -3.281 6.845 -14.614 1496 1HD PRO 94 2HD PRO 94 -3.629 7.616 -12.048 1497 2HD PRO 94 3HD PRO 94 -2.488 6.297 -12.454 1498 H HIS 95 H HIS 95 -1.884 10.403 -11.719 1499 HA HIS 95 HA HIS 95 -1.392 12.811 -13.226 1500 1HB HIS 95 2HB HIS 95 -1.896 12.368 -10.251 1501 2HB HIS 95 3HB HIS 95 -1.930 13.920 -11.071 1502 HD1 HIS 95 HD1 HIS 95 -4.501 13.532 -9.684 1503 HD2 HIS 95 HD2 HIS 95 -3.732 11.798 -13.454 1504 HE1 HIS 95 HE1 HIS 95 -6.762 12.997 -10.709 1505 H VAL 96 H VAL 96 0.705 10.720 -11.366 1506 HA VAL 96 HA VAL 96 2.688 12.906 -10.967 1507 HB VAL 96 HB VAL 96 2.292 10.593 -9.042 1508 1HG1 VAL 96 1HG1 VAL 96 3.334 13.437 -8.787 1509 2HG1 VAL 96 2HG1 VAL 96 3.199 12.303 -7.441 1510 3HG1 VAL 96 3HG1 VAL 96 4.306 11.961 -8.782 1511 1HG2 VAL 96 1HG2 VAL 96 0.056 11.545 -9.052 1512 2HG2 VAL 96 2HG2 VAL 96 0.900 12.038 -7.598 1513 3HG2 VAL 96 3HG2 VAL 96 0.720 13.200 -8.927 1514 H LYS 97 H LYS 97 4.893 12.311 -11.205 1515 HA LYS 97 HA LYS 97 5.418 9.803 -12.666 1516 1HB LYS 97 2HB LYS 97 6.436 12.136 -13.155 1517 2HB LYS 97 3HB LYS 97 7.431 11.899 -11.727 1518 1HG LYS 97 2HG LYS 97 7.467 9.610 -13.646 1519 2HG LYS 97 3HG LYS 97 7.980 11.117 -14.371 1520 1HD LYS 97 2HD LYS 97 9.197 9.924 -11.851 1521 2HD LYS 97 3HD LYS 97 9.850 9.709 -13.467 1522 1HE LYS 97 2HE LYS 97 9.503 12.423 -12.114 1523 2HE LYS 97 3HE LYS 97 10.985 11.468 -12.062 1524 1HZ LYS 97 1HZ LYS 97 9.782 12.673 -14.475 1525 2HZ LYS 97 2HZ LYS 97 11.191 13.090 -13.740 1526 3HZ LYS 97 3HZ LYS 97 11.063 11.650 -14.508 1527 H ARG 98 H ARG 98 6.939 8.173 -11.755 1528 HA ARG 98 HA ARG 98 7.381 8.361 -8.822 1529 1HB ARG 98 2HB ARG 98 5.266 6.980 -9.435 1530 2HB ARG 98 3HB ARG 98 6.375 5.844 -10.207 1531 1HG ARG 98 2HG ARG 98 7.577 5.901 -7.791 1532 2HG ARG 98 3HG ARG 98 6.005 6.514 -7.288 1533 1HD ARG 98 2HD ARG 98 5.036 4.457 -8.528 1534 2HD ARG 98 3HD ARG 98 6.683 3.855 -8.575 1535 HE ARG 98 HE ARG 98 6.617 4.298 -6.005 1536 1HH1 ARG 98 1HH1 ARG 98 3.653 3.383 -7.690 1537 2HH1 ARG 98 2HH1 ARG 98 3.220 2.156 -6.529 1538 1HH2 ARG 98 1HH2 ARG 98 5.928 2.836 -4.402 1539 2HH2 ARG 98 2HH2 ARG 98 4.440 1.950 -4.601 1540 H GLU 99 H GLU 99 9.295 7.313 -8.163 1541 HA GLU 99 HA GLU 99 10.415 5.252 -9.816 1542 1HB GLU 99 2HB GLU 99 11.444 7.471 -10.692 1543 2HB GLU 99 3HB GLU 99 12.276 7.572 -9.148 1544 1HG GLU 99 2HG GLU 99 13.380 5.397 -9.603 1545 2HG GLU 99 3HG GLU 99 12.466 5.238 -11.102 1546 H HIS 100 H HIS 100 12.052 4.042 -8.453 1547 HA HIS 100 HA HIS 100 11.679 4.550 -5.549 1548 1HB HIS 100 2HB HIS 100 12.825 2.188 -5.461 1549 2HB HIS 100 3HB HIS 100 11.106 2.348 -5.744 1550 HD1 HIS 100 HD1 HIS 100 14.129 2.146 -8.220 1551 HD2 HIS 100 HD2 HIS 100 10.232 0.730 -7.477 1552 HE1 HIS 100 HE1 HIS 100 13.568 0.538 -10.125 1553 H TRP 101 H TRP 101 13.275 5.237 -4.369 1554 HA TRP 101 HA TRP 101 16.009 5.471 -5.576 1555 1HB TRP 101 2HB TRP 101 14.666 7.400 -3.660 1556 2HB TRP 101 3HB TRP 101 16.237 7.567 -4.389 1557 HD1 TRP 101 HD1 TRP 101 12.644 7.221 -5.884 1558 HE1 TRP 101 HE1 TRP 101 12.277 9.060 -7.591 1559 HE3 TRP 101 HE3 TRP 101 17.196 9.448 -5.596 1560 HZ2 TRP 101 HZ2 TRP 101 13.761 11.337 -8.641 1561 HZ3 TRP 101 HZ3 TRP 101 17.716 11.482 -6.934 1562 HH2 TRP 101 HH2 TRP 101 15.996 12.431 -8.458 1563 H GLY 102 H GLY 102 14.026 4.701 -2.727 1564 1HA GLY 102 2HA GLY 102 16.372 4.139 -1.022 1565 2HA GLY 102 3HA GLY 102 14.677 3.837 -0.629 1566 H PHE 103 H PHE 103 16.735 1.920 -0.262 1567 HA PHE 103 HA PHE 103 15.767 -0.289 -1.972 1568 1HB PHE 103 2HB PHE 103 18.242 1.090 -2.440 1569 2HB PHE 103 3HB PHE 103 18.672 -0.431 -1.712 1570 HD1 PHE 103 HD1 PHE 103 17.134 1.216 -4.638 1571 HD2 PHE 103 HD2 PHE 103 18.227 -2.572 -2.882 1572 HE1 PHE 103 HE1 PHE 103 16.889 0.118 -6.850 1573 HE2 PHE 103 HE2 PHE 103 17.980 -3.665 -5.098 1574 HZ PHE 103 HZ PHE 103 17.316 -2.323 -7.087 1575 H ASP 104 H ASP 104 16.425 0.834 1.117 1576 HA ASP 104 HA ASP 104 16.525 -1.759 2.394 1577 1HB ASP 104 2HB ASP 104 18.919 -1.461 1.867 1578 2HB ASP 104 3HB ASP 104 18.883 0.178 2.522 1579 H ASP 105 H ASP 105 16.612 -1.199 4.923 1580 HA ASP 105 HA ASP 105 15.385 1.436 5.446 1581 1HB ASP 105 2HB ASP 105 13.510 0.014 5.070 1582 2HB ASP 105 3HB ASP 105 14.127 -1.181 6.206 1583 HA PRO 106 HA PRO 106 18.507 0.846 8.617 1584 1HB PRO 106 2HB PRO 106 18.453 3.354 9.737 1585 2HB PRO 106 3HB PRO 106 19.264 2.970 8.185 1586 1HG PRO 106 2HG PRO 106 16.529 4.172 8.640 1587 2HG PRO 106 3HG PRO 106 17.792 4.682 7.472 1588 1HD PRO 106 2HD PRO 106 15.678 3.081 6.822 1589 2HD PRO 106 3HD PRO 106 17.257 2.916 6.007 1590 H ALA 107 H ALA 107 15.108 1.651 9.117 1591 HA ALA 107 HA ALA 107 15.161 1.357 11.997 1592 1HB ALA 107 1HB ALA 107 12.868 0.959 10.030 1593 2HB ALA 107 2HB ALA 107 12.732 1.185 11.782 1594 3HB ALA 107 3HB ALA 107 13.331 2.511 10.766 1595 H ARG 108 H ARG 108 15.799 -0.899 9.511 1596 HA ARG 108 HA ARG 108 14.868 -3.209 11.161 1597 1HB ARG 108 2HB ARG 108 15.496 -3.322 8.203 1598 2HB ARG 108 3HB ARG 108 14.550 -4.452 9.166 1599 1HG ARG 108 2HG ARG 108 13.769 -1.643 8.364 1600 2HG ARG 108 3HG ARG 108 13.174 -3.098 7.599 1601 1HD ARG 108 2HD ARG 108 12.687 -2.675 10.563 1602 2HD ARG 108 3HD ARG 108 11.790 -1.726 9.379 1603 HE ARG 108 HE ARG 108 11.853 -4.683 9.109 1604 1HH1 ARG 108 1HH1 ARG 108 9.958 -1.775 9.873 1605 2HH1 ARG 108 2HH1 ARG 108 8.428 -2.545 9.676 1606 1HH2 ARG 108 1HH2 ARG 108 9.812 -5.697 8.804 1607 2HH2 ARG 108 2HH2 ARG 108 8.350 -4.823 9.053 1608 H ALA 109 H ALA 109 17.469 -1.545 11.207 1609 HA ALA 109 HA ALA 109 19.671 -3.080 10.374 1610 1HB ALA 109 1HB ALA 109 19.289 -1.419 12.895 1611 2HB ALA 109 2HB ALA 109 20.856 -1.885 12.185 1612 3HB ALA 109 3HB ALA 109 19.768 -0.780 11.317 1613 H GLN 110 H GLN 110 21.015 -4.551 11.548 1614 HA GLN 110 HA GLN 110 19.708 -6.748 12.651 1615 1HB GLN 110 2HB GLN 110 21.885 -6.843 11.559 1616 2HB GLN 110 3HB GLN 110 22.600 -5.860 12.832 1617 1HG GLN 110 2HG GLN 110 23.291 -8.149 13.086 1618 2HG GLN 110 3HG GLN 110 22.312 -7.686 14.462 1619 1HE2 GLN 110 2HE2 GLN 110 20.057 -8.530 14.567 1620 2HE2 GLN 110 1HE2 GLN 110 19.668 -10.027 13.736 1621 H GLY 111 H GLY 111 20.969 -3.899 14.378 1622 1HA GLY 111 2HA GLY 111 19.696 -3.226 16.252 1623 2HA GLY 111 3HA GLY 111 19.473 -4.900 16.744 1624 H THR 112 H THR 112 22.723 -4.865 16.019 1625 HA THR 112 HA THR 112 23.596 -4.338 18.752 1626 HB THR 112 HB THR 112 25.853 -4.659 17.772 1627 HG1 THR 112 1HG THR 112 25.963 -5.295 15.583 1628 1HG2 THR 112 1HG2 THR 112 23.926 -6.835 16.823 1629 2HG2 THR 112 2HG2 THR 112 25.650 -7.016 17.205 1630 3HG2 THR 112 3HG2 THR 112 24.495 -6.648 18.497 1631 H GLU 113 H GLU 113 25.051 -2.492 19.257 1632 HA GLU 113 HA GLU 113 23.993 -0.020 18.398 1633 1HB GLU 113 2HB GLU 113 26.706 -0.636 19.654 1634 2HB GLU 113 3HB GLU 113 25.966 0.967 19.549 1635 1HG GLU 113 2HG GLU 113 24.059 0.185 20.934 1636 2HG GLU 113 3HG GLU 113 24.795 -1.414 21.059 1637 H GLU 114 H GLU 114 26.830 -1.862 17.272 1638 HA GLU 114 HA GLU 114 27.815 0.195 15.534 1639 1HB GLU 114 2HB GLU 114 29.297 -1.545 14.652 1640 2HB GLU 114 3HB GLU 114 29.318 -1.447 16.410 1641 1HG GLU 114 2HG GLU 114 27.834 -3.458 16.530 1642 2HG GLU 114 3HG GLU 114 27.874 -3.573 14.769 1643 H GLU 115 H GLU 115 25.689 -2.715 14.925 1644 HA GLU 115 HA GLU 115 25.642 -2.155 12.088 1645 1HB GLU 115 2HB GLU 115 23.874 -3.879 13.862 1646 2HB GLU 115 3HB GLU 115 23.584 -3.682 12.144 1647 1HG GLU 115 3HG GLU 115 26.233 -4.649 13.247 1648 2HG GLU 115 2HG GLU 115 24.875 -5.726 12.797 1649 H LYS 116 H LYS 116 23.595 -1.154 14.866 1650 HA LYS 116 HA LYS 116 21.568 0.082 13.269 1651 1HB LYS 116 2HB LYS 116 22.563 0.516 16.113 1652 2HB LYS 116 3HB LYS 116 21.461 1.654 15.365 1653 1HG LYS 116 2HG LYS 116 20.083 -0.497 14.704 1654 2HG LYS 116 3HG LYS 116 20.965 -1.247 16.032 1655 1HD LYS 116 2HD LYS 116 19.953 0.263 17.626 1656 2HD LYS 116 3HD LYS 116 19.394 1.349 16.334 1657 1HE LYS 116 2HE LYS 116 17.936 -0.460 15.438 1658 2HE LYS 116 3HE LYS 116 18.397 -1.495 16.794 1659 1HZ LYS 116 1HZ LYS 116 17.000 1.111 17.056 1660 2HZ LYS 116 2HZ LYS 116 16.288 -0.348 17.158 1661 3HZ LYS 116 3HZ LYS 116 17.369 0.101 18.289 1662 H TRP 117 H TRP 117 24.546 1.635 14.691 1663 HA TRP 117 HA TRP 117 24.017 4.041 13.307 1664 1HB TRP 117 2HB TRP 117 25.666 3.580 15.226 1665 2HB TRP 117 3HB TRP 117 26.816 3.117 13.984 1666 HD1 TRP 117 HD1 TRP 117 25.539 5.808 12.149 1667 HE1 TRP 117 HE1 TRP 117 26.609 8.037 12.606 1668 HE3 TRP 117 HE3 TRP 117 27.558 4.742 16.734 1669 HZ2 TRP 117 HZ2 TRP 117 28.077 9.300 14.790 1670 HZ3 TRP 117 HZ3 TRP 117 28.777 6.499 17.990 1671 HH2 TRP 117 HH2 TRP 117 29.044 8.778 17.029 1672 H ALA 118 H ALA 118 25.940 1.154 12.227 1673 HA ALA 118 HA ALA 118 26.900 2.289 9.837 1674 1HB ALA 118 1HB ALA 118 26.106 -0.606 10.371 1675 2HB ALA 118 2HB ALA 118 27.157 -0.034 9.062 1676 3HB ALA 118 3HB ALA 118 27.682 0.132 10.749 1677 H PHE 119 H PHE 119 23.766 0.590 10.431 1678 HA PHE 119 HA PHE 119 22.862 0.707 7.711 1679 1HB PHE 119 2HB PHE 119 21.627 0.214 10.399 1680 2HB PHE 119 3HB PHE 119 20.565 0.745 9.130 1681 HD1 PHE 119 HD1 PHE 119 19.487 -0.854 7.804 1682 HD2 PHE 119 HD2 PHE 119 23.284 -1.851 9.598 1683 HE1 PHE 119 HE1 PHE 119 19.242 -3.175 7.029 1684 HE2 PHE 119 HE2 PHE 119 23.029 -4.185 8.815 1685 HZ PHE 119 HZ PHE 119 21.003 -4.861 7.537 1686 H PHE 120 H PHE 120 22.350 2.962 10.540 1687 HA PHE 120 HA PHE 120 20.682 4.759 9.090 1688 1HB PHE 120 2HB PHE 120 22.714 5.862 11.025 1689 2HB PHE 120 3HB PHE 120 21.107 6.429 10.665 1690 HD1 PHE 120 HD1 PHE 120 22.374 6.288 13.322 1691 HD2 PHE 120 HD2 PHE 120 19.930 3.384 11.270 1692 HE1 PHE 120 HE1 PHE 120 21.659 5.334 15.497 1693 HE2 PHE 120 HE2 PHE 120 19.184 2.478 13.439 1694 HZ PHE 120 HZ PHE 120 20.039 3.469 15.565 1695 H GLN 121 H GLN 121 24.228 4.708 9.552 1696 HA GLN 121 HA GLN 121 24.766 7.107 8.238 1697 1HB GLN 121 2HB GLN 121 26.180 5.965 9.873 1698 2HB GLN 121 3HB GLN 121 26.549 4.675 8.722 1699 1HG GLN 121 2HG GLN 121 27.840 6.136 7.353 1700 2HG GLN 121 3HG GLN 121 27.157 7.576 8.103 1701 1HE2 GLN 121 2HE2 GLN 121 27.679 7.919 10.538 1702 2HE2 GLN 121 1HE2 GLN 121 29.264 7.399 11.060 1703 H ARG 122 H ARG 122 24.834 3.733 6.901 1704 HA ARG 122 HA ARG 122 25.803 4.542 4.338 1705 1HB ARG 122 2HB ARG 122 25.765 2.198 5.261 1706 2HB ARG 122 3HB ARG 122 24.016 2.144 4.971 1707 1HG ARG 122 2HG ARG 122 24.405 2.469 2.540 1708 2HG ARG 122 3HG ARG 122 26.133 2.689 2.839 1709 1HD ARG 122 2HD ARG 122 25.927 0.494 2.043 1710 2HD ARG 122 3HD ARG 122 26.198 0.319 3.769 1711 HE ARG 122 HE ARG 122 23.726 -0.179 2.212 1712 1HH1 ARG 122 1HH1 ARG 122 25.219 -0.260 5.442 1713 2HH1 ARG 122 2HH1 ARG 122 24.046 -1.344 6.096 1714 1HH2 ARG 122 1HH2 ARG 122 22.173 -1.582 3.097 1715 2HH2 ARG 122 2HH2 ARG 122 22.205 -2.002 4.762 1716 H VAL 123 H VAL 123 22.430 4.068 5.556 1717 HA VAL 123 HA VAL 123 21.258 4.795 3.036 1718 HB VAL 123 HB VAL 123 20.124 4.675 5.861 1719 1HG1 VAL 123 1HG1 VAL 123 18.702 4.988 3.177 1720 2HG1 VAL 123 2HG1 VAL 123 17.899 4.536 4.693 1721 3HG1 VAL 123 3HG1 VAL 123 18.672 6.114 4.554 1722 1HG2 VAL 123 1HG2 VAL 123 20.942 2.490 4.949 1723 2HG2 VAL 123 2HG2 VAL 123 19.192 2.510 5.083 1724 3HG2 VAL 123 3HG2 VAL 123 19.952 2.735 3.497 1725 H ARG 124 H ARG 124 22.188 6.691 5.931 1726 HA ARG 124 HA ARG 124 21.027 9.146 5.153 1727 1HB ARG 124 2HB ARG 124 21.795 8.606 7.396 1728 2HB ARG 124 3HB ARG 124 23.463 8.463 6.869 1729 1HG ARG 124 2HG ARG 124 21.997 11.081 6.537 1730 2HG ARG 124 3HG ARG 124 22.550 10.591 8.129 1731 1HD ARG 124 2HD ARG 124 24.418 10.780 5.748 1732 2HD ARG 124 3HD ARG 124 24.125 12.089 6.907 1733 HE ARG 124 HE ARG 124 24.773 10.040 8.567 1734 1HH1 ARG 124 1HH1 ARG 124 26.427 11.390 5.705 1735 2HH1 ARG 124 2HH1 ARG 124 28.009 11.130 6.328 1736 1HH2 ARG 124 1HH2 ARG 124 26.894 9.707 9.396 1737 2HH2 ARG 124 2HH2 ARG 124 28.281 10.193 8.473 1738 H ASP 125 H ASP 125 24.296 7.804 4.439 1739 HA ASP 125 HA ASP 125 25.150 10.076 2.921 1740 1HB ASP 125 2HB ASP 125 26.729 8.415 3.739 1741 2HB ASP 125 3HB ASP 125 25.966 7.149 2.772 1742 H GLU 126 H GLU 126 23.449 7.045 1.973 1743 HA GLU 126 HA GLU 126 23.469 7.546 -0.813 1744 1HB GLU 126 2HB GLU 126 22.976 5.349 0.290 1745 2HB GLU 126 3HB GLU 126 21.436 5.994 0.850 1746 1HG GLU 126 2HG GLU 126 20.965 4.688 -1.066 1747 2HG GLU 126 3HG GLU 126 20.774 6.357 -1.570 1748 H ILE 127 H ILE 127 20.857 8.172 1.606 1749 HA ILE 127 HA ILE 127 19.050 9.407 -0.186 1750 HB ILE 127 HB ILE 127 19.423 9.482 2.829 1751 1HG1 ILE 127 2HG1 ILE 127 17.372 8.238 0.929 1752 2HG1 ILE 127 3HG1 ILE 127 18.634 7.378 1.796 1753 1HG2 ILE 127 1HG2 ILE 127 17.085 10.767 1.373 1754 2HG2 ILE 127 2HG2 ILE 127 17.331 10.637 3.132 1755 3HG2 ILE 127 3HG2 ILE 127 18.385 11.669 2.189 1756 1HD1 ILE 127 1HD1 ILE 127 16.156 8.674 2.991 1757 2HD1 ILE 127 2HD1 ILE 127 16.571 6.962 2.914 1758 3HD1 ILE 127 3HD1 ILE 127 17.506 8.051 3.966 1759 H GLY 128 H GLY 128 21.683 10.855 1.845 1760 1HA GLY 128 2HA GLY 128 21.061 13.528 1.191 1761 2HA GLY 128 3HA GLY 128 22.664 12.914 1.682 1762 H ASN 129 H ASN 129 23.382 11.270 -0.388 1763 HA ASN 129 HA ASN 129 24.183 13.080 -2.444 1764 1HB ASN 129 2HB ASN 129 25.489 11.097 -2.039 1765 2HB ASN 129 3HB ASN 129 24.092 10.044 -2.296 1766 1HD2 ASN 129 2HD2 ASN 129 23.855 9.191 -4.340 1767 2HD2 ASN 129 1HD2 ASN 129 24.282 10.052 -5.809 1768 H ARG 130 H ARG 130 21.481 10.688 -2.327 1769 HA ARG 130 HA ARG 130 20.657 11.093 -5.028 1770 1HB ARG 130 2HB ARG 130 19.299 10.058 -2.512 1771 2HB ARG 130 3HB ARG 130 18.403 10.218 -4.001 1772 1HG ARG 130 2HG ARG 130 20.947 8.544 -3.698 1773 2HG ARG 130 3HG ARG 130 19.300 7.935 -3.610 1774 1HD ARG 130 2HD ARG 130 19.415 7.543 -5.793 1775 2HD ARG 130 3HD ARG 130 19.265 9.270 -6.045 1776 HE ARG 130 HE ARG 130 21.687 9.465 -6.227 1777 1HH1 ARG 130 1HH1 ARG 130 20.412 6.145 -6.571 1778 2HH1 ARG 130 2HH1 ARG 130 21.681 5.653 -7.628 1779 1HH2 ARG 130 1HH2 ARG 130 23.259 8.842 -7.607 1780 2HH2 ARG 130 2HH2 ARG 130 23.401 7.199 -8.187 1781 H LEU 131 H LEU 131 19.482 12.742 -2.003 1782 HA LEU 131 HA LEU 131 17.612 14.323 -3.519 1783 1HB LEU 131 2HB LEU 131 18.719 14.456 -0.712 1784 2HB LEU 131 3HB LEU 131 17.994 15.904 -1.373 1785 HG LEU 131 HG LEU 131 16.367 14.720 -0.076 1786 1HD1 LEU 131 1HD1 LEU 131 15.561 14.379 -2.992 1787 2HD1 LEU 131 2HD1 LEU 131 14.520 14.704 -1.612 1788 3HD1 LEU 131 3HD1 LEU 131 15.642 15.954 -2.162 1789 1HD2 LEU 131 1HD2 LEU 131 17.202 12.425 -0.301 1790 2HD2 LEU 131 2HD2 LEU 131 15.478 12.525 -0.666 1791 3HD2 LEU 131 3HD2 LEU 131 16.652 12.364 -1.989 1792 H LYS 132 H LYS 132 21.038 14.835 -2.628 1793 HA LYS 132 HA LYS 132 21.205 17.498 -3.626 1794 1HB LYS 132 2HB LYS 132 22.883 16.317 -2.208 1795 2HB LYS 132 3HB LYS 132 23.361 15.340 -3.605 1796 1HG LYS 132 2HG LYS 132 24.003 17.417 -4.821 1797 2HG LYS 132 3HG LYS 132 23.534 18.380 -3.414 1798 1HD LYS 132 2HD LYS 132 25.736 16.266 -3.485 1799 2HD LYS 132 3HD LYS 132 25.978 18.018 -3.556 1800 1HE LYS 132 2HE LYS 132 24.918 18.243 -1.307 1801 2HE LYS 132 3HE LYS 132 24.747 16.487 -1.216 1802 1HZ LYS 132 1HZ LYS 132 27.330 17.928 -1.412 1803 2HZ LYS 132 2HZ LYS 132 26.727 17.248 -0.060 1804 3HZ LYS 132 3HZ LYS 132 27.162 16.305 -1.315 1805 H GLU 133 H GLU 133 21.706 14.316 -5.302 1806 HA GLU 133 HA GLU 133 22.198 15.414 -7.874 1807 1HB GLU 133 2HB GLU 133 21.033 12.754 -6.958 1808 2HB GLU 133 3HB GLU 133 21.171 13.178 -8.664 1809 1HG GLU 133 2HG GLU 133 23.614 13.545 -8.383 1810 2HG GLU 133 3HG GLU 133 23.491 13.027 -6.702 1811 H PHE 134 H PHE 134 19.054 14.524 -6.303 1812 HA PHE 134 HA PHE 134 17.446 15.092 -8.535 1813 1HB PHE 134 2HB PHE 134 16.634 13.918 -6.549 1814 2HB PHE 134 3HB PHE 134 16.861 15.355 -5.572 1815 HD1 PHE 134 HD1 PHE 134 14.680 15.601 -4.728 1816 HD2 PHE 134 HD2 PHE 134 15.256 15.325 -8.989 1817 HE1 PHE 134 HE1 PHE 134 12.361 16.352 -5.090 1818 HE2 PHE 134 HE2 PHE 134 12.904 16.013 -9.345 1819 HZ PHE 134 HZ PHE 134 11.451 16.548 -7.403 1820 H ALA 135 H ALA 135 18.721 17.360 -6.040 1821 HA ALA 135 HA ALA 135 17.264 19.631 -6.993 1822 1HB ALA 135 1HB ALA 135 19.973 19.561 -5.594 1823 2HB ALA 135 2HB ALA 135 18.860 20.939 -5.697 1824 3HB ALA 135 3HB ALA 135 18.393 19.493 -4.775 1825 H GLU 136 H GLU 136 20.249 18.086 -8.149 1826 HA GLU 136 HA GLU 136 21.015 20.376 -9.806 1827 1HB GLU 136 2HB GLU 136 22.035 17.512 -9.608 1828 2HB GLU 136 3HB GLU 136 22.729 18.725 -10.674 1829 1HG GLU 136 2HG GLU 136 22.549 19.134 -7.657 1830 2HG GLU 136 3HG GLU 136 23.888 18.307 -8.433 1831 H THR 137 H THR 137 19.468 17.136 -10.326 1832 HA THR 137 HA THR 137 19.408 17.543 -13.209 1833 HB THR 137 HB THR 137 18.258 15.342 -13.172 1834 HG1 THR 137 1HG THR 137 18.576 14.574 -10.713 1835 1HG2 THR 137 1HG2 THR 137 20.728 15.399 -11.375 1836 2HG2 THR 137 2HG2 THR 137 20.113 14.013 -12.301 1837 3HG2 THR 137 3HG2 THR 137 20.737 15.436 -13.148 1838 H GLY 138 H GLY 138 17.112 17.818 -10.517 1839 1HA GLY 138 2HA GLY 138 14.960 18.604 -10.409 1840 2HA GLY 138 3HA GLY 138 14.970 18.974 -12.142 1841 H LYS 139 H LYS 139 16.135 15.824 -11.582 1842 HA LYS 139 HA LYS 139 15.534 14.089 -12.851 1843 1HB LYS 139 2HB LYS 139 14.943 13.562 -10.414 1844 2HB LYS 139 3HB LYS 139 13.265 13.838 -10.860 1845 1HG LYS 139 2HG LYS 139 13.354 11.571 -11.182 1846 2HG LYS 139 3HG LYS 139 13.828 12.071 -12.792 1847 1HD LYS 139 2HD LYS 139 15.464 10.813 -10.612 1848 2HD LYS 139 3HD LYS 139 15.299 10.360 -12.301 1849 1HE LYS 139 2HE LYS 139 16.665 12.403 -12.914 1850 2HE LYS 139 3HE LYS 139 16.901 12.703 -11.186 1851 1HZ LYS 139 1HZ LYS 139 17.809 10.314 -12.686 1852 2HZ LYS 139 2HZ LYS 139 18.759 11.483 -12.072 1853 3HZ LYS 139 3HZ LYS 139 17.957 10.481 -11.066 Start of MODEL 2 1 1H MET 1 H1 MET 1 -23.054 -11.079 -7.569 2 2H MET 1 H2 MET 1 -24.685 -11.183 -7.411 3 3H MET 1 H3 MET 1 -24.033 -10.076 -8.446 4 HA MET 1 HA MET 1 -23.698 -12.970 -8.718 5 1HB MET 1 HB2 MET 1 -26.072 -12.330 -9.059 6 2HB MET 1 HB3 MET 1 -25.587 -11.163 -10.298 7 1HG MET 1 HG2 MET 1 -24.645 -13.010 -11.658 8 2HG MET 1 HG3 MET 1 -25.081 -14.168 -10.395 9 1HE MET 1 HE1 MET 1 -27.495 -15.094 -13.337 10 2HE MET 1 HE2 MET 1 -25.820 -14.512 -13.468 11 3HE MET 1 HE3 MET 1 -26.260 -15.683 -12.203 12 H ALA 2 HN ALA 2 -21.787 -13.252 -9.586 13 HA ALA 2 HA ALA 2 -19.986 -13.204 -10.809 14 1HB ALA 2 HB1 ALA 2 -19.803 -12.177 -12.989 15 2HB ALA 2 HB2 ALA 2 -21.372 -12.991 -12.848 16 3HB ALA 2 HB3 ALA 2 -21.265 -11.217 -12.719 17 H ILE 3 HN ILE 3 -18.058 -11.963 -11.181 18 HA ILE 3 HA ILE 3 -17.860 -9.529 -9.545 19 HB ILE 3 HB ILE 3 -15.901 -11.647 -10.472 20 1HG1 ILE 3 HG12 ILE 3 -15.043 -11.326 -8.138 21 2HG1 ILE 3 HG13 ILE 3 -16.364 -10.198 -7.837 22 1HG2 ILE 3 HG21 ILE 3 -15.161 -8.782 -9.719 23 2HG2 ILE 3 HG22 ILE 3 -14.016 -10.145 -9.824 24 3HG2 ILE 3 HG23 ILE 3 -14.832 -9.577 -11.272 25 1HD1 ILE 3 HD11 ILE 3 -16.757 -12.376 -6.928 26 2HD1 ILE 3 HD12 ILE 3 -17.991 -11.997 -8.134 27 3HD1 ILE 3 HD13 ILE 3 -16.670 -13.139 -8.531 28 H VAL 4 HN VAL 4 -18.290 -7.727 -10.599 29 HA VAL 4 HA VAL 4 -18.279 -7.596 -13.525 30 HB VAL 4 HB VAL 4 -19.269 -5.671 -11.411 31 1HG1 VAL 4 HG11 VAL 4 -20.729 -4.761 -13.215 32 2HG1 VAL 4 HG12 VAL 4 -19.035 -4.431 -13.486 33 3HG1 VAL 4 HG13 VAL 4 -19.840 -5.739 -14.399 34 1HG2 VAL 4 HG21 VAL 4 -20.539 -7.744 -11.221 35 2HG2 VAL 4 HG22 VAL 4 -21.547 -6.583 -12.068 36 3HG2 VAL 4 HG23 VAL 4 -20.718 -7.845 -12.987 37 H LYS 5 HN LYS 5 -17.432 -5.402 -14.409 38 HA LYS 5 HA LYS 5 -14.785 -4.810 -13.249 39 1HB LYS 5 HB2 LYS 5 -14.565 -6.345 -15.144 40 2HB LYS 5 HB3 LYS 5 -15.585 -5.315 -16.143 41 1HG LYS 5 HG2 LYS 5 -13.289 -5.061 -16.785 42 2HG LYS 5 HG3 LYS 5 -13.871 -3.538 -16.118 43 1HD LYS 5 HD2 LYS 5 -12.717 -3.991 -13.985 44 2HD LYS 5 HD3 LYS 5 -12.192 -5.577 -14.567 45 1HE LYS 5 HE2 LYS 5 -11.465 -2.892 -15.832 46 2HE LYS 5 HE3 LYS 5 -10.440 -3.774 -14.693 47 1HZ LYS 5 HZ1 LYS 5 -9.795 -4.172 -16.987 48 2HZ LYS 5 HZ2 LYS 5 -10.279 -5.578 -16.292 49 3HZ LYS 5 HZ3 LYS 5 -11.256 -4.797 -17.351 50 H ALA 6 HN ALA 6 -14.660 -2.731 -12.714 51 HA ALA 6 HA ALA 6 -16.524 -0.702 -13.779 52 1HB ALA 6 HB1 ALA 6 -15.103 0.720 -12.128 53 2HB ALA 6 HB2 ALA 6 -16.236 -0.434 -11.472 54 3HB ALA 6 HB3 ALA 6 -14.506 -0.837 -11.534 55 H THR 7 HN THR 7 -15.428 1.476 -14.263 56 HA THR 7 HA THR 7 -12.714 1.616 -15.046 57 HB THR 7 HB THR 7 -13.440 0.513 -17.073 58 HG1 THR 7 HG1 THR 7 -11.978 2.050 -17.499 59 1HG2 THR 7 HG21 THR 7 -15.081 1.544 -18.637 60 2HG2 THR 7 HG22 THR 7 -15.803 0.892 -17.168 61 3HG2 THR 7 HG23 THR 7 -15.569 2.655 -17.341 62 H ASP 8 HN ASP 8 -12.670 3.911 -16.299 63 HA ASP 8 HA ASP 8 -12.398 5.778 -14.444 64 1HB ASP 8 HB2 ASP 8 -11.492 6.008 -16.619 65 2HB ASP 8 HB3 ASP 8 -13.082 6.004 -17.379 66 H GLN 9 HN GLN 9 -15.565 5.259 -15.935 67 HA GLN 9 HA GLN 9 -16.746 7.146 -14.019 68 1HB GLN 9 HB2 GLN 9 -17.163 7.182 -17.029 69 2HB GLN 9 HB3 GLN 9 -18.355 7.859 -15.913 70 1HG GLN 9 HG2 GLN 9 -16.869 9.541 -15.123 71 2HG GLN 9 HG3 GLN 9 -15.460 8.759 -15.819 72 1HE2 GLN 9 HE22 GLN 9 -14.768 9.364 -17.818 73 2HE2 GLN 9 HE21 GLN 9 -15.686 10.381 -18.929 74 H SER 10 HN SER 10 -17.145 4.371 -16.277 75 HA SER 10 HA SER 10 -19.741 3.707 -15.564 76 1HB SER 10 HB2 SER 10 -17.581 1.687 -16.164 77 2HB SER 10 HB3 SER 10 -19.308 1.575 -16.526 78 HG SER 10 HG SER 10 -19.076 3.197 -18.062 79 H PHE 11 HN PHE 11 -16.866 3.396 -13.506 80 HA PHE 11 HA PHE 11 -17.694 1.468 -11.640 81 1HB PHE 11 HB2 PHE 11 -15.631 2.590 -11.215 82 2HB PHE 11 HB3 PHE 11 -16.350 4.168 -11.391 83 HD1 PHE 11 HD1 PHE 11 -17.387 5.333 -9.599 84 HD2 PHE 11 HD2 PHE 11 -16.033 1.257 -8.977 85 HE1 PHE 11 HE1 PHE 11 -17.597 5.630 -7.155 86 HE2 PHE 11 HE2 PHE 11 -16.196 1.620 -6.543 87 HZ PHE 11 HZ PHE 11 -16.996 3.768 -5.617 88 H SER 12 HN SER 12 -18.808 4.931 -11.864 89 HA SER 12 HA SER 12 -20.543 4.693 -9.629 90 1HB SER 12 HB2 SER 12 -20.869 6.515 -12.064 91 2HB SER 12 HB3 SER 12 -21.436 6.829 -10.417 92 HG SER 12 HG SER 12 -19.483 7.957 -10.883 93 H ALA 13 HN ALA 13 -21.057 4.296 -13.158 94 HA ALA 13 HA ALA 13 -23.853 4.145 -12.979 95 1HB ALA 13 HB1 ALA 13 -22.593 4.577 -15.072 96 2HB ALA 13 HB2 ALA 13 -22.012 2.892 -15.071 97 3HB ALA 13 HB3 ALA 13 -23.743 3.235 -15.273 98 H GLU 14 HN GLU 14 -21.334 1.650 -12.750 99 HA GLU 14 HA GLU 14 -23.111 -0.565 -12.584 100 1HB GLU 14 HB2 GLU 14 -20.175 -0.224 -11.896 101 2HB GLU 14 HB3 GLU 14 -21.005 -1.769 -11.756 102 1HG GLU 14 HG2 GLU 14 -20.789 -0.160 -14.323 103 2HG GLU 14 HG3 GLU 14 -19.750 -1.515 -13.877 104 H THR 15 HN THR 15 -22.314 1.855 -10.215 105 HA THR 15 HA THR 15 -22.973 -0.005 -8.003 106 HB THR 15 HB THR 15 -21.545 1.516 -6.621 107 HG1 THR 15 HG1 THR 15 -20.544 2.541 -9.022 108 1HG2 THR 15 HG21 THR 15 -20.164 0.268 -9.032 109 2HG2 THR 15 HG22 THR 15 -19.320 0.955 -7.639 110 3HG2 THR 15 HG23 THR 15 -20.396 -0.443 -7.421 111 H SER 16 HN SER 16 -24.470 2.374 -9.722 112 HA SER 16 HA SER 16 -25.368 4.104 -7.606 113 1HB SER 16 HB2 SER 16 -26.327 3.707 -10.461 114 2HB SER 16 HB3 SER 16 -26.915 4.971 -9.362 115 HG SER 16 HG SER 16 -24.187 4.609 -10.108 116 H GLU 17 HN GLU 17 -26.205 0.901 -8.058 117 HA GLU 17 HA GLU 17 -28.801 1.290 -6.768 118 1HB GLU 17 HB2 GLU 17 -28.339 -0.331 -9.314 119 2HB GLU 17 HB3 GLU 17 -29.777 -0.486 -8.298 120 1HG GLU 17 HG2 GLU 17 -30.277 1.938 -8.682 121 2HG GLU 17 HG3 GLU 17 -28.916 2.015 -9.807 122 H GLY 18 HN GLY 18 -29.563 -0.612 -5.651 123 1HA GLY 18 HA2 GLY 18 -29.412 -2.424 -4.359 124 2HA GLY 18 HA3 GLY 18 -28.196 -3.079 -5.475 125 H VAL 19 HN VAL 19 -27.247 -3.946 -3.544 126 HA VAL 19 HA VAL 19 -25.352 -2.013 -2.306 127 HB VAL 19 HB VAL 19 -26.263 -4.592 -0.968 128 1HG1 VAL 19 HG11 VAL 19 -24.522 -2.234 -0.081 129 2HG1 VAL 19 HG12 VAL 19 -25.018 -3.560 0.974 130 3HG1 VAL 19 HG13 VAL 19 -23.969 -3.888 -0.401 131 1HG2 VAL 19 HG21 VAL 19 -27.182 -1.740 -0.520 132 2HG2 VAL 19 HG22 VAL 19 -28.169 -3.160 -0.876 133 3HG2 VAL 19 HG23 VAL 19 -27.373 -3.019 0.690 134 H VAL 20 HN VAL 20 -23.385 -2.233 -2.667 135 HA VAL 20 HA VAL 20 -22.478 -4.511 -4.275 136 HB VAL 20 HB VAL 20 -23.474 -2.900 -5.808 137 1HG1 VAL 20 HG11 VAL 20 -21.563 -0.837 -4.669 138 2HG1 VAL 20 HG12 VAL 20 -22.642 -0.611 -6.049 139 3HG1 VAL 20 HG13 VAL 20 -23.332 -0.834 -4.459 140 1HG2 VAL 20 HG21 VAL 20 -21.685 -2.514 -7.337 141 2HG2 VAL 20 HG22 VAL 20 -20.453 -2.633 -6.062 142 3HG2 VAL 20 HG23 VAL 20 -21.394 -4.062 -6.541 143 H LEU 21 HN LEU 21 -20.368 -4.630 -4.412 144 HA LEU 21 HA LEU 21 -18.679 -3.350 -2.296 145 1HB LEU 21 HB2 LEU 21 -19.510 -5.607 -1.761 146 2HB LEU 21 HB3 LEU 21 -18.928 -6.205 -3.317 147 HG LEU 21 HG LEU 21 -16.574 -5.749 -2.585 148 1HD1 LEU 21 HD11 LEU 21 -16.256 -5.401 -0.094 149 2HD1 LEU 21 HD12 LEU 21 -16.869 -3.981 -0.953 150 3HD1 LEU 21 HD13 LEU 21 -17.970 -4.987 0.031 151 1HD2 LEU 21 HD21 LEU 21 -16.487 -7.663 -1.137 152 2HD2 LEU 21 HD22 LEU 21 -18.184 -7.463 -0.648 153 3HD2 LEU 21 HD23 LEU 21 -17.761 -7.938 -2.312 154 H ALA 22 HN ALA 22 -17.584 -1.862 -3.699 155 HA ALA 22 HA ALA 22 -16.477 -2.962 -6.174 156 1HB ALA 22 HB1 ALA 22 -15.618 -0.737 -6.627 157 2HB ALA 22 HB2 ALA 22 -17.305 -0.589 -6.128 158 3HB ALA 22 HB3 ALA 22 -15.995 -0.209 -4.970 159 H ASP 23 HN ASP 23 -14.200 -3.171 -6.488 160 HA ASP 23 HA ASP 23 -12.510 -3.303 -4.055 161 1HB ASP 23 HB2 ASP 23 -13.460 -5.523 -4.203 162 2HB ASP 23 HB3 ASP 23 -13.163 -5.587 -5.937 163 H PHE 24 HN PHE 24 -10.300 -3.238 -4.513 164 HA PHE 24 HA PHE 24 -9.554 -2.261 -7.238 165 1HB PHE 24 HB2 PHE 24 -9.048 -1.142 -4.466 166 2HB PHE 24 HB3 PHE 24 -8.154 -0.612 -5.864 167 HD1 PHE 24 HD1 PHE 24 -8.949 1.166 -7.170 168 HD2 PHE 24 HD2 PHE 24 -11.712 -0.903 -4.600 169 HE1 PHE 24 HE1 PHE 24 -10.758 2.775 -7.776 170 HE2 PHE 24 HE2 PHE 24 -13.494 0.687 -5.214 171 HZ PHE 24 HZ PHE 24 -13.014 2.555 -6.785 172 H TRP 25 HN TRP 25 -8.166 -3.714 -8.006 173 HA TRP 25 HA TRP 25 -6.204 -5.056 -6.232 174 1HB TRP 25 HB2 TRP 25 -6.688 -7.133 -7.053 175 2HB TRP 25 HB3 TRP 25 -8.290 -6.437 -6.899 176 HD1 TRP 25 HD1 TRP 25 -9.171 -5.271 -9.329 177 HE1 TRP 25 HE1 TRP 25 -8.842 -5.926 -11.732 178 HE3 TRP 25 HE3 TRP 25 -5.419 -8.667 -8.642 179 HZ2 TRP 25 HZ2 TRP 25 -6.802 -7.475 -13.263 180 HZ3 TRP 25 HZ3 TRP 25 -4.236 -9.642 -10.583 181 HH2 TRP 25 HH2 TRP 25 -4.920 -9.039 -12.897 182 H ALA 26 HN ALA 26 -4.148 -5.437 -7.378 183 HA ALA 26 HA ALA 26 -3.932 -5.435 -10.181 184 1HB ALA 26 HB1 ALA 26 -2.333 -3.322 -10.260 185 2HB ALA 26 HB2 ALA 26 -4.074 -3.131 -10.413 186 3HB ALA 26 HB3 ALA 26 -3.292 -2.816 -8.860 187 HA PRO 27 HA PRO 27 -0.397 -7.652 -9.296 188 1HB PRO 27 HB2 PRO 27 1.284 -5.901 -11.099 189 2HB PRO 27 HB3 PRO 27 1.195 -7.691 -11.035 190 1HG PRO 27 HG2 PRO 27 -0.206 -6.362 -12.931 191 2HG PRO 27 HG3 PRO 27 -1.027 -7.673 -12.017 192 1HD PRO 27 HD2 PRO 27 -1.177 -4.700 -11.576 193 2HD PRO 27 HD3 PRO 27 -2.489 -5.914 -11.624 194 H TRP 28 HN TRP 28 0.013 -4.268 -8.529 195 HA TRP 28 HA TRP 28 2.483 -4.097 -7.228 196 1HB TRP 28 HB2 TRP 28 -0.055 -2.910 -6.140 197 2HB TRP 28 HB3 TRP 28 1.580 -2.296 -6.006 198 HD1 TRP 28 HD1 TRP 28 -1.416 -2.346 -8.220 199 HE1 TRP 28 HE1 TRP 28 -1.268 -0.611 -10.078 200 HE3 TRP 28 HE3 TRP 28 3.471 -1.051 -7.590 201 HZ2 TRP 28 HZ2 TRP 28 0.794 1.128 -11.184 202 HZ3 TRP 28 HZ3 TRP 28 4.510 0.663 -9.051 203 HH2 TRP 28 HH2 TRP 28 3.181 1.765 -10.841 204 H CYS 29 HN CYS 29 -0.347 -5.941 -6.120 205 HA CYS 29 HA CYS 29 1.109 -6.362 -3.548 206 1HB CYS 29 HB2 CYS 29 -1.135 -4.815 -3.860 207 2HB CYS 29 HB3 CYS 29 -1.877 -6.368 -3.538 208 H GLY 30 HN GLY 30 0.979 -8.328 -2.560 209 1HA GLY 30 HA2 GLY 30 0.371 -10.703 -4.063 210 2HA GLY 30 HA3 GLY 30 0.690 -10.584 -2.323 211 HA PRO 31 HA PRO 31 -3.698 -10.536 -1.193 212 1HB PRO 31 HB2 PRO 31 -3.618 -7.517 -1.120 213 2HB PRO 31 HB3 PRO 31 -4.529 -8.643 -0.052 214 1HG PRO 31 HG2 PRO 31 -2.119 -7.659 0.750 215 2HG PRO 31 HG3 PRO 31 -2.492 -9.396 0.989 216 1HD PRO 31 HD2 PRO 31 -0.753 -8.114 -1.091 217 2HD PRO 31 HD3 PRO 31 -0.565 -9.688 -0.283 218 H SER 32 HN SER 32 -2.928 -8.282 -3.941 219 HA SER 32 HA SER 32 -5.576 -8.143 -4.927 220 1HB SER 32 HB2 SER 32 -2.993 -8.429 -6.534 221 2HB SER 32 HB3 SER 32 -4.469 -7.595 -7.036 222 HG SER 32 HG SER 32 -2.672 -6.288 -6.218 223 H LYS 33 HN LYS 33 -3.315 -10.810 -4.927 224 HA LYS 33 HA LYS 33 -5.101 -12.378 -6.700 225 1HB LYS 33 HB2 LYS 33 -2.427 -13.307 -5.642 226 2HB LYS 33 HB3 LYS 33 -3.421 -13.975 -6.933 227 1HG LYS 33 HG2 LYS 33 -1.796 -12.948 -8.159 228 2HG LYS 33 HG3 LYS 33 -3.034 -11.686 -8.151 229 1HD LYS 33 HD2 LYS 33 -1.824 -10.522 -6.332 230 2HD LYS 33 HD3 LYS 33 -0.660 -11.850 -6.231 231 1HE LYS 33 HE2 LYS 33 0.023 -11.366 -8.604 232 2HE LYS 33 HE3 LYS 33 -1.087 -9.989 -8.611 233 1HZ LYS 33 HZ1 LYS 33 1.136 -9.238 -8.062 234 2HZ LYS 33 HZ2 LYS 33 0.205 -9.089 -6.715 235 3HZ LYS 33 HZ3 LYS 33 1.280 -10.320 -6.855 236 H MET 34 HN MET 34 -5.267 -11.650 -3.550 237 HA MET 34 HA MET 34 -6.113 -14.411 -2.753 238 1HB MET 34 HB2 MET 34 -5.060 -12.245 -0.905 239 2HB MET 34 HB3 MET 34 -5.648 -13.845 -0.448 240 1HG MET 34 HG2 MET 34 -3.854 -14.837 -1.941 241 2HG MET 34 HG3 MET 34 -3.167 -13.221 -2.094 242 1HE MET 34 HE1 MET 34 -3.418 -11.955 0.836 243 2HE MET 34 HE2 MET 34 -1.880 -12.482 1.546 244 3HE MET 34 HE3 MET 34 -1.926 -11.927 -0.139 245 H ILE 35 HN ILE 35 -6.748 -10.862 -2.376 246 HA ILE 35 HA ILE 35 -9.397 -11.186 -1.461 247 HB ILE 35 HB ILE 35 -7.720 -9.079 -1.704 248 1HG1 ILE 35 HG12 ILE 35 -9.850 -7.624 -1.290 249 2HG1 ILE 35 HG13 ILE 35 -10.733 -9.151 -1.354 250 1HG2 ILE 35 HG21 ILE 35 -7.933 -8.843 -4.129 251 2HG2 ILE 35 HG22 ILE 35 -9.690 -8.556 -3.945 252 3HG2 ILE 35 HG23 ILE 35 -8.518 -7.427 -3.244 253 1HD1 ILE 35 HD11 ILE 35 -10.005 -8.468 0.965 254 2HD1 ILE 35 HD12 ILE 35 -9.353 -10.050 0.489 255 3HD1 ILE 35 HD13 ILE 35 -8.312 -8.609 0.448 256 H ALA 36 HN ALA 36 -7.936 -11.267 -4.719 257 HA ALA 36 HA ALA 36 -10.299 -11.176 -6.231 258 1HB ALA 36 HB1 ALA 36 -8.967 -12.514 -7.951 259 2HB ALA 36 HB2 ALA 36 -8.262 -10.980 -7.425 260 3HB ALA 36 HB3 ALA 36 -7.614 -12.498 -6.800 261 HA PRO 37 HA PRO 37 -10.902 -15.917 -5.951 262 1HB PRO 37 HB2 PRO 37 -9.605 -17.080 -3.681 263 2HB PRO 37 HB3 PRO 37 -9.266 -17.375 -5.417 264 1HG PRO 37 HG2 PRO 37 -7.843 -15.648 -3.463 265 2HG PRO 37 HG3 PRO 37 -7.201 -16.399 -4.949 266 1HD PRO 37 HD2 PRO 37 -7.766 -13.702 -4.752 267 2HD PRO 37 HD3 PRO 37 -7.857 -14.625 -6.269 268 H VAL 38 HN VAL 38 -10.211 -14.206 -2.837 269 HA VAL 38 HA VAL 38 -12.306 -15.326 -1.346 270 HB VAL 38 HB VAL 38 -10.660 -12.829 -1.271 271 1HG1 VAL 38 HG11 VAL 38 -11.712 -12.133 0.897 272 2HG1 VAL 38 HG12 VAL 38 -12.645 -11.787 -0.568 273 3HG1 VAL 38 HG13 VAL 38 -13.103 -13.161 0.450 274 1HG2 VAL 38 HG21 VAL 38 -9.845 -15.034 -0.458 275 2HG2 VAL 38 HG22 VAL 38 -9.869 -13.792 0.811 276 3HG2 VAL 38 HG23 VAL 38 -11.139 -15.038 0.758 277 H LEU 39 HN LEU 39 -12.377 -12.561 -3.632 278 HA LEU 39 HA LEU 39 -15.103 -11.911 -2.950 279 1HB LEU 39 HB2 LEU 39 -13.342 -11.185 -5.313 280 2HB LEU 39 HB3 LEU 39 -15.005 -10.630 -5.175 281 HG LEU 39 HG LEU 39 -12.934 -10.168 -2.963 282 1HD1 LEU 39 HD11 LEU 39 -12.589 -7.937 -3.829 283 2HD1 LEU 39 HD12 LEU 39 -12.103 -9.148 -5.016 284 3HD1 LEU 39 HD13 LEU 39 -13.640 -8.269 -5.232 285 1HD2 LEU 39 HD21 LEU 39 -15.471 -8.610 -3.525 286 2HD2 LEU 39 HD22 LEU 39 -15.297 -9.854 -2.262 287 3HD2 LEU 39 HD23 LEU 39 -14.332 -8.380 -2.194 288 H GLU 40 HN GLU 40 -13.605 -13.983 -5.517 289 HA GLU 40 HA GLU 40 -16.106 -14.477 -6.806 290 1HB GLU 40 HB2 GLU 40 -13.601 -16.183 -6.769 291 2HB GLU 40 HB3 GLU 40 -15.016 -16.375 -7.834 292 1HG GLU 40 HG2 GLU 40 -14.627 -14.160 -8.812 293 2HG GLU 40 HG3 GLU 40 -13.215 -13.926 -7.790 294 H GLU 41 HN GLU 41 -14.425 -15.964 -4.007 295 HA GLU 41 HA GLU 41 -16.293 -18.080 -3.593 296 1HB GLU 41 HB2 GLU 41 -14.224 -16.762 -1.814 297 2HB GLU 41 HB3 GLU 41 -15.266 -18.079 -1.273 298 1HG GLU 41 HG2 GLU 41 -14.439 -19.509 -3.126 299 2HG GLU 41 HG3 GLU 41 -13.331 -18.238 -3.625 300 H LEU 42 HN LEU 42 -16.267 -14.671 -2.732 301 HA LEU 42 HA LEU 42 -18.422 -14.834 -0.799 302 1HB LEU 42 HB2 LEU 42 -16.723 -13.006 -0.825 303 2HB LEU 42 HB3 LEU 42 -17.263 -12.523 -2.426 304 HG LEU 42 HG LEU 42 -19.514 -11.940 -1.519 305 1HD1 LEU 42 HD11 LEU 42 -18.099 -12.493 1.119 306 2HD1 LEU 42 HD12 LEU 42 -19.669 -11.674 0.943 307 3HD1 LEU 42 HD13 LEU 42 -19.515 -13.378 0.503 308 1HD2 LEU 42 HD21 LEU 42 -17.135 -10.593 -0.167 309 2HD2 LEU 42 HD22 LEU 42 -17.746 -10.239 -1.794 310 3HD2 LEU 42 HD23 LEU 42 -18.757 -9.893 -0.384 311 H ASP 43 HN ASP 43 -18.164 -14.027 -4.312 312 HA ASP 43 HA ASP 43 -20.926 -13.291 -4.418 313 1HB ASP 43 HB2 ASP 43 -19.286 -12.380 -6.040 314 2HB ASP 43 HB3 ASP 43 -18.948 -14.001 -6.639 315 H GLN 44 HN GLN 44 -19.179 -16.321 -5.176 316 HA GLN 44 HA GLN 44 -21.525 -17.617 -6.177 317 1HB GLN 44 HB2 GLN 44 -20.288 -19.620 -6.181 318 2HB GLN 44 HB3 GLN 44 -19.180 -18.309 -6.597 319 1HG GLN 44 HG2 GLN 44 -18.443 -18.327 -4.152 320 2HG GLN 44 HG3 GLN 44 -19.379 -19.807 -3.948 321 1HE2 GLN 44 HE22 GLN 44 -16.790 -18.336 -5.961 322 2HE2 GLN 44 HE21 GLN 44 -15.922 -19.835 -6.274 323 H GLU 45 HN GLU 45 -20.752 -16.620 -2.969 324 HA GLU 45 HA GLU 45 -22.293 -18.684 -1.674 325 1HB GLU 45 HB2 GLU 45 -20.286 -18.302 -0.543 326 2HB GLU 45 HB3 GLU 45 -20.236 -16.633 -1.033 327 1HG GLU 45 HG2 GLU 45 -20.511 -16.234 1.064 328 2HG GLU 45 HG3 GLU 45 -22.201 -16.280 0.674 329 H MET 46 HN MET 46 -22.255 -15.138 -2.011 330 HA MET 46 HA MET 46 -25.144 -15.072 -1.273 331 1HB MET 46 HB2 MET 46 -24.590 -13.062 0.079 332 2HB MET 46 HB3 MET 46 -24.026 -14.603 0.719 333 1HG MET 46 HG2 MET 46 -21.753 -14.151 -0.057 334 2HG MET 46 HG3 MET 46 -22.258 -12.661 -0.845 335 1HE MET 46 HE1 MET 46 -22.937 -10.259 2.010 336 2HE MET 46 HE2 MET 46 -22.770 -10.584 0.269 337 3HE MET 46 HE3 MET 46 -24.201 -11.213 1.128 338 H GLY 47 HN GLY 47 -23.395 -14.688 -3.851 339 1HA GLY 47 HA2 GLY 47 -23.809 -11.961 -4.615 340 2HA GLY 47 HA3 GLY 47 -23.512 -13.341 -5.710 341 H ASP 48 HN ASP 48 -26.083 -14.225 -3.986 342 HA ASP 48 HA ASP 48 -28.082 -13.578 -5.951 343 1HB ASP 48 HB2 ASP 48 -28.205 -15.664 -4.653 344 2HB ASP 48 HB3 ASP 48 -28.260 -14.748 -3.147 345 H LYS 49 HN LYS 49 -26.842 -12.066 -3.057 346 HA LYS 49 HA LYS 49 -29.040 -10.122 -3.085 347 1HB LYS 49 HB2 LYS 49 -27.120 -10.449 -0.796 348 2HB LYS 49 HB3 LYS 49 -28.776 -9.862 -0.791 349 1HG LYS 49 HG2 LYS 49 -29.144 -11.845 0.205 350 2HG LYS 49 HG3 LYS 49 -29.271 -12.434 -1.467 351 1HD LYS 49 HD2 LYS 49 -27.198 -13.522 -1.377 352 2HD LYS 49 HD3 LYS 49 -26.557 -12.378 -0.186 353 1HE LYS 49 HE2 LYS 49 -26.748 -14.462 0.891 354 2HE LYS 49 HE3 LYS 49 -27.890 -13.314 1.583 355 1HZ LYS 49 HZ1 LYS 49 -28.600 -15.480 -0.333 356 2HZ LYS 49 HZ2 LYS 49 -28.920 -15.479 1.262 357 3HZ LYS 49 HZ3 LYS 49 -29.664 -14.404 0.296 358 H LEU 50 HN LEU 50 -25.627 -10.557 -3.542 359 HA LEU 50 HA LEU 50 -25.026 -7.696 -3.175 360 1HB LEU 50 HB2 LEU 50 -24.319 -9.196 -1.418 361 2HB LEU 50 HB3 LEU 50 -23.566 -10.289 -2.558 362 HG LEU 50 HG LEU 50 -22.126 -8.910 -1.068 363 1HD1 LEU 50 HD11 LEU 50 -20.347 -8.671 -2.641 364 2HD1 LEU 50 HD12 LEU 50 -21.242 -10.168 -2.929 365 3HD1 LEU 50 HD13 LEU 50 -21.480 -8.779 -4.004 366 1HD2 LEU 50 HD21 LEU 50 -21.494 -6.662 -1.767 367 2HD2 LEU 50 HD22 LEU 50 -22.766 -6.620 -2.965 368 3HD2 LEU 50 HD23 LEU 50 -23.194 -6.732 -1.251 369 H LYS 51 HN LYS 51 -23.520 -6.776 -4.556 370 HA LYS 51 HA LYS 51 -22.754 -8.272 -7.035 371 1HB LYS 51 HB2 LYS 51 -24.551 -6.560 -7.403 372 2HB LYS 51 HB3 LYS 51 -23.484 -5.323 -6.731 373 1HG LYS 51 HG2 LYS 51 -21.870 -5.718 -8.601 374 2HG LYS 51 HG3 LYS 51 -22.967 -6.951 -9.263 375 1HD LYS 51 HD2 LYS 51 -24.743 -5.208 -9.469 376 2HD LYS 51 HD3 LYS 51 -23.614 -4.001 -8.815 377 1HE LYS 51 HE2 LYS 51 -22.062 -4.478 -10.740 378 2HE LYS 51 HE3 LYS 51 -23.268 -5.584 -11.406 379 1HZ LYS 51 HZ1 LYS 51 -24.800 -3.720 -11.590 380 2HZ LYS 51 HZ2 LYS 51 -23.704 -2.698 -10.897 381 3HZ LYS 51 HZ3 LYS 51 -23.398 -3.352 -12.369 382 H ILE 52 HN ILE 52 -20.594 -7.719 -7.853 383 HA ILE 52 HA ILE 52 -18.888 -6.233 -5.940 384 HB ILE 52 HB ILE 52 -18.189 -8.894 -7.258 385 1HG1 ILE 52 HG12 ILE 52 -18.939 -8.247 -4.394 386 2HG1 ILE 52 HG13 ILE 52 -19.805 -9.303 -5.521 387 1HG2 ILE 52 HG21 ILE 52 -16.632 -7.236 -5.214 388 2HG2 ILE 52 HG22 ILE 52 -16.126 -8.790 -5.905 389 3HG2 ILE 52 HG23 ILE 52 -16.225 -7.382 -6.938 390 1HD1 ILE 52 HD11 ILE 52 -17.778 -10.822 -5.505 391 2HD1 ILE 52 HD12 ILE 52 -17.212 -9.891 -4.108 392 3HD1 ILE 52 HD13 ILE 52 -18.755 -10.747 -4.019 393 H VAL 53 HN VAL 53 -17.340 -4.938 -7.029 394 HA VAL 53 HA VAL 53 -17.230 -5.201 -9.994 395 HB VAL 53 HB VAL 53 -17.581 -2.508 -8.621 396 1HG1 VAL 53 HG11 VAL 53 -17.802 -3.378 -11.526 397 2HG1 VAL 53 HG12 VAL 53 -17.997 -1.729 -10.886 398 3HG1 VAL 53 HG13 VAL 53 -16.423 -2.542 -10.771 399 1HG2 VAL 53 HG21 VAL 53 -19.780 -4.070 -10.036 400 2HG2 VAL 53 HG22 VAL 53 -19.711 -3.724 -8.305 401 3HG2 VAL 53 HG23 VAL 53 -19.871 -2.398 -9.454 402 H LYS 54 HN LYS 54 -15.059 -5.613 -10.388 403 HA LYS 54 HA LYS 54 -13.081 -4.524 -8.477 404 1HB LYS 54 HB2 LYS 54 -12.823 -6.483 -10.782 405 2HB LYS 54 HB3 LYS 54 -11.439 -5.812 -9.909 406 1HG LYS 54 HG2 LYS 54 -12.414 -6.673 -7.753 407 2HG LYS 54 HG3 LYS 54 -13.704 -7.426 -8.673 408 1HD LYS 54 HD2 LYS 54 -12.233 -9.208 -8.376 409 2HD LYS 54 HD3 LYS 54 -11.785 -8.628 -9.977 410 1HE LYS 54 HE2 LYS 54 -9.673 -8.799 -9.072 411 2HE LYS 54 HE3 LYS 54 -10.033 -7.148 -8.549 412 1HZ LYS 54 HZ1 LYS 54 -10.492 -7.805 -6.439 413 2HZ LYS 54 HZ2 LYS 54 -10.609 -9.420 -6.801 414 3HZ LYS 54 HZ3 LYS 54 -9.149 -8.648 -6.819 415 H ILE 55 HN ILE 55 -11.396 -3.164 -9.114 416 HA ILE 55 HA ILE 55 -11.578 -1.729 -11.716 417 HB ILE 55 HB ILE 55 -10.873 -0.854 -8.871 418 1HG1 ILE 55 HG12 ILE 55 -13.127 -0.324 -9.806 419 2HG1 ILE 55 HG13 ILE 55 -12.185 1.009 -9.171 420 1HG2 ILE 55 HG21 ILE 55 -9.737 0.394 -11.397 421 2HG2 ILE 55 HG22 ILE 55 -9.735 1.170 -9.790 422 3HG2 ILE 55 HG23 ILE 55 -8.850 -0.332 -10.071 423 1HD1 ILE 55 HD11 ILE 55 -13.293 1.709 -11.191 424 2HD1 ILE 55 HD12 ILE 55 -11.553 1.747 -11.420 425 3HD1 ILE 55 HD13 ILE 55 -12.490 0.419 -12.133 426 H ASP 56 HN ASP 56 -9.745 -2.188 -12.946 427 HA ASP 56 HA ASP 56 -7.556 -3.827 -11.771 428 1HB ASP 56 HB2 ASP 56 -8.333 -4.429 -14.029 429 2HB ASP 56 HB3 ASP 56 -7.977 -2.802 -14.612 430 H VAL 57 HN VAL 57 -6.413 -2.529 -10.450 431 HA VAL 57 HA VAL 57 -6.210 0.256 -10.896 432 HB VAL 57 HB VAL 57 -4.798 -1.321 -8.765 433 1HG1 VAL 57 HG11 VAL 57 -6.030 1.465 -8.905 434 2HG1 VAL 57 HG12 VAL 57 -5.352 0.704 -7.455 435 3HG1 VAL 57 HG13 VAL 57 -4.295 1.081 -8.838 436 1HG2 VAL 57 HG21 VAL 57 -7.585 -0.246 -8.342 437 2HG2 VAL 57 HG22 VAL 57 -7.303 -1.923 -8.801 438 3HG2 VAL 57 HG23 VAL 57 -6.595 -1.305 -7.319 439 H ASP 58 HN ASP 58 -5.049 -0.829 -13.043 440 HA ASP 58 HA ASP 58 -2.557 0.702 -13.015 441 1HB ASP 58 HB2 ASP 58 -1.632 -1.533 -12.509 442 2HB ASP 58 HB3 ASP 58 -2.577 -2.250 -13.819 443 H GLU 59 HN GLU 59 -4.822 -1.468 -14.942 444 HA GLU 59 HA GLU 59 -4.333 -0.013 -17.392 445 1HB GLU 59 HB2 GLU 59 -4.793 -2.338 -17.579 446 2HB GLU 59 HB3 GLU 59 -5.990 -2.290 -16.282 447 1HG GLU 59 HG2 GLU 59 -7.478 -0.999 -17.663 448 2HG GLU 59 HG3 GLU 59 -6.423 -1.281 -19.067 449 H ASN 60 HN ASN 60 -6.633 -0.082 -14.714 450 HA ASN 60 HA ASN 60 -8.256 2.127 -15.840 451 1HB ASN 60 HB2 ASN 60 -8.977 -0.723 -15.206 452 2HB ASN 60 HB3 ASN 60 -10.111 0.460 -14.594 453 1HD2 ASN 60 HD22 ASN 60 -9.554 -1.460 -17.323 454 2HD2 ASN 60 HD21 ASN 60 -10.487 -0.480 -18.423 455 H GLN 61 HN GLN 61 -6.182 2.235 -13.894 456 HA GLN 61 HA GLN 61 -7.326 2.197 -11.289 457 1HB GLN 61 HB2 GLN 61 -5.233 3.004 -10.478 458 2HB GLN 61 HB3 GLN 61 -4.910 1.866 -11.780 459 1HG GLN 61 HG2 GLN 61 -4.518 3.772 -13.333 460 2HG GLN 61 HG3 GLN 61 -4.682 4.862 -11.957 461 1HE2 GLN 61 HE22 GLN 61 -3.266 3.822 -9.869 462 2HE2 GLN 61 HE21 GLN 61 -1.612 3.519 -10.299 463 H GLU 62 HN GLU 62 -7.780 4.373 -13.782 464 HA GLU 62 HA GLU 62 -7.484 6.951 -12.889 465 1HB GLU 62 HB2 GLU 62 -9.474 5.495 -14.651 466 2HB GLU 62 HB3 GLU 62 -9.662 7.228 -14.351 467 1HG GLU 62 HG2 GLU 62 -8.495 6.954 -16.421 468 2HG GLU 62 HG3 GLU 62 -7.404 7.660 -15.232 469 H THR 63 HN THR 63 -10.425 4.869 -12.366 470 HA THR 63 HA THR 63 -11.871 6.697 -10.837 471 HB THR 63 HB THR 63 -11.699 3.681 -10.626 472 HG1 THR 63 HG1 THR 63 -13.467 3.846 -12.161 473 1HG2 THR 63 HG21 THR 63 -14.038 5.460 -9.833 474 2HG2 THR 63 HG22 THR 63 -13.999 3.677 -9.831 475 3HG2 THR 63 HG23 THR 63 -12.992 4.555 -8.710 476 H ALA 64 HN ALA 64 -9.145 4.646 -9.898 477 HA ALA 64 HA ALA 64 -9.768 4.614 -7.092 478 1HB ALA 64 HB1 ALA 64 -8.374 2.909 -8.472 479 2HB ALA 64 HB2 ALA 64 -7.049 4.052 -8.377 480 3HB ALA 64 HB3 ALA 64 -7.731 3.377 -6.883 481 H GLY 65 HN GLY 65 -6.961 6.026 -8.795 482 1HA GLY 65 HA2 GLY 65 -6.151 8.039 -7.127 483 2HA GLY 65 HA3 GLY 65 -6.189 8.196 -8.898 484 H LYS 66 HN LYS 66 -8.914 8.354 -9.466 485 HA LYS 66 HA LYS 66 -9.463 11.073 -8.919 486 1HB LYS 66 HB2 LYS 66 -10.242 9.796 -10.872 487 2HB LYS 66 HB3 LYS 66 -11.331 8.849 -9.842 488 1HG LYS 66 HG2 LYS 66 -12.530 11.001 -9.262 489 2HG LYS 66 HG3 LYS 66 -11.489 11.837 -10.424 490 1HD LYS 66 HD2 LYS 66 -13.461 9.581 -11.008 491 2HD LYS 66 HD3 LYS 66 -13.666 11.291 -11.416 492 1HE LYS 66 HE2 LYS 66 -11.677 11.160 -12.923 493 2HE LYS 66 HE3 LYS 66 -11.495 9.447 -12.521 494 1HZ LYS 66 HZ1 LYS 66 -13.782 10.641 -13.958 495 2HZ LYS 66 HZ2 LYS 66 -12.625 9.618 -14.554 496 3HZ LYS 66 HZ3 LYS 66 -13.694 9.054 -13.487 497 H TYR 67 HN TYR 67 -10.769 8.060 -7.368 498 HA TYR 67 HA TYR 67 -12.637 9.499 -5.760 499 1HB TYR 67 HB2 TYR 67 -12.782 7.082 -6.413 500 2HB TYR 67 HB3 TYR 67 -11.450 6.732 -5.321 501 HD1 TYR 67 HD1 TYR 67 -11.821 6.796 -2.845 502 HD2 TYR 67 HD2 TYR 67 -14.998 7.704 -5.626 503 HE1 TYR 67 HE1 TYR 67 -13.473 6.613 -1.012 504 HE2 TYR 67 HE2 TYR 67 -16.655 7.531 -3.800 505 HH TYR 67 HH TYR 67 -16.981 7.176 -1.538 506 H GLY 68 HN GLY 68 -9.257 8.560 -5.422 507 1HA GLY 68 HA2 GLY 68 -7.728 9.716 -3.932 508 2HA GLY 68 HA3 GLY 68 -9.043 9.911 -2.752 509 H VAL 69 HN VAL 69 -7.225 7.381 -4.622 510 HA VAL 69 HA VAL 69 -7.163 5.584 -2.323 511 HB VAL 69 HB VAL 69 -8.229 4.750 -5.093 512 1HG1 VAL 69 HG11 VAL 69 -7.552 3.019 -2.705 513 2HG1 VAL 69 HG12 VAL 69 -8.337 2.483 -4.216 514 3HG1 VAL 69 HG13 VAL 69 -6.677 3.075 -4.246 515 1HG2 VAL 69 HG21 VAL 69 -9.655 4.603 -2.435 516 2HG2 VAL 69 HG22 VAL 69 -10.030 5.689 -3.794 517 3HG2 VAL 69 HG23 VAL 69 -10.223 3.952 -3.999 518 H MET 70 HN MET 70 -4.965 5.111 -2.278 519 HA MET 70 HA MET 70 -3.573 5.022 -4.853 520 1HB MET 70 HB2 MET 70 -1.945 6.502 -4.516 521 2HB MET 70 HB3 MET 70 -3.400 7.328 -4.086 522 1HG MET 70 HG2 MET 70 -1.998 8.141 -2.552 523 2HG MET 70 HG3 MET 70 -2.739 6.856 -1.632 524 1HE MET 70 HE1 MET 70 0.162 5.451 -4.156 525 2HE MET 70 HE2 MET 70 0.106 7.215 -4.290 526 3HE MET 70 HE3 MET 70 1.507 6.428 -3.543 527 H SER 71 HN SER 71 -4.542 3.188 -2.609 528 HA SER 71 HA SER 71 -2.097 1.653 -2.128 529 1HB SER 71 HB2 SER 71 -3.455 1.190 0.069 530 2HB SER 71 HB3 SER 71 -2.455 2.639 -0.101 531 HG SER 71 HG SER 71 -4.577 3.131 0.690 532 H ILE 72 HN ILE 72 -2.566 -0.646 -1.580 533 HA ILE 72 HA ILE 72 -5.136 -1.593 -2.615 534 HB ILE 72 HB ILE 72 -2.432 -2.336 -3.696 535 1HG1 ILE 72 HG12 ILE 72 -4.995 -1.188 -4.869 536 2HG1 ILE 72 HG13 ILE 72 -3.409 -0.415 -4.727 537 1HG2 ILE 72 HG21 ILE 72 -3.701 -4.515 -3.391 538 2HG2 ILE 72 HG22 ILE 72 -4.930 -3.858 -4.502 539 3HG2 ILE 72 HG23 ILE 72 -3.271 -4.117 -5.033 540 1HD1 ILE 72 HD11 ILE 72 -3.666 -0.913 -6.959 541 2HD1 ILE 72 HD12 ILE 72 -2.531 -2.135 -6.342 542 3HD1 ILE 72 HD13 ILE 72 -4.240 -2.565 -6.653 543 HA PRO 73 HA PRO 73 -6.117 -3.597 -2.777 544 1HB PRO 73 HB2 PRO 73 -7.776 -5.259 -1.468 545 2HB PRO 73 HB3 PRO 73 -6.294 -5.864 -2.280 546 1HG PRO 73 HG2 PRO 73 -6.716 -5.242 0.643 547 2HG PRO 73 HG3 PRO 73 -5.929 -6.677 -0.074 548 1HD PRO 73 HD2 PRO 73 -4.552 -4.452 0.883 549 2HD PRO 73 HD3 PRO 73 -3.920 -5.489 -0.422 550 H THR 74 HN THR 74 -8.009 -2.444 -2.837 551 HA THR 74 HA THR 74 -8.960 -1.255 -0.248 552 HB THR 74 HB THR 74 -8.618 0.149 -2.916 553 HG1 THR 74 HG1 THR 74 -6.825 0.569 -1.964 554 1HG2 THR 74 HG21 THR 74 -9.511 2.165 -1.714 555 2HG2 THR 74 HG22 THR 74 -10.742 0.944 -2.041 556 3HG2 THR 74 HG23 THR 74 -10.058 1.102 -0.408 557 H LEU 75 HN LEU 75 -11.159 -1.081 0.052 558 HA LEU 75 HA LEU 75 -12.974 -2.271 -1.981 559 1HB LEU 75 HB2 LEU 75 -13.121 -2.526 1.054 560 2HB LEU 75 HB3 LEU 75 -14.424 -2.951 -0.035 561 HG LEU 75 HG LEU 75 -11.729 -4.355 0.048 562 1HD1 LEU 75 HD11 LEU 75 -13.016 -4.727 2.118 563 2HD1 LEU 75 HD12 LEU 75 -14.455 -5.176 1.191 564 3HD1 LEU 75 HD13 LEU 75 -13.001 -6.190 1.137 565 1HD2 LEU 75 HD21 LEU 75 -12.845 -4.501 -2.161 566 2HD2 LEU 75 HD22 LEU 75 -12.797 -6.067 -1.346 567 3HD2 LEU 75 HD23 LEU 75 -14.313 -5.118 -1.403 568 H LEU 76 HN LEU 76 -14.746 -0.971 -2.329 569 HA LEU 76 HA LEU 76 -15.307 1.226 -0.450 570 1HB LEU 76 HB2 LEU 76 -15.739 1.485 -3.445 571 2HB LEU 76 HB3 LEU 76 -16.056 2.675 -2.189 572 HG LEU 76 HG LEU 76 -13.300 1.796 -3.189 573 1HD1 LEU 76 HD11 LEU 76 -13.180 4.079 -4.038 574 2HD1 LEU 76 HD12 LEU 76 -14.544 3.204 -4.747 575 3HD1 LEU 76 HD13 LEU 76 -14.832 4.401 -3.469 576 1HD2 LEU 76 HD21 LEU 76 -13.248 2.362 -0.740 577 2HD2 LEU 76 HD22 LEU 76 -12.401 3.560 -1.725 578 3HD2 LEU 76 HD23 LEU 76 -14.029 3.909 -1.103 579 H VAL 77 HN VAL 77 -17.070 0.380 0.567 580 HA VAL 77 HA VAL 77 -18.846 -1.469 -0.917 581 HB VAL 77 HB VAL 77 -19.186 -0.719 1.985 582 1HG1 VAL 77 HG11 VAL 77 -20.928 -2.032 0.848 583 2HG1 VAL 77 HG12 VAL 77 -19.726 -3.272 0.436 584 3HG1 VAL 77 HG13 VAL 77 -20.139 -2.948 2.139 585 1HG2 VAL 77 HG21 VAL 77 -16.837 -1.365 1.976 586 2HG2 VAL 77 HG22 VAL 77 -17.795 -2.685 2.644 587 3HG2 VAL 77 HG23 VAL 77 -17.191 -2.784 0.980 588 H LEU 78 HN LEU 78 -20.729 -0.677 -1.742 589 HA LEU 78 HA LEU 78 -21.542 2.099 -1.035 590 1HB LEU 78 HB2 LEU 78 -20.762 0.919 -3.692 591 2HB LEU 78 HB3 LEU 78 -22.205 1.922 -3.659 592 HG LEU 78 HG LEU 78 -20.852 3.778 -2.687 593 1HD1 LEU 78 HD11 LEU 78 -18.461 2.043 -3.408 594 2HD1 LEU 78 HD12 LEU 78 -18.416 3.759 -2.920 595 3HD1 LEU 78 HD13 LEU 78 -18.932 2.532 -1.769 596 1HD2 LEU 78 HD21 LEU 78 -19.888 2.766 -5.374 597 2HD2 LEU 78 HD22 LEU 78 -21.403 3.649 -5.082 598 3HD2 LEU 78 HD23 LEU 78 -19.853 4.443 -4.784 599 H LYS 79 HN LYS 79 -23.809 2.513 -1.376 600 HA LYS 79 HA LYS 79 -25.437 0.275 -2.261 601 1HB LYS 79 HB2 LYS 79 -27.106 0.516 -0.507 602 2HB LYS 79 HB3 LYS 79 -25.571 -0.094 0.126 603 1HG LYS 79 HG2 LYS 79 -25.101 2.004 1.213 604 2HG LYS 79 HG3 LYS 79 -26.413 2.827 0.378 605 1HD LYS 79 HD2 LYS 79 -26.998 2.330 2.709 606 2HD LYS 79 HD3 LYS 79 -28.101 1.600 1.539 607 1HE LYS 79 HE2 LYS 79 -26.910 -0.589 1.807 608 2HE LYS 79 HE3 LYS 79 -25.865 0.146 3.027 609 1HZ LYS 79 HZ1 LYS 79 -27.729 -1.078 3.975 610 2HZ LYS 79 HZ2 LYS 79 -27.833 0.506 4.398 611 3HZ LYS 79 HZ3 LYS 79 -28.815 -0.105 3.241 612 H ASP 80 HN ASP 80 -27.131 1.004 -3.426 613 HA ASP 80 HA ASP 80 -28.164 2.363 -4.843 614 1HB ASP 80 HB2 ASP 80 -29.499 2.294 -2.749 615 2HB ASP 80 HB3 ASP 80 -28.801 3.839 -2.267 616 H GLY 81 HN GLY 81 -25.343 3.221 -4.524 617 1HA GLY 81 HA2 GLY 81 -24.183 4.709 -5.828 618 2HA GLY 81 HA3 GLY 81 -25.549 5.836 -5.859 619 H GLU 82 HN GLU 82 -24.612 4.733 -2.685 620 HA GLU 82 HA GLU 82 -22.734 6.972 -2.324 621 1HB GLU 82 HB2 GLU 82 -23.780 7.709 -0.404 622 2HB GLU 82 HB3 GLU 82 -25.140 7.303 -1.460 623 1HG GLU 82 HG2 GLU 82 -25.376 5.123 -0.235 624 2HG GLU 82 HG3 GLU 82 -24.077 5.599 0.848 625 H VAL 83 HN VAL 83 -20.971 6.563 -0.935 626 HA VAL 83 HA VAL 83 -20.275 3.797 -0.345 627 HB VAL 83 HB VAL 83 -18.641 5.589 -0.931 628 1HG1 VAL 83 HG11 VAL 83 -19.540 7.469 0.412 629 2HG1 VAL 83 HG12 VAL 83 -19.085 6.615 1.904 630 3HG1 VAL 83 HG13 VAL 83 -17.838 7.151 0.776 631 1HG2 VAL 83 HG21 VAL 83 -17.893 3.500 0.108 632 2HG2 VAL 83 HG22 VAL 83 -16.893 4.860 0.615 633 3HG2 VAL 83 HG23 VAL 83 -18.105 4.207 1.725 634 H VAL 84 HN VAL 84 -20.448 2.724 1.493 635 HA VAL 84 HA VAL 84 -21.707 4.049 3.834 636 HB VAL 84 HB VAL 84 -23.393 3.000 2.404 637 1HG1 VAL 84 HG11 VAL 84 -21.963 0.370 2.955 638 2HG1 VAL 84 HG12 VAL 84 -23.590 0.527 2.267 639 3HG1 VAL 84 HG13 VAL 84 -22.213 1.168 1.380 640 1HG2 VAL 84 HG21 VAL 84 -23.112 1.584 5.065 641 2HG2 VAL 84 HG22 VAL 84 -23.772 3.219 4.794 642 3HG2 VAL 84 HG23 VAL 84 -24.600 1.815 4.115 643 H GLU 85 HN GLU 85 -19.331 1.805 2.546 644 HA GLU 85 HA GLU 85 -18.020 1.884 5.093 645 1HB GLU 85 HB2 GLU 85 -19.272 -0.623 4.115 646 2HB GLU 85 HB3 GLU 85 -17.535 -0.801 4.374 647 1HG GLU 85 HG2 GLU 85 -19.473 0.333 6.380 648 2HG GLU 85 HG3 GLU 85 -19.002 -1.374 6.283 649 H THR 86 HN THR 86 -15.764 1.130 4.860 650 HA THR 86 HA THR 86 -14.659 1.150 2.113 651 HB THR 86 HB THR 86 -13.317 3.057 3.947 652 HG1 THR 86 HG1 THR 86 -15.406 3.739 4.375 653 1HG2 THR 86 HG21 THR 86 -13.069 4.353 1.913 654 2HG2 THR 86 HG22 THR 86 -12.638 2.661 1.613 655 3HG2 THR 86 HG23 THR 86 -14.229 3.285 1.085 656 H SER 87 HN SER 87 -12.553 0.123 2.152 657 HA SER 87 HA SER 87 -11.228 -0.290 4.722 658 1HB SER 87 HB2 SER 87 -12.369 -2.591 3.095 659 2HB SER 87 HB3 SER 87 -10.918 -2.794 4.088 660 HG SER 87 HG SER 87 -13.196 -1.562 5.183 661 H VAL 88 HN VAL 88 -9.030 -0.596 4.438 662 HA VAL 88 HA VAL 88 -7.967 -0.474 1.674 663 HB VAL 88 HB VAL 88 -7.156 1.469 3.863 664 1HG1 VAL 88 HG11 VAL 88 -5.887 0.700 1.501 665 2HG1 VAL 88 HG12 VAL 88 -6.755 2.131 0.994 666 3HG1 VAL 88 HG13 VAL 88 -5.627 2.235 2.378 667 1HG2 VAL 88 HG21 VAL 88 -9.431 2.112 3.346 668 2HG2 VAL 88 HG22 VAL 88 -8.322 3.248 2.578 669 3HG2 VAL 88 HG23 VAL 88 -9.110 1.990 1.600 670 H GLY 89 HN GLY 89 -7.705 -2.711 2.336 671 1HA GLY 89 HA2 GLY 89 -5.302 -3.661 3.172 672 2HA GLY 89 HA3 GLY 89 -6.200 -3.489 4.696 673 H PHE 90 HN PHE 90 -5.411 -6.033 3.638 674 HA PHE 90 HA PHE 90 -7.573 -7.188 2.131 675 1HB PHE 90 HB2 PHE 90 -6.337 -9.253 2.287 676 2HB PHE 90 HB3 PHE 90 -5.250 -7.935 1.899 677 HD1 PHE 90 HD1 PHE 90 -3.431 -7.288 3.384 678 HD2 PHE 90 HD2 PHE 90 -6.248 -10.354 4.535 679 HE1 PHE 90 HE1 PHE 90 -1.946 -7.959 5.251 680 HE2 PHE 90 HE2 PHE 90 -4.755 -11.018 6.399 681 HZ PHE 90 HZ PHE 90 -2.603 -9.822 6.764 682 H LYS 91 HN LYS 91 -8.901 -9.025 2.869 683 HA LYS 91 HA LYS 91 -9.182 -9.442 5.766 684 1HB LYS 91 HB2 LYS 91 -11.055 -7.782 4.243 685 2HB LYS 91 HB3 LYS 91 -11.834 -9.297 4.644 686 1HG LYS 91 HG2 LYS 91 -12.427 -8.086 6.456 687 2HG LYS 91 HG3 LYS 91 -10.981 -8.872 7.074 688 1HD LYS 91 HD2 LYS 91 -10.938 -6.668 7.850 689 2HD LYS 91 HD3 LYS 91 -9.716 -6.718 6.579 690 1HE LYS 91 HE2 LYS 91 -11.204 -5.593 5.012 691 2HE LYS 91 HE3 LYS 91 -12.586 -5.812 6.095 692 1HZ LYS 91 HZ1 LYS 91 -10.262 -4.067 6.659 693 2HZ LYS 91 HZ2 LYS 91 -11.768 -3.569 6.230 694 3HZ LYS 91 HZ3 LYS 91 -11.528 -4.302 7.668 695 HA PRO 92 HA PRO 92 -9.850 -13.518 3.874 696 1HB PRO 92 HB2 PRO 92 -10.873 -14.954 5.963 697 2HB PRO 92 HB3 PRO 92 -9.160 -14.442 5.893 698 1HG PRO 92 HG2 PRO 92 -11.457 -13.068 7.321 699 2HG PRO 92 HG3 PRO 92 -9.850 -13.507 7.988 700 1HD PRO 92 HD2 PRO 92 -10.328 -11.000 7.067 701 2HD PRO 92 HD3 PRO 92 -8.760 -11.791 6.769 702 H LYS 93 HN LYS 93 -11.703 -15.016 3.437 703 HA LYS 93 HA LYS 93 -13.887 -13.805 2.266 704 1HB LYS 93 HB2 LYS 93 -13.330 -15.951 1.553 705 2HB LYS 93 HB3 LYS 93 -13.195 -16.578 3.186 706 1HG LYS 93 HG2 LYS 93 -14.978 -17.661 2.104 707 2HG LYS 93 HG3 LYS 93 -15.597 -16.689 3.432 708 1HD LYS 93 HD2 LYS 93 -16.479 -15.026 1.820 709 2HD LYS 93 HD3 LYS 93 -15.728 -15.897 0.475 710 1HE LYS 93 HE2 LYS 93 -18.208 -16.308 0.777 711 2HE LYS 93 HE3 LYS 93 -17.206 -17.748 0.673 712 1HZ LYS 93 HZ1 LYS 93 -18.946 -17.782 2.475 713 2HZ LYS 93 HZ2 LYS 93 -17.434 -18.102 3.002 714 3HZ LYS 93 HZ3 LYS 93 -18.127 -16.641 3.278 715 H GLU 94 HN GLU 94 -13.920 -15.248 5.577 716 HA GLU 94 HA GLU 94 -16.679 -14.684 5.887 717 1HB GLU 94 HB2 GLU 94 -14.484 -15.090 7.967 718 2HB GLU 94 HB3 GLU 94 -16.219 -15.008 8.336 719 1HG GLU 94 HG2 GLU 94 -16.629 -16.972 6.861 720 2HG GLU 94 HG3 GLU 94 -14.900 -17.085 6.526 721 H ALA 95 HN ALA 95 -13.769 -12.796 6.842 722 HA ALA 95 HA ALA 95 -15.274 -10.761 8.198 723 1HB ALA 95 HB1 ALA 95 -12.510 -10.650 6.959 724 2HB ALA 95 HB2 ALA 95 -13.178 -9.522 8.169 725 3HB ALA 95 HB3 ALA 95 -12.867 -11.208 8.614 726 H LEU 96 HN LEU 96 -14.246 -11.286 4.852 727 HA LEU 96 HA LEU 96 -14.939 -8.748 3.807 728 1HB LEU 96 HB2 LEU 96 -13.904 -11.149 2.776 729 2HB LEU 96 HB3 LEU 96 -15.490 -11.112 2.070 730 HG LEU 96 HG LEU 96 -14.091 -10.121 0.493 731 1HD1 LEU 96 HD11 LEU 96 -15.201 -7.672 1.939 732 2HD1 LEU 96 HD12 LEU 96 -14.762 -7.818 0.237 733 3HD1 LEU 96 HD13 LEU 96 -16.138 -8.742 0.884 734 1HD2 LEU 96 HD21 LEU 96 -12.883 -8.314 2.620 735 2HD2 LEU 96 HD22 LEU 96 -12.137 -9.799 1.987 736 3HD2 LEU 96 HD23 LEU 96 -12.416 -8.430 0.907 737 H GLN 97 HN GLN 97 -16.793 -11.809 4.009 738 HA GLN 97 HA GLN 97 -19.155 -10.699 2.878 739 1HB GLN 97 HB2 GLN 97 -20.033 -12.725 3.007 740 2HB GLN 97 HB3 GLN 97 -18.349 -13.182 3.144 741 1HG GLN 97 HG2 GLN 97 -18.674 -13.401 5.567 742 2HG GLN 97 HG3 GLN 97 -20.414 -13.085 5.336 743 1HE2 GLN 97 HE22 GLN 97 -21.480 -14.626 3.514 744 2HE2 GLN 97 HE21 GLN 97 -20.888 -16.278 3.510 745 H GLU 98 HN GLU 98 -18.044 -11.033 6.280 746 HA GLU 98 HA GLU 98 -20.391 -10.003 7.454 747 1HB GLU 98 HB2 GLU 98 -18.638 -11.094 8.727 748 2HB GLU 98 HB3 GLU 98 -17.485 -9.811 8.332 749 1HG GLU 98 HG2 GLU 98 -18.789 -8.179 9.597 750 2HG GLU 98 HG3 GLU 98 -20.063 -9.369 9.891 751 H LEU 99 HN LEU 99 -17.524 -8.277 6.178 752 HA LEU 99 HA LEU 99 -18.105 -5.725 7.128 753 1HB LEU 99 HB2 LEU 99 -15.934 -6.280 6.262 754 2HB LEU 99 HB3 LEU 99 -16.603 -6.709 4.691 755 HG LEU 99 HG LEU 99 -17.169 -4.345 4.240 756 1HD1 LEU 99 HD11 LEU 99 -17.469 -3.424 6.467 757 2HD1 LEU 99 HD12 LEU 99 -15.789 -3.816 6.908 758 3HD1 LEU 99 HD13 LEU 99 -16.138 -2.576 5.683 759 1HD2 LEU 99 HD21 LEU 99 -15.034 -5.365 3.539 760 2HD2 LEU 99 HD22 LEU 99 -14.883 -3.625 3.841 761 3HD2 LEU 99 HD23 LEU 99 -14.273 -4.791 5.037 762 H VAL 100 HN VAL 100 -19.176 -7.295 4.106 763 HA VAL 100 HA VAL 100 -20.681 -4.833 3.459 764 HB VAL 100 HB VAL 100 -19.526 -5.841 1.689 765 1HG1 VAL 100 HG11 VAL 100 -19.612 -8.256 2.234 766 2HG1 VAL 100 HG12 VAL 100 -21.364 -8.278 1.943 767 3HG1 VAL 100 HG13 VAL 100 -20.243 -7.954 0.611 768 1HG2 VAL 100 HG21 VAL 100 -22.497 -6.238 1.132 769 2HG2 VAL 100 HG22 VAL 100 -21.810 -4.641 1.451 770 3HG2 VAL 100 HG23 VAL 100 -21.225 -5.565 0.076 771 H ASN 101 HN ASN 101 -21.392 -8.198 4.577 772 HA ASN 101 HA ASN 101 -24.164 -8.206 4.226 773 1HB ASN 101 HB2 ASN 101 -22.969 -10.212 4.818 774 2HB ASN 101 HB3 ASN 101 -22.543 -9.542 6.402 775 1HD2 ASN 101 HD22 ASN 101 -24.149 -9.533 8.072 776 2HD2 ASN 101 HD21 ASN 101 -25.718 -10.260 7.856 777 H LYS 102 HN LYS 102 -22.252 -6.748 6.843 778 HA LYS 102 HA LYS 102 -24.487 -6.286 8.561 779 1HB LYS 102 HB2 LYS 102 -22.976 -5.118 9.972 780 2HB LYS 102 HB3 LYS 102 -22.075 -6.441 9.231 781 1HG LYS 102 HG2 LYS 102 -21.298 -4.681 7.504 782 2HG LYS 102 HG3 LYS 102 -21.906 -3.494 8.681 783 1HD LYS 102 HD2 LYS 102 -20.435 -4.504 10.440 784 2HD LYS 102 HD3 LYS 102 -19.879 -5.705 9.255 785 1HE LYS 102 HE2 LYS 102 -18.196 -4.086 9.302 786 2HE LYS 102 HE3 LYS 102 -19.110 -3.860 7.795 787 1HZ LYS 102 HZ1 LYS 102 -20.192 -1.961 8.769 788 2HZ LYS 102 HZ2 LYS 102 -19.444 -2.191 10.224 789 3HZ LYS 102 HZ3 LYS 102 -18.579 -1.753 8.898 790 H HIS 103 HN HIS 103 -23.841 -4.757 5.608 791 HA HIS 103 HA HIS 103 -25.683 -2.513 6.347 792 1HB HIS 103 HB2 HIS 103 -23.417 -2.469 4.313 793 2HB HIS 103 HB3 HIS 103 -24.566 -1.164 4.606 794 HD1 HIS 103 HD1 HIS 103 -24.441 -0.117 7.249 795 HD2 HIS 103 HD2 HIS 103 -21.274 -2.506 5.819 796 HE1 HIS 103 HE1 HIS 103 -22.495 0.262 8.839 797 H LEU 104 HN LEU 104 -24.863 -5.065 4.104 798 HA LEU 104 HA LEU 104 -26.602 -4.633 1.901 799 1HB LEU 104 HB2 LEU 104 -24.816 -6.213 1.876 800 2HB LEU 104 HB3 LEU 104 -25.422 -6.951 3.366 801 HG LEU 104 HG LEU 104 -27.241 -7.972 2.310 802 1HD1 LEU 104 HD11 LEU 104 -26.247 -6.805 -0.340 803 2HD1 LEU 104 HD12 LEU 104 -27.635 -7.884 -0.116 804 3HD1 LEU 104 HD13 LEU 104 -27.703 -6.240 0.509 805 1HD2 LEU 104 HD21 LEU 104 -25.133 -9.140 2.348 806 2HD2 LEU 104 HD22 LEU 104 -26.003 -9.541 0.874 807 3HD2 LEU 104 HD23 LEU 104 -24.642 -8.396 0.807 808 1H MET 1 H1 MET 1 10.075 26.451 -12.180 809 2H MET 1 H2 MET 1 10.515 28.009 -11.963 810 3H MET 1 H3 MET 1 9.656 27.587 -13.291 811 HA MET 1 HA MET 1 8.240 28.698 -11.693 812 1HB MET 1 HB2 MET 1 7.655 25.717 -12.018 813 2HB MET 1 HB3 MET 1 6.526 26.890 -11.337 814 1HG MET 1 HG2 MET 1 6.567 28.183 -13.446 815 2HG MET 1 HG3 MET 1 7.654 26.984 -14.159 816 1HE MET 1 HE1 MET 1 6.043 26.743 -16.232 817 2HE MET 1 HE2 MET 1 4.305 26.396 -16.098 818 3HE MET 1 HE3 MET 1 4.947 27.947 -15.515 819 H GLU 2 HN GLU 2 8.280 29.341 -9.590 820 HA GLU 2 HA GLU 2 9.552 27.682 -7.535 821 1HB GLU 2 HB2 GLU 2 8.115 30.369 -7.456 822 2HB GLU 2 HB3 GLU 2 8.788 29.560 -6.031 823 1HG GLU 2 HG2 GLU 2 11.038 29.578 -7.044 824 2HG GLU 2 HG3 GLU 2 10.406 30.379 -8.483 825 H ASN 3 HN ASN 3 8.548 26.563 -6.010 826 HA ASN 3 HA ASN 3 7.179 25.319 -4.903 827 1HB ASN 3 HB2 ASN 3 4.747 26.848 -5.778 828 2HB ASN 3 HB3 ASN 3 4.893 25.553 -4.573 829 1HD2 ASN 3 HD22 ASN 3 6.334 26.026 -2.613 830 2HD2 ASN 3 HD21 ASN 3 6.454 27.676 -2.077 831 H LYS 4 HN LYS 4 6.946 23.481 -5.387 832 HA LYS 4 HA LYS 4 5.496 22.213 -7.478 833 1HB LYS 4 HB2 LYS 4 7.689 21.082 -8.378 834 2HB LYS 4 HB3 LYS 4 7.179 22.630 -9.044 835 1HG LYS 4 HG2 LYS 4 8.794 23.829 -7.639 836 2HG LYS 4 HG3 LYS 4 9.340 22.302 -6.919 837 1HD LYS 4 HD2 LYS 4 10.272 21.578 -9.025 838 2HD LYS 4 HD3 LYS 4 9.475 22.909 -9.906 839 1HE LYS 4 HE2 LYS 4 10.744 24.581 -8.673 840 2HE LYS 4 HE3 LYS 4 11.476 23.346 -7.650 841 1HZ LYS 4 HZ1 LYS 4 12.958 24.110 -9.391 842 2HZ LYS 4 HZ2 LYS 4 12.657 22.502 -9.556 843 3HZ LYS 4 HZ3 LYS 4 11.937 23.583 -10.567 844 H ILE 5 HN ILE 5 5.166 20.104 -6.685 845 HA ILE 5 HA ILE 5 6.248 19.757 -3.934 846 HB ILE 5 HB ILE 5 3.571 19.047 -5.177 847 1HG1 ILE 5 HG12 ILE 5 4.555 21.046 -3.124 848 2HG1 ILE 5 HG13 ILE 5 3.669 21.359 -4.614 849 1HG2 ILE 5 HG21 ILE 5 2.918 18.076 -3.044 850 2HG2 ILE 5 HG22 ILE 5 4.327 17.227 -3.632 851 3HG2 ILE 5 HG23 ILE 5 4.533 18.469 -2.351 852 1HD1 ILE 5 HD11 ILE 5 2.619 20.137 -2.040 853 2HD1 ILE 5 HD12 ILE 5 2.233 21.726 -2.737 854 3HD1 ILE 5 HD13 ILE 5 1.673 20.235 -3.549 855 H ILE 6 HN ILE 6 6.983 17.836 -3.274 856 HA ILE 6 HA ILE 6 7.160 15.560 -5.135 857 HB ILE 6 HB ILE 6 9.054 16.774 -5.782 858 1HG1 ILE 6 HG12 ILE 6 9.302 14.266 -5.278 859 2HG1 ILE 6 HG13 ILE 6 10.691 15.244 -5.680 860 1HG2 ILE 6 HG21 ILE 6 9.772 17.199 -2.881 861 2HG2 ILE 6 HG22 ILE 6 10.886 17.510 -4.235 862 3HG2 ILE 6 HG23 ILE 6 9.388 18.420 -4.110 863 1HD1 ILE 6 HD11 ILE 6 9.986 14.340 -2.857 864 2HD1 ILE 6 HD12 ILE 6 11.247 13.686 -3.920 865 3HD1 ILE 6 HD13 ILE 6 11.394 15.329 -3.311 866 H TYR 7 HN TYR 7 7.325 13.605 -4.038 867 HA TYR 7 HA TYR 7 6.814 13.801 -1.116 868 1HB TYR 7 HB2 TYR 7 5.023 13.206 -3.264 869 2HB TYR 7 HB3 TYR 7 5.359 11.681 -2.488 870 HD1 TYR 7 HD1 TYR 7 4.688 11.266 -0.147 871 HD2 TYR 7 HD2 TYR 7 3.897 15.037 -2.083 872 HE1 TYR 7 HE1 TYR 7 3.038 11.814 1.597 873 HE2 TYR 7 HE2 TYR 7 2.269 15.590 -0.322 874 HH TYR 7 HH TYR 7 1.513 13.388 2.410 875 H PHE 8 HN PHE 8 7.528 12.134 0.156 876 HA PHE 8 HA PHE 8 9.026 9.909 -1.161 877 1HB PHE 8 HB2 PHE 8 9.071 10.626 1.782 878 2HB PHE 8 HB3 PHE 8 10.096 9.479 0.941 879 HD1 PHE 8 HD1 PHE 8 10.250 12.538 2.483 880 HD2 PHE 8 HD2 PHE 8 11.273 10.707 -1.278 881 HE1 PHE 8 HE1 PHE 8 11.809 14.368 2.009 882 HE2 PHE 8 HE2 PHE 8 12.851 12.567 -1.754 883 HZ PHE 8 HZ PHE 8 13.099 14.417 -0.092 884 H LEU 9 HN LEU 9 8.354 7.802 -0.712 885 HA LEU 9 HA LEU 9 5.887 7.460 0.909 886 1HB LEU 9 HB2 LEU 9 5.505 7.641 -1.576 887 2HB LEU 9 HB3 LEU 9 6.441 6.164 -1.787 888 HG LEU 9 HG LEU 9 4.761 4.871 -0.619 889 1HD1 LEU 9 HD11 LEU 9 2.555 5.978 0.097 890 2HD1 LEU 9 HD12 LEU 9 3.925 6.284 1.148 891 3HD1 LEU 9 HD13 LEU 9 3.394 7.546 0.013 892 1HD2 LEU 9 HD21 LEU 9 3.518 6.865 -2.545 893 2HD2 LEU 9 HD22 LEU 9 4.369 5.360 -2.984 894 3HD2 LEU 9 HD23 LEU 9 2.828 5.308 -2.103 895 H SER 10 HN SER 10 6.427 6.184 2.551 896 HA SER 10 HA SER 10 8.663 4.243 2.284 897 1HB SER 10 HB2 SER 10 8.356 6.564 4.253 898 2HB SER 10 HB3 SER 10 9.554 5.281 4.423 899 HG SER 10 HG SER 10 10.627 5.977 2.768 900 H THR 11 HN THR 11 8.234 2.365 3.435 901 HA THR 11 HA THR 11 5.948 1.711 4.745 902 HB THR 11 HB THR 11 8.731 0.729 5.478 903 HG1 THR 11 HG1 THR 11 8.541 -0.606 3.702 904 1HG2 THR 11 HG21 THR 11 6.889 -0.200 6.854 905 2HG2 THR 11 HG22 THR 11 6.016 -0.664 5.379 906 3HG2 THR 11 HG23 THR 11 7.575 -1.430 5.790 907 H GLY 12 HN GLY 12 4.959 2.689 6.404 908 1HA GLY 12 HA2 GLY 12 4.538 3.424 8.541 909 2HA GLY 12 HA3 GLY 12 6.123 2.811 9.027 910 H ASN 13 HN ASN 13 6.357 4.953 6.445 911 HA ASN 13 HA ASN 13 8.004 6.711 6.561 912 1HB ASN 13 HB2 ASN 13 5.853 6.933 5.322 913 2HB ASN 13 HB3 ASN 13 5.217 7.887 6.641 914 1HD2 ASN 13 HD22 ASN 13 6.463 9.919 7.199 915 2HD2 ASN 13 HD21 ASN 13 7.062 10.835 5.807 916 H SER 14 HN SER 14 8.881 6.359 8.853 917 HA SER 14 HA SER 14 8.436 8.876 10.373 918 1HB SER 14 HB2 SER 14 8.465 6.075 11.566 919 2HB SER 14 HB3 SER 14 8.404 7.587 12.481 920 HG SER 14 HG SER 14 6.482 6.497 10.714 921 H ALA 15 HN ALA 15 10.744 7.304 8.719 922 HA ALA 15 HA ALA 15 12.862 8.370 10.414 923 1HB ALA 15 HB1 ALA 15 12.737 6.088 11.276 924 2HB ALA 15 HB2 ALA 15 12.867 5.421 9.638 925 3HB ALA 15 HB3 ALA 15 14.234 6.312 10.343 926 H ARG 16 HN ARG 16 12.881 6.063 7.589 927 HA ARG 16 HA ARG 16 14.892 7.270 6.090 928 1HB ARG 16 HB2 ARG 16 12.393 5.700 5.475 929 2HB ARG 16 HB3 ARG 16 13.053 6.581 4.129 930 1HG ARG 16 HG2 ARG 16 14.842 4.770 5.749 931 2HG ARG 16 HG3 ARG 16 13.790 4.122 4.492 932 1HD ARG 16 HD2 ARG 16 14.770 5.904 2.939 933 2HD ARG 16 HD3 ARG 16 15.997 6.159 4.190 934 HE ARG 16 HE ARG 16 15.941 3.406 3.612 935 1HH1 ARG 16 HH11 ARG 16 16.188 6.187 1.478 936 2HH1 ARG 16 HH12 ARG 16 17.496 5.543 0.522 937 1HH2 ARG 16 HH21 ARG 16 17.703 2.515 2.346 938 2HH2 ARG 16 HH22 ARG 16 18.218 3.400 0.920 939 H SER 17 HN SER 17 11.429 8.013 5.927 940 HA SER 17 HA SER 17 11.402 10.035 4.030 941 1HB SER 17 HB2 SER 17 9.263 10.566 5.335 942 2HB SER 17 HB3 SER 17 9.468 8.907 4.722 943 HG SER 17 HG SER 17 8.879 9.469 7.139 944 H GLN 18 HN GLN 18 11.482 10.347 7.607 945 HA GLN 18 HA GLN 18 11.575 13.110 7.825 946 1HB GLN 18 HB2 GLN 18 13.080 11.115 9.560 947 2HB GLN 18 HB3 GLN 18 12.695 12.770 9.968 948 1HG GLN 18 HG2 GLN 18 10.659 10.560 9.568 949 2HG GLN 18 HG3 GLN 18 11.252 11.172 11.107 950 1HE2 GLN 18 HE22 GLN 18 8.366 11.393 10.580 951 2HE2 GLN 18 HE21 GLN 18 7.986 12.989 9.972 952 H MET 19 HN MET 19 14.287 10.831 7.586 953 HA MET 19 HA MET 19 16.300 12.770 7.811 954 1HB MET 19 HB2 MET 19 16.329 10.152 7.969 955 2HB MET 19 HB3 MET 19 16.537 10.190 6.212 956 1HG MET 19 HG2 MET 19 18.504 11.851 6.779 957 2HG MET 19 HG3 MET 19 18.361 11.188 8.399 958 1HE MET 19 HE1 MET 19 18.083 8.396 8.620 959 2HE MET 19 HE2 MET 19 17.426 7.972 7.012 960 3HE MET 19 HE3 MET 19 18.985 7.302 7.546 961 H ALA 20 HN ALA 20 14.634 11.340 4.976 962 HA ALA 20 HA ALA 20 16.088 12.679 2.952 963 1HB ALA 20 HB1 ALA 20 14.303 11.970 1.491 964 2HB ALA 20 HB2 ALA 20 14.659 10.666 2.640 965 3HB ALA 20 HB3 ALA 20 13.220 11.673 2.863 966 H GLU 21 HN GLU 21 13.148 13.735 4.825 967 HA GLU 21 HA GLU 21 12.613 15.949 3.140 968 1HB GLU 21 HB2 GLU 21 12.150 15.970 6.125 969 2HB GLU 21 HB3 GLU 21 11.340 16.926 4.869 970 1HG GLU 21 HG2 GLU 21 10.665 14.402 4.114 971 2HG GLU 21 HG3 GLU 21 10.890 14.182 5.866 972 H GLY 22 HN GLY 22 14.695 15.715 6.045 973 1HA GLY 22 HA2 GLY 22 15.435 18.504 5.964 974 2HA GLY 22 HA3 GLY 22 16.257 17.238 6.869 975 H TRP 23 HN TRP 23 17.073 15.490 4.773 976 HA TRP 23 HA TRP 23 19.344 16.760 3.645 977 1HB TRP 23 HB2 TRP 23 17.886 14.169 3.188 978 2HB TRP 23 HB3 TRP 23 18.943 14.721 1.908 979 HD1 TRP 23 HD1 TRP 23 19.074 12.915 5.078 980 HE1 TRP 23 HE1 TRP 23 21.486 12.368 5.711 981 HE3 TRP 23 HE3 TRP 23 21.452 16.014 1.794 982 HZ2 TRP 23 HZ2 TRP 23 24.143 13.174 4.879 983 HZ3 TRP 23 HZ3 TRP 23 23.938 16.036 1.667 984 HH2 TRP 23 HH2 TRP 23 25.286 14.635 3.211 985 H ALA 24 HN ALA 24 16.054 16.267 2.290 986 HA ALA 24 HA ALA 24 16.696 17.173 -0.298 987 1HB ALA 24 HB1 ALA 24 14.030 17.502 1.199 988 2HB ALA 24 HB2 ALA 24 14.275 17.586 -0.541 989 3HB ALA 24 HB3 ALA 24 14.524 16.051 0.297 990 H LYS 25 HN LYS 25 15.382 18.962 2.581 991 HA LYS 25 HA LYS 25 15.101 21.318 1.065 992 1HB LYS 25 HB2 LYS 25 14.657 20.500 3.853 993 2HB LYS 25 HB3 LYS 25 15.212 22.167 3.765 994 1HG LYS 25 HG2 LYS 25 13.034 21.191 1.887 995 2HG LYS 25 HG3 LYS 25 12.636 21.636 3.552 996 1HD LYS 25 HD2 LYS 25 13.388 23.872 3.278 997 2HD LYS 25 HD3 LYS 25 14.178 23.533 1.745 998 1HE LYS 25 HE2 LYS 25 11.138 23.408 2.180 999 2HE LYS 25 HE3 LYS 25 12.003 24.791 1.516 1000 1HZ LYS 25 HZ1 LYS 25 11.179 23.510 -0.280 1001 2HZ LYS 25 HZ2 LYS 25 12.797 23.323 -0.283 1002 3HZ LYS 25 HZ3 LYS 25 11.852 22.114 0.284 1003 H GLN 26 HN GLN 26 17.973 20.115 2.701 1004 HA GLN 26 HA GLN 26 19.297 22.637 2.604 1005 1HB GLN 26 HB2 GLN 26 21.200 21.619 3.321 1006 2HB GLN 26 HB3 GLN 26 19.929 20.669 4.033 1007 1HG GLN 26 HG2 GLN 26 20.734 18.786 3.136 1008 2HG GLN 26 HG3 GLN 26 20.614 19.417 1.511 1009 1HE2 GLN 26 HE22 GLN 26 22.748 17.702 2.874 1010 2HE2 GLN 26 HE21 GLN 26 24.232 18.552 2.526 1011 H TYR 27 HN TYR 27 18.429 20.545 0.021 1012 HA TYR 27 HA TYR 27 20.251 22.024 -1.811 1013 1HB TYR 27 HB2 TYR 27 19.694 19.080 -1.545 1014 2HB TYR 27 HB3 TYR 27 19.816 19.718 -3.169 1015 HD1 TYR 27 HD1 TYR 27 21.814 21.094 -3.866 1016 HD2 TYR 27 HD2 TYR 27 21.759 18.601 -0.346 1017 HE1 TYR 27 HE1 TYR 27 24.288 21.244 -3.729 1018 HE2 TYR 27 HE2 TYR 27 24.225 18.754 -0.190 1019 HH TYR 27 HH TYR 27 26.200 20.626 -2.537 1020 H LEU 28 HN LEU 28 17.008 21.382 -1.015 1021 HA LEU 28 HA LEU 28 16.006 22.245 -3.669 1022 1HB LEU 28 HB2 LEU 28 14.645 20.418 -1.632 1023 2HB LEU 28 HB3 LEU 28 13.945 21.025 -3.119 1024 HG LEU 28 HG LEU 28 16.138 18.964 -2.815 1025 1HD1 LEU 28 HD11 LEU 28 13.660 18.393 -2.458 1026 2HD1 LEU 28 HD12 LEU 28 13.397 18.809 -4.151 1027 3HD1 LEU 28 HD13 LEU 28 14.484 17.472 -3.716 1028 1HD2 LEU 28 HD21 LEU 28 16.148 18.714 -5.243 1029 2HD2 LEU 28 HD22 LEU 28 15.002 20.057 -5.426 1030 3HD2 LEU 28 HD23 LEU 28 16.638 20.362 -4.820 1031 H GLY 29 HN GLY 29 16.215 24.382 -2.875 1032 1HA GLY 29 HA2 GLY 29 15.485 25.372 -0.331 1033 2HA GLY 29 HA3 GLY 29 15.707 26.332 -1.795 1034 H ASP 30 HN ASP 30 13.950 27.620 -0.719 1035 HA ASP 30 HA ASP 30 11.316 26.741 -0.302 1036 1HB ASP 30 HB2 ASP 30 12.260 28.864 0.505 1037 2HB ASP 30 HB3 ASP 30 12.340 29.472 -1.150 1038 H GLU 31 HN GLU 31 12.939 27.244 -3.291 1039 HA GLU 31 HA GLU 31 10.815 27.636 -5.132 1040 1HB GLU 31 HB2 GLU 31 13.123 27.917 -5.743 1041 2HB GLU 31 HB3 GLU 31 13.545 26.279 -5.233 1042 1HG GLU 31 HG2 GLU 31 12.247 25.320 -7.032 1043 2HG GLU 31 HG3 GLU 31 11.728 26.924 -7.584 1044 H TRP 32 HN TRP 32 11.510 24.862 -3.110 1045 HA TRP 32 HA TRP 32 9.658 23.142 -4.710 1046 1HB TRP 32 HB2 TRP 32 12.020 22.216 -3.054 1047 2HB TRP 32 HB3 TRP 32 11.029 21.245 -4.123 1048 HD1 TRP 32 HD1 TRP 32 13.689 24.031 -4.295 1049 HE1 TRP 32 HE1 TRP 32 15.143 23.693 -6.379 1050 HE3 TRP 32 HE3 TRP 32 11.184 20.090 -6.408 1051 HZ2 TRP 32 HZ2 TRP 32 15.300 21.875 -8.576 1052 HZ3 TRP 32 HZ3 TRP 32 12.041 19.051 -8.489 1053 HH2 TRP 32 HH2 TRP 32 14.103 19.912 -9.576 1054 H LYS 33 HN LYS 33 8.537 21.522 -3.356 1055 HA LYS 33 HA LYS 33 8.551 22.081 -0.434 1056 1HB LYS 33 HB2 LYS 33 6.267 22.142 -2.388 1057 2HB LYS 33 HB3 LYS 33 5.932 21.444 -0.819 1058 1HG LYS 33 HG2 LYS 33 7.297 24.171 -1.153 1059 2HG LYS 33 HG3 LYS 33 5.541 24.012 -1.162 1060 1HD LYS 33 HD2 LYS 33 7.375 23.212 1.150 1061 2HD LYS 33 HD3 LYS 33 6.474 24.725 1.019 1062 1HE LYS 33 HE2 LYS 33 4.337 23.429 0.917 1063 2HE LYS 33 HE3 LYS 33 5.250 21.933 1.151 1064 1HZ LYS 33 HZ1 LYS 33 5.109 24.170 3.089 1065 2HZ LYS 33 HZ2 LYS 33 4.341 22.735 3.217 1066 3HZ LYS 33 HZ3 LYS 33 5.972 22.797 3.310 1067 H VAL 34 HN VAL 34 8.481 20.284 0.808 1068 HA VAL 34 HA VAL 34 8.623 17.666 -0.602 1069 HB VAL 34 HB VAL 34 10.452 18.822 1.561 1070 1HG1 VAL 34 HG11 VAL 34 11.746 16.711 1.244 1071 2HG1 VAL 34 HG12 VAL 34 10.182 16.474 2.025 1072 3HG1 VAL 34 HG13 VAL 34 10.391 16.056 0.302 1073 1HG2 VAL 34 HG21 VAL 34 12.227 18.703 -0.053 1074 2HG2 VAL 34 HG22 VAL 34 11.162 17.980 -1.273 1075 3HG2 VAL 34 HG23 VAL 34 10.938 19.665 -0.760 1076 H TYR 35 HN TYR 35 7.431 16.105 0.341 1077 HA TYR 35 HA TYR 35 6.447 16.320 3.115 1078 1HB TYR 35 HB2 TYR 35 4.752 16.102 0.615 1079 2HB TYR 35 HB3 TYR 35 4.166 15.621 2.202 1080 HD1 TYR 35 HD1 TYR 35 3.893 18.153 -0.101 1081 HD2 TYR 35 HD2 TYR 35 4.644 17.566 4.107 1082 HE1 TYR 35 HE1 TYR 35 2.931 20.381 0.373 1083 HE2 TYR 35 HE2 TYR 35 3.706 19.805 4.590 1084 HH TYR 35 HH TYR 35 2.286 21.893 2.037 1085 H SER 36 HN SER 36 5.312 14.082 3.628 1086 HA SER 36 HA SER 36 6.134 11.884 1.932 1087 1HB SER 36 HB2 SER 36 7.661 10.911 3.586 1088 2HB SER 36 HB3 SER 36 8.231 12.461 3.021 1089 HG SER 36 HG SER 36 7.766 13.424 4.860 1090 H ALA 37 HN ALA 37 5.278 9.789 2.719 1091 HA ALA 37 HA ALA 37 3.520 9.765 5.019 1092 1HB ALA 37 HB1 ALA 37 2.044 10.913 3.379 1093 2HB ALA 37 HB2 ALA 37 2.297 9.557 2.225 1094 3HB ALA 37 HB3 ALA 37 1.476 9.306 3.783 1095 H GLY 38 HN GLY 38 2.293 7.577 5.103 1096 1HA GLY 38 HA2 GLY 38 3.192 5.397 3.456 1097 2HA GLY 38 HA3 GLY 38 4.040 5.425 5.003 1098 H ILE 39 HN ILE 39 2.766 3.254 4.786 1099 HA ILE 39 HA ILE 39 0.088 2.896 4.977 1100 HB ILE 39 HB ILE 39 1.397 1.051 4.688 1101 1HG1 ILE 39 HG12 ILE 39 0.442 0.540 7.518 1102 2HG1 ILE 39 HG13 ILE 39 -0.698 0.892 6.223 1103 1HG2 ILE 39 HG21 ILE 39 3.516 1.623 5.700 1104 2HG2 ILE 39 HG22 ILE 39 2.843 1.556 7.322 1105 3HG2 ILE 39 HG23 ILE 39 2.990 0.085 6.370 1106 1HD1 ILE 39 HD11 ILE 39 1.214 -1.449 6.296 1107 2HD1 ILE 39 HD12 ILE 39 -0.551 -1.474 6.457 1108 3HD1 ILE 39 HD13 ILE 39 0.176 -1.001 4.911 1109 H GLU 40 HN GLU 40 2.093 3.181 7.934 1110 HA GLU 40 HA GLU 40 -0.311 3.894 9.535 1111 1HB GLU 40 HB2 GLU 40 0.509 2.372 11.302 1112 2HB GLU 40 HB3 GLU 40 -0.030 1.544 9.854 1113 1HG GLU 40 HG2 GLU 40 2.161 0.867 9.239 1114 2HG GLU 40 HG3 GLU 40 2.931 2.086 10.249 1115 H ALA 41 HN ALA 41 1.599 5.526 8.334 1116 HA ALA 41 HA ALA 41 3.841 6.239 9.953 1117 1HB ALA 41 HB1 ALA 41 3.726 6.507 7.529 1118 2HB ALA 41 HB2 ALA 41 2.291 7.534 7.675 1119 3HB ALA 41 HB3 ALA 41 3.849 8.134 8.282 1120 H HIS 42 HN HIS 42 4.245 8.198 10.899 1121 HA HIS 42 HA HIS 42 3.479 10.521 11.293 1122 1HB HIS 42 HB2 HIS 42 1.069 10.194 11.512 1123 2HB HIS 42 HB3 HIS 42 1.292 9.098 12.877 1124 HD1 HIS 42 HD1 HIS 42 2.554 10.453 15.098 1125 HD2 HIS 42 HD2 HIS 42 0.465 12.621 12.159 1126 HE1 HIS 42 HE1 HIS 42 1.964 12.704 16.152 1127 H GLY 43 HN GLY 43 5.642 10.265 11.969 1128 1HA GLY 43 HA2 GLY 43 6.133 9.886 14.777 1129 2HA GLY 43 HA3 GLY 43 6.551 8.447 13.823 1130 H LEU 44 HN LEU 44 8.442 9.948 15.238 1131 HA LEU 44 HA LEU 44 10.194 11.052 13.118 1132 1HB LEU 44 HB2 LEU 44 9.032 12.982 14.143 1133 2HB LEU 44 HB3 LEU 44 9.435 12.395 15.752 1134 HG LEU 44 HG LEU 44 11.892 12.706 15.197 1135 1HD1 LEU 44 HD11 LEU 44 11.904 12.637 12.791 1136 2HD1 LEU 44 HD12 LEU 44 10.738 13.984 12.688 1137 3HD1 LEU 44 HD13 LEU 44 12.382 14.263 13.286 1138 1HD2 LEU 44 HD21 LEU 44 11.867 15.132 15.454 1139 2HD2 LEU 44 HD22 LEU 44 10.157 15.189 14.984 1140 3HD2 LEU 44 HD23 LEU 44 10.643 14.379 16.488 1141 H ASN 45 HN ASN 45 11.223 8.937 13.312 1142 HA ASN 45 HA ASN 45 11.873 7.823 15.852 1143 1HB ASN 45 HB2 ASN 45 11.791 6.626 13.642 1144 2HB ASN 45 HB3 ASN 45 13.337 7.370 13.223 1145 1HD2 ASN 45 HD22 ASN 45 12.348 4.452 13.914 1146 2HD2 ASN 45 HD21 ASN 45 13.558 3.909 15.047 1147 HA PRO 46 HA PRO 46 15.152 10.716 16.894 1148 1HB PRO 46 HB2 PRO 46 16.500 9.263 18.848 1149 2HB PRO 46 HB3 PRO 46 15.021 10.239 19.100 1150 1HG PRO 46 HG2 PRO 46 15.234 7.260 18.599 1151 2HG PRO 46 HG3 PRO 46 14.239 8.113 19.824 1152 1HD PRO 46 HD2 PRO 46 13.150 7.256 17.516 1153 2HD PRO 46 HD3 PRO 46 12.695 8.854 18.173 1154 H ASN 47 HN ASN 47 15.805 7.395 15.751 1155 HA ASN 47 HA ASN 47 18.613 7.779 15.281 1156 1HB ASN 47 HB2 ASN 47 18.538 5.755 14.287 1157 2HB ASN 47 HB3 ASN 47 16.977 5.623 15.081 1158 1HD2 ASN 47 HD21 ASN 47 18.650 5.852 12.013 1159 2HD2 ASN 47 HD22 ASN 47 17.210 5.577 11.042 1160 H ALA 48 HN ALA 48 15.685 8.758 13.450 1161 HA ALA 48 HA ALA 48 17.198 9.506 11.094 1162 1HB ALA 48 HB1 ALA 48 14.830 8.841 11.052 1163 2HB ALA 48 HB2 ALA 48 14.354 10.319 11.925 1164 3HB ALA 48 HB3 ALA 48 15.086 10.444 10.317 1165 H VAL 49 HN VAL 49 16.024 11.073 14.038 1166 HA VAL 49 HA VAL 49 16.770 13.763 13.324 1167 HB VAL 49 HB VAL 49 16.715 12.570 16.128 1168 1HG1 VAL 49 HG11 VAL 49 17.782 14.799 15.986 1169 2HG1 VAL 49 HG12 VAL 49 16.356 15.438 15.139 1170 3HG1 VAL 49 HG13 VAL 49 16.229 14.892 16.823 1171 1HG2 VAL 49 HG21 VAL 49 14.396 13.385 16.300 1172 2HG2 VAL 49 HG22 VAL 49 14.416 13.861 14.594 1173 3HG2 VAL 49 HG23 VAL 49 14.519 12.154 15.047 1174 H LYS 50 HN LYS 50 18.510 11.167 15.127 1175 HA LYS 50 HA LYS 50 20.940 12.574 15.399 1176 1HB LYS 50 HB2 LYS 50 20.243 10.512 16.622 1177 2HB LYS 50 HB3 LYS 50 20.528 9.558 15.155 1178 1HG LYS 50 HG2 LYS 50 22.890 10.105 15.190 1179 2HG LYS 50 HG3 LYS 50 22.650 11.286 16.496 1180 1HD LYS 50 HD2 LYS 50 21.957 9.463 18.032 1181 2HD LYS 50 HD3 LYS 50 22.138 8.292 16.728 1182 1HE LYS 50 HE2 LYS 50 24.081 8.119 18.103 1183 2HE LYS 50 HE3 LYS 50 24.576 8.854 16.577 1184 1HZ LYS 50 HZ1 LYS 50 24.085 10.328 19.107 1185 2HZ LYS 50 HZ2 LYS 50 25.547 9.974 18.491 1186 3HZ LYS 50 HZ3 LYS 50 24.575 11.015 17.703 1187 H ALA 51 HN ALA 51 19.875 10.360 12.774 1188 HA ALA 51 HA ALA 51 22.139 10.430 11.172 1189 1HB ALA 51 HB1 ALA 51 20.208 8.971 10.790 1190 2HB ALA 51 HB2 ALA 51 19.211 10.368 10.348 1191 3HB ALA 51 HB3 ALA 51 20.599 9.904 9.332 1192 H MET 52 HN MET 52 19.665 13.018 11.565 1193 HA MET 52 HA MET 52 20.732 14.536 9.307 1194 1HB MET 52 HB2 MET 52 18.646 15.128 11.453 1195 2HB MET 52 HB3 MET 52 19.065 16.241 10.156 1196 1HG MET 52 HG2 MET 52 18.325 13.476 9.295 1197 2HG MET 52 HG3 MET 52 17.062 14.459 10.001 1198 1HE MET 52 HE1 MET 52 20.101 15.886 7.758 1199 2HE MET 52 HE2 MET 52 19.741 14.243 7.176 1200 3HE MET 52 HE3 MET 52 19.362 15.658 6.165 1201 H LYS 53 HN LYS 53 20.929 14.562 12.893 1202 HA LYS 53 HA LYS 53 22.492 16.947 13.042 1203 1HB LYS 53 HB2 LYS 53 22.447 14.529 14.902 1204 2HB LYS 53 HB3 LYS 53 23.185 16.076 15.293 1205 1HG LYS 53 HG2 LYS 53 20.222 15.756 14.658 1206 2HG LYS 53 HG3 LYS 53 20.891 15.652 16.280 1207 1HD LYS 53 HD2 LYS 53 21.611 17.962 16.214 1208 2HD LYS 53 HD3 LYS 53 21.168 18.110 14.494 1209 1HE LYS 53 HE2 LYS 53 18.828 17.747 14.971 1210 2HE LYS 53 HE3 LYS 53 19.159 17.344 16.658 1211 1HZ LYS 53 HZ1 LYS 53 19.662 19.581 17.121 1212 2HZ LYS 53 HZ2 LYS 53 19.758 20.014 15.545 1213 3HZ LYS 53 HZ3 LYS 53 18.303 19.626 16.192 1214 H GLU 54 HN GLU 54 23.427 13.611 12.163 1215 HA GLU 54 HA GLU 54 26.208 13.827 12.372 1216 1HB GLU 54 HB2 GLU 54 24.642 12.598 10.066 1217 2HB GLU 54 HB3 GLU 54 26.359 12.378 10.356 1218 1HG GLU 54 HG2 GLU 54 25.822 11.334 12.580 1219 2HG GLU 54 HG3 GLU 54 24.114 11.370 12.128 1220 H VAL 55 HN VAL 55 24.067 15.357 9.995 1221 HA VAL 55 HA VAL 55 26.396 16.760 8.784 1222 HB VAL 55 HB VAL 55 24.965 16.976 6.769 1223 1HG1 VAL 55 HG11 VAL 55 26.691 15.178 7.097 1224 2HG1 VAL 55 HG12 VAL 55 25.390 14.075 7.599 1225 3HG1 VAL 55 HG13 VAL 55 25.409 14.767 5.962 1226 1HG2 VAL 55 HG21 VAL 55 22.717 16.636 7.851 1227 2HG2 VAL 55 HG22 VAL 55 22.993 15.600 6.446 1228 3HG2 VAL 55 HG23 VAL 55 23.114 14.918 8.077 1229 H GLY 56 HN GLY 56 24.608 17.347 11.236 1230 1HA GLY 56 HA2 GLY 56 23.974 19.221 12.321 1231 2HA GLY 56 HA3 GLY 56 24.874 20.129 11.098 1232 H ILE 57 HN ILE 57 21.908 18.091 10.505 1233 HA ILE 57 HA ILE 57 20.454 20.628 9.815 1234 HB ILE 57 HB ILE 57 20.120 17.807 8.743 1235 1HG1 ILE 57 HG12 ILE 57 20.950 20.400 7.357 1236 2HG1 ILE 57 HG13 ILE 57 22.040 19.087 7.787 1237 1HG2 ILE 57 HG21 ILE 57 18.305 18.670 7.334 1238 2HG2 ILE 57 HG22 ILE 57 17.903 18.946 9.019 1239 3HG2 ILE 57 HG23 ILE 57 18.490 20.294 8.019 1240 1HD1 ILE 57 HD11 ILE 57 19.836 18.945 5.703 1241 2HD1 ILE 57 HD12 ILE 57 21.586 18.951 5.451 1242 3HD1 ILE 57 HD13 ILE 57 20.826 17.563 6.239 1243 H ASP 58 HN ASP 58 18.657 21.029 11.096 1244 HA ASP 58 HA ASP 58 18.129 19.084 13.284 1245 1HB ASP 58 HB2 ASP 58 18.351 21.395 14.036 1246 2HB ASP 58 HB3 ASP 58 17.096 21.922 12.892 1247 H ILE 59 HN ILE 59 16.322 17.897 13.339 1248 HA ILE 59 HA ILE 59 14.005 18.725 11.711 1249 HB ILE 59 HB ILE 59 13.467 16.501 11.057 1250 1HG1 ILE 59 HG12 ILE 59 16.212 15.476 11.910 1251 2HG1 ILE 59 HG13 ILE 59 14.827 15.375 12.991 1252 1HG2 ILE 59 HG21 ILE 59 14.894 17.968 9.606 1253 2HG2 ILE 59 HG22 ILE 59 16.331 17.115 10.199 1254 3HG2 ILE 59 HG23 ILE 59 15.095 16.241 9.265 1255 1HD1 ILE 59 HD11 ILE 59 13.535 14.158 11.322 1256 2HD1 ILE 59 HD12 ILE 59 14.910 14.146 10.206 1257 3HD1 ILE 59 HD13 ILE 59 15.010 13.287 11.756 1258 H SER 60 HN SER 60 14.878 18.878 14.645 1259 HA SER 60 HA SER 60 13.121 17.073 16.002 1260 1HB SER 60 HB2 SER 60 14.304 19.673 17.072 1261 2HB SER 60 HB3 SER 60 13.816 18.244 18.001 1262 HG SER 60 HG SER 60 16.036 18.697 16.333 1263 H ASN 61 HN ASN 61 11.951 18.658 13.908 1264 HA ASN 61 HA ASN 61 9.729 20.117 15.089 1265 1HB ASN 61 HB2 ASN 61 10.126 22.014 13.606 1266 2HB ASN 61 HB3 ASN 61 11.575 21.754 14.566 1267 1HD2 ASN 61 HD22 ASN 61 13.601 21.191 13.440 1268 2HD2 ASN 61 HD21 ASN 61 13.637 21.092 11.705 1269 H GLN 62 HN GLN 62 10.788 17.633 13.032 1270 HA GLN 62 HA GLN 62 8.891 18.121 10.823 1271 1HB GLN 62 HB2 GLN 62 11.021 16.057 11.221 1272 2HB GLN 62 HB3 GLN 62 9.814 16.113 9.907 1273 1HG GLN 62 HG2 GLN 62 10.569 18.386 9.281 1274 2HG GLN 62 HG3 GLN 62 11.864 18.271 10.480 1275 1HE2 GLN 62 HE22 GLN 62 11.534 15.127 9.263 1276 2HE2 GLN 62 HE21 GLN 62 12.807 15.242 8.053 1277 H THR 63 HN THR 63 7.224 16.675 10.408 1278 HA THR 63 HA THR 63 6.463 14.614 12.410 1279 HB THR 63 HB THR 63 4.123 15.454 12.083 1280 HG1 THR 63 HG1 THR 63 4.165 16.542 10.168 1281 1HG2 THR 63 HG21 THR 63 5.555 16.322 13.966 1282 2HG2 THR 63 HG22 THR 63 6.001 17.697 12.927 1283 3HG2 THR 63 HG23 THR 63 4.310 17.467 13.428 1284 H SER 64 HN SER 64 4.346 13.440 11.173 1285 HA SER 64 HA SER 64 4.536 13.354 8.334 1286 1HB SER 64 HB2 SER 64 4.949 10.890 8.154 1287 2HB SER 64 HB3 SER 64 6.359 11.862 8.564 1288 HG SER 64 HG SER 64 6.101 9.892 9.749 1289 H ASP 65 HN ASP 65 2.975 11.177 7.783 1290 HA ASP 65 HA ASP 65 0.674 10.942 9.471 1291 1HB ASP 65 HB2 ASP 65 0.389 13.303 8.620 1292 2HB ASP 65 HB3 ASP 65 0.448 12.676 6.971 1293 H ILE 66 HN ILE 66 -1.049 9.650 8.145 1294 HA ILE 66 HA ILE 66 0.269 7.619 6.617 1295 HB ILE 66 HB ILE 66 -2.097 6.794 6.324 1296 1HG1 ILE 66 HG12 ILE 66 -2.809 9.052 8.232 1297 2HG1 ILE 66 HG13 ILE 66 -3.196 9.042 6.506 1298 1HG2 ILE 66 HG21 ILE 66 -0.538 6.083 8.109 1299 2HG2 ILE 66 HG22 ILE 66 -1.214 7.324 9.188 1300 3HG2 ILE 66 HG23 ILE 66 -2.225 5.979 8.607 1301 1HD1 ILE 66 HD11 ILE 66 -4.534 6.953 6.876 1302 2HD1 ILE 66 HD12 ILE 66 -4.221 7.123 8.626 1303 3HD1 ILE 66 HD13 ILE 66 -5.134 8.372 7.766 1304 H ILE 67 HN ILE 67 -0.629 6.897 4.440 1305 HA ILE 67 HA ILE 67 -0.099 8.725 2.478 1306 HB ILE 67 HB ILE 67 -0.495 7.152 0.941 1307 1HG1 ILE 67 HG12 ILE 67 -3.043 6.294 2.344 1308 2HG1 ILE 67 HG13 ILE 67 -2.890 7.299 0.895 1309 1HG2 ILE 67 HG21 ILE 67 0.790 6.063 2.727 1310 2HG2 ILE 67 HG22 ILE 67 -0.711 5.285 3.312 1311 3HG2 ILE 67 HG23 ILE 67 -0.078 4.942 1.691 1312 1HD1 ILE 67 HD11 ILE 67 -1.671 5.159 -0.110 1313 2HD1 ILE 67 HD12 ILE 67 -2.582 4.348 1.176 1314 3HD1 ILE 67 HD13 ILE 67 -3.432 5.324 -0.071 1315 H ASP 68 HN ASP 68 -1.118 10.361 1.464 1316 HA ASP 68 HA ASP 68 -4.040 10.710 1.754 1317 1HB ASP 68 HB2 ASP 68 -3.081 11.828 3.721 1318 2HB ASP 68 HB3 ASP 68 -2.088 12.842 2.668 1319 H SER 69 HN SER 69 -4.301 10.388 -0.349 1320 HA SER 69 HA SER 69 -3.015 11.281 -2.543 1321 1HB SER 69 HB2 SER 69 -5.994 11.152 -2.083 1322 2HB SER 69 HB3 SER 69 -5.159 10.995 -3.649 1323 HG SER 69 HG SER 69 -5.627 8.931 -2.727 1324 H ASP 70 HN ASP 70 -4.820 13.445 -0.362 1325 HA ASP 70 HA ASP 70 -5.447 15.471 -2.294 1326 1HB ASP 70 HB2 ASP 70 -6.423 15.272 0.026 1327 2HB ASP 70 HB3 ASP 70 -4.853 15.817 0.656 1328 H ILE 71 HN ILE 71 -2.436 14.552 -0.865 1329 HA ILE 71 HA ILE 71 -1.185 16.950 -2.105 1330 HB ILE 71 HB ILE 71 0.098 15.663 0.228 1331 1HG1 ILE 71 HG12 ILE 71 -1.036 17.848 1.490 1332 2HG1 ILE 71 HG13 ILE 71 -2.387 17.349 0.482 1333 1HG2 ILE 71 HG21 ILE 71 1.285 17.400 -1.123 1334 2HG2 ILE 71 HG22 ILE 71 0.070 18.578 -0.578 1335 3HG2 ILE 71 HG23 ILE 71 1.102 17.744 0.617 1336 1HD1 ILE 71 HD11 ILE 71 -2.097 15.017 1.374 1337 2HD1 ILE 71 HD12 ILE 71 -0.724 15.643 2.344 1338 3HD1 ILE 71 HD13 ILE 71 -2.384 16.215 2.669 1339 H LEU 72 HN LEU 72 -0.957 13.449 -1.252 1340 HA LEU 72 HA LEU 72 1.495 12.923 -2.552 1341 1HB LEU 72 HB2 LEU 72 0.259 11.404 -0.992 1342 2HB LEU 72 HB3 LEU 72 -0.923 11.092 -2.240 1343 HG LEU 72 HG LEU 72 0.562 9.248 -2.024 1344 1HD1 LEU 72 HD11 LEU 72 -0.197 9.699 -4.341 1345 2HD1 LEU 72 HD12 LEU 72 1.320 10.589 -4.644 1346 3HD1 LEU 72 HD13 LEU 72 1.386 8.892 -4.265 1347 1HD2 LEU 72 HD21 LEU 72 2.968 9.341 -2.478 1348 2HD2 LEU 72 HD22 LEU 72 2.872 11.108 -2.642 1349 3HD2 LEU 72 HD23 LEU 72 2.505 10.322 -1.086 1350 H ASN 73 HN ASN 73 -1.876 12.482 -3.889 1351 HA ASN 73 HA ASN 73 -0.950 11.970 -6.540 1352 1HB ASN 73 HB2 ASN 73 -3.056 11.433 -6.896 1353 2HB ASN 73 HB3 ASN 73 -3.458 11.858 -5.253 1354 1HD2 ASN 73 HD22 ASN 73 -4.173 14.213 -4.901 1355 2HD2 ASN 73 HD21 ASN 73 -5.021 14.998 -6.223 1356 H ASN 74 HN ASN 74 -1.379 14.871 -4.712 1357 HA ASN 74 HA ASN 74 -1.655 16.759 -6.846 1358 1HB ASN 74 HB2 ASN 74 -2.123 16.726 -4.162 1359 2HB ASN 74 HB3 ASN 74 -0.603 17.618 -4.181 1360 1HD2 ASN 74 HD22 ASN 74 -3.477 18.315 -3.538 1361 2HD2 ASN 74 HD21 ASN 74 -3.806 19.747 -4.505 1362 H ALA 75 HN ALA 75 1.091 15.234 -5.258 1363 HA ALA 75 HA ALA 75 3.112 17.092 -5.821 1364 1HB ALA 75 HB1 ALA 75 3.235 15.077 -4.301 1365 2HB ALA 75 HB2 ALA 75 3.359 14.055 -5.746 1366 3HB ALA 75 HB3 ALA 75 4.624 15.242 -5.388 1367 H ASP 76 HN ASP 76 4.969 16.606 -7.268 1368 HA ASP 76 HA ASP 76 4.130 15.934 -10.056 1369 1HB ASP 76 HB2 ASP 76 5.437 17.983 -9.715 1370 2HB ASP 76 HB3 ASP 76 6.721 17.058 -8.929 1371 H LEU 77 HN LEU 77 6.151 14.726 -7.381 1372 HA LEU 77 HA LEU 77 6.778 12.281 -8.884 1373 1HB LEU 77 HB2 LEU 77 8.749 13.662 -9.173 1374 2HB LEU 77 HB3 LEU 77 8.711 14.160 -7.490 1375 HG LEU 77 HG LEU 77 9.307 11.777 -6.810 1376 1HD1 LEU 77 HD11 LEU 77 9.688 11.388 -9.734 1377 2HD1 LEU 77 HD12 LEU 77 10.204 10.251 -8.458 1378 3HD1 LEU 77 HD13 LEU 77 8.490 10.547 -8.736 1379 1HD2 LEU 77 HD21 LEU 77 11.038 13.525 -7.026 1380 2HD2 LEU 77 HD22 LEU 77 11.610 11.912 -7.411 1381 3HD2 LEU 77 HD23 LEU 77 11.268 13.067 -8.727 1382 H VAL 78 HN VAL 78 6.666 10.502 -7.681 1383 HA VAL 78 HA VAL 78 6.621 10.609 -4.697 1384 HB VAL 78 HB VAL 78 5.226 8.705 -6.610 1385 1HG1 VAL 78 HG11 VAL 78 6.022 7.549 -4.559 1386 2HG1 VAL 78 HG12 VAL 78 5.260 8.806 -3.559 1387 3HG1 VAL 78 HG13 VAL 78 4.266 7.720 -4.559 1388 1HG2 VAL 78 HG21 VAL 78 4.074 10.899 -6.413 1389 2HG2 VAL 78 HG22 VAL 78 3.167 9.604 -5.630 1390 3HG2 VAL 78 HG23 VAL 78 4.101 10.763 -4.653 1391 H VAL 79 HN VAL 79 8.813 10.368 -4.337 1392 HA VAL 79 HA VAL 79 10.191 8.208 -5.824 1393 HB VAL 79 HB VAL 79 11.875 9.558 -5.627 1394 1HG1 VAL 79 HG11 VAL 79 12.201 11.405 -4.013 1395 2HG1 VAL 79 HG12 VAL 79 10.734 11.547 -4.977 1396 3HG1 VAL 79 HG13 VAL 79 10.622 11.012 -3.296 1397 1HG2 VAL 79 HG21 VAL 79 12.531 7.771 -4.091 1398 2HG2 VAL 79 HG22 VAL 79 13.276 9.313 -3.632 1399 3HG2 VAL 79 HG23 VAL 79 11.913 8.723 -2.711 1400 H THR 80 HN THR 80 9.823 6.221 -5.192 1401 HA THR 80 HA THR 80 8.770 5.607 -2.491 1402 HB THR 80 HB THR 80 9.787 3.779 -4.715 1403 HG1 THR 80 HG1 THR 80 7.804 5.297 -4.867 1404 1HG2 THR 80 HG21 THR 80 9.704 2.617 -2.541 1405 2HG2 THR 80 HG22 THR 80 8.040 3.197 -2.288 1406 3HG2 THR 80 HG23 THR 80 8.402 2.053 -3.602 1407 H LEU 81 HN LEU 81 10.205 5.229 -0.724 1408 HA LEU 81 HA LEU 81 13.125 5.290 -1.430 1409 1HB LEU 81 HB2 LEU 81 11.915 7.484 -0.898 1410 2HB LEU 81 HB3 LEU 81 11.716 6.891 0.735 1411 HG LEU 81 HG LEU 81 14.124 6.982 1.126 1412 1HD1 LEU 81 HD11 LEU 81 15.692 7.864 -0.597 1413 2HD1 LEU 81 HD12 LEU 81 15.038 6.293 -1.052 1414 3HD1 LEU 81 HD13 LEU 81 14.390 7.777 -1.796 1415 1HD2 LEU 81 HD21 LEU 81 14.490 9.378 0.818 1416 2HD2 LEU 81 HD22 LEU 81 13.141 9.458 -0.316 1417 3HD2 LEU 81 HD23 LEU 81 12.846 9.045 1.392 1418 H SER 82 HN SER 82 11.202 3.105 -0.016 1419 HA SER 82 HA SER 82 13.103 2.464 2.062 1420 1HB SER 82 HB2 SER 82 10.306 3.085 3.033 1421 2HB SER 82 HB3 SER 82 11.752 2.768 3.989 1422 HG SER 82 HG SER 82 12.580 4.703 2.735 1423 H GLY 83 HN GLY 83 10.081 1.758 0.350 1424 1HA GLY 83 HA2 GLY 83 10.291 -0.956 0.034 1425 2HA GLY 83 HA3 GLY 83 9.475 -0.737 1.598 1426 H ASP 84 HN ASP 84 7.831 -1.846 -0.139 1427 HA ASP 84 HA ASP 84 5.973 0.337 -0.906 1428 1HB ASP 84 HB2 ASP 84 7.314 -0.084 -2.926 1429 2HB ASP 84 HB3 ASP 84 6.899 -1.796 -2.867 1430 H ALA 85 HN ALA 85 6.461 -3.269 -0.913 1431 HA ALA 85 HA ALA 85 3.738 -3.888 -0.915 1432 1HB ALA 85 HB1 ALA 85 4.429 -6.120 -0.104 1433 2HB ALA 85 HB2 ALA 85 5.481 -5.536 -1.406 1434 3HB ALA 85 HB3 ALA 85 6.044 -5.491 0.282 1435 H ALA 86 HN ALA 86 5.912 -3.843 1.988 1436 HA ALA 86 HA ALA 86 3.797 -4.110 3.883 1437 1HB ALA 86 HB1 ALA 86 6.106 -4.539 4.562 1438 2HB ALA 86 HB2 ALA 86 6.561 -2.857 4.195 1439 3HB ALA 86 HB3 ALA 86 5.447 -3.200 5.532 1440 H ASP 87 HN ASP 87 4.885 -1.337 2.021 1441 HA ASP 87 HA ASP 87 3.768 0.627 3.834 1442 1HB ASP 87 HB2 ASP 87 5.757 0.966 2.296 1443 2HB ASP 87 HB3 ASP 87 4.595 1.104 0.972 1444 H LYS 88 HN LYS 88 2.151 -1.608 2.254 1445 HA LYS 88 HA LYS 88 -0.066 -1.887 2.015 1446 1HB LYS 88 HB2 LYS 88 -0.358 0.417 3.218 1447 2HB LYS 88 HB3 LYS 88 -0.676 1.045 1.598 1448 1HG LYS 88 HG2 LYS 88 -2.492 -0.662 1.342 1449 2HG LYS 88 HG3 LYS 88 -2.173 -1.240 2.975 1450 1HD LYS 88 HD2 LYS 88 -2.917 1.652 2.314 1451 2HD LYS 88 HD3 LYS 88 -4.095 0.384 2.656 1452 1HE LYS 88 HE2 LYS 88 -1.941 1.247 4.612 1453 2HE LYS 88 HE3 LYS 88 -3.595 1.901 4.551 1454 1HZ LYS 88 HZ1 LYS 88 -4.429 -0.345 4.951 1455 2HZ LYS 88 HZ2 LYS 88 -2.910 -0.931 5.112 1456 3HZ LYS 88 HZ3 LYS 88 -3.486 0.163 6.186 1457 H CYS 89 HN CYS 89 1.917 -2.026 0.081 1458 HA CYS 89 HA CYS 89 2.498 -1.847 -2.091 1459 1HB CYS 89 HB2 CYS 89 -0.289 -2.909 -2.523 1460 2HB CYS 89 HB3 CYS 89 1.134 -3.215 -3.521 1461 HA PRO 90 HA PRO 90 -0.242 1.944 -2.748 1462 1HB PRO 90 HB2 PRO 90 2.422 3.258 -3.201 1463 2HB PRO 90 HB3 PRO 90 0.914 3.933 -2.495 1464 1HG PRO 90 HG2 PRO 90 2.924 3.151 -0.859 1465 2HG PRO 90 HG3 PRO 90 1.223 2.763 -0.460 1466 1HD PRO 90 HD2 PRO 90 3.311 0.989 -1.798 1467 2HD PRO 90 HD3 PRO 90 2.203 0.593 -0.469 1468 H MET 91 HN MET 91 -1.081 2.361 -4.740 1469 HA MET 91 HA MET 91 0.379 1.152 -7.013 1470 1HB MET 91 HB2 MET 91 -1.862 1.031 -8.038 1471 2HB MET 91 HB3 MET 91 -1.657 0.196 -6.491 1472 1HG MET 91 HG2 MET 91 -3.714 1.246 -6.389 1473 2HG MET 91 HG3 MET 91 -2.702 2.189 -5.359 1474 1HE MET 91 HE1 MET 91 -5.473 2.620 -6.789 1475 2HE MET 91 HE2 MET 91 -4.703 3.463 -5.468 1476 3HE MET 91 HE3 MET 91 -5.421 4.409 -6.869 1477 H THR 92 HN THR 92 0.425 4.147 -5.944 1478 HA THR 92 HA THR 92 0.486 6.252 -6.735 1479 HB THR 92 HB THR 92 2.256 6.443 -8.608 1480 HG1 THR 92 HG1 THR 92 2.094 4.269 -9.289 1481 1HG2 THR 92 HG21 THR 92 2.867 5.127 -5.923 1482 2HG2 THR 92 HG22 THR 92 3.997 6.055 -6.933 1483 3HG2 THR 92 HG23 THR 92 2.617 6.865 -6.204 1484 HA PRO 93 HA PRO 93 -2.787 6.351 -9.898 1485 1HB PRO 93 HB2 PRO 93 -3.770 8.858 -9.287 1486 2HB PRO 93 HB3 PRO 93 -4.171 7.389 -8.329 1487 1HG PRO 93 HG2 PRO 93 -2.006 9.412 -7.696 1488 2HG PRO 93 HG3 PRO 93 -3.316 8.773 -6.639 1489 1HD PRO 93 HD2 PRO 93 -0.885 7.683 -6.562 1490 2HD PRO 93 HD3 PRO 93 -2.330 6.611 -6.571 1491 HA PRO 94 HA PRO 94 0.046 7.860 -12.800 1492 1HB PRO 94 HB2 PRO 94 -1.517 8.538 -15.020 1493 2HB PRO 94 HB3 PRO 94 -1.099 6.885 -14.486 1494 1HG PRO 94 HG2 PRO 94 -3.599 8.480 -13.840 1495 2HG PRO 94 HG3 PRO 94 -3.481 6.786 -14.429 1496 1HD PRO 94 HD2 PRO 94 -3.808 7.264 -11.808 1497 2HD PRO 94 HD3 PRO 94 -2.614 6.034 -12.346 1498 H HIS 95 HN HIS 95 -1.773 10.228 -11.313 1499 HA HIS 95 HA HIS 95 -1.076 12.510 -12.941 1500 1HB HIS 95 HB2 HIS 95 -1.866 12.348 -10.010 1501 2HB HIS 95 HB3 HIS 95 -1.839 13.804 -11.000 1502 HD1 HIS 95 HD1 HIS 95 -4.520 12.792 -9.599 1503 HD2 HIS 95 HD2 HIS 95 -3.339 12.093 -13.582 1504 HE1 HIS 95 HE1 HIS 95 -6.651 12.280 -10.905 1505 H VAL 96 HN VAL 96 0.877 10.466 -10.953 1506 HA VAL 96 HA VAL 96 2.928 12.604 -10.617 1507 HB VAL 96 HB VAL 96 3.596 10.980 -8.676 1508 1HG1 VAL 96 HG11 VAL 96 1.284 12.928 -8.454 1509 2HG1 VAL 96 HG12 VAL 96 2.215 12.282 -7.084 1510 3HG1 VAL 96 HG13 VAL 96 3.030 13.256 -8.307 1511 1HG2 VAL 96 HG21 VAL 96 0.608 10.427 -8.626 1512 2HG2 VAL 96 HG22 VAL 96 1.852 9.236 -9.093 1513 3HG2 VAL 96 HG23 VAL 96 1.817 9.902 -7.457 1514 H LYS 97 HN LYS 97 5.057 12.066 -10.990 1515 HA LYS 97 HA LYS 97 5.638 9.631 -12.555 1516 1HB LYS 97 HB2 LYS 97 6.716 11.907 -12.923 1517 2HB LYS 97 HB3 LYS 97 7.557 11.711 -11.387 1518 1HG LYS 97 HG2 LYS 97 7.795 9.458 -13.358 1519 2HG LYS 97 HG3 LYS 97 8.515 10.969 -13.860 1520 1HD LYS 97 HD2 LYS 97 9.165 9.822 -11.138 1521 2HD LYS 97 HD3 LYS 97 9.929 9.156 -12.566 1522 1HE LYS 97 HE2 LYS 97 10.102 12.103 -11.743 1523 2HE LYS 97 HE3 LYS 97 11.342 10.898 -11.433 1524 1HZ LYS 97 HZ1 LYS 97 11.947 12.072 -13.374 1525 2HZ LYS 97 HZ2 LYS 97 11.517 10.580 -13.866 1526 3HZ LYS 97 HZ3 LYS 97 10.497 11.840 -14.104 1527 H ARG 98 HN ARG 98 7.059 7.921 -11.641 1528 HA ARG 98 HA ARG 98 7.779 8.198 -8.834 1529 1HB ARG 98 HB2 ARG 98 5.507 7.144 -8.720 1530 2HB ARG 98 HB3 ARG 98 6.083 5.830 -9.736 1531 1HG ARG 98 HG2 ARG 98 7.912 6.044 -7.499 1532 2HG ARG 98 HG3 ARG 98 6.317 6.200 -6.834 1533 1HD ARG 98 HD2 ARG 98 7.119 3.975 -8.784 1534 2HD ARG 98 HD3 ARG 98 7.438 3.849 -7.070 1535 HE ARG 98 HE ARG 98 4.711 4.102 -8.289 1536 1HH1 ARG 98 HH11 ARG 98 6.605 3.121 -5.408 1537 2HH1 ARG 98 HH12 ARG 98 5.413 1.947 -4.907 1538 1HH2 ARG 98 HH21 ARG 98 3.139 2.871 -7.469 1539 2HH2 ARG 98 HH22 ARG 98 3.328 1.900 -6.031 1540 H GLU 99 HN GLU 99 9.564 7.044 -8.302 1541 HA GLU 99 HA GLU 99 10.511 4.822 -9.866 1542 1HB GLU 99 HB2 GLU 99 11.528 6.770 -11.075 1543 2HB GLU 99 HB3 GLU 99 12.253 7.323 -9.560 1544 1HG GLU 99 HG2 GLU 99 13.594 5.273 -9.415 1545 2HG GLU 99 HG3 GLU 99 12.754 4.578 -10.801 1546 H HIS 100 HN HIS 100 11.743 3.516 -8.399 1547 HA HIS 100 HA HIS 100 11.654 4.341 -5.587 1548 1HB HIS 100 HB2 HIS 100 12.543 2.012 -5.184 1549 2HB HIS 100 HB3 HIS 100 10.930 2.130 -5.866 1550 HD1 HIS 100 HD1 HIS 100 14.172 2.167 -7.993 1551 HD2 HIS 100 HD2 HIS 100 10.773 -0.153 -7.116 1552 HE1 HIS 100 HE1 HIS 100 14.195 0.206 -9.638 1553 H TRP 101 HN TRP 101 13.312 5.221 -4.556 1554 HA TRP 101 HA TRP 101 16.040 5.101 -5.797 1555 1HB TRP 101 HB2 TRP 101 14.892 7.133 -3.874 1556 2HB TRP 101 HB3 TRP 101 16.503 7.153 -4.539 1557 HD1 TRP 101 HD1 TRP 101 14.376 6.470 -7.444 1558 HE1 TRP 101 HE1 TRP 101 13.561 8.574 -8.607 1559 HE3 TRP 101 HE3 TRP 101 15.738 9.927 -3.922 1560 HZ2 TRP 101 HZ2 TRP 101 13.671 11.432 -8.187 1561 HZ3 TRP 101 HZ3 TRP 101 15.321 12.336 -4.322 1562 HH2 TRP 101 HH2 TRP 101 14.229 13.081 -6.424 1563 H GLY 102 HN GLY 102 14.109 3.959 -3.163 1564 1HA GLY 102 HA2 GLY 102 16.394 2.656 -1.963 1565 2HA GLY 102 HA3 GLY 102 15.597 3.829 -0.893 1566 H PHE 103 HN PHE 103 15.594 1.099 -0.311 1567 HA PHE 103 HA PHE 103 12.799 0.334 -0.374 1568 1HB PHE 103 HB2 PHE 103 14.128 -0.375 -2.613 1569 2HB PHE 103 HB3 PHE 103 14.600 -1.728 -1.611 1570 HD1 PHE 103 HD1 PHE 103 11.732 0.197 -3.015 1571 HD2 PHE 103 HD2 PHE 103 12.936 -3.477 -1.098 1572 HE1 PHE 103 HE1 PHE 103 9.512 -0.792 -3.511 1573 HE2 PHE 103 HE2 PHE 103 10.707 -4.456 -1.582 1574 HZ PHE 103 HZ PHE 103 8.993 -3.120 -2.795 1575 H ASP 104 HN ASP 104 14.828 0.988 1.621 1576 HA ASP 104 HA ASP 104 14.679 -1.237 3.458 1577 1HB ASP 104 HB2 ASP 104 17.068 -1.240 3.978 1578 2HB ASP 104 HB3 ASP 104 16.793 -1.805 2.331 1579 H ASP 105 HN ASP 105 15.344 -0.345 5.692 1580 HA ASP 105 HA ASP 105 15.219 2.583 5.817 1581 1HB ASP 105 HB2 ASP 105 12.886 2.045 5.627 1582 2HB ASP 105 HB3 ASP 105 13.002 0.768 6.817 1583 HA PRO 106 HA PRO 106 17.911 1.419 8.991 1584 1HB PRO 106 HB2 PRO 106 18.457 3.743 10.269 1585 2HB PRO 106 HB3 PRO 106 18.898 3.462 8.556 1586 1HG PRO 106 HG2 PRO 106 16.444 4.915 9.610 1587 2HG PRO 106 HG3 PRO 106 17.586 5.448 8.332 1588 1HD PRO 106 HD2 PRO 106 15.209 4.177 7.822 1589 2HD PRO 106 HD3 PRO 106 16.643 3.948 6.776 1590 H ALA 107 HN ALA 107 14.742 2.627 10.008 1591 HA ALA 107 HA ALA 107 15.146 2.029 12.788 1592 1HB ALA 107 HB1 ALA 107 12.746 2.255 12.974 1593 2HB ALA 107 HB2 ALA 107 13.345 3.555 11.912 1594 3HB ALA 107 HB3 ALA 107 12.536 2.129 11.225 1595 H ARG 108 HN ARG 108 15.327 0.100 10.088 1596 HA ARG 108 HA ARG 108 14.076 -2.311 11.350 1597 1HB ARG 108 HB2 ARG 108 15.323 -2.176 8.601 1598 2HB ARG 108 HB3 ARG 108 14.257 -3.399 9.255 1599 1HG ARG 108 HG2 ARG 108 13.448 -0.530 8.567 1600 2HG ARG 108 HG3 ARG 108 13.149 -1.937 7.553 1601 1HD ARG 108 HD2 ARG 108 12.035 -1.484 10.345 1602 2HD ARG 108 HD3 ARG 108 11.143 -1.249 8.825 1603 HE ARG 108 HE ARG 108 12.045 -3.863 8.712 1604 1HH1 ARG 108 HH21 ARG 108 9.940 -2.009 10.887 1605 2HH1 ARG 108 HH22 ARG 108 8.990 -3.367 11.361 1606 1HH2 ARG 108 HH12 ARG 108 10.788 -5.681 9.352 1607 2HH2 ARG 108 HH11 ARG 108 9.483 -5.499 10.460 1608 H ALA 109 HN ALA 109 16.923 -0.698 11.593 1609 HA ALA 109 HA ALA 109 18.969 -2.464 11.039 1610 1HB ALA 109 HB1 ALA 109 18.624 -0.720 13.512 1611 2HB ALA 109 HB2 ALA 109 20.151 -1.374 12.891 1612 3HB ALA 109 HB3 ALA 109 19.260 -0.166 11.947 1613 H GLN 110 HN GLN 110 20.067 -3.971 12.336 1614 HA GLN 110 HA GLN 110 18.448 -6.001 13.247 1615 1HB GLN 110 HB2 GLN 110 20.766 -6.406 12.548 1616 2HB GLN 110 HB3 GLN 110 21.382 -5.410 13.873 1617 1HG GLN 110 HG2 GLN 110 21.742 -7.780 14.306 1618 2HG GLN 110 HG3 GLN 110 20.729 -7.036 15.529 1619 1HE2 GLN 110 HE22 GLN 110 18.410 -7.556 15.574 1620 2HE2 GLN 110 HE21 GLN 110 17.866 -9.071 14.871 1621 H GLY 111 HN GLY 111 20.119 -3.493 15.159 1622 1HA GLY 111 HA2 GLY 111 18.384 -2.702 16.807 1623 2HA GLY 111 HA3 GLY 111 18.541 -4.358 17.502 1624 H THR 112 HN THR 112 21.516 -4.105 16.812 1625 HA THR 112 HA THR 112 22.321 -3.315 19.475 1626 HB THR 112 HB THR 112 24.567 -3.897 18.714 1627 HG1 THR 112 HG1 THR 112 24.804 -4.546 16.514 1628 1HG2 THR 112 HG21 THR 112 22.659 -5.851 17.384 1629 2HG2 THR 112 HG22 THR 112 24.240 -6.186 18.125 1630 3HG2 THR 112 HG23 THR 112 22.861 -5.730 19.160 1631 H GLU 113 HN GLU 113 24.093 -1.686 19.779 1632 HA GLU 113 HA GLU 113 23.232 0.813 18.868 1633 1HB GLU 113 HB2 GLU 113 25.955 -0.085 19.954 1634 2HB GLU 113 HB3 GLU 113 25.424 1.611 19.868 1635 1HG GLU 113 HG2 GLU 113 23.473 1.018 21.347 1636 2HG GLU 113 HG3 GLU 113 24.139 -0.607 21.517 1637 H GLU 114 HN GLU 114 25.800 -1.352 17.755 1638 HA GLU 114 HA GLU 114 26.952 0.430 15.847 1639 1HB GLU 114 HB2 GLU 114 27.976 -1.769 15.001 1640 2HB GLU 114 HB3 GLU 114 28.437 -1.198 16.619 1641 1HG GLU 114 HG2 GLU 114 26.758 -2.816 17.579 1642 2HG GLU 114 HG3 GLU 114 26.488 -3.398 15.913 1643 H GLU 115 HN GLU 115 24.375 -2.219 15.695 1644 HA GLU 115 HA GLU 115 24.486 -2.052 12.822 1645 1HB GLU 115 HB2 GLU 115 22.585 -3.405 14.727 1646 2HB GLU 115 HB3 GLU 115 22.404 -3.466 12.973 1647 1HG GLU 115 HG2 GLU 115 25.077 -4.206 14.238 1648 2HG GLU 115 HG3 GLU 115 23.756 -5.371 14.192 1649 H LYS 116 HN LYS 116 22.441 -0.576 15.365 1650 HA LYS 116 HA LYS 116 20.661 0.809 13.633 1651 1HB LYS 116 HB2 LYS 116 21.855 1.471 16.364 1652 2HB LYS 116 HB3 LYS 116 20.730 2.568 15.573 1653 1HG LYS 116 HG2 LYS 116 19.921 -0.310 15.981 1654 2HG LYS 116 HG3 LYS 116 19.875 0.840 17.330 1655 1HD LYS 116 HD2 LYS 116 18.401 2.358 16.083 1656 2HD LYS 116 HD3 LYS 116 18.550 1.371 14.630 1657 1HE LYS 116 HE2 LYS 116 16.446 0.876 15.591 1658 2HE LYS 116 HE3 LYS 116 17.492 -0.533 15.823 1659 1HZ LYS 116 HZ1 LYS 116 17.805 0.180 18.138 1660 2HZ LYS 116 HZ2 LYS 116 16.855 1.491 17.904 1661 3HZ LYS 116 HZ3 LYS 116 16.217 -0.002 17.823 1662 H TRP 117 HN TRP 117 23.810 1.946 14.927 1663 HA TRP 117 HA TRP 117 23.613 4.322 13.365 1664 1HB TRP 117 HB2 TRP 117 25.110 3.934 15.389 1665 2HB TRP 117 HB3 TRP 117 26.237 3.138 14.291 1666 HD1 TRP 117 HD1 TRP 117 24.906 5.810 12.267 1667 HE1 TRP 117 HE1 TRP 117 26.292 7.966 12.374 1668 HE3 TRP 117 HE3 TRP 117 27.631 4.806 16.498 1669 HZ2 TRP 117 HZ2 TRP 117 28.063 9.208 14.225 1670 HZ3 TRP 117 HZ3 TRP 117 29.132 6.542 17.446 1671 HH2 TRP 117 HH2 TRP 117 29.356 8.756 16.330 1672 H ALA 118 HN ALA 118 25.127 1.181 12.709 1673 HA ALA 118 HA ALA 118 26.358 1.842 10.282 1674 1HB ALA 118 HB1 ALA 118 26.236 -0.658 9.879 1675 2HB ALA 118 HB2 ALA 118 26.752 -0.284 11.544 1676 3HB ALA 118 HB3 ALA 118 25.088 -0.775 11.237 1677 H PHE 119 HN PHE 119 22.983 0.713 10.828 1678 HA PHE 119 HA PHE 119 22.340 0.690 8.029 1679 1HB PHE 119 HB2 PHE 119 20.741 0.730 10.584 1680 2HB PHE 119 HB3 PHE 119 19.955 1.127 9.080 1681 HD1 PHE 119 HD1 PHE 119 18.630 -0.575 8.252 1682 HD2 PHE 119 HD2 PHE 119 22.433 -1.589 10.032 1683 HE1 PHE 119 HE1 PHE 119 18.219 -2.963 7.784 1684 HE2 PHE 119 HE2 PHE 119 22.005 -3.978 9.569 1685 HZ PHE 119 HZ PHE 119 19.898 -4.678 8.446 1686 H PHE 120 HN PHE 120 21.928 3.213 10.637 1687 HA PHE 120 HA PHE 120 20.712 4.929 8.675 1688 1HB PHE 120 HB2 PHE 120 20.348 6.532 10.225 1689 2HB PHE 120 HB3 PHE 120 20.129 4.995 11.038 1690 HD1 PHE 120 HD1 PHE 120 22.636 7.782 10.658 1691 HD2 PHE 120 HD2 PHE 120 20.810 4.818 13.217 1692 HE1 PHE 120 HE1 PHE 120 23.733 8.782 12.641 1693 HE2 PHE 120 HE2 PHE 120 21.943 5.812 15.178 1694 HZ PHE 120 HZ PHE 120 23.451 7.768 14.875 1695 H GLN 121 HN GLN 121 24.086 4.524 9.589 1696 HA GLN 121 HA GLN 121 25.081 6.902 8.389 1697 1HB GLN 121 HB2 GLN 121 26.366 5.511 9.902 1698 2HB GLN 121 HB3 GLN 121 26.276 4.125 8.808 1699 1HG GLN 121 HG2 GLN 121 27.633 5.287 7.136 1700 2HG GLN 121 HG3 GLN 121 27.647 6.753 8.126 1701 1HE2 GLN 121 HE22 GLN 121 28.369 6.167 10.601 1702 2HE2 GLN 121 HE21 GLN 121 29.851 5.249 10.676 1703 H ARG 122 HN ARG 122 24.635 3.544 7.088 1704 HA ARG 122 HA ARG 122 25.475 4.152 4.454 1705 1HB ARG 122 HB2 ARG 122 25.283 1.846 5.221 1706 2HB ARG 122 HB3 ARG 122 23.558 2.047 5.554 1707 1HG ARG 122 HG2 ARG 122 23.155 2.409 3.103 1708 2HG ARG 122 HG3 ARG 122 24.863 2.088 2.790 1709 1HD ARG 122 HD2 ARG 122 24.656 -0.184 3.336 1710 2HD ARG 122 HD3 ARG 122 23.231 0.064 4.346 1711 HE ARG 122 HE ARG 122 23.314 -0.340 1.465 1712 1HH1 ARG 122 HH11 ARG 122 21.330 0.852 4.165 1713 2HH1 ARG 122 HH12 ARG 122 19.843 0.853 3.267 1714 1HH2 ARG 122 HH21 ARG 122 21.306 -0.408 0.297 1715 2HH2 ARG 122 HH22 ARG 122 19.822 0.053 1.083 1716 H VAL 123 HN VAL 123 22.158 4.068 5.891 1717 HA VAL 123 HA VAL 123 20.851 4.832 3.496 1718 HB VAL 123 HB VAL 123 20.044 5.042 6.421 1719 1HG1 VAL 123 HG11 VAL 123 18.405 5.633 3.931 1720 2HG1 VAL 123 HG12 VAL 123 17.721 5.398 5.559 1721 3HG1 VAL 123 HG13 VAL 123 18.787 6.766 5.230 1722 1HG2 VAL 123 HG21 VAL 123 20.231 2.726 5.478 1723 2HG2 VAL 123 HG22 VAL 123 18.544 3.126 5.788 1724 3HG2 VAL 123 HG23 VAL 123 19.166 3.189 4.142 1725 H ARG 124 HN ARG 124 22.165 6.922 6.169 1726 HA ARG 124 HA ARG 124 21.227 9.358 5.168 1727 1HB ARG 124 HB2 ARG 124 22.085 9.233 7.348 1728 2HB ARG 124 HB3 ARG 124 23.620 8.542 6.842 1729 1HG ARG 124 HG2 ARG 124 23.011 11.297 5.867 1730 2HG ARG 124 HG3 ARG 124 23.284 11.119 7.594 1731 1HD ARG 124 HD2 ARG 124 25.234 10.116 5.483 1732 2HD ARG 124 HD3 ARG 124 25.335 11.701 6.266 1733 HE ARG 124 HE ARG 124 25.169 9.920 8.377 1734 1HH1 ARG 124 HH11 ARG 124 27.418 10.359 5.647 1735 2HH1 ARG 124 HH12 ARG 124 28.803 9.832 6.524 1736 1HH2 ARG 124 HH21 ARG 124 27.017 9.263 9.560 1737 2HH2 ARG 124 HH22 ARG 124 28.575 9.217 8.799 1738 H ASP 125 HN ASP 125 24.291 7.677 4.324 1739 HA ASP 125 HA ASP 125 25.234 9.745 2.607 1740 1HB ASP 125 HB2 ASP 125 26.688 7.944 3.388 1741 2HB ASP 125 HB3 ASP 125 25.714 6.736 2.546 1742 H GLU 126 HN GLU 126 23.202 6.861 1.944 1743 HA GLU 126 HA GLU 126 23.062 7.230 -0.877 1744 1HB GLU 126 HB2 GLU 126 22.609 5.116 0.329 1745 2HB GLU 126 HB3 GLU 126 21.168 5.812 1.049 1746 1HG GLU 126 HG2 GLU 126 21.015 6.132 -1.846 1747 2HG GLU 126 HG3 GLU 126 21.479 4.477 -1.479 1748 H ILE 127 HN ILE 127 20.744 8.139 1.732 1749 HA ILE 127 HA ILE 127 18.820 9.365 0.048 1750 HB ILE 127 HB ILE 127 19.258 8.957 2.896 1751 1HG1 ILE 127 HG12 ILE 127 16.751 9.573 1.303 1752 2HG1 ILE 127 HG13 ILE 127 17.530 7.993 1.356 1753 1HG2 ILE 127 HG21 ILE 127 18.039 11.609 2.159 1754 2HG2 ILE 127 HG22 ILE 127 17.992 10.848 3.779 1755 3HG2 ILE 127 HG23 ILE 127 19.533 11.323 3.099 1756 1HD1 ILE 127 HD11 ILE 127 17.188 7.924 3.841 1757 2HD1 ILE 127 HD12 ILE 127 16.290 9.437 3.732 1758 3HD1 ILE 127 HD13 ILE 127 15.673 8.000 2.904 1759 H GLY 128 HN GLY 128 21.657 10.827 1.728 1760 1HA GLY 128 HA2 GLY 128 20.976 13.471 0.921 1761 2HA GLY 128 HA3 GLY 128 22.598 12.894 1.417 1762 H ASN 129 HN ASN 129 23.148 10.994 -0.630 1763 HA ASN 129 HA ASN 129 23.867 12.679 -2.792 1764 1HB ASN 129 HB2 ASN 129 25.112 10.624 -2.438 1765 2HB ASN 129 HB3 ASN 129 23.655 9.644 -2.667 1766 1HD2 ASN 129 HD22 ASN 129 23.006 9.132 -4.801 1767 2HD2 ASN 129 HD21 ASN 129 23.582 9.964 -6.228 1768 H ARG 130 HN ARG 130 21.152 10.365 -2.489 1769 HA ARG 130 HA ARG 130 20.188 10.670 -5.151 1770 1HB ARG 130 HB2 ARG 130 18.794 9.943 -2.544 1771 2HB ARG 130 HB3 ARG 130 17.959 9.959 -4.084 1772 1HG ARG 130 HG2 ARG 130 20.407 8.211 -3.605 1773 2HG ARG 130 HG3 ARG 130 18.759 7.721 -3.239 1774 1HD ARG 130 HD2 ARG 130 18.967 6.812 -5.327 1775 2HD ARG 130 HD3 ARG 130 18.236 8.356 -5.730 1776 HE ARG 130 HE ARG 130 20.179 9.034 -6.799 1777 1HH1 ARG 130 HH11 ARG 130 20.784 5.903 -5.212 1778 2HH1 ARG 130 HH12 ARG 130 22.271 5.638 -6.043 1779 1HH2 ARG 130 HH21 ARG 130 22.171 8.792 -7.718 1780 2HH2 ARG 130 HH22 ARG 130 23.054 7.291 -7.581 1781 H LEU 131 HN LEU 131 19.298 12.542 -2.172 1782 HA LEU 131 HA LEU 131 17.420 14.132 -3.678 1783 1HB LEU 131 HB2 LEU 131 18.574 14.216 -0.890 1784 2HB LEU 131 HB3 LEU 131 17.917 15.703 -1.529 1785 HG LEU 131 HG LEU 131 16.247 14.566 -0.231 1786 1HD1 LEU 131 HD11 LEU 131 15.590 15.900 -2.271 1787 2HD1 LEU 131 HD12 LEU 131 15.419 14.374 -3.165 1788 3HD1 LEU 131 HD13 LEU 131 14.397 14.695 -1.782 1789 1HD2 LEU 131 HD21 LEU 131 16.943 12.236 -0.488 1790 2HD2 LEU 131 HD22 LEU 131 15.231 12.437 -0.868 1791 3HD2 LEU 131 HD23 LEU 131 16.408 12.233 -2.180 1792 H LYS 132 HN LYS 132 20.879 14.565 -2.885 1793 HA LYS 132 HA LYS 132 21.019 17.301 -3.709 1794 1HB LYS 132 HB2 LYS 132 22.614 16.156 -2.273 1795 2HB LYS 132 HB3 LYS 132 22.997 14.985 -3.551 1796 1HG LYS 132 HG2 LYS 132 23.923 16.947 -4.910 1797 2HG LYS 132 HG3 LYS 132 23.748 17.910 -3.443 1798 1HD LYS 132 HD2 LYS 132 25.462 15.468 -3.947 1799 2HD LYS 132 HD3 LYS 132 25.992 17.097 -3.448 1800 1HE LYS 132 HE2 LYS 132 24.763 16.673 -1.250 1801 2HE LYS 132 HE3 LYS 132 24.518 15.006 -1.795 1802 1HZ LYS 132 HZ1 LYS 132 27.165 16.295 -1.372 1803 2HZ LYS 132 HZ2 LYS 132 26.488 15.186 -0.391 1804 3HZ LYS 132 HZ3 LYS 132 26.950 14.763 -1.895 1805 H GLU 133 HN GLU 133 21.790 14.206 -5.478 1806 HA GLU 133 HA GLU 133 22.267 15.549 -7.948 1807 1HB GLU 133 HB2 GLU 133 22.252 13.552 -9.047 1808 2HB GLU 133 HB3 GLU 133 23.049 13.280 -7.443 1809 1HG GLU 133 HG2 GLU 133 20.819 12.663 -6.646 1810 2HG GLU 133 HG3 GLU 133 20.286 12.734 -8.357 1811 H PHE 134 HN PHE 134 19.296 14.268 -6.578 1812 HA PHE 134 HA PHE 134 17.642 14.828 -8.799 1813 1HB PHE 134 HB2 PHE 134 16.710 13.661 -6.985 1814 2HB PHE 134 HB3 PHE 134 17.043 14.968 -5.858 1815 HD1 PHE 134 HD1 PHE 134 15.322 14.939 -9.232 1816 HD2 PHE 134 HD2 PHE 134 15.060 15.808 -5.033 1817 HE1 PHE 134 HE1 PHE 134 13.019 15.784 -9.565 1818 HE2 PHE 134 HE2 PHE 134 12.755 16.675 -5.362 1819 HZ PHE 134 HZ PHE 134 11.726 16.658 -7.626 1820 H ALA 135 HN ALA 135 18.789 17.112 -6.325 1821 HA ALA 135 HA ALA 135 17.380 19.372 -7.289 1822 1HB ALA 135 HB1 ALA 135 20.141 19.479 -6.009 1823 2HB ALA 135 HB2 ALA 135 18.845 20.698 -5.964 1824 3HB ALA 135 HB3 ALA 135 18.652 19.172 -5.091 1825 H GLU 136 HN GLU 136 20.336 17.849 -8.450 1826 HA GLU 136 HA GLU 136 21.111 20.025 -10.179 1827 1HB GLU 136 HB2 GLU 136 22.213 17.231 -9.771 1828 2HB GLU 136 HB3 GLU 136 22.947 18.432 -10.822 1829 1HG GLU 136 HG2 GLU 136 22.471 18.939 -7.860 1830 2HG GLU 136 HG3 GLU 136 23.901 18.120 -8.459 1831 H THR 137 HN THR 137 19.979 16.727 -10.497 1832 HA THR 137 HA THR 137 20.050 16.568 -13.379 1833 HB THR 137 HB THR 137 19.308 14.260 -12.927 1834 HG1 THR 137 HG1 THR 137 19.235 14.900 -10.207 1835 1HG2 THR 137 HG21 THR 137 21.038 13.594 -11.120 1836 2HG2 THR 137 HG22 THR 137 21.618 14.323 -12.642 1837 3HG2 THR 137 HG23 THR 137 21.549 15.294 -11.169 1838 H GLY 138 HN GLY 138 17.596 17.259 -10.934 1839 1HA GLY 138 HA2 GLY 138 15.366 17.608 -10.996 1840 2HA GLY 138 HA3 GLY 138 15.467 17.897 -12.757 1841 H LYS 139 HN LYS 139 16.765 14.942 -11.517 1842 HA LYS 139 HA LYS 139 16.503 12.925 -12.465 1843 1HB LYS 139 HB2 LYS 139 15.643 12.955 -10.116 1844 2HB LYS 139 HB3 LYS 139 13.997 13.029 -10.766 1845 1HG LYS 139 HG2 LYS 139 14.472 10.758 -10.238 1846 2HG LYS 139 HG3 LYS 139 14.443 10.909 -11.988 1847 1HD LYS 139 HD2 LYS 139 16.231 9.421 -11.281 1848 2HD LYS 139 HD3 LYS 139 16.912 10.842 -12.074 1849 1HE LYS 139 HE2 LYS 139 17.501 11.814 -9.879 1850 2HE LYS 139 HE3 LYS 139 16.732 10.450 -9.049 1851 1HZ LYS 139 HZ1 LYS 139 19.084 10.240 -10.843 1852 2HZ LYS 139 HZ2 LYS 139 19.149 10.158 -9.215 1853 3HZ LYS 139 HZ3 LYS 139 18.380 8.990 -10.059 Start of MODEL 3 1 1H MET 1 H1 MET 1 -23.058 -10.868 -7.854 2 2H MET 1 H2 MET 1 -23.054 -12.491 -7.800 3 3H MET 1 H3 MET 1 -24.471 -11.658 -7.604 4 HA MET 1 HA MET 1 -24.641 -12.469 -9.730 5 1HB MET 1 HB2 MET 1 -23.450 -9.669 -9.977 6 2HB MET 1 HB3 MET 1 -24.303 -10.535 -11.257 7 1HG MET 1 HG2 MET 1 -26.353 -10.590 -9.885 8 2HG MET 1 HG3 MET 1 -25.505 -9.789 -8.562 9 1HE MET 1 HE1 MET 1 -25.516 -8.989 -12.528 10 2HE MET 1 HE2 MET 1 -27.177 -9.428 -12.062 11 3HE MET 1 HE3 MET 1 -26.794 -7.758 -12.526 12 H ALA 2 HN ALA 2 -21.483 -10.671 -9.941 13 HA ALA 2 HA ALA 2 -19.939 -13.065 -10.280 14 1HB ALA 2 HB1 ALA 2 -20.788 -12.791 -12.634 15 2HB ALA 2 HB2 ALA 2 -20.224 -11.104 -12.624 16 3HB ALA 2 HB3 ALA 2 -19.058 -12.439 -12.523 17 H ILE 3 HN ILE 3 -17.616 -12.273 -10.682 18 HA ILE 3 HA ILE 3 -17.116 -9.780 -9.206 19 HB ILE 3 HB ILE 3 -15.413 -12.215 -9.899 20 1HG1 ILE 3 HG12 ILE 3 -14.717 -11.876 -7.469 21 2HG1 ILE 3 HG13 ILE 3 -15.993 -10.667 -7.343 22 1HG2 ILE 3 HG21 ILE 3 -14.040 -10.303 -10.602 23 2HG2 ILE 3 HG22 ILE 3 -14.414 -9.454 -9.087 24 3HG2 ILE 3 HG23 ILE 3 -13.429 -10.943 -9.084 25 1HD1 ILE 3 HD11 ILE 3 -16.349 -13.620 -7.932 26 2HD1 ILE 3 HD12 ILE 3 -16.648 -12.739 -6.412 27 3HD1 ILE 3 HD13 ILE 3 -17.669 -12.414 -7.821 28 H VAL 4 HN VAL 4 -17.708 -8.224 -10.586 29 HA VAL 4 HA VAL 4 -17.235 -8.357 -13.462 30 HB VAL 4 HB VAL 4 -18.423 -6.202 -11.669 31 1HG1 VAL 4 HG11 VAL 4 -19.666 -5.460 -13.711 32 2HG1 VAL 4 HG12 VAL 4 -17.942 -5.191 -13.834 33 3HG1 VAL 4 HG13 VAL 4 -18.685 -6.575 -14.682 34 1HG2 VAL 4 HG21 VAL 4 -19.781 -8.209 -11.416 35 2HG2 VAL 4 HG22 VAL 4 -20.655 -7.076 -12.432 36 3HG2 VAL 4 HG23 VAL 4 -19.818 -8.453 -13.178 37 H LYS 5 HN LYS 5 -16.248 -6.268 -14.445 38 HA LYS 5 HA LYS 5 -13.856 -5.454 -12.934 39 1HB LYS 5 HB2 LYS 5 -13.471 -7.232 -14.764 40 2HB LYS 5 HB3 LYS 5 -13.929 -6.007 -15.926 41 1HG LYS 5 HG2 LYS 5 -11.543 -6.080 -15.827 42 2HG LYS 5 HG3 LYS 5 -12.056 -4.552 -15.122 43 1HD LYS 5 HD2 LYS 5 -10.195 -5.537 -13.857 44 2HD LYS 5 HD3 LYS 5 -11.634 -5.429 -12.860 45 1HE LYS 5 HE2 LYS 5 -10.633 -7.564 -12.426 46 2HE LYS 5 HE3 LYS 5 -12.125 -7.840 -13.327 47 1HZ LYS 5 HZ1 LYS 5 -10.290 -9.190 -14.158 48 2HZ LYS 5 HZ2 LYS 5 -10.783 -8.171 -15.327 49 3HZ LYS 5 HZ3 LYS 5 -9.399 -7.872 -14.508 50 H ALA 6 HN ALA 6 -14.014 -3.354 -12.548 51 HA ALA 6 HA ALA 6 -15.760 -1.551 -14.088 52 1HB ALA 6 HB1 ALA 6 -14.715 0.084 -12.363 53 2HB ALA 6 HB2 ALA 6 -15.891 -1.076 -11.829 54 3HB ALA 6 HB3 ALA 6 -14.164 -1.384 -11.541 55 H THR 7 HN THR 7 -14.711 0.662 -14.513 56 HA THR 7 HA THR 7 -11.933 0.976 -14.826 57 HB THR 7 HB THR 7 -12.228 -0.240 -16.913 58 HG1 THR 7 HG1 THR 7 -10.768 1.131 -17.378 59 1HG2 THR 7 HG21 THR 7 -14.519 0.045 -17.498 60 2HG2 THR 7 HG22 THR 7 -14.344 1.816 -17.634 61 3HG2 THR 7 HG23 THR 7 -13.547 0.733 -18.796 62 H ASP 8 HN ASP 8 -11.942 3.313 -16.202 63 HA ASP 8 HA ASP 8 -12.306 5.186 -14.315 64 1HB ASP 8 HB2 ASP 8 -11.052 5.556 -16.330 65 2HB ASP 8 HB3 ASP 8 -12.516 5.513 -17.313 66 H GLN 9 HN GLN 9 -14.950 4.277 -16.523 67 HA GLN 9 HA GLN 9 -16.778 6.038 -15.003 68 1HB GLN 9 HB2 GLN 9 -16.512 5.702 -18.005 69 2HB GLN 9 HB3 GLN 9 -17.947 6.411 -17.250 70 1HG GLN 9 HG2 GLN 9 -16.732 8.272 -16.372 71 2HG GLN 9 HG3 GLN 9 -15.180 7.507 -16.650 72 1HE2 GLN 9 HE22 GLN 9 -14.050 8.443 -18.247 73 2HE2 GLN 9 HE21 GLN 9 -14.733 9.103 -19.732 74 H SER 10 HN SER 10 -16.370 3.003 -16.886 75 HA SER 10 HA SER 10 -18.954 2.023 -16.479 76 1HB SER 10 HB2 SER 10 -16.445 0.336 -16.452 77 2HB SER 10 HB3 SER 10 -18.072 -0.128 -16.978 78 HG SER 10 HG SER 10 -16.805 0.382 -18.783 79 H PHE 11 HN PHE 11 -16.369 2.436 -14.070 80 HA PHE 11 HA PHE 11 -17.295 0.712 -12.026 81 1HB PHE 11 HB2 PHE 11 -15.279 2.009 -11.654 82 2HB PHE 11 HB3 PHE 11 -16.097 3.502 -12.012 83 HD1 PHE 11 HD1 PHE 11 -17.219 4.768 -10.365 84 HD2 PHE 11 HD2 PHE 11 -15.831 0.775 -9.360 85 HE1 PHE 11 HE1 PHE 11 -17.593 5.223 -7.967 86 HE2 PHE 11 HE2 PHE 11 -16.129 1.317 -6.978 87 HZ PHE 11 HZ PHE 11 -17.012 3.510 -6.263 88 H SER 12 HN SER 12 -18.337 4.128 -12.757 89 HA SER 12 HA SER 12 -20.360 4.145 -10.811 90 1HB SER 12 HB2 SER 12 -20.441 5.613 -13.484 91 2HB SER 12 HB3 SER 12 -21.096 6.161 -11.933 92 HG SER 12 HG SER 12 -19.105 7.195 -12.419 93 H ALA 13 HN ALA 13 -20.436 3.282 -14.293 94 HA ALA 13 HA ALA 13 -23.214 3.105 -14.469 95 1HB ALA 13 HB1 ALA 13 -21.159 1.514 -16.066 96 2HB ALA 13 HB2 ALA 13 -22.821 1.889 -16.562 97 3HB ALA 13 HB3 ALA 13 -21.633 3.203 -16.390 98 H GLU 14 HN GLU 14 -20.835 0.637 -13.497 99 HA GLU 14 HA GLU 14 -22.778 -1.456 -13.228 100 1HB GLU 14 HB2 GLU 14 -19.857 -1.167 -12.458 101 2HB GLU 14 HB3 GLU 14 -20.780 -2.603 -12.040 102 1HG GLU 14 HG2 GLU 14 -20.375 -1.561 -14.866 103 2HG GLU 14 HG3 GLU 14 -19.496 -2.895 -14.123 104 H THR 15 HN THR 15 -21.973 1.210 -11.162 105 HA THR 15 HA THR 15 -22.774 -0.343 -8.764 106 HB THR 15 HB THR 15 -21.382 1.304 -7.511 107 HG1 THR 15 HG1 THR 15 -20.328 2.089 -9.969 108 1HG2 THR 15 HG21 THR 15 -20.135 -0.667 -8.001 109 2HG2 THR 15 HG22 THR 15 -19.950 -0.249 -9.715 110 3HG2 THR 15 HG23 THR 15 -19.103 0.692 -8.490 111 H SER 16 HN SER 16 -24.099 1.942 -10.812 112 HA SER 16 HA SER 16 -25.091 3.833 -8.893 113 1HB SER 16 HB2 SER 16 -25.916 3.253 -11.757 114 2HB SER 16 HB3 SER 16 -26.488 4.624 -10.784 115 HG SER 16 HG SER 16 -23.773 4.065 -11.450 116 H GLU 17 HN GLU 17 -26.021 0.628 -9.217 117 HA GLU 17 HA GLU 17 -28.659 1.169 -8.074 118 1HB GLU 17 HB2 GLU 17 -28.119 -0.579 -10.518 119 2HB GLU 17 HB3 GLU 17 -29.605 -0.666 -9.562 120 1HG GLU 17 HG2 GLU 17 -30.038 1.749 -10.069 121 2HG GLU 17 HG3 GLU 17 -28.625 1.753 -11.132 122 H GLY 18 HN GLY 18 -29.497 -0.647 -6.866 123 1HA GLY 18 HA2 GLY 18 -29.433 -2.437 -5.520 124 2HA GLY 18 HA3 GLY 18 -28.157 -3.129 -6.545 125 H VAL 19 HN VAL 19 -27.362 -3.928 -4.515 126 HA VAL 19 HA VAL 19 -25.500 -1.985 -3.245 127 HB VAL 19 HB VAL 19 -26.553 -4.495 -1.862 128 1HG1 VAL 19 HG11 VAL 19 -25.411 -3.466 0.101 129 2HG1 VAL 19 HG12 VAL 19 -24.277 -3.809 -1.200 130 3HG1 VAL 19 HG13 VAL 19 -24.830 -2.149 -0.927 131 1HG2 VAL 19 HG21 VAL 19 -27.496 -1.631 -1.779 132 2HG2 VAL 19 HG22 VAL 19 -28.438 -3.118 -1.871 133 3HG2 VAL 19 HG23 VAL 19 -27.654 -2.660 -0.354 134 H VAL 20 HN VAL 20 -23.513 -2.259 -3.406 135 HA VAL 20 HA VAL 20 -22.508 -4.561 -4.926 136 HB VAL 20 HB VAL 20 -23.395 -2.957 -6.541 137 1HG1 VAL 20 HG11 VAL 20 -22.503 -0.683 -6.750 138 2HG1 VAL 20 HG12 VAL 20 -23.302 -0.880 -5.210 139 3HG1 VAL 20 HG13 VAL 20 -21.520 -0.909 -5.301 140 1HG2 VAL 20 HG21 VAL 20 -21.294 -4.180 -7.098 141 2HG2 VAL 20 HG22 VAL 20 -21.480 -2.642 -7.943 142 3HG2 VAL 20 HG23 VAL 20 -20.358 -2.768 -6.569 143 H LEU 21 HN LEU 21 -20.403 -4.800 -4.719 144 HA LEU 21 HA LEU 21 -18.918 -3.162 -2.693 145 1HB LEU 21 HB2 LEU 21 -19.743 -5.330 -1.865 146 2HB LEU 21 HB3 LEU 21 -18.836 -6.174 -3.120 147 HG LEU 21 HG LEU 21 -17.246 -4.230 -1.496 148 1HD1 LEU 21 HD11 LEU 21 -18.442 -6.735 -0.227 149 2HD1 LEU 21 HD12 LEU 21 -17.117 -5.783 0.466 150 3HD1 LEU 21 HD13 LEU 21 -18.693 -5.039 0.259 151 1HD2 LEU 21 HD21 LEU 21 -16.805 -7.164 -2.147 152 2HD2 LEU 21 HD22 LEU 21 -16.178 -5.809 -3.112 153 3HD2 LEU 21 HD23 LEU 21 -15.602 -6.050 -1.466 154 H ALA 22 HN ALA 22 -17.536 -1.932 -3.918 155 HA ALA 22 HA ALA 22 -16.243 -3.224 -6.208 156 1HB ALA 22 HB1 ALA 22 -17.084 -0.899 -6.525 157 2HB ALA 22 HB2 ALA 22 -15.939 -0.355 -5.258 158 3HB ALA 22 HB3 ALA 22 -15.349 -1.046 -6.790 159 H ASP 23 HN ASP 23 -13.959 -3.408 -6.277 160 HA ASP 23 HA ASP 23 -12.516 -3.312 -3.679 161 1HB ASP 23 HB2 ASP 23 -13.475 -5.517 -3.722 162 2HB ASP 23 HB3 ASP 23 -12.974 -5.767 -5.396 163 H PHE 24 HN PHE 24 -10.193 -3.237 -4.065 164 HA PHE 24 HA PHE 24 -9.397 -2.511 -6.852 165 1HB PHE 24 HB2 PHE 24 -8.883 -1.112 -4.212 166 2HB PHE 24 HB3 PHE 24 -8.058 -0.726 -5.691 167 HD1 PHE 24 HD1 PHE 24 -11.614 -0.978 -4.347 168 HD2 PHE 24 HD2 PHE 24 -8.887 1.000 -7.022 169 HE1 PHE 24 HE1 PHE 24 -13.444 0.466 -5.133 170 HE2 PHE 24 HE2 PHE 24 -10.725 2.520 -7.742 171 HZ PHE 24 HZ PHE 24 -13.003 2.248 -6.813 172 H TRP 25 HN TRP 25 -7.811 -3.795 -7.500 173 HA TRP 25 HA TRP 25 -5.990 -5.129 -5.571 174 1HB TRP 25 HB2 TRP 25 -6.494 -7.231 -6.322 175 2HB TRP 25 HB3 TRP 25 -8.085 -6.493 -6.246 176 HD1 TRP 25 HD1 TRP 25 -8.796 -5.362 -8.797 177 HE1 TRP 25 HE1 TRP 25 -8.444 -6.234 -11.139 178 HE3 TRP 25 HE3 TRP 25 -5.316 -8.957 -7.743 179 HZ2 TRP 25 HZ2 TRP 25 -6.584 -8.101 -12.473 180 HZ3 TRP 25 HZ3 TRP 25 -4.206 -10.201 -9.568 181 HH2 TRP 25 HH2 TRP 25 -4.835 -9.777 -11.938 182 H ALA 26 HN ALA 26 -3.937 -5.752 -6.689 183 HA ALA 26 HA ALA 26 -3.663 -5.810 -9.484 184 1HB ALA 26 HB1 ALA 26 -3.648 -3.447 -9.688 185 2HB ALA 26 HB2 ALA 26 -2.781 -3.258 -8.152 186 3HB ALA 26 HB3 ALA 26 -1.934 -3.834 -9.601 187 HA PRO 27 HA PRO 27 -0.309 -8.246 -8.399 188 1HB PRO 27 HB2 PRO 27 1.512 -6.691 -10.245 189 2HB PRO 27 HB3 PRO 27 1.320 -8.467 -10.091 190 1HG PRO 27 HG2 PRO 27 0.048 -7.157 -12.087 191 2HG PRO 27 HG3 PRO 27 -0.859 -8.383 -11.136 192 1HD PRO 27 HD2 PRO 27 -0.896 -5.385 -10.857 193 2HD PRO 27 HD3 PRO 27 -2.253 -6.549 -10.851 194 H TRP 28 HN TRP 28 0.369 -4.829 -7.849 195 HA TRP 28 HA TRP 28 2.923 -4.811 -6.809 196 1HB TRP 28 HB2 TRP 28 0.711 -3.273 -5.462 197 2HB TRP 28 HB3 TRP 28 2.389 -2.829 -5.650 198 HD1 TRP 28 HD1 TRP 28 -0.874 -2.995 -7.526 199 HE1 TRP 28 HE1 TRP 28 -0.982 -1.151 -9.324 200 HE3 TRP 28 HE3 TRP 28 3.902 -1.283 -7.114 201 HZ2 TRP 28 HZ2 TRP 28 0.811 0.846 -10.390 202 HZ3 TRP 28 HZ3 TRP 28 4.658 0.661 -8.456 203 HH2 TRP 28 HH2 TRP 28 3.120 1.735 -10.091 204 H CYS 29 HN CYS 29 0.037 -6.085 -5.109 205 HA CYS 29 HA CYS 29 1.797 -6.540 -2.739 206 1HB CYS 29 HB2 CYS 29 -0.226 -4.617 -2.941 207 2HB CYS 29 HB3 CYS 29 -1.012 -5.923 -2.101 208 H GLY 30 HN GLY 30 0.946 -8.059 -1.157 209 1HA GLY 30 HA2 GLY 30 0.245 -10.564 -2.317 210 2HA GLY 30 HA3 GLY 30 0.342 -10.176 -0.596 211 HA PRO 31 HA PRO 31 -4.028 -9.899 0.029 212 1HB PRO 31 HB2 PRO 31 -4.162 -6.920 -0.456 213 2HB PRO 31 HB3 PRO 31 -5.031 -7.902 0.783 214 1HG PRO 31 HG2 PRO 31 -2.751 -6.599 1.488 215 2HG PRO 31 HG3 PRO 31 -2.975 -8.304 1.989 216 1HD PRO 31 HD2 PRO 31 -1.342 -7.209 -0.296 217 2HD PRO 31 HD3 PRO 31 -0.934 -8.519 0.850 218 H SER 32 HN SER 32 -3.100 -8.084 -2.947 219 HA SER 32 HA SER 32 -5.564 -8.193 -4.267 220 1HB SER 32 HB2 SER 32 -2.819 -8.696 -5.505 221 2HB SER 32 HB3 SER 32 -4.195 -7.861 -6.243 222 HG SER 32 HG SER 32 -2.460 -6.528 -5.404 223 H LYS 33 HN LYS 33 -3.428 -10.826 -3.485 224 HA LYS 33 HA LYS 33 -5.031 -12.620 -5.239 225 1HB LYS 33 HB2 LYS 33 -2.388 -13.394 -4.024 226 2HB LYS 33 HB3 LYS 33 -3.344 -14.189 -5.273 227 1HG LYS 33 HG2 LYS 33 -1.716 -13.262 -6.571 228 2HG LYS 33 HG3 LYS 33 -2.942 -11.990 -6.670 229 1HD LYS 33 HD2 LYS 33 -1.745 -10.741 -4.879 230 2HD LYS 33 HD3 LYS 33 -0.570 -12.056 -4.744 231 1HE LYS 33 HE2 LYS 33 0.072 -11.660 -7.152 232 2HE LYS 33 HE3 LYS 33 -1.033 -10.279 -7.181 233 1HZ LYS 33 HZ1 LYS 33 1.375 -10.564 -5.475 234 2HZ LYS 33 HZ2 LYS 33 1.188 -9.493 -6.693 235 3HZ LYS 33 HZ3 LYS 33 0.299 -9.333 -5.331 236 H MET 34 HN MET 34 -5.426 -11.517 -2.277 237 HA MET 34 HA MET 34 -6.203 -14.173 -1.130 238 1HB MET 34 HB2 MET 34 -5.274 -11.732 0.425 239 2HB MET 34 HB3 MET 34 -5.845 -13.263 1.094 240 1HG MET 34 HG2 MET 34 -3.967 -14.418 -0.145 241 2HG MET 34 HG3 MET 34 -3.319 -12.828 -0.546 242 1HE MET 34 HE1 MET 34 -2.192 -11.447 2.962 243 2HE MET 34 HE2 MET 34 -2.216 -11.168 1.209 244 3HE MET 34 HE3 MET 34 -3.730 -11.108 2.146 245 H ILE 35 HN ILE 35 -6.940 -10.616 -1.231 246 HA ILE 35 HA ILE 35 -9.626 -10.964 -0.396 247 HB ILE 35 HB ILE 35 -8.019 -8.825 -0.677 248 1HG1 ILE 35 HG12 ILE 35 -10.227 -7.412 -0.545 249 2HG1 ILE 35 HG13 ILE 35 -11.046 -8.978 -0.560 250 1HG2 ILE 35 HG21 ILE 35 -8.024 -8.789 -3.120 251 2HG2 ILE 35 HG22 ILE 35 -9.797 -8.541 -3.107 252 3HG2 ILE 35 HG23 ILE 35 -8.715 -7.323 -2.409 253 1HD1 ILE 35 HD11 ILE 35 -9.759 -9.676 1.440 254 2HD1 ILE 35 HD12 ILE 35 -8.805 -8.178 1.366 255 3HD1 ILE 35 HD13 ILE 35 -10.546 -8.112 1.741 256 H ALA 36 HN ALA 36 -7.993 -11.266 -3.550 257 HA ALA 36 HA ALA 36 -10.258 -11.345 -5.200 258 1HB ALA 36 HB1 ALA 36 -7.520 -12.650 -5.500 259 2HB ALA 36 HB2 ALA 36 -8.794 -12.757 -6.732 260 3HB ALA 36 HB3 ALA 36 -8.145 -11.183 -6.260 261 HA PRO 37 HA PRO 37 -10.759 -16.074 -4.587 262 1HB PRO 37 HB2 PRO 37 -9.630 -16.991 -2.112 263 2HB PRO 37 HB3 PRO 37 -9.139 -17.433 -3.781 264 1HG PRO 37 HG2 PRO 37 -7.929 -15.499 -1.882 265 2HG PRO 37 HG3 PRO 37 -7.149 -16.362 -3.235 266 1HD PRO 37 HD2 PRO 37 -7.788 -13.674 -3.330 267 2HD PRO 37 HD3 PRO 37 -7.734 -14.724 -4.762 268 H VAL 38 HN VAL 38 -10.379 -14.093 -1.590 269 HA VAL 38 HA VAL 38 -12.591 -15.108 -0.191 270 HB VAL 38 HB VAL 38 -10.982 -12.582 -0.218 271 1HG1 VAL 38 HG11 VAL 38 -13.064 -11.534 0.187 272 2HG1 VAL 38 HG12 VAL 38 -13.559 -12.797 1.327 273 3HG1 VAL 38 HG13 VAL 38 -12.232 -11.676 1.743 274 1HG2 VAL 38 HG21 VAL 38 -10.384 -13.319 2.012 275 2HG2 VAL 38 HG22 VAL 38 -11.626 -14.593 1.964 276 3HG2 VAL 38 HG23 VAL 38 -10.223 -14.676 0.877 277 H LEU 39 HN LEU 39 -12.479 -12.597 -2.747 278 HA LEU 39 HA LEU 39 -15.260 -11.934 -2.397 279 1HB LEU 39 HB2 LEU 39 -13.258 -11.415 -4.626 280 2HB LEU 39 HB3 LEU 39 -14.932 -10.891 -4.741 281 HG LEU 39 HG LEU 39 -13.124 -10.149 -2.379 282 1HD1 LEU 39 HD11 LEU 39 -12.769 -7.996 -3.419 283 2HD1 LEU 39 HD12 LEU 39 -12.132 -9.290 -4.436 284 3HD1 LEU 39 HD13 LEU 39 -13.665 -8.495 -4.875 285 1HD2 LEU 39 HD21 LEU 39 -15.706 -8.889 -3.341 286 2HD2 LEU 39 HD22 LEU 39 -15.514 -9.886 -1.882 287 3HD2 LEU 39 HD23 LEU 39 -14.688 -8.336 -1.993 288 H GLU 40 HN GLU 40 -13.512 -14.158 -4.657 289 HA GLU 40 HA GLU 40 -15.870 -14.810 -6.118 290 1HB GLU 40 HB2 GLU 40 -13.347 -16.438 -5.706 291 2HB GLU 40 HB3 GLU 40 -14.648 -16.760 -6.884 292 1HG GLU 40 HG2 GLU 40 -14.226 -14.614 -7.992 293 2HG GLU 40 HG3 GLU 40 -12.929 -14.252 -6.860 294 H GLU 41 HN GLU 41 -14.437 -16.064 -3.093 295 HA GLU 41 HA GLU 41 -16.342 -18.138 -2.657 296 1HB GLU 41 HB2 GLU 41 -14.397 -16.651 -0.875 297 2HB GLU 41 HB3 GLU 41 -15.461 -17.895 -0.248 298 1HG GLU 41 HG2 GLU 41 -13.453 -18.314 -2.502 299 2HG GLU 41 HG3 GLU 41 -13.170 -18.712 -0.810 300 H LEU 42 HN LEU 42 -16.510 -14.662 -2.252 301 HA LEU 42 HA LEU 42 -18.778 -14.790 -0.407 302 1HB LEU 42 HB2 LEU 42 -17.153 -12.905 -0.332 303 2HB LEU 42 HB3 LEU 42 -17.580 -12.468 -1.984 304 HG LEU 42 HG LEU 42 -19.900 -11.942 -1.296 305 1HD1 LEU 42 HD11 LEU 42 -20.403 -11.793 1.152 306 2HD1 LEU 42 HD12 LEU 42 -20.128 -13.462 0.659 307 3HD1 LEU 42 HD13 LEU 42 -18.829 -12.578 1.482 308 1HD2 LEU 42 HD21 LEU 42 -17.793 -10.589 0.435 309 2HD2 LEU 42 HD22 LEU 42 -18.148 -10.169 -1.253 310 3HD2 LEU 42 HD23 LEU 42 -19.381 -9.918 -0.006 311 H ASP 43 HN ASP 43 -18.193 -14.199 -3.902 312 HA ASP 43 HA ASP 43 -20.873 -13.444 -4.471 313 1HB ASP 43 HB2 ASP 43 -19.049 -12.901 -6.000 314 2HB ASP 43 HB3 ASP 43 -18.692 -14.611 -6.240 315 H GLN 44 HN GLN 44 -19.242 -16.601 -4.518 316 HA GLN 44 HA GLN 44 -21.557 -17.976 -5.488 317 1HB GLN 44 HB2 GLN 44 -20.317 -19.967 -5.168 318 2HB GLN 44 HB3 GLN 44 -19.215 -18.702 -5.728 319 1HG GLN 44 HG2 GLN 44 -18.521 -18.372 -3.307 320 2HG GLN 44 HG3 GLN 44 -19.460 -19.808 -2.898 321 1HE2 GLN 44 HE22 GLN 44 -16.773 -18.618 -4.961 322 2HE2 GLN 44 HE21 GLN 44 -15.923 -20.156 -5.051 323 H GLU 45 HN GLU 45 -21.164 -16.461 -2.496 324 HA GLU 45 HA GLU 45 -22.759 -18.408 -1.045 325 1HB GLU 45 HB2 GLU 45 -20.879 -18.116 0.255 326 2HB GLU 45 HB3 GLU 45 -20.544 -16.542 -0.421 327 1HG GLU 45 HG2 GLU 45 -20.921 -16.195 1.837 328 2HG GLU 45 HG3 GLU 45 -22.246 -15.486 0.951 329 H MET 46 HN MET 46 -22.556 -14.931 -1.797 330 HA MET 46 HA MET 46 -25.483 -14.726 -1.253 331 1HB MET 46 HB2 MET 46 -25.029 -12.626 -0.160 332 2HB MET 46 HB3 MET 46 -24.266 -13.960 0.701 333 1HG MET 46 HG2 MET 46 -22.265 -13.037 0.525 334 2HG MET 46 HG3 MET 46 -22.351 -12.952 -1.229 335 1HE MET 46 HE1 MET 46 -23.837 -9.669 1.582 336 2HE MET 46 HE2 MET 46 -24.938 -10.915 0.914 337 3HE MET 46 HE3 MET 46 -23.551 -11.398 1.948 338 H GLY 47 HN GLY 47 -23.549 -14.716 -3.770 339 1HA GLY 47 HA2 GLY 47 -23.885 -12.100 -4.869 340 2HA GLY 47 HA3 GLY 47 -23.543 -13.606 -5.776 341 H ASP 48 HN ASP 48 -26.241 -14.157 -4.063 342 HA ASP 48 HA ASP 48 -28.105 -13.781 -6.232 343 1HB ASP 48 HB2 ASP 48 -28.369 -15.685 -4.713 344 2HB ASP 48 HB3 ASP 48 -28.465 -14.598 -3.328 345 H LYS 49 HN LYS 49 -26.991 -11.912 -3.466 346 HA LYS 49 HA LYS 49 -29.172 -9.991 -3.896 347 1HB LYS 49 HB2 LYS 49 -27.463 -10.146 -1.415 348 2HB LYS 49 HB3 LYS 49 -29.101 -9.528 -1.614 349 1HG LYS 49 HG2 LYS 49 -29.666 -11.394 -0.524 350 2HG LYS 49 HG3 LYS 49 -29.579 -12.146 -2.130 351 1HD LYS 49 HD2 LYS 49 -27.506 -13.180 -1.664 352 2HD LYS 49 HD3 LYS 49 -27.120 -12.020 -0.388 353 1HE LYS 49 HE2 LYS 49 -27.549 -14.126 0.630 354 2HE LYS 49 HE3 LYS 49 -28.783 -12.961 1.094 355 1HZ LYS 49 HZ1 LYS 49 -30.275 -14.009 -0.556 356 2HZ LYS 49 HZ2 LYS 49 -29.131 -15.124 -0.917 357 3HZ LYS 49 HZ3 LYS 49 -29.787 -15.078 0.569 358 H LEU 50 HN LEU 50 -25.768 -10.400 -4.265 359 HA LEU 50 HA LEU 50 -25.258 -7.498 -4.172 360 1HB LEU 50 HB2 LEU 50 -24.783 -8.564 -2.093 361 2HB LEU 50 HB3 LEU 50 -23.967 -9.908 -2.862 362 HG LEU 50 HG LEU 50 -22.638 -8.336 -1.519 363 1HD1 LEU 50 HD11 LEU 50 -21.618 -9.957 -2.980 364 2HD1 LEU 50 HD12 LEU 50 -21.648 -8.809 -4.327 365 3HD1 LEU 50 HD13 LEU 50 -20.669 -8.470 -2.878 366 1HD2 LEU 50 HD21 LEU 50 -23.533 -6.199 -2.198 367 2HD2 LEU 50 HD22 LEU 50 -21.785 -6.268 -2.530 368 3HD2 LEU 50 HD23 LEU 50 -22.935 -6.420 -3.840 369 H LYS 51 HN LYS 51 -23.597 -6.762 -5.453 370 HA LYS 51 HA LYS 51 -22.461 -8.577 -7.559 371 1HB LYS 51 HB2 LYS 51 -24.064 -6.853 -8.434 372 2HB LYS 51 HB3 LYS 51 -23.089 -5.590 -7.691 373 1HG LYS 51 HG2 LYS 51 -21.133 -6.429 -9.165 374 2HG LYS 51 HG3 LYS 51 -22.324 -7.409 -10.017 375 1HD LYS 51 HD2 LYS 51 -22.310 -4.372 -9.716 376 2HD LYS 51 HD3 LYS 51 -21.789 -5.272 -11.141 377 1HE LYS 51 HE2 LYS 51 -24.097 -6.170 -11.419 378 2HE LYS 51 HE3 LYS 51 -24.624 -5.225 -10.015 379 1HZ LYS 51 HZ1 LYS 51 -25.083 -4.041 -12.063 380 2HZ LYS 51 HZ2 LYS 51 -23.927 -3.218 -11.221 381 3HZ LYS 51 HZ3 LYS 51 -23.503 -4.111 -12.528 382 H ILE 52 HN ILE 52 -20.145 -8.275 -7.977 383 HA ILE 52 HA ILE 52 -18.753 -6.463 -6.081 384 HB ILE 52 HB ILE 52 -18.056 -9.296 -6.909 385 1HG1 ILE 52 HG12 ILE 52 -17.884 -8.144 -4.108 386 2HG1 ILE 52 HG13 ILE 52 -19.454 -8.509 -4.778 387 1HG2 ILE 52 HG21 ILE 52 -16.182 -7.257 -5.609 388 2HG2 ILE 52 HG22 ILE 52 -15.871 -8.998 -5.722 389 3HG2 ILE 52 HG23 ILE 52 -15.963 -8.041 -7.192 390 1HD1 ILE 52 HD11 ILE 52 -18.726 -10.396 -3.480 391 2HD1 ILE 52 HD12 ILE 52 -18.821 -10.842 -5.185 392 3HD1 ILE 52 HD13 ILE 52 -17.234 -10.544 -4.438 393 H VAL 53 HN VAL 53 -17.120 -5.202 -7.072 394 HA VAL 53 HA VAL 53 -16.689 -5.681 -9.979 395 HB VAL 53 HB VAL 53 -17.234 -2.894 -8.896 396 1HG1 VAL 53 HG11 VAL 53 -17.224 -4.096 -11.693 397 2HG1 VAL 53 HG12 VAL 53 -17.539 -2.401 -11.271 398 3HG1 VAL 53 HG13 VAL 53 -15.941 -3.119 -10.945 399 1HG2 VAL 53 HG21 VAL 53 -19.463 -2.953 -9.917 400 2HG2 VAL 53 HG22 VAL 53 -19.287 -4.687 -10.262 401 3HG2 VAL 53 HG23 VAL 53 -19.353 -4.105 -8.590 402 H LYS 54 HN LYS 54 -14.508 -6.037 -10.144 403 HA LYS 54 HA LYS 54 -12.757 -4.801 -8.124 404 1HB LYS 54 HB2 LYS 54 -12.256 -6.882 -10.271 405 2HB LYS 54 HB3 LYS 54 -10.963 -6.135 -9.319 406 1HG LYS 54 HG2 LYS 54 -12.103 -6.864 -7.207 407 2HG LYS 54 HG3 LYS 54 -13.339 -7.658 -8.175 408 1HD LYS 54 HD2 LYS 54 -11.944 -9.438 -7.661 409 2HD LYS 54 HD3 LYS 54 -11.362 -8.972 -9.253 410 1HE LYS 54 HE2 LYS 54 -9.350 -9.209 -8.106 411 2HE LYS 54 HE3 LYS 54 -9.626 -7.479 -7.901 412 1HZ LYS 54 HZ1 LYS 54 -10.327 -7.778 -5.718 413 2HZ LYS 54 HZ2 LYS 54 -10.463 -9.419 -5.860 414 3HZ LYS 54 HZ3 LYS 54 -8.989 -8.689 -5.866 415 H ILE 55 HN ILE 55 -11.046 -3.428 -8.671 416 HA ILE 55 HA ILE 55 -10.976 -2.177 -11.371 417 HB ILE 55 HB ILE 55 -10.723 -1.020 -8.557 418 1HG1 ILE 55 HG12 ILE 55 -12.888 -0.773 -9.805 419 2HG1 ILE 55 HG13 ILE 55 -12.146 0.692 -9.193 420 1HG2 ILE 55 HG21 ILE 55 -9.669 1.022 -9.584 421 2HG2 ILE 55 HG22 ILE 55 -8.651 -0.419 -9.519 422 3HG2 ILE 55 HG23 ILE 55 -9.372 0.051 -11.051 423 1HD1 ILE 55 HD11 ILE 55 -11.276 1.266 -11.434 424 2HD1 ILE 55 HD12 ILE 55 -12.034 -0.194 -12.098 425 3HD1 ILE 55 HD13 ILE 55 -13.020 1.120 -11.396 426 H ASP 56 HN ASP 56 -9.100 -2.829 -12.328 427 HA ASP 56 HA ASP 56 -6.910 -4.059 -10.787 428 1HB ASP 56 HB2 ASP 56 -7.472 -4.927 -13.018 429 2HB ASP 56 HB3 ASP 56 -7.134 -3.353 -13.738 430 H VAL 57 HN VAL 57 -5.862 -2.523 -9.528 431 HA VAL 57 HA VAL 57 -5.657 0.175 -10.442 432 HB VAL 57 HB VAL 57 -4.602 0.727 -8.407 433 1HG1 VAL 57 HG11 VAL 57 -7.093 -0.939 -7.998 434 2HG1 VAL 57 HG12 VAL 57 -6.515 0.386 -6.961 435 3HG1 VAL 57 HG13 VAL 57 -7.014 0.741 -8.619 436 1HG2 VAL 57 HG21 VAL 57 -3.373 -1.221 -7.746 437 2HG2 VAL 57 HG22 VAL 57 -4.569 -0.867 -6.488 438 3HG2 VAL 57 HG23 VAL 57 -4.866 -2.187 -7.619 439 H ASP 58 HN ASP 58 -4.462 -1.157 -12.336 440 HA ASP 58 HA ASP 58 -2.048 0.470 -12.460 441 1HB ASP 58 HB2 ASP 58 -1.016 -1.615 -11.672 442 2HB ASP 58 HB3 ASP 58 -1.917 -2.560 -12.861 443 H GLU 59 HN GLU 59 -4.198 -1.989 -14.068 444 HA GLU 59 HA GLU 59 -3.784 -0.768 -16.698 445 1HB GLU 59 HB2 GLU 59 -4.052 -2.981 -17.020 446 2HB GLU 59 HB3 GLU 59 -4.965 -3.225 -15.538 447 1HG GLU 59 HG2 GLU 59 -6.979 -2.400 -16.510 448 2HG GLU 59 HG3 GLU 59 -6.149 -2.013 -18.031 449 H ASN 60 HN ASN 60 -6.158 -0.637 -14.089 450 HA ASN 60 HA ASN 60 -7.816 1.292 -15.611 451 1HB ASN 60 HB2 ASN 60 -8.601 -1.346 -14.346 452 2HB ASN 60 HB3 ASN 60 -9.778 -0.046 -14.349 453 1HD2 ASN 60 HD22 ASN 60 -9.695 -2.698 -15.875 454 2HD2 ASN 60 HD21 ASN 60 -10.007 -2.201 -17.516 455 H GLN 61 HN GLN 61 -5.820 1.819 -13.680 456 HA GLN 61 HA GLN 61 -6.979 1.941 -11.090 457 1HB GLN 61 HB2 GLN 61 -4.894 2.781 -10.334 458 2HB GLN 61 HB3 GLN 61 -4.552 1.636 -11.628 459 1HG GLN 61 HG2 GLN 61 -4.243 3.525 -13.218 460 2HG GLN 61 HG3 GLN 61 -4.394 4.630 -11.850 461 1HE2 GLN 61 HE22 GLN 61 -2.889 3.708 -9.801 462 2HE2 GLN 61 HE21 GLN 61 -1.247 3.421 -10.271 463 H GLU 62 HN GLU 62 -7.487 3.903 -13.743 464 HA GLU 62 HA GLU 62 -7.277 6.553 -12.980 465 1HB GLU 62 HB2 GLU 62 -9.158 4.981 -14.763 466 2HB GLU 62 HB3 GLU 62 -9.325 6.733 -14.598 467 1HG GLU 62 HG2 GLU 62 -8.049 6.307 -16.566 468 2HG GLU 62 HG3 GLU 62 -6.993 7.041 -15.362 469 H THR 63 HN THR 63 -10.169 4.389 -12.470 470 HA THR 63 HA THR 63 -11.774 6.229 -11.123 471 HB THR 63 HB THR 63 -11.439 3.255 -10.602 472 HG1 THR 63 HG1 THR 63 -13.136 3.158 -12.223 473 1HG2 THR 63 HG21 THR 63 -12.894 4.293 -8.884 474 2HG2 THR 63 HG22 THR 63 -13.911 4.984 -10.173 475 3HG2 THR 63 HG23 THR 63 -13.784 3.220 -9.944 476 H ALA 64 HN ALA 64 -9.073 4.275 -9.936 477 HA ALA 64 HA ALA 64 -9.719 4.525 -7.156 478 1HB ALA 64 HB1 ALA 64 -8.373 2.691 -8.327 479 2HB ALA 64 HB2 ALA 64 -7.028 3.808 -8.419 480 3HB ALA 64 HB3 ALA 64 -7.660 3.327 -6.832 481 H GLY 65 HN GLY 65 -6.867 5.751 -8.933 482 1HA GLY 65 HA2 GLY 65 -6.011 7.823 -7.376 483 2HA GLY 65 HA3 GLY 65 -6.018 7.888 -9.154 484 H LYS 66 HN LYS 66 -8.778 8.096 -9.713 485 HA LYS 66 HA LYS 66 -9.252 10.859 -9.281 486 1HB LYS 66 HB2 LYS 66 -10.095 9.642 -11.203 487 2HB LYS 66 HB3 LYS 66 -11.080 8.596 -10.165 488 1HG LYS 66 HG2 LYS 66 -12.540 10.441 -9.566 489 2HG LYS 66 HG3 LYS 66 -11.457 11.609 -10.344 490 1HD LYS 66 HD2 LYS 66 -13.390 11.189 -11.751 491 2HD LYS 66 HD3 LYS 66 -11.911 10.615 -12.538 492 1HE LYS 66 HE2 LYS 66 -12.497 8.275 -11.675 493 2HE LYS 66 HE3 LYS 66 -14.057 8.939 -11.158 494 1HZ LYS 66 HZ1 LYS 66 -12.996 8.751 -13.923 495 2HZ LYS 66 HZ2 LYS 66 -14.247 7.939 -13.327 496 3HZ LYS 66 HZ3 LYS 66 -14.392 9.564 -13.540 497 H TYR 67 HN TYR 67 -10.616 7.950 -7.584 498 HA TYR 67 HA TYR 67 -12.408 9.591 -6.070 499 1HB TYR 67 HB2 TYR 67 -11.789 6.680 -6.241 500 2HB TYR 67 HB3 TYR 67 -12.334 7.236 -4.679 501 HD1 TYR 67 HD1 TYR 67 -13.293 7.366 -8.317 502 HD2 TYR 67 HD2 TYR 67 -14.603 7.656 -4.217 503 HE1 TYR 67 HE1 TYR 67 -15.644 7.527 -9.084 504 HE2 TYR 67 HE2 TYR 67 -16.950 7.823 -4.968 505 HH TYR 67 HH TYR 67 -18.390 7.937 -6.797 506 H GLY 68 HN GLY 68 -9.076 8.644 -5.691 507 1HA GLY 68 HA2 GLY 68 -7.597 9.696 -4.133 508 2HA GLY 68 HA3 GLY 68 -8.944 9.966 -3.007 509 H VAL 69 HN VAL 69 -7.154 7.350 -4.733 510 HA VAL 69 HA VAL 69 -7.217 5.526 -2.486 511 HB VAL 69 HB VAL 69 -8.506 4.861 -5.193 512 1HG1 VAL 69 HG11 VAL 69 -7.060 3.045 -4.624 513 2HG1 VAL 69 HG12 VAL 69 -7.660 3.028 -2.966 514 3HG1 VAL 69 HG13 VAL 69 -8.729 2.560 -4.324 515 1HG2 VAL 69 HG21 VAL 69 -9.728 4.780 -2.432 516 2HG2 VAL 69 HG22 VAL 69 -10.161 5.866 -3.770 517 3HG2 VAL 69 HG23 VAL 69 -10.465 4.137 -3.926 518 H MET 70 HN MET 70 -5.151 4.734 -2.565 519 HA MET 70 HA MET 70 -3.713 4.608 -5.124 520 1HB MET 70 HB2 MET 70 -1.893 5.970 -4.414 521 2HB MET 70 HB3 MET 70 -3.380 6.916 -4.506 522 1HG MET 70 HG2 MET 70 -3.627 6.944 -2.122 523 2HG MET 70 HG3 MET 70 -2.345 5.733 -1.935 524 1HE MET 70 HE1 MET 70 0.924 7.474 -2.611 525 2HE MET 70 HE2 MET 70 0.148 6.201 -1.652 526 3HE MET 70 HE3 MET 70 -0.028 6.244 -3.424 527 H SER 71 HN SER 71 -4.737 2.791 -2.882 528 HA SER 71 HA SER 71 -2.221 1.561 -2.004 529 1HB SER 71 HB2 SER 71 -3.908 1.115 0.033 530 2HB SER 71 HB3 SER 71 -2.929 2.571 -0.108 531 HG SER 71 HG SER 71 -5.704 2.239 -0.657 532 H ILE 72 HN ILE 72 -2.461 -0.732 -1.330 533 HA ILE 72 HA ILE 72 -4.832 -1.996 -2.515 534 HB ILE 72 HB ILE 72 -2.552 -3.795 -2.373 535 1HG1 ILE 72 HG12 ILE 72 -1.243 -1.824 -3.010 536 2HG1 ILE 72 HG13 ILE 72 -1.221 -3.135 -4.163 537 1HG2 ILE 72 HG21 ILE 72 -4.635 -3.172 -4.458 538 2HG2 ILE 72 HG22 ILE 72 -3.300 -4.310 -4.723 539 3HG2 ILE 72 HG23 ILE 72 -4.442 -4.620 -3.420 540 1HD1 ILE 72 HD11 ILE 72 -3.005 -0.711 -4.604 541 2HD1 ILE 72 HD12 ILE 72 -1.329 -0.864 -5.147 542 3HD1 ILE 72 HD13 ILE 72 -2.549 -2.007 -5.731 543 HA PRO 73 HA PRO 73 -6.140 -3.537 -2.192 544 1HB PRO 73 HB2 PRO 73 -8.042 -4.850 -0.855 545 2HB PRO 73 HB3 PRO 73 -6.533 -5.688 -1.345 546 1HG PRO 73 HG2 PRO 73 -7.263 -4.545 1.347 547 2HG PRO 73 HG3 PRO 73 -6.501 -6.119 0.994 548 1HD PRO 73 HD2 PRO 73 -5.122 -3.774 1.720 549 2HD PRO 73 HD3 PRO 73 -4.379 -5.117 0.823 550 H THR 74 HN THR 74 -7.909 -2.175 -2.520 551 HA THR 74 HA THR 74 -8.945 -0.676 -0.137 552 HB THR 74 HB THR 74 -8.567 0.502 -2.905 553 HG1 THR 74 HG1 THR 74 -6.696 0.583 -1.868 554 1HG2 THR 74 HG21 THR 74 -9.386 2.607 -1.626 555 2HG2 THR 74 HG22 THR 74 -10.618 1.437 -2.124 556 3HG2 THR 74 HG23 THR 74 -10.057 1.489 -0.447 557 H LEU 75 HN LEU 75 -11.209 -0.357 -0.127 558 HA LEU 75 HA LEU 75 -12.826 -1.990 -2.011 559 1HB LEU 75 HB2 LEU 75 -11.725 -3.336 -0.117 560 2HB LEU 75 HB3 LEU 75 -12.708 -2.409 1.006 561 HG LEU 75 HG LEU 75 -13.799 -4.135 -1.270 562 1HD1 LEU 75 HD11 LEU 75 -14.320 -5.779 0.527 563 2HD1 LEU 75 HD12 LEU 75 -12.581 -5.543 0.296 564 3HD1 LEU 75 HD13 LEU 75 -13.422 -4.791 1.687 565 1HD2 LEU 75 HD21 LEU 75 -15.071 -2.572 1.001 566 2HD2 LEU 75 HD22 LEU 75 -15.509 -2.648 -0.734 567 3HD2 LEU 75 HD23 LEU 75 -15.854 -4.004 0.345 568 H LEU 76 HN LEU 76 -14.666 -0.929 -2.417 569 HA LEU 76 HA LEU 76 -15.488 1.285 -0.656 570 1HB LEU 76 HB2 LEU 76 -15.672 1.339 -3.692 571 2HB LEU 76 HB3 LEU 76 -16.159 2.595 -2.572 572 HG LEU 76 HG LEU 76 -13.308 1.765 -3.275 573 1HD1 LEU 76 HD11 LEU 76 -13.187 3.984 -4.285 574 2HD1 LEU 76 HD12 LEU 76 -14.528 3.068 -4.990 575 3HD1 LEU 76 HD13 LEU 76 -14.859 4.336 -3.793 576 1HD2 LEU 76 HD21 LEU 76 -12.544 3.652 -1.910 577 2HD2 LEU 76 HD22 LEU 76 -14.208 3.974 -1.383 578 3HD2 LEU 76 HD23 LEU 76 -13.381 2.471 -0.904 579 H VAL 77 HN VAL 77 -17.369 0.419 0.208 580 HA VAL 77 HA VAL 77 -19.080 -1.354 -1.466 581 HB VAL 77 HB VAL 77 -19.649 -0.505 1.385 582 1HG1 VAL 77 HG11 VAL 77 -20.474 -2.959 -0.222 583 2HG1 VAL 77 HG12 VAL 77 -20.958 -2.572 1.447 584 3HG1 VAL 77 HG13 VAL 77 -21.503 -1.551 0.115 585 1HG2 VAL 77 HG21 VAL 77 -17.949 -2.842 0.461 586 2HG2 VAL 77 HG22 VAL 77 -17.462 -1.532 1.557 587 3HG2 VAL 77 HG23 VAL 77 -18.665 -2.715 2.080 588 H LEU 78 HN LEU 78 -20.978 -0.589 -2.376 589 HA LEU 78 HA LEU 78 -21.820 2.167 -1.705 590 1HB LEU 78 HB2 LEU 78 -21.770 1.166 -4.577 591 2HB LEU 78 HB3 LEU 78 -22.214 2.734 -3.994 592 HG LEU 78 HG LEU 78 -19.645 2.711 -3.126 593 1HD1 LEU 78 HD11 LEU 78 -19.562 1.107 -5.727 594 2HD1 LEU 78 HD12 LEU 78 -18.179 1.659 -4.759 595 3HD1 LEU 78 HD13 LEU 78 -19.261 0.411 -4.130 596 1HD2 LEU 78 HD21 LEU 78 -20.681 4.438 -4.560 597 2HD2 LEU 78 HD22 LEU 78 -19.080 3.994 -5.154 598 3HD2 LEU 78 HD23 LEU 78 -20.530 3.370 -5.972 599 H LYS 79 HN LYS 79 -24.048 2.600 -2.300 600 HA LYS 79 HA LYS 79 -25.597 0.351 -3.263 601 1HB LYS 79 HB2 LYS 79 -27.373 0.568 -1.577 602 2HB LYS 79 HB3 LYS 79 -25.866 -0.094 -0.929 603 1HG LYS 79 HG2 LYS 79 -25.344 2.163 0.009 604 2HG LYS 79 HG3 LYS 79 -26.939 2.727 -0.497 605 1HD LYS 79 HD2 LYS 79 -26.446 0.349 1.363 606 2HD LYS 79 HD3 LYS 79 -26.814 1.989 1.918 607 1HE LYS 79 HE2 LYS 79 -28.964 1.960 0.763 608 2HE LYS 79 HE3 LYS 79 -28.630 0.345 0.115 609 1HZ LYS 79 HZ1 LYS 79 -28.605 -0.505 2.387 610 2HZ LYS 79 HZ2 LYS 79 -28.947 0.987 2.988 611 3HZ LYS 79 HZ3 LYS 79 -30.038 0.215 2.058 612 H ASP 80 HN ASP 80 -27.255 1.038 -4.465 613 HA ASP 80 HA ASP 80 -28.186 2.328 -5.994 614 1HB ASP 80 HB2 ASP 80 -29.657 2.514 -4.000 615 2HB ASP 80 HB3 ASP 80 -28.889 4.048 -3.590 616 H GLY 81 HN GLY 81 -25.345 3.004 -5.604 617 1HA GLY 81 HA2 GLY 81 -24.088 4.251 -7.055 618 2HA GLY 81 HA3 GLY 81 -25.353 5.487 -7.178 619 H GLU 82 HN GLU 82 -24.602 4.749 -3.905 620 HA GLU 82 HA GLU 82 -22.454 6.761 -3.811 621 1HB GLU 82 HB2 GLU 82 -23.496 7.954 -2.119 622 2HB GLU 82 HB3 GLU 82 -24.791 7.582 -3.282 623 1HG GLU 82 HG2 GLU 82 -25.534 5.724 -1.802 624 2HG GLU 82 HG3 GLU 82 -24.283 6.179 -0.634 625 H VAL 83 HN VAL 83 -20.939 6.565 -2.131 626 HA VAL 83 HA VAL 83 -20.411 3.841 -1.225 627 HB VAL 83 HB VAL 83 -19.031 6.471 -0.512 628 1HG1 VAL 83 HG11 VAL 83 -17.077 5.052 0.067 629 2HG1 VAL 83 HG12 VAL 83 -18.458 4.646 1.078 630 3HG1 VAL 83 HG13 VAL 83 -18.024 3.595 -0.284 631 1HG2 VAL 83 HG21 VAL 83 -18.227 4.452 -2.654 632 2HG2 VAL 83 HG22 VAL 83 -18.893 6.069 -2.969 633 3HG2 VAL 83 HG23 VAL 83 -17.324 5.900 -2.184 634 H VAL 84 HN VAL 84 -20.788 2.981 0.645 635 HA VAL 84 HA VAL 84 -21.848 4.647 2.873 636 HB VAL 84 HB VAL 84 -23.379 2.776 3.410 637 1HG1 VAL 84 HG11 VAL 84 -24.082 4.877 2.249 638 2HG1 VAL 84 HG12 VAL 84 -23.937 4.027 0.697 639 3HG1 VAL 84 HG13 VAL 84 -25.118 3.493 1.914 640 1HG2 VAL 84 HG21 VAL 84 -22.295 0.960 2.084 641 2HG2 VAL 84 HG22 VAL 84 -24.022 1.126 1.752 642 3HG2 VAL 84 HG23 VAL 84 -22.840 1.755 0.589 643 H GLU 85 HN GLU 85 -19.621 2.140 1.840 644 HA GLU 85 HA GLU 85 -18.458 2.340 4.455 645 1HB GLU 85 HB2 GLU 85 -19.709 -0.194 3.526 646 2HB GLU 85 HB3 GLU 85 -18.012 -0.387 3.967 647 1HG GLU 85 HG2 GLU 85 -20.094 0.932 5.705 648 2HG GLU 85 HG3 GLU 85 -19.672 -0.783 5.785 649 H THR 86 HN THR 86 -16.263 1.542 4.495 650 HA THR 86 HA THR 86 -14.912 1.467 1.880 651 HB THR 86 HB THR 86 -13.771 3.520 3.655 652 HG1 THR 86 HG1 THR 86 -15.858 4.123 4.112 653 1HG2 THR 86 HG21 THR 86 -14.715 3.587 0.789 654 2HG2 THR 86 HG22 THR 86 -13.676 4.807 1.570 655 3HG2 THR 86 HG23 THR 86 -13.071 3.158 1.344 656 H SER 87 HN SER 87 -12.788 0.599 2.076 657 HA SER 87 HA SER 87 -11.521 0.443 4.700 658 1HB SER 87 HB2 SER 87 -12.380 -2.040 3.157 659 2HB SER 87 HB3 SER 87 -11.065 -2.052 4.347 660 HG SER 87 HG SER 87 -13.458 -0.833 5.098 661 H VAL 88 HN VAL 88 -9.329 0.195 4.517 662 HA VAL 88 HA VAL 88 -8.073 0.120 1.835 663 HB VAL 88 HB VAL 88 -7.719 2.299 3.943 664 1HG1 VAL 88 HG11 VAL 88 -5.529 1.912 3.158 665 2HG1 VAL 88 HG12 VAL 88 -6.085 1.541 1.506 666 3HG1 VAL 88 HG13 VAL 88 -6.095 3.215 2.123 667 1HG2 VAL 88 HG21 VAL 88 -9.642 2.665 2.422 668 2HG2 VAL 88 HG22 VAL 88 -8.346 3.812 2.092 669 3HG2 VAL 88 HG23 VAL 88 -8.572 2.410 1.026 670 H GLY 89 HN GLY 89 -8.045 -2.036 2.661 671 1HA GLY 89 HA2 GLY 89 -5.845 -3.161 3.793 672 2HA GLY 89 HA3 GLY 89 -6.814 -2.737 5.217 673 H PHE 90 HN PHE 90 -6.255 -5.432 4.548 674 HA PHE 90 HA PHE 90 -8.335 -6.545 2.909 675 1HB PHE 90 HB2 PHE 90 -7.311 -8.704 3.469 676 2HB PHE 90 HB3 PHE 90 -6.128 -7.537 2.934 677 HD1 PHE 90 HD1 PHE 90 -4.299 -6.833 4.359 678 HD2 PHE 90 HD2 PHE 90 -7.436 -9.365 5.912 679 HE1 PHE 90 HE1 PHE 90 -2.948 -7.272 6.391 680 HE2 PHE 90 HE2 PHE 90 -6.077 -9.797 7.939 681 HZ PHE 90 HZ PHE 90 -3.833 -8.751 8.187 682 H LYS 91 HN LYS 91 -9.667 -8.453 3.718 683 HA LYS 91 HA LYS 91 -10.406 -8.478 6.541 684 1HB LYS 91 HB2 LYS 91 -12.029 -7.093 4.509 685 2HB LYS 91 HB3 LYS 91 -12.909 -8.479 5.145 686 1HG LYS 91 HG2 LYS 91 -12.778 -7.692 7.383 687 2HG LYS 91 HG3 LYS 91 -11.605 -6.448 6.995 688 1HD LYS 91 HD2 LYS 91 -14.362 -6.461 5.720 689 2HD LYS 91 HD3 LYS 91 -14.142 -5.841 7.352 690 1HE LYS 91 HE2 LYS 91 -12.578 -4.822 4.929 691 2HE LYS 91 HE3 LYS 91 -14.053 -4.082 5.547 692 1HZ LYS 91 HZ1 LYS 91 -12.887 -3.761 7.686 693 2HZ LYS 91 HZ2 LYS 91 -11.482 -4.244 6.979 694 3HZ LYS 91 HZ3 LYS 91 -12.288 -2.915 6.428 695 HA PRO 92 HA PRO 92 -10.749 -12.752 5.045 696 1HB PRO 92 HB2 PRO 92 -11.957 -13.979 7.171 697 2HB PRO 92 HB3 PRO 92 -10.255 -13.425 7.219 698 1HG PRO 92 HG2 PRO 92 -12.717 -11.975 8.238 699 2HG PRO 92 HG3 PRO 92 -11.182 -12.285 9.113 700 1HD PRO 92 HD2 PRO 92 -11.597 -9.905 7.868 701 2HD PRO 92 HD3 PRO 92 -9.997 -10.688 7.820 702 H LYS 93 HN LYS 93 -12.535 -14.342 4.594 703 HA LYS 93 HA LYS 93 -14.588 -13.289 3.078 704 1HB LYS 93 HB2 LYS 93 -13.914 -15.516 2.705 705 2HB LYS 93 HB3 LYS 93 -14.074 -15.953 4.399 706 1HG LYS 93 HG2 LYS 93 -15.733 -17.090 3.152 707 2HG LYS 93 HG3 LYS 93 -16.503 -15.954 4.247 708 1HD LYS 93 HD2 LYS 93 -16.801 -14.375 2.267 709 2HD LYS 93 HD3 LYS 93 -16.196 -15.659 1.211 710 1HE LYS 93 HE2 LYS 93 -18.533 -15.967 3.170 711 2HE LYS 93 HE3 LYS 93 -18.754 -15.499 1.487 712 1HZ LYS 93 HZ1 LYS 93 -19.029 -17.925 1.967 713 2HZ LYS 93 HZ2 LYS 93 -17.986 -17.591 0.755 714 3HZ LYS 93 HZ3 LYS 93 -17.431 -18.041 2.244 715 H GLU 94 HN GLU 94 -14.966 -14.428 6.484 716 HA GLU 94 HA GLU 94 -17.742 -13.886 6.470 717 1HB GLU 94 HB2 GLU 94 -15.752 -14.026 8.781 718 2HB GLU 94 HB3 GLU 94 -17.516 -13.945 8.976 719 1HG GLU 94 HG2 GLU 94 -17.753 -16.062 7.679 720 2HG GLU 94 HG3 GLU 94 -15.998 -16.170 7.532 721 H ALA 95 HN ALA 95 -14.954 -11.869 7.493 722 HA ALA 95 HA ALA 95 -16.589 -9.742 8.502 723 1HB ALA 95 HB1 ALA 95 -14.521 -8.475 8.548 724 2HB ALA 95 HB2 ALA 95 -14.220 -10.110 9.167 725 3HB ALA 95 HB3 ALA 95 -13.738 -9.689 7.498 726 H LEU 96 HN LEU 96 -15.301 -10.601 5.321 727 HA LEU 96 HA LEU 96 -15.881 -8.165 3.980 728 1HB LEU 96 HB2 LEU 96 -14.716 -10.600 3.278 729 2HB LEU 96 HB3 LEU 96 -16.253 -10.721 2.469 730 HG LEU 96 HG LEU 96 -14.748 -9.836 0.898 731 1HD1 LEU 96 HD11 LEU 96 -16.942 -8.590 1.011 732 2HD1 LEU 96 HD12 LEU 96 -16.105 -7.316 1.909 733 3HD1 LEU 96 HD13 LEU 96 -15.605 -7.725 0.254 734 1HD2 LEU 96 HD21 LEU 96 -13.880 -7.718 2.912 735 2HD2 LEU 96 HD22 LEU 96 -12.972 -9.192 2.517 736 3HD2 LEU 96 HD23 LEU 96 -13.238 -7.965 1.272 737 H GLN 97 HN GLN 97 -17.757 -11.211 4.335 738 HA GLN 97 HA GLN 97 -20.012 -10.146 2.998 739 1HB GLN 97 HB2 GLN 97 -21.119 -12.046 3.313 740 2HB GLN 97 HB3 GLN 97 -19.453 -12.614 3.463 741 1HG GLN 97 HG2 GLN 97 -19.666 -12.798 5.831 742 2HG GLN 97 HG3 GLN 97 -21.341 -12.196 5.770 743 1HE2 GLN 97 HE22 GLN 97 -22.899 -13.517 4.353 744 2HE2 GLN 97 HE21 GLN 97 -22.606 -15.222 4.096 745 H GLU 98 HN GLU 98 -19.062 -10.106 6.447 746 HA GLU 98 HA GLU 98 -21.443 -8.927 7.396 747 1HB GLU 98 HB2 GLU 98 -19.776 -9.895 8.869 748 2HB GLU 98 HB3 GLU 98 -18.585 -8.673 8.395 749 1HG GLU 98 HG2 GLU 98 -19.922 -6.898 9.393 750 2HG GLU 98 HG3 GLU 98 -21.230 -8.031 9.754 751 H LEU 99 HN LEU 99 -18.465 -7.375 6.085 752 HA LEU 99 HA LEU 99 -19.060 -4.738 6.659 753 1HB LEU 99 HB2 LEU 99 -16.911 -5.644 5.705 754 2HB LEU 99 HB3 LEU 99 -17.733 -5.825 4.156 755 HG LEU 99 HG LEU 99 -18.157 -3.287 4.220 756 1HD1 LEU 99 HD11 LEU 99 -16.565 -1.973 5.597 757 2HD1 LEU 99 HD12 LEU 99 -17.731 -2.854 6.589 758 3HD1 LEU 99 HD13 LEU 99 -16.070 -3.460 6.434 759 1HD2 LEU 99 HD21 LEU 99 -15.342 -4.407 4.010 760 2HD2 LEU 99 HD22 LEU 99 -16.547 -4.267 2.727 761 3HD2 LEU 99 HD23 LEU 99 -15.844 -2.801 3.429 762 H VAL 100 HN VAL 100 -20.119 -6.688 3.879 763 HA VAL 100 HA VAL 100 -21.638 -4.354 2.868 764 HB VAL 100 HB VAL 100 -20.447 -5.594 1.303 765 1HG1 VAL 100 HG11 VAL 100 -22.217 -8.015 1.838 766 2HG1 VAL 100 HG12 VAL 100 -21.045 -7.852 0.520 767 3HG1 VAL 100 HG13 VAL 100 -20.483 -7.894 2.191 768 1HG2 VAL 100 HG21 VAL 100 -23.382 -6.072 0.729 769 2HG2 VAL 100 HG22 VAL 100 -22.627 -4.463 0.730 770 3HG2 VAL 100 HG23 VAL 100 -22.063 -5.691 -0.400 771 H ASN 101 HN ASN 101 -22.402 -7.545 4.375 772 HA ASN 101 HA ASN 101 -25.160 -7.570 3.854 773 1HB ASN 101 HB2 ASN 101 -24.009 -9.507 4.741 774 2HB ASN 101 HB3 ASN 101 -23.661 -8.661 6.256 775 1HD2 ASN 101 HD22 ASN 101 -25.337 -8.476 7.833 776 2HD2 ASN 101 HD21 ASN 101 -26.905 -9.207 7.622 777 H LYS 102 HN LYS 102 -23.359 -5.810 6.363 778 HA LYS 102 HA LYS 102 -25.692 -5.113 7.873 779 1HB LYS 102 HB2 LYS 102 -24.228 -3.825 9.235 780 2HB LYS 102 HB3 LYS 102 -23.342 -5.261 8.721 781 1HG LYS 102 HG2 LYS 102 -22.385 -3.746 6.846 782 2HG LYS 102 HG3 LYS 102 -23.007 -2.411 7.848 783 1HD LYS 102 HD2 LYS 102 -21.719 -3.351 9.810 784 2HD LYS 102 HD3 LYS 102 -21.104 -4.628 8.740 785 1HE LYS 102 HE2 LYS 102 -19.405 -3.027 8.837 786 2HE LYS 102 HE3 LYS 102 -20.182 -2.885 7.243 787 1HZ LYS 102 HZ1 LYS 102 -19.695 -0.733 8.331 788 2HZ LYS 102 HZ2 LYS 102 -21.282 -0.907 7.967 789 3HZ LYS 102 HZ3 LYS 102 -20.760 -1.081 9.527 790 H HIS 103 HN HIS 103 -24.813 -3.969 4.811 791 HA HIS 103 HA HIS 103 -26.602 -1.593 5.141 792 1HB HIS 103 HB2 HIS 103 -24.171 -1.841 3.322 793 2HB HIS 103 HB3 HIS 103 -25.285 -0.475 3.381 794 HD1 HIS 103 HD1 HIS 103 -25.332 0.827 5.923 795 HD2 HIS 103 HD2 HIS 103 -22.127 -1.730 4.948 796 HE1 HIS 103 HE1 HIS 103 -23.479 1.346 7.583 797 H LEU 104 HN LEU 104 -25.792 -4.463 3.372 798 HA LEU 104 HA LEU 104 -27.254 -4.242 0.948 799 1HB LEU 104 HB2 LEU 104 -25.633 -5.928 1.300 800 2HB LEU 104 HB3 LEU 104 -26.408 -6.409 2.822 801 HG LEU 104 HG LEU 104 -28.195 -7.447 1.774 802 1HD1 LEU 104 HD11 LEU 104 -28.452 -7.609 -0.687 803 2HD1 LEU 104 HD12 LEU 104 -28.463 -5.912 -0.238 804 3HD1 LEU 104 HD13 LEU 104 -26.996 -6.629 -0.931 805 1HD2 LEU 104 HD21 LEU 104 -27.062 -9.275 0.649 806 2HD2 LEU 104 HD22 LEU 104 -25.623 -8.260 0.387 807 3HD2 LEU 104 HD23 LEU 104 -26.129 -8.718 2.033 808 1H MET 1 H1 MET 1 11.410 28.208 -9.434 809 2H MET 1 H2 MET 1 10.930 29.753 -9.660 810 3H MET 1 H3 MET 1 10.741 28.663 -10.871 811 HA MET 1 HA MET 1 8.635 29.106 -9.835 812 1HB MET 1 HB2 MET 1 9.745 26.321 -9.251 813 2HB MET 1 HB3 MET 1 8.053 26.768 -9.045 814 1HG MET 1 HG2 MET 1 7.943 27.430 -11.452 815 2HG MET 1 HG3 MET 1 9.609 26.887 -11.650 816 1HE MET 1 HE1 MET 1 6.424 25.289 -9.762 817 2HE MET 1 HE2 MET 1 5.861 25.905 -11.333 818 3HE MET 1 HE3 MET 1 5.916 24.156 -11.028 819 H GLU 2 HN GLU 2 7.273 28.589 -7.797 820 HA GLU 2 HA GLU 2 8.773 29.314 -5.333 821 1HB GLU 2 HB2 GLU 2 7.979 31.292 -6.777 822 2HB GLU 2 HB3 GLU 2 6.337 30.830 -6.338 823 1HG GLU 2 HG2 GLU 2 6.953 31.137 -3.916 824 2HG GLU 2 HG3 GLU 2 8.599 31.536 -4.404 825 H ASN 3 HN ASN 3 7.841 26.822 -5.942 826 HA ASN 3 HA ASN 3 7.033 25.361 -4.200 827 1HB ASN 3 HB2 ASN 3 4.382 26.766 -4.663 828 2HB ASN 3 HB3 ASN 3 4.563 25.115 -4.085 829 1HD2 ASN 3 HD22 ASN 3 7.140 26.964 -2.651 830 2HD2 ASN 3 HD21 ASN 3 6.327 27.198 -1.140 831 H LYS 4 HN LYS 4 6.848 23.541 -4.974 832 HA LYS 4 HA LYS 4 5.041 22.608 -6.958 833 1HB LYS 4 HB2 LYS 4 6.706 21.476 -8.387 834 2HB LYS 4 HB3 LYS 4 6.824 23.229 -8.508 835 1HG LYS 4 HG2 LYS 4 8.747 23.110 -6.837 836 2HG LYS 4 HG3 LYS 4 8.704 21.351 -7.022 837 1HD LYS 4 HD2 LYS 4 9.064 21.623 -9.479 838 2HD LYS 4 HD3 LYS 4 9.101 23.388 -9.263 839 1HE LYS 4 HE2 LYS 4 11.064 23.151 -7.749 840 2HE LYS 4 HE3 LYS 4 11.038 21.403 -8.013 841 1HZ LYS 4 HZ1 LYS 4 11.479 21.797 -10.359 842 2HZ LYS 4 HZ2 LYS 4 11.502 23.416 -10.140 843 3HZ LYS 4 HZ3 LYS 4 12.648 22.481 -9.451 844 H ILE 5 HN ILE 5 4.817 20.230 -6.482 845 HA ILE 5 HA ILE 5 5.842 19.812 -3.716 846 HB ILE 5 HB ILE 5 3.243 18.992 -5.027 847 1HG1 ILE 5 HG12 ILE 5 4.126 21.232 -3.241 848 2HG1 ILE 5 HG13 ILE 5 3.003 21.237 -4.584 849 1HG2 ILE 5 HG21 ILE 5 2.626 18.056 -2.846 850 2HG2 ILE 5 HG22 ILE 5 4.052 17.251 -3.464 851 3HG2 ILE 5 HG23 ILE 5 4.237 18.499 -2.194 852 1HD1 ILE 5 HD11 ILE 5 1.850 21.698 -2.520 853 2HD1 ILE 5 HD12 ILE 5 1.321 20.099 -3.113 854 3HD1 ILE 5 HD13 ILE 5 2.490 20.224 -1.768 855 H ILE 6 HN ILE 6 6.755 18.005 -3.120 856 HA ILE 6 HA ILE 6 6.962 15.719 -4.976 857 HB ILE 6 HB ILE 6 8.964 16.971 -5.430 858 1HG1 ILE 6 HG12 ILE 6 9.561 14.580 -3.641 859 2HG1 ILE 6 HG13 ILE 6 9.118 14.536 -5.349 860 1HG2 ILE 6 HG21 ILE 6 10.638 17.590 -3.743 861 2HG2 ILE 6 HG22 ILE 6 9.113 18.390 -3.424 862 3HG2 ILE 6 HG23 ILE 6 9.579 16.975 -2.457 863 1HD1 ILE 6 HD11 ILE 6 11.479 14.259 -5.258 864 2HD1 ILE 6 HD12 ILE 6 11.218 15.919 -5.817 865 3HD1 ILE 6 HD13 ILE 6 11.691 15.597 -4.128 866 H TYR 7 HN TYR 7 6.922 13.771 -3.868 867 HA TYR 7 HA TYR 7 6.357 13.973 -0.951 868 1HB TYR 7 HB2 TYR 7 4.441 13.776 -2.928 869 2HB TYR 7 HB3 TYR 7 4.751 12.085 -2.603 870 HD1 TYR 7 HD1 TYR 7 4.296 11.156 -0.274 871 HD2 TYR 7 HD2 TYR 7 3.431 15.263 -1.326 872 HE1 TYR 7 HE1 TYR 7 2.926 11.398 1.721 873 HE2 TYR 7 HE2 TYR 7 2.105 15.495 0.746 874 HH TYR 7 HH TYR 7 1.271 14.433 2.659 875 H PHE 8 HN PHE 8 6.901 12.057 0.234 876 HA PHE 8 HA PHE 8 8.322 9.979 -1.367 877 1HB PHE 8 HB2 PHE 8 8.928 10.491 1.526 878 2HB PHE 8 HB3 PHE 8 9.846 9.585 0.357 879 HD1 PHE 8 HD1 PHE 8 9.825 11.823 -1.876 880 HD2 PHE 8 HD2 PHE 8 10.742 11.828 2.334 881 HE1 PHE 8 HE1 PHE 8 11.347 13.730 -2.222 882 HE2 PHE 8 HE2 PHE 8 12.248 13.733 1.965 883 HZ PHE 8 HZ PHE 8 12.559 14.708 -0.282 884 H LEU 9 HN LEU 9 8.214 7.810 -0.572 885 HA LEU 9 HA LEU 9 5.966 7.149 1.270 886 1HB LEU 9 HB2 LEU 9 6.484 6.162 -1.556 887 2HB LEU 9 HB3 LEU 9 5.745 5.099 -0.376 888 HG LEU 9 HG LEU 9 4.563 7.752 -1.264 889 1HD1 LEU 9 HD11 LEU 9 4.610 6.037 -3.043 890 2HD1 LEU 9 HD12 LEU 9 3.888 4.859 -1.950 891 3HD1 LEU 9 HD13 LEU 9 2.948 6.278 -2.471 892 1HD2 LEU 9 HD21 LEU 9 2.444 6.783 -0.179 893 2HD2 LEU 9 HD22 LEU 9 3.477 5.564 0.576 894 3HD2 LEU 9 HD23 LEU 9 3.710 7.280 0.955 895 H SER 10 HN SER 10 6.566 5.628 2.739 896 HA SER 10 HA SER 10 8.261 3.484 2.110 897 1HB SER 10 HB2 SER 10 10.043 3.778 3.633 898 2HB SER 10 HB3 SER 10 10.085 5.164 2.537 899 HG SER 10 HG SER 10 9.487 6.481 4.166 900 H THR 11 HN THR 11 8.163 1.898 3.916 901 HA THR 11 HA THR 11 5.732 1.590 5.042 902 HB THR 11 HB THR 11 8.422 0.587 6.034 903 HG1 THR 11 HG1 THR 11 7.838 -1.170 4.657 904 1HG2 THR 11 HG21 THR 11 7.192 -1.295 6.983 905 2HG2 THR 11 HG22 THR 11 6.631 0.192 7.727 906 3HG2 THR 11 HG23 THR 11 5.633 -0.579 6.474 907 H GLY 12 HN GLY 12 4.662 3.051 6.231 908 1HA GLY 12 HA2 GLY 12 4.000 4.200 8.106 909 2HA GLY 12 HA3 GLY 12 5.294 3.398 9.006 910 H ASN 13 HN ASN 13 6.282 5.145 6.208 911 HA ASN 13 HA ASN 13 7.975 6.587 6.037 912 1HB ASN 13 HB2 ASN 13 7.134 8.551 5.524 913 2HB ASN 13 HB3 ASN 13 5.595 7.830 5.943 914 1HD2 ASN 13 HD22 ASN 13 7.010 10.719 6.168 915 2HD2 ASN 13 HD21 ASN 13 6.500 11.189 7.767 916 H SER 14 HN SER 14 8.258 5.172 8.504 917 HA SER 14 HA SER 14 9.644 6.909 10.309 918 1HB SER 14 HB2 SER 14 10.677 4.612 10.941 919 2HB SER 14 HB3 SER 14 8.936 4.836 11.155 920 HG SER 14 HG SER 14 9.315 2.875 10.160 921 H ALA 15 HN ALA 15 11.944 6.716 10.551 922 HA ALA 15 HA ALA 15 14.100 7.052 9.954 923 1HB ALA 15 HB1 ALA 15 13.557 4.517 8.403 924 2HB ALA 15 HB2 ALA 15 15.149 5.157 8.889 925 3HB ALA 15 HB3 ALA 15 13.986 4.668 10.120 926 H ARG 16 HN ARG 16 13.503 5.682 6.813 927 HA ARG 16 HA ARG 16 15.267 7.399 5.520 928 1HB ARG 16 HB2 ARG 16 13.196 6.336 3.705 929 2HB ARG 16 HB3 ARG 16 14.931 6.162 3.678 930 1HG ARG 16 HG2 ARG 16 14.286 3.958 3.982 931 2HG ARG 16 HG3 ARG 16 14.545 4.448 5.657 932 1HD ARG 16 HD2 ARG 16 11.955 5.160 5.456 933 2HD ARG 16 HD3 ARG 16 11.996 4.013 4.120 934 HE ARG 16 HE ARG 16 13.064 2.525 6.130 935 1HH1 ARG 16 HH11 ARG 16 10.095 4.509 6.009 936 2HH1 ARG 16 HH12 ARG 16 9.250 3.468 7.131 937 1HH2 ARG 16 HH21 ARG 16 11.804 1.052 7.269 938 2HH2 ARG 16 HH22 ARG 16 10.265 1.562 7.946 939 H SER 17 HN SER 17 11.628 7.656 5.463 940 HA SER 17 HA SER 17 11.687 9.905 3.759 941 1HB SER 17 HB2 SER 17 9.561 9.119 5.780 942 2HB SER 17 HB3 SER 17 9.358 10.162 4.363 943 HG SER 17 HG SER 17 9.860 8.392 3.035 944 H GLN 18 HN GLN 18 11.652 9.760 7.356 945 HA GLN 18 HA GLN 18 11.335 12.550 7.876 946 1HB GLN 18 HB2 GLN 18 13.053 10.582 9.437 947 2HB GLN 18 HB3 GLN 18 12.364 12.070 10.035 948 1HG GLN 18 HG2 GLN 18 10.836 9.553 9.253 949 2HG GLN 18 HG3 GLN 18 11.230 10.072 10.882 950 1HE2 GLN 18 HE22 GLN 18 8.535 9.761 9.187 951 2HE2 GLN 18 HE21 GLN 18 7.679 11.221 9.667 952 H MET 19 HN MET 19 14.196 10.483 7.505 953 HA MET 19 HA MET 19 16.154 12.463 7.947 954 1HB MET 19 HB2 MET 19 16.318 9.922 8.087 955 2HB MET 19 HB3 MET 19 16.276 9.880 6.324 956 1HG MET 19 HG2 MET 19 18.356 11.528 6.599 957 2HG MET 19 HG3 MET 19 18.451 10.770 8.184 958 1HE MET 19 HE1 MET 19 18.537 7.968 8.437 959 2HE MET 19 HE2 MET 19 17.262 7.667 7.228 960 3HE MET 19 HE3 MET 19 18.860 6.911 7.053 961 H ALA 20 HN ALA 20 14.524 11.247 4.998 962 HA ALA 20 HA ALA 20 16.257 12.534 3.115 963 1HB ALA 20 HB1 ALA 20 13.441 11.415 2.801 964 2HB ALA 20 HB2 ALA 20 14.516 11.913 1.477 965 3HB ALA 20 HB3 ALA 20 14.967 10.546 2.512 966 H GLU 21 HN GLU 21 13.132 13.446 4.673 967 HA GLU 21 HA GLU 21 12.891 15.669 2.877 968 1HB GLU 21 HB2 GLU 21 10.854 16.095 3.779 969 2HB GLU 21 HB3 GLU 21 11.036 14.374 4.037 970 1HG GLU 21 HG2 GLU 21 10.161 15.026 6.051 971 2HG GLU 21 HG3 GLU 21 11.882 15.014 6.411 972 H GLY 22 HN GLY 22 14.410 15.270 6.070 973 1HA GLY 22 HA2 GLY 22 14.992 18.078 6.440 974 2HA GLY 22 HA3 GLY 22 15.826 16.704 7.183 975 H TRP 23 HN TRP 23 16.845 15.302 5.019 976 HA TRP 23 HA TRP 23 19.109 16.701 4.126 977 1HB TRP 23 HB2 TRP 23 17.644 14.213 3.274 978 2HB TRP 23 HB3 TRP 23 18.781 14.891 2.139 979 HD1 TRP 23 HD1 TRP 23 18.752 12.368 4.630 980 HE1 TRP 23 HE1 TRP 23 21.129 11.676 5.238 981 HE3 TRP 23 HE3 TRP 23 21.229 16.431 2.820 982 HZ2 TRP 23 HZ2 TRP 23 23.815 12.718 4.871 983 HZ3 TRP 23 HZ3 TRP 23 23.716 16.504 2.839 984 HH2 TRP 23 HH2 TRP 23 25.012 14.647 3.838 985 H ALA 24 HN ALA 24 15.957 16.254 2.465 986 HA ALA 24 HA ALA 24 16.740 17.496 0.043 987 1HB ALA 24 HB1 ALA 24 14.317 17.620 -0.396 988 2HB ALA 24 HB2 ALA 24 14.669 16.060 0.378 989 3HB ALA 24 HB3 ALA 24 13.944 17.379 1.315 990 H LYS 25 HN LYS 25 15.026 18.840 2.949 991 HA LYS 25 HA LYS 25 14.487 21.261 1.593 992 1HB LYS 25 HB2 LYS 25 14.258 20.379 4.473 993 2HB LYS 25 HB3 LYS 25 14.015 22.081 4.047 994 1HG LYS 25 HG2 LYS 25 12.296 21.521 2.414 995 2HG LYS 25 HG3 LYS 25 12.528 19.786 2.700 996 1HD LYS 25 HD2 LYS 25 11.775 20.011 4.995 997 2HD LYS 25 HD3 LYS 25 11.637 21.775 4.833 998 1HE LYS 25 HE2 LYS 25 9.750 21.635 3.379 999 2HE LYS 25 HE3 LYS 25 10.179 20.009 2.869 1000 1HZ LYS 25 HZ1 LYS 25 8.949 20.704 5.451 1001 2HZ LYS 25 HZ2 LYS 25 8.316 19.790 4.231 1002 3HZ LYS 25 HZ3 LYS 25 9.555 19.209 5.103 1003 H GLN 26 HN GLN 26 17.455 20.317 3.268 1004 HA GLN 26 HA GLN 26 18.247 23.027 3.565 1005 1HB GLN 26 HB2 GLN 26 20.499 22.366 3.816 1006 2HB GLN 26 HB3 GLN 26 19.440 21.363 4.803 1007 1HG GLN 26 HG2 GLN 26 19.764 19.469 3.485 1008 2HG GLN 26 HG3 GLN 26 20.315 20.376 2.077 1009 1HE2 GLN 26 HE22 GLN 26 21.912 18.396 2.468 1010 2HE2 GLN 26 HE21 GLN 26 23.327 18.754 3.428 1011 H TYR 27 HN TYR 27 17.840 21.238 0.632 1012 HA TYR 27 HA TYR 27 19.213 23.465 -0.838 1013 1HB TYR 27 HB2 TYR 27 18.632 21.033 -2.381 1014 2HB TYR 27 HB3 TYR 27 20.029 22.077 -2.422 1015 HD1 TYR 27 HD1 TYR 27 18.675 18.919 -1.557 1016 HD2 TYR 27 HD2 TYR 27 21.808 21.694 -0.505 1017 HE1 TYR 27 HE1 TYR 27 19.964 17.064 -0.533 1018 HE2 TYR 27 HE2 TYR 27 23.117 19.837 0.493 1019 HH TYR 27 HH TYR 27 22.002 16.427 0.375 1020 H LEU 28 HN LEU 28 16.388 21.312 -0.712 1021 HA LEU 28 HA LEU 28 15.054 22.523 -2.988 1022 1HB LEU 28 HB2 LEU 28 14.317 20.273 -1.063 1023 2HB LEU 28 HB3 LEU 28 13.115 21.047 -2.074 1024 HG LEU 28 HG LEU 28 14.480 20.517 -4.101 1025 1HD1 LEU 28 HD11 LEU 28 16.108 18.674 -3.975 1026 2HD1 LEU 28 HD12 LEU 28 16.638 20.156 -3.187 1027 3HD1 LEU 28 HD13 LEU 28 16.076 18.783 -2.198 1028 1HD2 LEU 28 HD21 LEU 28 12.510 19.196 -3.446 1029 2HD2 LEU 28 HD22 LEU 28 13.725 18.225 -4.280 1030 3HD2 LEU 28 HD23 LEU 28 13.551 18.099 -2.513 1031 H GLY 29 HN GLY 29 15.346 24.570 -2.032 1032 1HA GLY 29 HA2 GLY 29 14.218 25.596 0.352 1033 2HA GLY 29 HA3 GLY 29 14.648 26.520 -1.097 1034 H ASP 30 HN ASP 30 12.730 27.831 -0.407 1035 HA ASP 30 HA ASP 30 10.085 26.880 -0.338 1036 1HB ASP 30 HB2 ASP 30 10.862 29.059 0.532 1037 2HB ASP 30 HB3 ASP 30 11.103 29.632 -1.121 1038 H GLU 31 HN GLU 31 12.108 27.182 -3.072 1039 HA GLU 31 HA GLU 31 10.211 27.513 -5.178 1040 1HB GLU 31 HB2 GLU 31 12.535 27.706 -5.616 1041 2HB GLU 31 HB3 GLU 31 12.896 26.115 -4.932 1042 1HG GLU 31 HG2 GLU 31 12.045 24.961 -6.782 1043 2HG GLU 31 HG3 GLU 31 11.060 26.327 -7.315 1044 H TRP 32 HN TRP 32 10.735 24.918 -2.907 1045 HA TRP 32 HA TRP 32 8.921 23.057 -4.362 1046 1HB TRP 32 HB2 TRP 32 11.217 22.352 -2.513 1047 2HB TRP 32 HB3 TRP 32 10.217 21.236 -3.413 1048 HD1 TRP 32 HD1 TRP 32 13.005 23.805 -3.975 1049 HE1 TRP 32 HE1 TRP 32 14.582 22.867 -5.754 1050 HE3 TRP 32 HE3 TRP 32 10.257 19.745 -5.458 1051 HZ2 TRP 32 HZ2 TRP 32 14.586 20.763 -7.697 1052 HZ3 TRP 32 HZ3 TRP 32 11.111 18.245 -7.240 1053 HH2 TRP 32 HH2 TRP 32 13.277 18.732 -8.359 1054 H LYS 33 HN LYS 33 7.990 21.465 -2.842 1055 HA LYS 33 HA LYS 33 7.946 22.121 0.036 1056 1HB LYS 33 HB2 LYS 33 5.515 21.891 -1.743 1057 2HB LYS 33 HB3 LYS 33 5.488 21.403 -0.048 1058 1HG LYS 33 HG2 LYS 33 6.802 23.855 0.121 1059 2HG LYS 33 HG3 LYS 33 5.679 24.150 -1.218 1060 1HD LYS 33 HD2 LYS 33 5.019 23.006 1.504 1061 2HD LYS 33 HD3 LYS 33 4.899 24.731 1.113 1062 1HE LYS 33 HE2 LYS 33 3.210 24.277 -0.632 1063 2HE LYS 33 HE3 LYS 33 3.309 22.542 -0.309 1064 1HZ LYS 33 HZ1 LYS 33 2.369 24.586 1.620 1065 2HZ LYS 33 HZ2 LYS 33 1.418 23.537 0.814 1066 3HZ LYS 33 HZ3 LYS 33 2.481 22.979 1.930 1067 H VAL 34 HN VAL 34 8.276 20.249 1.139 1068 HA VAL 34 HA VAL 34 8.352 17.719 -0.427 1069 HB VAL 34 HB VAL 34 10.376 18.515 1.697 1070 1HG1 VAL 34 HG11 VAL 34 11.679 16.685 0.783 1071 2HG1 VAL 34 HG12 VAL 34 10.094 16.105 1.298 1072 3HG1 VAL 34 HG13 VAL 34 10.423 16.351 -0.427 1073 1HG2 VAL 34 HG21 VAL 34 10.693 18.818 -1.313 1074 2HG2 VAL 34 HG22 VAL 34 10.738 20.118 -0.106 1075 3HG2 VAL 34 HG23 VAL 34 12.011 18.902 -0.127 1076 H TYR 35 HN TYR 35 7.272 16.108 0.530 1077 HA TYR 35 HA TYR 35 6.526 16.197 3.404 1078 1HB TYR 35 HB2 TYR 35 4.670 16.025 1.022 1079 2HB TYR 35 HB3 TYR 35 4.185 15.611 2.664 1080 HD1 TYR 35 HD1 TYR 35 4.741 17.553 4.479 1081 HD2 TYR 35 HD2 TYR 35 4.016 18.135 0.264 1082 HE1 TYR 35 HE1 TYR 35 4.000 19.868 4.933 1083 HE2 TYR 35 HE2 TYR 35 3.245 20.441 0.713 1084 HH TYR 35 HH TYR 35 3.168 21.830 4.035 1085 H SER 36 HN SER 36 5.435 13.962 3.947 1086 HA SER 36 HA SER 36 5.840 11.862 2.016 1087 1HB SER 36 HB2 SER 36 7.328 10.496 3.432 1088 2HB SER 36 HB3 SER 36 8.113 11.979 2.861 1089 HG SER 36 HG SER 36 7.824 12.905 4.870 1090 H ALA 37 HN ALA 37 5.060 9.758 2.848 1091 HA ALA 37 HA ALA 37 3.373 9.731 5.233 1092 1HB ALA 37 HB1 ALA 37 1.887 10.843 3.593 1093 2HB ALA 37 HB2 ALA 37 2.158 9.494 2.442 1094 3HB ALA 37 HB3 ALA 37 1.338 9.227 4.001 1095 H GLY 38 HN GLY 38 2.094 7.472 5.044 1096 1HA GLY 38 HA2 GLY 38 3.100 5.386 3.418 1097 2HA GLY 38 HA3 GLY 38 3.952 5.362 4.968 1098 H ILE 39 HN ILE 39 2.648 3.222 4.663 1099 HA ILE 39 HA ILE 39 -0.003 2.842 4.866 1100 HB ILE 39 HB ILE 39 1.338 1.009 4.589 1101 1HG1 ILE 39 HG12 ILE 39 0.489 0.455 7.424 1102 2HG1 ILE 39 HG13 ILE 39 -0.742 0.816 6.206 1103 1HG2 ILE 39 HG21 ILE 39 2.678 1.361 7.309 1104 2HG2 ILE 39 HG22 ILE 39 2.974 0.074 6.142 1105 3HG2 ILE 39 HG23 ILE 39 3.415 1.729 5.740 1106 1HD1 ILE 39 HD11 ILE 39 -0.583 -1.546 6.352 1107 2HD1 ILE 39 HD12 ILE 39 0.146 -1.059 4.810 1108 3HD1 ILE 39 HD13 ILE 39 1.180 -1.513 6.196 1109 H GLU 40 HN GLU 40 2.025 3.231 7.748 1110 HA GLU 40 HA GLU 40 -0.336 3.728 9.513 1111 1HB GLU 40 HB2 GLU 40 1.978 1.779 9.595 1112 2HB GLU 40 HB3 GLU 40 1.367 2.377 11.136 1113 1HG GLU 40 HG2 GLU 40 -0.565 1.222 9.121 1114 2HG GLU 40 HG3 GLU 40 0.478 0.151 10.046 1115 H ALA 41 HN ALA 41 1.376 5.580 8.078 1116 HA ALA 41 HA ALA 41 3.628 6.426 9.615 1117 1HB ALA 41 HB1 ALA 41 3.616 6.650 7.227 1118 2HB ALA 41 HB2 ALA 41 2.065 7.491 7.250 1119 3HB ALA 41 HB3 ALA 41 3.509 8.312 7.861 1120 H HIS 42 HN HIS 42 4.012 8.248 10.639 1121 HA HIS 42 HA HIS 42 3.252 10.511 11.381 1122 1HB HIS 42 HB2 HIS 42 0.847 10.133 11.578 1123 2HB HIS 42 HB3 HIS 42 1.105 8.848 12.766 1124 HD1 HIS 42 HD1 HIS 42 1.321 12.668 12.408 1125 HD2 HIS 42 HD2 HIS 42 1.555 9.622 15.305 1126 HE1 HIS 42 HE1 HIS 42 1.352 13.840 14.680 1127 H GLY 43 HN GLY 43 5.402 10.323 12.152 1128 1HA GLY 43 HA2 GLY 43 5.909 9.208 14.748 1129 2HA GLY 43 HA3 GLY 43 6.441 8.123 13.442 1130 H LEU 44 HN LEU 44 8.367 8.981 15.021 1131 HA LEU 44 HA LEU 44 10.093 10.380 13.158 1132 1HB LEU 44 HB2 LEU 44 9.317 12.314 14.416 1133 2HB LEU 44 HB3 LEU 44 9.583 11.490 15.954 1134 HG LEU 44 HG LEU 44 12.009 11.512 15.622 1135 1HD1 LEU 44 HD11 LEU 44 11.349 12.629 12.876 1136 2HD1 LEU 44 HD12 LEU 44 12.927 12.876 13.641 1137 3HD1 LEU 44 HD13 LEU 44 12.373 11.239 13.287 1138 1HD2 LEU 44 HD21 LEU 44 10.937 13.474 16.643 1139 2HD2 LEU 44 HD22 LEU 44 12.391 13.915 15.736 1140 3HD2 LEU 44 HD23 LEU 44 10.790 14.237 15.045 1141 H ASN 45 HN ASN 45 11.421 8.615 12.995 1142 HA ASN 45 HA ASN 45 11.959 6.863 15.254 1143 1HB ASN 45 HB2 ASN 45 11.824 6.099 12.874 1144 2HB ASN 45 HB3 ASN 45 13.332 6.969 12.530 1145 1HD2 ASN 45 HD22 ASN 45 13.091 4.129 12.085 1146 2HD2 ASN 45 HD21 ASN 45 14.079 3.326 13.262 1147 HA PRO 46 HA PRO 46 15.249 9.623 16.670 1148 1HB PRO 46 HB2 PRO 46 16.536 7.940 18.467 1149 2HB PRO 46 HB3 PRO 46 15.062 8.895 18.814 1150 1HG PRO 46 HG2 PRO 46 15.251 5.995 17.960 1151 2HG PRO 46 HG3 PRO 46 14.260 6.703 19.279 1152 1HD PRO 46 HD2 PRO 46 13.173 6.147 16.879 1153 2HD PRO 46 HD3 PRO 46 12.729 7.652 17.731 1154 H ASN 47 HN ASN 47 15.759 6.428 15.155 1155 HA ASN 47 HA ASN 47 18.555 6.670 14.677 1156 1HB ASN 47 HB2 ASN 47 18.211 4.774 13.588 1157 2HB ASN 47 HB3 ASN 47 16.557 4.790 14.120 1158 1HD2 ASN 47 HD21 ASN 47 18.605 4.672 11.485 1159 2HD2 ASN 47 HD22 ASN 47 17.530 5.267 10.215 1160 H ALA 48 HN ALA 48 15.676 8.104 13.082 1161 HA ALA 48 HA ALA 48 17.122 8.996 10.783 1162 1HB ALA 48 HB1 ALA 48 15.113 10.189 10.217 1163 2HB ALA 48 HB2 ALA 48 14.582 8.678 10.984 1164 3HB ALA 48 HB3 ALA 48 14.515 10.180 11.888 1165 H VAL 49 HN VAL 49 16.121 10.354 13.897 1166 HA VAL 49 HA VAL 49 17.065 13.028 13.546 1167 HB VAL 49 HB VAL 49 17.003 11.413 16.137 1168 1HG1 VAL 49 HG11 VAL 49 16.968 14.422 15.642 1169 2HG1 VAL 49 HG12 VAL 49 16.770 13.631 17.218 1170 3HG1 VAL 49 HG13 VAL 49 18.304 13.485 16.356 1171 1HG2 VAL 49 HG21 VAL 49 14.753 11.442 15.043 1172 2HG2 VAL 49 HG22 VAL 49 14.793 12.382 16.536 1173 3HG2 VAL 49 HG23 VAL 49 14.840 13.213 14.973 1174 H LYS 50 HN LYS 50 18.750 10.161 15.012 1175 HA LYS 50 HA LYS 50 21.279 11.370 15.275 1176 1HB LYS 50 HB2 LYS 50 20.663 9.263 16.320 1177 2HB LYS 50 HB3 LYS 50 20.508 8.463 14.750 1178 1HG LYS 50 HG2 LYS 50 22.884 8.622 14.335 1179 2HG LYS 50 HG3 LYS 50 23.119 9.672 15.749 1180 1HD LYS 50 HD2 LYS 50 22.486 7.863 17.261 1181 2HD LYS 50 HD3 LYS 50 22.110 6.794 15.892 1182 1HE LYS 50 HE2 LYS 50 24.425 6.787 15.166 1183 2HE LYS 50 HE3 LYS 50 24.855 8.035 16.345 1184 1HZ LYS 50 HZ1 LYS 50 24.362 6.454 18.117 1185 2HZ LYS 50 HZ2 LYS 50 23.982 5.286 17.038 1186 3HZ LYS 50 HZ3 LYS 50 25.512 5.858 17.130 1187 H ALA 51 HN ALA 51 19.964 9.552 12.476 1188 HA ALA 51 HA ALA 51 22.168 9.617 10.795 1189 1HB ALA 51 HB1 ALA 51 20.169 8.314 10.346 1190 2HB ALA 51 HB2 ALA 51 19.196 9.783 10.144 1191 3HB ALA 51 HB3 ALA 51 20.479 9.404 8.981 1192 H MET 52 HN MET 52 19.837 12.276 11.475 1193 HA MET 52 HA MET 52 20.883 13.968 9.338 1194 1HB MET 52 HB2 MET 52 18.875 14.370 11.600 1195 2HB MET 52 HB3 MET 52 19.305 15.633 10.459 1196 1HG MET 52 HG2 MET 52 18.452 13.049 9.229 1197 2HG MET 52 HG3 MET 52 17.240 13.921 10.143 1198 1HE MET 52 HE1 MET 52 20.217 15.371 7.791 1199 2HE MET 52 HE2 MET 52 19.538 13.899 7.038 1200 3HE MET 52 HE3 MET 52 19.263 15.488 6.292 1201 H LYS 53 HN LYS 53 21.157 13.695 12.942 1202 HA LYS 53 HA LYS 53 22.668 16.075 13.248 1203 1HB LYS 53 HB2 LYS 53 22.993 13.488 14.850 1204 2HB LYS 53 HB3 LYS 53 23.569 15.069 15.337 1205 1HG LYS 53 HG2 LYS 53 20.671 14.204 15.158 1206 2HG LYS 53 HG3 LYS 53 21.639 14.384 16.600 1207 1HD LYS 53 HD2 LYS 53 21.815 16.851 16.119 1208 2HD LYS 53 HD3 LYS 53 20.671 16.618 14.767 1209 1HE LYS 53 HE2 LYS 53 19.008 15.641 16.328 1210 2HE LYS 53 HE3 LYS 53 20.167 15.763 17.658 1211 1HZ LYS 53 HZ1 LYS 53 18.731 17.546 17.891 1212 2HZ LYS 53 HZ2 LYS 53 20.057 18.247 17.245 1213 3HZ LYS 53 HZ3 LYS 53 18.703 17.945 16.332 1214 H GLU 54 HN GLU 54 23.701 12.835 12.122 1215 HA GLU 54 HA GLU 54 26.479 13.117 12.351 1216 1HB GLU 54 HB2 GLU 54 24.866 11.859 10.095 1217 2HB GLU 54 HB3 GLU 54 26.620 11.766 10.226 1218 1HG GLU 54 HG2 GLU 54 26.244 10.713 12.549 1219 2HG GLU 54 HG3 GLU 54 24.572 10.465 12.021 1220 H VAL 55 HN VAL 55 24.302 14.685 10.045 1221 HA VAL 55 HA VAL 55 26.608 16.063 8.764 1222 HB VAL 55 HB VAL 55 25.139 16.261 6.793 1223 1HG1 VAL 55 HG11 VAL 55 25.483 13.375 7.734 1224 2HG1 VAL 55 HG12 VAL 55 25.419 13.958 6.066 1225 3HG1 VAL 55 HG13 VAL 55 26.781 14.400 7.088 1226 1HG2 VAL 55 HG21 VAL 55 23.224 14.332 8.192 1227 2HG2 VAL 55 HG22 VAL 55 22.922 16.075 8.010 1228 3HG2 VAL 55 HG23 VAL 55 23.061 15.058 6.584 1229 H GLY 56 HN GLY 56 24.856 16.652 11.268 1230 1HA GLY 56 HA2 GLY 56 24.328 18.542 12.374 1231 2HA GLY 56 HA3 GLY 56 25.132 19.451 11.085 1232 H ILE 57 HN ILE 57 22.161 17.349 10.681 1233 HA ILE 57 HA ILE 57 20.606 19.882 10.274 1234 HB ILE 57 HB ILE 57 20.218 17.178 8.963 1235 1HG1 ILE 57 HG12 ILE 57 20.970 19.922 7.859 1236 2HG1 ILE 57 HG13 ILE 57 21.989 18.485 7.911 1237 1HG2 ILE 57 HG21 ILE 57 18.266 18.192 7.814 1238 2HG2 ILE 57 HG22 ILE 57 18.018 18.156 9.542 1239 3HG2 ILE 57 HG23 ILE 57 18.481 19.684 8.752 1240 1HD1 ILE 57 HD11 ILE 57 21.302 18.653 5.694 1241 2HD1 ILE 57 HD12 ILE 57 20.312 17.366 6.346 1242 3HD1 ILE 57 HD13 ILE 57 19.607 18.986 6.088 1243 H ASP 58 HN ASP 58 18.566 19.867 11.361 1244 HA ASP 58 HA ASP 58 18.350 17.859 13.565 1245 1HB ASP 58 HB2 ASP 58 19.039 19.975 14.530 1246 2HB ASP 58 HB3 ASP 58 17.791 20.849 13.622 1247 H ILE 59 HN ILE 59 16.432 16.934 13.773 1248 HA ILE 59 HA ILE 59 14.035 18.018 12.437 1249 HB ILE 59 HB ILE 59 13.446 15.834 11.563 1250 1HG1 ILE 59 HG12 ILE 59 16.285 14.841 12.020 1251 2HG1 ILE 59 HG13 ILE 59 14.974 14.497 13.141 1252 1HG2 ILE 59 HG21 ILE 59 16.127 16.718 10.444 1253 2HG2 ILE 59 HG22 ILE 59 14.855 15.851 9.568 1254 3HG2 ILE 59 HG23 ILE 59 14.570 17.509 10.120 1255 1HD1 ILE 59 HD11 ILE 59 15.002 13.669 10.212 1256 2HD1 ILE 59 HD12 ILE 59 15.209 12.631 11.634 1257 3HD1 ILE 59 HD13 ILE 59 13.660 13.429 11.350 1258 H SER 60 HN SER 60 15.113 17.732 15.279 1259 HA SER 60 HA SER 60 13.780 15.557 16.463 1260 1HB SER 60 HB2 SER 60 14.696 18.146 17.786 1261 2HB SER 60 HB3 SER 60 14.449 16.579 18.578 1262 HG SER 60 HG SER 60 16.435 17.376 16.718 1263 H ASN 61 HN ASN 61 11.997 17.558 14.880 1264 HA ASN 61 HA ASN 61 9.807 17.788 16.782 1265 1HB ASN 61 HB2 ASN 61 11.374 19.950 16.510 1266 2HB ASN 61 HB3 ASN 61 10.441 20.175 15.037 1267 1HD2 ASN 61 HD22 ASN 61 7.891 19.656 15.626 1268 2HD2 ASN 61 HD21 ASN 61 7.298 20.601 16.991 1269 H GLN 62 HN GLN 62 10.703 16.362 13.942 1270 HA GLN 62 HA GLN 62 8.851 17.051 12.031 1271 1HB GLN 62 HB2 GLN 62 9.757 14.298 12.931 1272 2HB GLN 62 HB3 GLN 62 8.871 14.581 11.441 1273 1HG GLN 62 HG2 GLN 62 11.430 16.049 12.006 1274 2HG GLN 62 HG3 GLN 62 11.447 14.408 11.353 1275 1HE2 GLN 62 HE22 GLN 62 12.650 15.457 9.603 1276 2HE2 GLN 62 HE21 GLN 62 11.823 16.396 8.377 1277 H THR 63 HN THR 63 6.986 15.959 11.336 1278 HA THR 63 HA THR 63 5.337 14.360 13.054 1279 HB THR 63 HB THR 63 4.655 16.637 13.762 1280 HG1 THR 63 HG1 THR 63 2.515 16.200 13.593 1281 1HG2 THR 63 HG21 THR 63 5.043 17.905 11.666 1282 2HG2 THR 63 HG22 THR 63 3.700 17.037 10.890 1283 3HG2 THR 63 HG23 THR 63 3.395 18.113 12.269 1284 H SER 64 HN SER 64 3.469 13.533 11.588 1285 HA SER 64 HA SER 64 3.820 13.692 8.727 1286 1HB SER 64 HB2 SER 64 4.759 11.164 10.161 1287 2HB SER 64 HB3 SER 64 4.496 11.323 8.422 1288 HG SER 64 HG SER 64 6.086 13.305 9.376 1289 H ASP 65 HN ASP 65 2.512 11.345 7.968 1290 HA ASP 65 HA ASP 65 0.076 10.948 9.480 1291 1HB ASP 65 HB2 ASP 65 -0.171 13.297 8.486 1292 2HB ASP 65 HB3 ASP 65 0.009 12.556 6.889 1293 H ILE 66 HN ILE 66 -1.450 9.571 8.109 1294 HA ILE 66 HA ILE 66 -0.005 7.581 6.620 1295 HB ILE 66 HB ILE 66 -2.319 6.646 6.279 1296 1HG1 ILE 66 HG12 ILE 66 -4.086 7.307 7.863 1297 2HG1 ILE 66 HG13 ILE 66 -3.202 8.763 8.282 1298 1HG2 ILE 66 HG21 ILE 66 -1.387 7.146 9.129 1299 2HG2 ILE 66 HG22 ILE 66 -2.408 5.800 8.572 1300 3HG2 ILE 66 HG23 ILE 66 -0.743 5.927 8.004 1301 1HD1 ILE 66 HD11 ILE 66 -3.528 9.636 6.003 1302 2HD1 ILE 66 HD12 ILE 66 -4.246 8.081 5.498 1303 3HD1 ILE 66 HD13 ILE 66 -5.078 9.118 6.671 1304 H ILE 67 HN ILE 67 -0.749 6.844 4.396 1305 HA ILE 67 HA ILE 67 -0.226 8.773 2.525 1306 HB ILE 67 HB ILE 67 -0.979 7.276 0.837 1307 1HG1 ILE 67 HG12 ILE 67 -1.843 5.067 2.668 1308 2HG1 ILE 67 HG13 ILE 67 -3.027 6.326 2.397 1309 1HG2 ILE 67 HG21 ILE 67 1.182 6.879 2.058 1310 2HG2 ILE 67 HG22 ILE 67 0.351 5.598 2.979 1311 3HG2 ILE 67 HG23 ILE 67 0.515 5.465 1.228 1312 1HD1 ILE 67 HD11 ILE 67 -1.601 4.960 0.075 1313 2HD1 ILE 67 HD12 ILE 67 -3.150 4.420 0.784 1314 3HD1 ILE 67 HD13 ILE 67 -3.055 6.017 0.045 1315 H ASP 68 HN ASP 68 -1.238 10.384 1.527 1316 HA ASP 68 HA ASP 68 -4.192 10.644 1.724 1317 1HB ASP 68 HB2 ASP 68 -3.246 11.711 3.724 1318 2HB ASP 68 HB3 ASP 68 -2.263 12.767 2.701 1319 H SER 69 HN SER 69 -4.663 10.595 -0.307 1320 HA SER 69 HA SER 69 -3.243 11.404 -2.509 1321 1HB SER 69 HB2 SER 69 -6.246 11.437 -2.065 1322 2HB SER 69 HB3 SER 69 -5.425 11.227 -3.625 1323 HG SER 69 HG SER 69 -4.565 9.261 -2.805 1324 H ASP 70 HN ASP 70 -4.948 13.528 -0.228 1325 HA ASP 70 HA ASP 70 -5.593 15.625 -2.060 1326 1HB ASP 70 HB2 ASP 70 -6.519 15.354 0.260 1327 2HB ASP 70 HB3 ASP 70 -4.935 15.855 0.888 1328 H ILE 71 HN ILE 71 -2.559 14.629 -0.763 1329 HA ILE 71 HA ILE 71 -1.277 17.107 -1.816 1330 HB ILE 71 HB ILE 71 -0.117 15.550 0.444 1331 1HG1 ILE 71 HG12 ILE 71 -1.117 17.799 1.766 1332 2HG1 ILE 71 HG13 ILE 71 -2.467 17.389 0.720 1333 1HG2 ILE 71 HG21 ILE 71 1.333 17.185 -0.699 1334 2HG2 ILE 71 HG22 ILE 71 0.192 18.483 -0.266 1335 3HG2 ILE 71 HG23 ILE 71 1.041 17.570 1.010 1336 1HD1 ILE 71 HD11 ILE 71 -2.585 16.211 2.879 1337 2HD1 ILE 71 HD12 ILE 71 -2.331 15.029 1.566 1338 3HD1 ILE 71 HD13 ILE 71 -0.956 15.546 2.590 1339 H LEU 72 HN LEU 72 -1.024 13.540 -1.154 1340 HA LEU 72 HA LEU 72 1.469 13.304 -2.542 1341 1HB LEU 72 HB2 LEU 72 0.534 11.777 -0.797 1342 2HB LEU 72 HB3 LEU 72 -0.573 11.106 -1.993 1343 HG LEU 72 HG LEU 72 2.455 11.168 -2.389 1344 1HD1 LEU 72 HD11 LEU 72 2.040 10.036 -0.290 1345 2HD1 LEU 72 HD12 LEU 72 0.777 9.049 -1.005 1346 3HD1 LEU 72 HD13 LEU 72 2.477 8.849 -1.515 1347 1HD2 LEU 72 HD21 LEU 72 1.473 10.636 -4.483 1348 2HD2 LEU 72 HD22 LEU 72 1.946 9.100 -3.803 1349 3HD2 LEU 72 HD23 LEU 72 0.240 9.592 -3.767 1350 H ASN 73 HN ASN 73 -1.941 12.575 -3.597 1351 HA ASN 73 HA ASN 73 -1.127 12.031 -6.290 1352 1HB ASN 73 HB2 ASN 73 -3.177 11.273 -6.434 1353 2HB ASN 73 HB3 ASN 73 -3.603 11.915 -4.876 1354 1HD2 ASN 73 HD22 ASN 73 -4.423 14.241 -4.848 1355 2HD2 ASN 73 HD21 ASN 73 -5.316 14.795 -6.255 1356 H ASN 74 HN ASN 74 -1.660 14.923 -4.453 1357 HA ASN 74 HA ASN 74 -1.946 16.770 -6.621 1358 1HB ASN 74 HB2 ASN 74 -2.336 16.822 -3.915 1359 2HB ASN 74 HB3 ASN 74 -0.830 17.726 -4.022 1360 1HD2 ASN 74 HD22 ASN 74 -3.694 18.445 -3.321 1361 2HD2 ASN 74 HD21 ASN 74 -4.073 19.812 -4.359 1362 H ALA 75 HN ALA 75 0.821 15.242 -5.070 1363 HA ALA 75 HA ALA 75 2.843 17.053 -5.651 1364 1HB ALA 75 HB1 ALA 75 3.116 14.012 -5.644 1365 2HB ALA 75 HB2 ALA 75 4.360 15.212 -5.272 1366 3HB ALA 75 HB3 ALA 75 2.979 15.013 -4.179 1367 H ASP 76 HN ASP 76 4.633 16.762 -7.125 1368 HA ASP 76 HA ASP 76 3.823 16.177 -9.927 1369 1HB ASP 76 HB2 ASP 76 5.198 18.195 -9.412 1370 2HB ASP 76 HB3 ASP 76 6.477 17.140 -8.785 1371 H LEU 77 HN LEU 77 5.839 14.851 -7.300 1372 HA LEU 77 HA LEU 77 6.455 12.469 -8.879 1373 1HB LEU 77 HB2 LEU 77 8.288 13.867 -9.422 1374 2HB LEU 77 HB3 LEU 77 8.403 14.501 -7.785 1375 HG LEU 77 HG LEU 77 9.334 12.416 -6.957 1376 1HD1 LEU 77 HD11 LEU 77 9.509 10.454 -7.981 1377 2HD1 LEU 77 HD12 LEU 77 8.274 11.043 -9.109 1378 3HD1 LEU 77 HD13 LEU 77 10.004 11.147 -9.506 1379 1HD2 LEU 77 HD21 LEU 77 11.471 12.503 -8.304 1380 2HD2 LEU 77 HD22 LEU 77 10.667 13.626 -9.404 1381 3HD2 LEU 77 HD23 LEU 77 10.889 14.073 -7.704 1382 H VAL 78 HN VAL 78 6.571 10.642 -7.675 1383 HA VAL 78 HA VAL 78 6.585 10.794 -4.705 1384 HB VAL 78 HB VAL 78 5.549 8.461 -6.276 1385 1HG1 VAL 78 HG11 VAL 78 6.117 8.107 -3.886 1386 2HG1 VAL 78 HG12 VAL 78 5.113 9.502 -3.431 1387 3HG1 VAL 78 HG13 VAL 78 4.365 8.056 -4.129 1388 1HG2 VAL 78 HG21 VAL 78 4.132 10.208 -7.023 1389 2HG2 VAL 78 HG22 VAL 78 3.251 9.360 -5.773 1390 3HG2 VAL 78 HG23 VAL 78 4.000 10.940 -5.400 1391 H VAL 79 HN VAL 79 8.528 10.534 -3.945 1392 HA VAL 79 HA VAL 79 10.476 8.821 -5.369 1393 HB VAL 79 HB VAL 79 11.026 10.343 -2.812 1394 1HG1 VAL 79 HG11 VAL 79 12.787 9.746 -5.184 1395 2HG1 VAL 79 HG12 VAL 79 13.287 10.351 -3.592 1396 3HG1 VAL 79 HG13 VAL 79 12.675 8.694 -3.746 1397 1HG2 VAL 79 HG21 VAL 79 10.109 12.088 -4.288 1398 2HG2 VAL 79 HG22 VAL 79 11.867 12.238 -4.191 1399 3HG2 VAL 79 HG23 VAL 79 11.122 11.507 -5.628 1400 H THR 80 HN THR 80 9.972 6.684 -4.943 1401 HA THR 80 HA THR 80 9.089 5.861 -2.275 1402 HB THR 80 HB THR 80 10.010 4.339 -4.748 1403 HG1 THR 80 HG1 THR 80 7.932 5.647 -4.420 1404 1HG2 THR 80 HG21 THR 80 8.850 3.296 -2.126 1405 2HG2 THR 80 HG22 THR 80 8.893 2.368 -3.643 1406 3HG2 THR 80 HG23 THR 80 10.409 2.859 -2.878 1407 H LEU 81 HN LEU 81 10.431 5.408 -0.590 1408 HA LEU 81 HA LEU 81 13.383 5.316 -1.024 1409 1HB LEU 81 HB2 LEU 81 11.803 7.130 0.840 1410 2HB LEU 81 HB3 LEU 81 13.532 6.839 0.999 1411 HG LEU 81 HG LEU 81 12.214 8.155 -1.401 1412 1HD1 LEU 81 HD11 LEU 81 13.974 9.295 0.801 1413 2HD1 LEU 81 HD12 LEU 81 13.255 10.199 -0.553 1414 3HD1 LEU 81 HD13 LEU 81 12.219 9.505 0.702 1415 1HD2 LEU 81 HD21 LEU 81 14.242 7.007 -2.134 1416 2HD2 LEU 81 HD22 LEU 81 14.588 8.732 -2.016 1417 3HD2 LEU 81 HD23 LEU 81 15.154 7.635 -0.742 1418 H SER 82 HN SER 82 12.563 2.906 -0.716 1419 HA SER 82 HA SER 82 13.470 2.313 1.936 1420 1HB SER 82 HB2 SER 82 10.864 2.569 2.068 1421 2HB SER 82 HB3 SER 82 10.818 1.031 1.196 1422 HG SER 82 HG SER 82 10.810 0.760 3.489 1423 H GLY 83 HN GLY 83 13.273 -0.209 2.153 1424 1HA GLY 83 HA2 GLY 83 13.765 -1.677 -0.369 1425 2HA GLY 83 HA3 GLY 83 14.966 -1.785 0.945 1426 H ASP 84 HN ASP 84 11.444 -1.396 1.245 1427 HA ASP 84 HA ASP 84 10.957 -4.081 2.322 1428 1HB ASP 84 HB2 ASP 84 11.676 -2.777 4.295 1429 2HB ASP 84 HB3 ASP 84 10.558 -1.478 3.868 1430 H ALA 85 HN ALA 85 8.567 -4.418 2.409 1431 HA ALA 85 HA ALA 85 7.125 -2.658 0.479 1432 1HB ALA 85 HB1 ALA 85 6.315 -4.691 -0.607 1433 2HB ALA 85 HB2 ALA 85 8.087 -4.684 -0.585 1434 3HB ALA 85 HB3 ALA 85 7.186 -5.700 0.567 1435 H ALA 86 HN ALA 86 6.954 -3.259 3.662 1436 HA ALA 86 HA ALA 86 4.241 -4.271 3.912 1437 1HB ALA 86 HB1 ALA 86 6.081 -2.806 5.829 1438 2HB ALA 86 HB2 ALA 86 4.457 -3.357 6.272 1439 3HB ALA 86 HB3 ALA 86 5.713 -4.531 5.798 1440 H ASP 87 HN ASP 87 5.433 -1.291 2.764 1441 HA ASP 87 HA ASP 87 3.833 0.573 3.991 1442 1HB ASP 87 HB2 ASP 87 5.918 0.893 2.612 1443 2HB ASP 87 HB3 ASP 87 4.889 0.846 1.182 1444 H LYS 88 HN LYS 88 2.057 -1.659 2.807 1445 HA LYS 88 HA LYS 88 0.024 -1.925 1.868 1446 1HB LYS 88 HB2 LYS 88 -0.295 0.379 3.123 1447 2HB LYS 88 HB3 LYS 88 -0.400 1.046 1.500 1448 1HG LYS 88 HG2 LYS 88 -2.291 -0.433 1.000 1449 2HG LYS 88 HG3 LYS 88 -2.159 -1.200 2.585 1450 1HD LYS 88 HD2 LYS 88 -2.731 1.768 2.107 1451 2HD LYS 88 HD3 LYS 88 -3.965 0.533 2.352 1452 1HE LYS 88 HE2 LYS 88 -1.802 1.176 4.401 1453 2HE LYS 88 HE3 LYS 88 -3.368 1.976 4.364 1454 1HZ LYS 88 HZ1 LYS 88 -3.373 0.126 5.912 1455 2HZ LYS 88 HZ2 LYS 88 -4.455 -0.135 4.729 1456 3HZ LYS 88 HZ3 LYS 88 -3.027 -0.950 4.730 1457 H CYS 89 HN CYS 89 2.499 -1.610 0.271 1458 HA CYS 89 HA CYS 89 3.347 -1.125 -1.786 1459 1HB CYS 89 HB2 CYS 89 1.101 -2.891 -2.737 1460 2HB CYS 89 HB3 CYS 89 2.749 -2.820 -3.312 1461 HA PRO 90 HA PRO 90 -0.183 1.833 -2.707 1462 1HB PRO 90 HB2 PRO 90 2.065 3.819 -2.960 1463 2HB PRO 90 HB3 PRO 90 0.441 4.049 -2.249 1464 1HG PRO 90 HG2 PRO 90 2.514 3.687 -0.580 1465 2HG PRO 90 HG3 PRO 90 1.002 2.772 -0.307 1466 1HD PRO 90 HD2 PRO 90 3.493 1.846 -1.808 1467 2HD PRO 90 HD3 PRO 90 2.672 1.021 -0.472 1468 H MET 91 HN MET 91 -1.037 2.125 -4.738 1469 HA MET 91 HA MET 91 0.719 1.373 -6.952 1470 1HB MET 91 HB2 MET 91 -1.389 1.326 -8.290 1471 2HB MET 91 HB3 MET 91 -1.280 0.234 -6.935 1472 1HG MET 91 HG2 MET 91 -3.390 1.073 -6.771 1473 2HG MET 91 HG3 MET 91 -2.561 2.005 -5.575 1474 1HE MET 91 HE1 MET 91 -5.314 2.347 -7.308 1475 2HE MET 91 HE2 MET 91 -4.696 2.900 -5.757 1476 3HE MET 91 HE3 MET 91 -5.370 4.099 -6.976 1477 H THR 92 HN THR 92 0.381 4.291 -5.641 1478 HA THR 92 HA THR 92 0.545 6.454 -6.296 1479 HB THR 92 HB THR 92 2.535 6.740 -7.888 1480 HG1 THR 92 HG1 THR 92 2.223 4.604 -8.783 1481 1HG2 THR 92 HG21 THR 92 2.855 5.068 -5.353 1482 2HG2 THR 92 HG22 THR 92 4.099 6.088 -6.115 1483 3HG2 THR 92 HG23 THR 92 2.662 6.830 -5.412 1484 HA PRO 93 HA PRO 93 -2.407 6.333 -9.652 1485 1HB PRO 93 HB2 PRO 93 -3.653 8.768 -9.296 1486 2HB PRO 93 HB3 PRO 93 -3.932 7.341 -8.240 1487 1HG PRO 93 HG2 PRO 93 -2.030 9.636 -7.737 1488 2HG PRO 93 HG3 PRO 93 -3.270 8.933 -6.636 1489 1HD PRO 93 HD2 PRO 93 -0.680 8.187 -6.468 1490 2HD PRO 93 HD3 PRO 93 -1.991 6.975 -6.309 1491 HA PRO 94 HA PRO 94 0.153 7.925 -12.747 1492 1HB PRO 94 HB2 PRO 94 -1.529 8.186 -14.956 1493 2HB PRO 94 HB3 PRO 94 -0.931 6.643 -14.280 1494 1HG PRO 94 HG2 PRO 94 -3.565 8.036 -13.697 1495 2HG PRO 94 HG3 PRO 94 -3.293 6.316 -14.141 1496 1HD PRO 94 HD2 PRO 94 -3.593 6.988 -11.563 1497 2HD PRO 94 HD3 PRO 94 -2.292 5.846 -12.034 1498 H HIS 95 HN HIS 95 -2.061 10.078 -11.433 1499 HA HIS 95 HA HIS 95 -1.624 12.401 -13.067 1500 1HB HIS 95 HB2 HIS 95 -2.163 12.249 -10.078 1501 2HB HIS 95 HB3 HIS 95 -2.462 13.618 -11.141 1502 HD1 HIS 95 HD1 HIS 95 -4.756 12.243 -9.354 1503 HD2 HIS 95 HD2 HIS 95 -3.978 11.599 -13.445 1504 HE1 HIS 95 HE1 HIS 95 -6.912 11.329 -10.366 1505 H VAL 96 HN VAL 96 0.538 10.533 -11.120 1506 HA VAL 96 HA VAL 96 2.381 12.837 -10.734 1507 HB VAL 96 HB VAL 96 2.179 10.483 -8.828 1508 1HG1 VAL 96 HG11 VAL 96 3.018 12.251 -7.233 1509 2HG1 VAL 96 HG12 VAL 96 4.111 11.962 -8.595 1510 3HG1 VAL 96 HG13 VAL 96 3.064 13.380 -8.589 1511 1HG2 VAL 96 HG21 VAL 96 0.763 11.840 -7.326 1512 2HG2 VAL 96 HG22 VAL 96 0.489 13.004 -8.642 1513 3HG2 VAL 96 HG23 VAL 96 -0.108 11.326 -8.766 1514 H LYS 97 HN LYS 97 4.586 12.417 -11.006 1515 HA LYS 97 HA LYS 97 5.417 10.061 -12.552 1516 1HB LYS 97 HB2 LYS 97 6.166 12.497 -12.821 1517 2HB LYS 97 HB3 LYS 97 7.065 12.315 -11.324 1518 1HG LYS 97 HG2 LYS 97 7.582 10.190 -13.352 1519 2HG LYS 97 HG3 LYS 97 7.965 11.808 -13.922 1520 1HD LYS 97 HD2 LYS 97 8.945 10.664 -11.313 1521 2HD LYS 97 HD3 LYS 97 9.854 10.506 -12.804 1522 1HE LYS 97 HE2 LYS 97 9.122 13.200 -11.517 1523 2HE LYS 97 HE3 LYS 97 10.677 12.390 -11.332 1524 1HZ LYS 97 HZ1 LYS 97 10.958 13.936 -13.022 1525 2HZ LYS 97 HZ2 LYS 97 10.886 12.509 -13.800 1526 3HZ LYS 97 HZ3 LYS 97 9.589 13.512 -13.830 1527 H ARG 98 HN ARG 98 7.174 8.570 -11.629 1528 HA ARG 98 HA ARG 98 7.503 8.706 -8.707 1529 1HB ARG 98 HB2 ARG 98 5.494 7.245 -9.082 1530 2HB ARG 98 HB3 ARG 98 6.494 6.184 -10.084 1531 1HG ARG 98 HG2 ARG 98 7.986 5.821 -8.003 1532 2HG ARG 98 HG3 ARG 98 6.763 6.740 -7.093 1533 1HD ARG 98 HD2 ARG 98 5.069 5.086 -7.941 1534 2HD ARG 98 HD3 ARG 98 6.376 4.133 -8.644 1535 HE ARG 98 HE ARG 98 7.230 4.335 -6.108 1536 1HH1 ARG 98 HH21 ARG 98 3.967 3.474 -7.231 1537 2HH1 ARG 98 HH22 ARG 98 3.657 2.411 -5.913 1538 1HH2 ARG 98 HH11 ARG 98 6.736 3.201 -4.308 1539 2HH2 ARG 98 HH12 ARG 98 5.321 2.179 -4.210 1540 H GLU 99 HN GLU 99 9.416 7.731 -8.009 1541 HA GLU 99 HA GLU 99 10.944 6.018 -9.798 1542 1HB GLU 99 HB2 GLU 99 12.055 8.647 -8.724 1543 2HB GLU 99 HB3 GLU 99 13.049 7.333 -9.363 1544 1HG GLU 99 HG2 GLU 99 11.061 9.006 -10.935 1545 2HG GLU 99 HG3 GLU 99 12.806 9.164 -10.945 1546 H HIS 100 HN HIS 100 12.545 4.843 -8.504 1547 HA HIS 100 HA HIS 100 12.039 4.862 -5.564 1548 1HB HIS 100 HB2 HIS 100 12.851 2.597 -7.444 1549 2HB HIS 100 HB3 HIS 100 12.774 2.478 -5.696 1550 HD1 HIS 100 HD1 HIS 100 10.751 0.983 -5.170 1551 HD2 HIS 100 HD2 HIS 100 10.084 3.653 -8.352 1552 HE1 HIS 100 HE1 HIS 100 8.348 0.621 -5.925 1553 H TRP 101 HN TRP 101 13.835 5.266 -4.304 1554 HA TRP 101 HA TRP 101 16.551 4.891 -5.495 1555 1HB TRP 101 HB2 TRP 101 15.703 7.389 -3.997 1556 2HB TRP 101 HB3 TRP 101 17.268 7.068 -4.712 1557 HD1 TRP 101 HD1 TRP 101 13.673 7.852 -5.699 1558 HE1 TRP 101 HE1 TRP 101 13.644 9.097 -7.928 1559 HE3 TRP 101 HE3 TRP 101 18.597 7.300 -6.988 1560 HZ2 TRP 101 HZ2 TRP 101 15.408 9.418 -10.175 1561 HZ3 TRP 101 HZ3 TRP 101 19.387 8.049 -9.216 1562 HH2 TRP 101 HH2 TRP 101 17.805 9.083 -10.833 1563 H GLY 102 HN GLY 102 14.602 3.992 -2.947 1564 1HA GLY 102 HA2 GLY 102 16.438 4.494 -0.730 1565 2HA GLY 102 HA3 GLY 102 14.995 3.476 -0.705 1566 H PHE 103 HN PHE 103 15.198 1.472 -2.154 1567 HA PHE 103 HA PHE 103 15.868 -0.590 -2.296 1568 1HB PHE 103 HB2 PHE 103 17.905 -1.086 -3.521 1569 2HB PHE 103 HB3 PHE 103 16.967 0.202 -4.230 1570 HD1 PHE 103 HD1 PHE 103 17.907 2.372 -4.624 1571 HD2 PHE 103 HD2 PHE 103 20.080 -0.527 -2.278 1572 HE1 PHE 103 HE1 PHE 103 19.930 3.805 -4.723 1573 HE2 PHE 103 HE2 PHE 103 22.098 0.909 -2.381 1574 HZ PHE 103 HZ PHE 103 22.030 3.077 -3.600 1575 H ASP 104 HN ASP 104 16.536 0.825 0.363 1576 HA ASP 104 HA ASP 104 17.589 -1.489 1.726 1577 1HB ASP 104 HB2 ASP 104 19.662 -0.202 0.921 1578 2HB ASP 104 HB3 ASP 104 19.111 1.154 1.903 1579 H ASP 105 HN ASP 105 17.411 -0.953 4.149 1580 HA ASP 105 HA ASP 105 15.628 1.303 4.764 1581 1HB ASP 105 HB2 ASP 105 14.052 -0.425 4.177 1582 2HB ASP 105 HB3 ASP 105 14.765 -1.521 5.368 1583 HA PRO 106 HA PRO 106 18.708 0.763 8.069 1584 1HB PRO 106 HB2 PRO 106 18.831 3.344 8.919 1585 2HB PRO 106 HB3 PRO 106 19.503 2.841 7.340 1586 1HG PRO 106 HG2 PRO 106 16.826 4.116 7.934 1587 2HG PRO 106 HG3 PRO 106 17.998 4.570 6.665 1588 1HD PRO 106 HD2 PRO 106 15.801 2.876 6.295 1589 2HD PRO 106 HD3 PRO 106 17.273 2.790 5.284 1590 H ALA 107 HN ALA 107 15.309 1.512 8.353 1591 HA ALA 107 HA ALA 107 15.195 1.697 11.210 1592 1HB ALA 107 HB1 ALA 107 12.796 1.400 10.889 1593 2HB ALA 107 HB2 ALA 107 13.373 2.500 9.627 1594 3HB ALA 107 HB3 ALA 107 13.046 0.804 9.240 1595 H ARG 108 HN ARG 108 16.371 -0.737 9.334 1596 HA ARG 108 HA ARG 108 15.140 -2.936 10.972 1597 1HB ARG 108 HB2 ARG 108 16.154 -3.364 8.156 1598 2HB ARG 108 HB3 ARG 108 15.087 -4.370 9.127 1599 1HG ARG 108 HG2 ARG 108 14.409 -1.735 7.808 1600 2HG ARG 108 HG3 ARG 108 13.951 -3.332 7.227 1601 1HD ARG 108 HD2 ARG 108 12.957 -1.903 9.691 1602 2HD ARG 108 HD3 ARG 108 12.024 -2.364 8.273 1603 HE ARG 108 HE ARG 108 12.232 -4.691 8.913 1604 1HH1 ARG 108 HH11 ARG 108 13.005 -2.364 11.537 1605 2HH1 ARG 108 HH12 ARG 108 12.508 -3.449 12.783 1606 1HH2 ARG 108 HH21 ARG 108 11.666 -6.112 10.606 1607 2HH2 ARG 108 HH22 ARG 108 11.786 -5.621 12.251 1608 H ALA 109 HN ALA 109 17.893 -2.205 8.821 1609 HA ALA 109 HA ALA 109 20.048 -2.892 8.830 1610 1HB ALA 109 HB1 ALA 109 19.976 -2.361 11.826 1611 2HB ALA 109 HB2 ALA 109 21.323 -2.105 10.712 1612 3HB ALA 109 HB3 ALA 109 19.910 -1.035 10.629 1613 H GLN 110 HN GLN 110 21.743 -4.025 10.556 1614 HA GLN 110 HA GLN 110 20.632 -6.749 11.092 1615 1HB GLN 110 HB2 GLN 110 22.836 -6.749 9.858 1616 2HB GLN 110 HB3 GLN 110 23.525 -5.846 11.228 1617 1HG GLN 110 HG2 GLN 110 24.052 -8.275 11.289 1618 2HG GLN 110 HG3 GLN 110 23.276 -7.640 12.728 1619 1HE2 GLN 110 HE22 GLN 110 21.767 -9.058 13.572 1620 2HE2 GLN 110 HE21 GLN 110 20.723 -10.075 12.620 1621 H GLY 111 HN GLY 111 20.482 -7.184 13.278 1622 1HA GLY 111 HA2 GLY 111 20.099 -4.764 14.819 1623 2HA GLY 111 HA3 GLY 111 19.604 -6.412 15.293 1624 H THR 112 HN THR 112 22.717 -4.634 14.720 1625 HA THR 112 HA THR 112 23.534 -5.316 17.491 1626 HB THR 112 HB THR 112 25.812 -5.573 16.899 1627 HG1 THR 112 HG1 THR 112 26.498 -5.450 14.731 1628 1HG2 THR 112 HG21 THR 112 25.854 -7.560 15.565 1629 2HG2 THR 112 HG22 THR 112 24.341 -7.564 16.509 1630 3HG2 THR 112 HG23 THR 112 24.317 -7.127 14.776 1631 H GLU 113 HN GLU 113 25.076 -3.597 18.290 1632 HA GLU 113 HA GLU 113 23.780 -1.144 17.881 1633 1HB GLU 113 HB2 GLU 113 26.538 -1.762 19.079 1634 2HB GLU 113 HB3 GLU 113 25.656 -0.238 19.328 1635 1HG GLU 113 HG2 GLU 113 23.775 -1.560 20.357 1636 2HG GLU 113 HG3 GLU 113 24.768 -3.013 20.221 1637 H GLU 114 HN GLU 114 26.740 -2.507 16.528 1638 HA GLU 114 HA GLU 114 27.691 -0.059 15.346 1639 1HB GLU 114 HB2 GLU 114 29.256 -1.740 14.174 1640 2HB GLU 114 HB3 GLU 114 29.434 -1.511 15.925 1641 1HG GLU 114 HG2 GLU 114 28.101 -3.608 16.276 1642 2HG GLU 114 HG3 GLU 114 28.057 -3.803 14.507 1643 H GLU 115 HN GLU 115 25.837 -3.049 14.275 1644 HA GLU 115 HA GLU 115 26.112 -2.163 11.554 1645 1HB GLU 115 HB2 GLU 115 24.453 -4.332 12.806 1646 2HB GLU 115 HB3 GLU 115 24.493 -3.961 11.073 1647 1HG GLU 115 HG2 GLU 115 27.071 -4.509 12.598 1648 2HG GLU 115 HG3 GLU 115 26.078 -5.826 11.974 1649 H LYS 116 HN LYS 116 23.651 -1.772 14.119 1650 HA LYS 116 HA LYS 116 21.679 -0.508 12.545 1651 1HB LYS 116 HB2 LYS 116 22.595 -0.256 15.434 1652 2HB LYS 116 HB3 LYS 116 21.424 0.892 14.818 1653 1HG LYS 116 HG2 LYS 116 20.939 -2.077 14.514 1654 2HG LYS 116 HG3 LYS 116 20.545 -1.209 16.011 1655 1HD LYS 116 HD2 LYS 116 19.066 0.332 14.832 1656 2HD LYS 116 HD3 LYS 116 19.616 -0.255 13.264 1657 1HE LYS 116 HE2 LYS 116 17.514 -1.131 13.543 1658 2HE LYS 116 HE3 LYS 116 18.653 -2.482 13.777 1659 1HZ LYS 116 HZ1 LYS 116 18.307 -2.249 16.185 1660 2HZ LYS 116 HZ2 LYS 116 17.258 -1.015 15.955 1661 3HZ LYS 116 HZ3 LYS 116 16.884 -2.511 15.439 1662 H TRP 117 HN TRP 117 24.396 1.062 14.290 1663 HA TRP 117 HA TRP 117 23.907 3.610 13.148 1664 1HB TRP 117 HB2 TRP 117 25.367 3.069 15.136 1665 2HB TRP 117 HB3 TRP 117 26.603 2.504 14.022 1666 HD1 TRP 117 HD1 TRP 117 25.458 5.430 12.283 1667 HE1 TRP 117 HE1 TRP 117 26.850 7.475 12.783 1668 HE3 TRP 117 HE3 TRP 117 27.685 3.806 16.609 1669 HZ2 TRP 117 HZ2 TRP 117 28.546 8.400 14.900 1670 HZ3 TRP 117 HZ3 TRP 117 29.174 5.336 17.876 1671 HH2 TRP 117 HH2 TRP 117 29.620 7.638 17.039 1672 H ALA 118 HN ALA 118 25.959 0.901 12.009 1673 HA ALA 118 HA ALA 118 27.088 2.172 9.799 1674 1HB ALA 118 HB1 ALA 118 27.724 -0.101 10.797 1675 2HB ALA 118 HB2 ALA 118 26.279 -0.765 10.035 1676 3HB ALA 118 HB3 ALA 118 27.577 -0.111 9.021 1677 H PHE 119 HN PHE 119 23.942 0.434 9.957 1678 HA PHE 119 HA PHE 119 23.347 0.837 7.174 1679 1HB PHE 119 HB2 PHE 119 21.786 0.014 9.599 1680 2HB PHE 119 HB3 PHE 119 20.887 0.646 8.248 1681 HD1 PHE 119 HD1 PHE 119 20.088 -0.820 6.626 1682 HD2 PHE 119 HD2 PHE 119 23.642 -1.890 8.834 1683 HE1 PHE 119 HE1 PHE 119 20.080 -3.062 5.581 1684 HE2 PHE 119 HE2 PHE 119 23.606 -4.138 7.804 1685 HZ PHE 119 HZ PHE 119 21.830 -4.729 6.164 1686 H PHE 120 HN PHE 120 22.589 2.762 10.165 1687 HA PHE 120 HA PHE 120 20.975 4.683 8.824 1688 1HB PHE 120 HB2 PHE 120 22.875 5.480 11.037 1689 2HB PHE 120 HB3 PHE 120 21.332 6.188 10.600 1690 HD1 PHE 120 HD1 PHE 120 22.159 5.716 13.344 1691 HD2 PHE 120 HD2 PHE 120 20.090 3.054 10.648 1692 HE1 PHE 120 HE1 PHE 120 21.175 4.509 15.273 1693 HE2 PHE 120 HE2 PHE 120 19.070 1.906 12.565 1694 HZ PHE 120 HZ PHE 120 19.631 2.607 14.895 1695 H GLN 121 HN GLN 121 24.526 4.612 9.424 1696 HA GLN 121 HA GLN 121 25.094 7.087 8.225 1697 1HB GLN 121 HB2 GLN 121 26.513 5.906 9.820 1698 2HB GLN 121 HB3 GLN 121 26.835 4.619 8.645 1699 1HG GLN 121 HG2 GLN 121 27.995 6.130 7.170 1700 2HG GLN 121 HG3 GLN 121 27.461 7.541 8.109 1701 1HE2 GLN 121 HE22 GLN 121 28.087 7.512 10.552 1702 2HE2 GLN 121 HE21 GLN 121 29.728 6.987 10.888 1703 H ARG 122 HN ARG 122 25.152 3.742 6.848 1704 HA ARG 122 HA ARG 122 26.192 4.484 4.344 1705 1HB ARG 122 HB2 ARG 122 25.957 2.124 5.154 1706 2HB ARG 122 HB3 ARG 122 24.203 2.267 5.085 1707 1HG ARG 122 HG2 ARG 122 24.616 2.768 2.504 1708 2HG ARG 122 HG3 ARG 122 26.187 2.021 2.812 1709 1HD ARG 122 HD2 ARG 122 23.417 0.835 3.237 1710 2HD ARG 122 HD3 ARG 122 24.576 0.365 1.992 1711 HE ARG 122 HE ARG 122 26.085 -0.330 3.919 1712 1HH1 ARG 122 HH11 ARG 122 22.496 -0.655 4.095 1713 2HH1 ARG 122 HH12 ARG 122 22.574 -1.776 5.401 1714 1HH2 ARG 122 HH21 ARG 122 26.105 -1.890 5.597 1715 2HH2 ARG 122 HH22 ARG 122 24.627 -2.535 6.210 1716 H VAL 123 HN VAL 123 22.762 4.065 5.413 1717 HA VAL 123 HA VAL 123 21.686 4.800 2.879 1718 HB VAL 123 HB VAL 123 20.414 4.693 5.646 1719 1HG1 VAL 123 HG11 VAL 123 19.152 4.974 2.879 1720 2HG1 VAL 123 HG12 VAL 123 18.249 4.516 4.331 1721 3HG1 VAL 123 HG13 VAL 123 19.021 6.098 4.251 1722 1HG2 VAL 123 HG21 VAL 123 21.281 2.489 4.785 1723 2HG2 VAL 123 HG22 VAL 123 19.525 2.515 4.871 1724 3HG2 VAL 123 HG23 VAL 123 20.341 2.721 3.306 1725 H ARG 124 HN ARG 124 22.331 6.794 5.870 1726 HA ARG 124 HA ARG 124 20.996 9.031 4.779 1727 1HB ARG 124 HB2 ARG 124 21.754 10.276 6.596 1728 2HB ARG 124 HB3 ARG 124 21.609 8.633 7.168 1729 1HG ARG 124 HG2 ARG 124 23.494 9.140 8.197 1730 2HG ARG 124 HG3 ARG 124 24.221 8.544 6.721 1731 1HD ARG 124 HD2 ARG 124 23.613 11.453 6.671 1732 2HD ARG 124 HD3 ARG 124 24.655 11.000 7.990 1733 HE ARG 124 HE ARG 124 25.284 10.872 5.113 1734 1HH1 ARG 124 HH21 ARG 124 26.360 9.903 8.369 1735 2HH1 ARG 124 HH22 ARG 124 28.042 10.125 8.005 1736 1HH2 ARG 124 HH11 ARG 124 27.571 10.843 4.561 1737 2HH2 ARG 124 HH12 ARG 124 28.713 10.589 5.821 1738 H ASP 125 HN ASP 125 24.364 8.014 4.379 1739 HA ASP 125 HA ASP 125 25.159 10.442 3.072 1740 1HB ASP 125 HB2 ASP 125 26.669 8.578 3.982 1741 2HB ASP 125 HB3 ASP 125 26.321 7.693 2.492 1742 H GLU 126 HN GLU 126 23.764 7.389 1.832 1743 HA GLU 126 HA GLU 126 23.895 8.113 -0.932 1744 1HB GLU 126 HB2 GLU 126 23.591 5.787 0.055 1745 2HB GLU 126 HB3 GLU 126 21.930 6.225 0.443 1746 1HG GLU 126 HG2 GLU 126 21.886 4.999 -1.606 1747 2HG GLU 126 HG3 GLU 126 21.532 6.672 -2.014 1748 H ILE 127 HN ILE 127 21.236 8.340 1.503 1749 HA ILE 127 HA ILE 127 19.295 9.502 -0.183 1750 HB ILE 127 HB ILE 127 19.742 9.553 2.820 1751 1HG1 ILE 127 HG12 ILE 127 17.685 8.268 0.954 1752 2HG1 ILE 127 HG13 ILE 127 18.972 7.441 1.820 1753 1HG2 ILE 127 HG21 ILE 127 17.294 10.750 1.470 1754 2HG2 ILE 127 HG22 ILE 127 17.636 10.647 3.212 1755 3HG2 ILE 127 HG23 ILE 127 18.587 11.719 2.208 1756 1HD1 ILE 127 HD11 ILE 127 17.824 8.124 3.993 1757 2HD1 ILE 127 HD12 ILE 127 16.458 8.697 3.011 1758 3HD1 ILE 127 HD13 ILE 127 16.929 6.992 2.965 1759 H GLY 128 HN GLY 128 21.815 11.162 1.870 1760 1HA GLY 128 HA2 GLY 128 20.919 13.764 1.256 1761 2HA GLY 128 HA3 GLY 128 22.584 13.315 1.714 1762 H ASN 129 HN ASN 129 23.385 11.746 -0.445 1763 HA ASN 129 HA ASN 129 24.030 13.740 -2.353 1764 1HB ASN 129 HB2 ASN 129 25.470 11.781 -1.867 1765 2HB ASN 129 HB3 ASN 129 24.235 10.708 -2.535 1766 1HD2 ASN 129 HD22 ASN 129 25.157 9.930 -4.433 1767 2HD2 ASN 129 HD21 ASN 129 25.833 10.945 -5.681 1768 H ARG 130 HN ARG 130 21.660 11.068 -2.437 1769 HA ARG 130 HA ARG 130 20.755 11.590 -5.128 1770 1HB ARG 130 HB2 ARG 130 19.715 10.043 -2.760 1771 2HB ARG 130 HB3 ARG 130 18.543 10.529 -3.968 1772 1HG ARG 130 HG2 ARG 130 19.433 8.260 -4.312 1773 2HG ARG 130 HG3 ARG 130 19.587 9.311 -5.711 1774 1HD ARG 130 HD2 ARG 130 21.944 9.008 -3.838 1775 2HD ARG 130 HD3 ARG 130 21.527 7.695 -4.943 1776 HE ARG 130 HE ARG 130 21.673 10.244 -6.335 1777 1HH1 ARG 130 HH11 ARG 130 23.746 7.657 -5.009 1778 2HH1 ARG 130 HH12 ARG 130 24.866 7.730 -6.336 1779 1HH2 ARG 130 HH21 ARG 130 23.169 10.450 -7.935 1780 2HH2 ARG 130 HH22 ARG 130 24.558 9.400 -8.038 1781 H LEU 131 HN LEU 131 19.520 12.792 -1.931 1782 HA LEU 131 HA LEU 131 17.444 14.217 -3.205 1783 1HB LEU 131 HB2 LEU 131 18.519 14.192 -0.436 1784 2HB LEU 131 HB3 LEU 131 17.656 15.630 -0.931 1785 HG LEU 131 HG LEU 131 16.131 14.076 0.125 1786 1HD1 LEU 131 HD11 LEU 131 15.328 15.538 -1.809 1787 2HD1 LEU 131 HD12 LEU 131 15.395 14.094 -2.833 1788 3HD1 LEU 131 HD13 LEU 131 14.341 14.110 -1.436 1789 1HD2 LEU 131 HD21 LEU 131 16.673 12.108 -2.141 1790 2HD2 LEU 131 HD22 LEU 131 17.228 11.936 -0.467 1791 3HD2 LEU 131 HD23 LEU 131 15.497 11.927 -0.826 1792 H LYS 132 HN LYS 132 20.817 15.167 -2.553 1793 HA LYS 132 HA LYS 132 20.532 17.898 -3.266 1794 1HB LYS 132 HB2 LYS 132 22.506 16.685 -2.215 1795 2HB LYS 132 HB3 LYS 132 22.902 16.067 -3.819 1796 1HG LYS 132 HG2 LYS 132 23.207 18.351 -4.658 1797 2HG LYS 132 HG3 LYS 132 22.702 19.032 -3.101 1798 1HD LYS 132 HD2 LYS 132 25.064 17.136 -3.416 1799 2HD LYS 132 HD3 LYS 132 25.216 18.906 -3.524 1800 1HE LYS 132 HE2 LYS 132 24.326 19.131 -1.235 1801 2HE LYS 132 HE3 LYS 132 24.177 17.374 -1.103 1802 1HZ LYS 132 HZ1 LYS 132 26.214 18.161 -0.080 1803 2HZ LYS 132 HZ2 LYS 132 26.591 17.220 -1.355 1804 3HZ LYS 132 HZ3 LYS 132 26.725 18.845 -1.466 1805 H GLU 133 HN GLU 133 20.851 14.948 -5.347 1806 HA GLU 133 HA GLU 133 21.176 16.445 -7.740 1807 1HB GLU 133 HB2 GLU 133 20.080 13.654 -7.211 1808 2HB GLU 133 HB3 GLU 133 20.031 14.351 -8.829 1809 1HG GLU 133 HG2 GLU 133 22.287 14.524 -9.051 1810 2HG GLU 133 HG3 GLU 133 22.624 14.362 -7.311 1811 H PHE 134 HN PHE 134 18.129 15.709 -5.929 1812 HA PHE 134 HA PHE 134 16.522 16.324 -8.238 1813 1HB PHE 134 HB2 PHE 134 15.767 16.713 -5.313 1814 2HB PHE 134 HB3 PHE 134 14.658 16.825 -6.670 1815 HD1 PHE 134 HD1 PHE 134 17.083 14.546 -5.130 1816 HD2 PHE 134 HD2 PHE 134 13.440 14.862 -7.311 1817 HE1 PHE 134 HE1 PHE 134 16.740 12.078 -4.828 1818 HE2 PHE 134 HE2 PHE 134 13.011 12.418 -6.914 1819 HZ PHE 134 HZ PHE 134 14.679 11.029 -5.732 1820 H ALA 135 HN ALA 135 18.061 18.277 -5.740 1821 HA ALA 135 HA ALA 135 16.834 20.735 -6.365 1822 1HB ALA 135 HB1 ALA 135 19.688 20.657 -5.408 1823 2HB ALA 135 HB2 ALA 135 18.299 21.621 -4.818 1824 3HB ALA 135 HB3 ALA 135 18.478 19.904 -4.376 1825 H GLU 136 HN GLU 136 19.624 19.008 -7.687 1826 HA GLU 136 HA GLU 136 20.618 21.189 -9.276 1827 1HB GLU 136 HB2 GLU 136 21.311 18.238 -9.123 1828 2HB GLU 136 HB3 GLU 136 22.196 19.383 -10.117 1829 1HG GLU 136 HG2 GLU 136 21.886 19.756 -7.112 1830 2HG GLU 136 HG3 GLU 136 23.156 18.772 -7.820 1831 H THR 137 HN THR 137 18.944 18.162 -9.895 1832 HA THR 137 HA THR 137 19.010 18.420 -12.804 1833 HB THR 137 HB THR 137 18.200 16.116 -12.739 1834 HG1 THR 137 HG1 THR 137 18.199 16.299 -9.931 1835 1HG2 THR 137 HG21 THR 137 20.608 16.426 -12.464 1836 2HG2 THR 137 HG22 THR 137 20.440 16.519 -10.706 1837 3HG2 THR 137 HG23 THR 137 20.034 15.019 -11.552 1838 H GLY 138 HN GLY 138 16.734 19.069 -10.225 1839 1HA GLY 138 HA2 GLY 138 14.542 19.598 -10.168 1840 2HA GLY 138 HA3 GLY 138 14.583 19.959 -11.919 1841 H LYS 139 HN LYS 139 15.684 16.905 -10.806 1842 HA LYS 139 HA LYS 139 15.317 14.955 -11.651 1843 1HB LYS 139 HB2 LYS 139 14.320 15.122 -9.352 1844 2HB LYS 139 HB3 LYS 139 12.725 15.027 -10.125 1845 1HG LYS 139 HG2 LYS 139 13.428 12.837 -9.415 1846 2HG LYS 139 HG3 LYS 139 13.346 12.906 -11.172 1847 1HD LYS 139 HD2 LYS 139 15.231 11.579 -10.402 1848 2HD LYS 139 HD3 LYS 139 15.811 12.960 -11.317 1849 1HE LYS 139 HE2 LYS 139 16.420 14.138 -9.252 1850 2HE LYS 139 HE3 LYS 139 15.686 12.861 -8.271 1851 1HZ LYS 139 HZ1 LYS 139 17.356 11.323 -9.134 1852 2HZ LYS 139 HZ2 LYS 139 18.059 12.521 -10.007 1853 3HZ LYS 139 HZ3 LYS 139 18.058 12.575 -8.369 Start of MODEL 4 1 1H MET 1 H1 MET 1 -23.641 -10.491 -8.142 2 2H MET 1 H2 MET 1 -23.549 -12.096 -7.911 3 3H MET 1 H3 MET 1 -25.011 -11.325 -7.824 4 HA MET 1 HA MET 1 -25.136 -12.329 -9.851 5 1HB MET 1 HB2 MET 1 -25.637 -9.911 -10.026 6 2HB MET 1 HB3 MET 1 -23.948 -9.576 -10.416 7 1HG MET 1 HG2 MET 1 -24.192 -11.040 -12.461 8 2HG MET 1 HG3 MET 1 -25.890 -11.268 -12.040 9 1HE MET 1 HE1 MET 1 -23.947 -7.404 -13.711 10 2HE MET 1 HE2 MET 1 -23.456 -8.046 -12.132 11 3HE MET 1 HE3 MET 1 -23.169 -8.998 -13.606 12 H ALA 2 HN ALA 2 -21.965 -10.556 -10.144 13 HA ALA 2 HA ALA 2 -20.437 -12.976 -10.413 14 1HB ALA 2 HB1 ALA 2 -19.577 -12.420 -12.680 15 2HB ALA 2 HB2 ALA 2 -21.310 -12.763 -12.763 16 3HB ALA 2 HB3 ALA 2 -20.735 -11.080 -12.807 17 H ILE 3 HN ILE 3 -18.109 -12.230 -10.810 18 HA ILE 3 HA ILE 3 -17.583 -9.719 -9.389 19 HB ILE 3 HB ILE 3 -15.911 -12.139 -10.151 20 1HG1 ILE 3 HG12 ILE 3 -15.116 -11.844 -7.781 21 2HG1 ILE 3 HG13 ILE 3 -16.274 -10.529 -7.590 22 1HG2 ILE 3 HG21 ILE 3 -13.879 -10.865 -9.440 23 2HG2 ILE 3 HG22 ILE 3 -14.548 -10.273 -10.956 24 3HG2 ILE 3 HG23 ILE 3 -14.852 -9.369 -9.457 25 1HD1 ILE 3 HD11 ILE 3 -16.950 -13.431 -8.150 26 2HD1 ILE 3 HD12 ILE 3 -17.024 -12.564 -6.598 27 3HD1 ILE 3 HD13 ILE 3 -18.126 -12.101 -7.898 28 H VAL 4 HN VAL 4 -18.163 -8.110 -10.699 29 HA VAL 4 HA VAL 4 -17.740 -8.136 -13.603 30 HB VAL 4 HB VAL 4 -18.860 -6.044 -11.693 31 1HG1 VAL 4 HG11 VAL 4 -20.091 -5.155 -13.680 32 2HG1 VAL 4 HG12 VAL 4 -18.364 -4.936 -13.803 33 3HG1 VAL 4 HG13 VAL 4 -19.154 -6.248 -14.718 34 1HG2 VAL 4 HG21 VAL 4 -21.124 -6.794 -12.476 35 2HG2 VAL 4 HG22 VAL 4 -20.346 -8.163 -13.299 36 3HG2 VAL 4 HG23 VAL 4 -20.284 -8.008 -11.528 37 H LYS 5 HN LYS 5 -16.707 -6.010 -14.453 38 HA LYS 5 HA LYS 5 -14.406 -5.209 -12.823 39 1HB LYS 5 HB2 LYS 5 -12.992 -5.159 -14.846 40 2HB LYS 5 HB3 LYS 5 -13.506 -6.780 -14.376 41 1HG LYS 5 HG2 LYS 5 -15.347 -6.618 -16.133 42 2HG LYS 5 HG3 LYS 5 -14.603 -5.104 -16.678 43 1HD LYS 5 HD2 LYS 5 -12.544 -6.279 -17.263 44 2HD LYS 5 HD3 LYS 5 -13.147 -7.784 -16.522 45 1HE LYS 5 HE2 LYS 5 -15.029 -7.840 -18.123 46 2HE LYS 5 HE3 LYS 5 -14.450 -6.351 -18.881 47 1HZ LYS 5 HZ1 LYS 5 -12.429 -7.539 -19.520 48 2HZ LYS 5 HZ2 LYS 5 -12.965 -8.918 -18.823 49 3HZ LYS 5 HZ3 LYS 5 -13.740 -8.299 -20.115 50 H ALA 6 HN ALA 6 -14.164 -3.098 -12.691 51 HA ALA 6 HA ALA 6 -16.074 -1.289 -14.076 52 1HB ALA 6 HB1 ALA 6 -15.015 0.310 -12.329 53 2HB ALA 6 HB2 ALA 6 -16.191 -0.858 -11.807 54 3HB ALA 6 HB3 ALA 6 -14.463 -1.172 -11.534 55 H THR 7 HN THR 7 -14.891 0.963 -14.404 56 HA THR 7 HA THR 7 -12.110 1.134 -14.705 57 HB THR 7 HB THR 7 -12.461 -0.089 -16.794 58 HG1 THR 7 HG1 THR 7 -11.380 1.318 -18.082 59 1HG2 THR 7 HG21 THR 7 -14.731 0.423 -17.392 60 2HG2 THR 7 HG22 THR 7 -14.358 2.156 -17.580 61 3HG2 THR 7 HG23 THR 7 -13.673 0.956 -18.698 62 H ASP 8 HN ASP 8 -11.981 3.406 -16.122 63 HA ASP 8 HA ASP 8 -12.132 5.375 -14.359 64 1HB ASP 8 HB2 ASP 8 -10.987 5.599 -16.429 65 2HB ASP 8 HB3 ASP 8 -12.482 5.493 -17.358 66 H GLN 9 HN GLN 9 -14.995 4.564 -16.299 67 HA GLN 9 HA GLN 9 -16.600 6.430 -14.674 68 1HB GLN 9 HB2 GLN 9 -16.548 6.199 -17.701 69 2HB GLN 9 HB3 GLN 9 -17.918 6.908 -16.834 70 1HG GLN 9 HG2 GLN 9 -16.603 8.705 -15.957 71 2HG GLN 9 HG3 GLN 9 -15.093 7.940 -16.412 72 1HE2 GLN 9 HE22 GLN 9 -14.129 8.642 -18.244 73 2HE2 GLN 9 HE21 GLN 9 -14.947 9.476 -19.564 74 H SER 10 HN SER 10 -16.463 3.454 -16.685 75 HA SER 10 HA SER 10 -19.068 2.596 -16.260 76 1HB SER 10 HB2 SER 10 -16.657 0.769 -16.311 77 2HB SER 10 HB3 SER 10 -18.303 0.434 -16.877 78 HG SER 10 HG SER 10 -16.987 0.955 -18.641 79 H PHE 11 HN PHE 11 -16.460 2.773 -13.860 80 HA PHE 11 HA PHE 11 -17.443 1.007 -11.880 81 1HB PHE 11 HB2 PHE 11 -15.367 2.218 -11.502 82 2HB PHE 11 HB3 PHE 11 -16.146 3.750 -11.760 83 HD1 PHE 11 HD1 PHE 11 -15.908 0.873 -9.262 84 HD2 PHE 11 HD2 PHE 11 -17.182 4.959 -10.028 85 HE1 PHE 11 HE1 PHE 11 -16.064 1.328 -6.846 86 HE2 PHE 11 HE2 PHE 11 -17.433 5.321 -7.596 87 HZ PHE 11 HZ PHE 11 -16.824 3.523 -5.999 88 H SER 12 HN SER 12 -18.388 4.472 -12.501 89 HA SER 12 HA SER 12 -20.353 4.517 -10.489 90 1HB SER 12 HB2 SER 12 -20.451 6.023 -13.139 91 2HB SER 12 HB3 SER 12 -21.092 6.555 -11.578 92 HG SER 12 HG SER 12 -19.087 7.568 -12.058 93 H ALA 13 HN ALA 13 -20.541 3.703 -13.977 94 HA ALA 13 HA ALA 13 -23.328 3.594 -14.079 95 1HB ALA 13 HB1 ALA 13 -21.818 3.701 -16.047 96 2HB ALA 13 HB2 ALA 13 -21.337 2.009 -15.761 97 3HB ALA 13 HB3 ALA 13 -23.013 2.391 -16.202 98 H GLU 14 HN GLU 14 -20.975 1.066 -13.207 99 HA GLU 14 HA GLU 14 -22.953 -0.992 -12.932 100 1HB GLU 14 HB2 GLU 14 -20.011 -0.792 -12.229 101 2HB GLU 14 HB3 GLU 14 -20.963 -2.216 -11.828 102 1HG GLU 14 HG2 GLU 14 -20.584 -1.104 -14.629 103 2HG GLU 14 HG3 GLU 14 -19.741 -2.494 -13.944 104 H THR 15 HN THR 15 -22.037 1.601 -10.826 105 HA THR 15 HA THR 15 -22.802 0.038 -8.409 106 HB THR 15 HB THR 15 -21.354 1.625 -7.200 107 HG1 THR 15 HG1 THR 15 -20.367 2.449 -9.677 108 1HG2 THR 15 HG21 THR 15 -20.029 0.068 -9.472 109 2HG2 THR 15 HG22 THR 15 -19.107 1.019 -8.313 110 3HG2 THR 15 HG23 THR 15 -20.118 -0.321 -7.741 111 H SER 16 HN SER 16 -24.115 2.364 -10.441 112 HA SER 16 HA SER 16 -25.045 4.279 -8.532 113 1HB SER 16 HB2 SER 16 -25.917 3.675 -11.374 114 2HB SER 16 HB3 SER 16 -26.492 5.051 -10.411 115 HG SER 16 HG SER 16 -23.780 4.503 -11.088 116 H GLU 17 HN GLU 17 -26.106 1.085 -8.911 117 HA GLU 17 HA GLU 17 -28.658 1.697 -7.626 118 1HB GLU 17 HB2 GLU 17 -28.328 0.052 -10.179 119 2HB GLU 17 HB3 GLU 17 -29.769 -0.008 -9.153 120 1HG GLU 17 HG2 GLU 17 -30.103 2.446 -9.527 121 2HG GLU 17 HG3 GLU 17 -28.742 2.436 -10.653 122 H GLY 18 HN GLY 18 -29.484 -0.125 -6.416 123 1HA GLY 18 HA2 GLY 18 -29.390 -1.985 -5.162 124 2HA GLY 18 HA3 GLY 18 -28.194 -2.665 -6.285 125 H VAL 19 HN VAL 19 -27.191 -3.517 -4.379 126 HA VAL 19 HA VAL 19 -25.305 -1.582 -3.144 127 HB VAL 19 HB VAL 19 -26.338 -4.089 -1.754 128 1HG1 VAL 19 HG11 VAL 19 -25.073 -3.189 0.173 129 2HG1 VAL 19 HG12 VAL 19 -23.987 -3.490 -1.184 130 3HG1 VAL 19 HG13 VAL 19 -24.508 -1.832 -0.807 131 1HG2 VAL 19 HG21 VAL 19 -28.137 -2.550 -1.682 132 2HG2 VAL 19 HG22 VAL 19 -27.281 -2.250 -0.164 133 3HG2 VAL 19 HG23 VAL 19 -27.060 -1.155 -1.527 134 H VAL 20 HN VAL 20 -23.306 -1.826 -3.515 135 HA VAL 20 HA VAL 20 -22.462 -4.156 -5.126 136 HB VAL 20 HB VAL 20 -22.099 -1.234 -5.940 137 1HG1 VAL 20 HG11 VAL 20 -21.470 -3.879 -7.310 138 2HG1 VAL 20 HG12 VAL 20 -21.384 -2.290 -8.098 139 3HG1 VAL 20 HG13 VAL 20 -20.307 -2.666 -6.744 140 1HG2 VAL 20 HG21 VAL 20 -23.672 -1.876 -7.854 141 2HG2 VAL 20 HG22 VAL 20 -24.133 -3.287 -6.899 142 3HG2 VAL 20 HG23 VAL 20 -24.425 -1.651 -6.282 143 H LEU 21 HN LEU 21 -20.665 -4.881 -4.376 144 HA LEU 21 HA LEU 21 -18.925 -3.283 -2.570 145 1HB LEU 21 HB2 LEU 21 -19.669 -5.553 -1.873 146 2HB LEU 21 HB3 LEU 21 -18.938 -6.232 -3.328 147 HG LEU 21 HG LEU 21 -16.686 -5.529 -2.525 148 1HD1 LEU 21 HD11 LEU 21 -17.220 -3.578 -1.173 149 2HD1 LEU 21 HD12 LEU 21 -18.266 -4.549 -0.097 150 3HD1 LEU 21 HD13 LEU 21 -16.514 -4.789 -0.111 151 1HD2 LEU 21 HD21 LEU 21 -17.590 -7.769 -1.965 152 2HD2 LEU 21 HD22 LEU 21 -16.518 -7.157 -0.696 153 3HD2 LEU 21 HD23 LEU 21 -18.279 -7.119 -0.461 154 H ALA 22 HN ALA 22 -17.544 -1.971 -3.850 155 HA ALA 22 HA ALA 22 -16.380 -3.203 -6.253 156 1HB ALA 22 HB1 ALA 22 -17.149 -0.829 -6.400 157 2HB ALA 22 HB2 ALA 22 -15.913 -0.402 -5.178 158 3HB ALA 22 HB3 ALA 22 -15.440 -1.038 -6.772 159 H ASP 23 HN ASP 23 -14.116 -3.455 -6.445 160 HA ASP 23 HA ASP 23 -12.534 -3.541 -3.938 161 1HB ASP 23 HB2 ASP 23 -13.447 -5.762 -4.071 162 2HB ASP 23 HB3 ASP 23 -13.150 -5.848 -5.801 163 H PHE 24 HN PHE 24 -10.275 -3.565 -4.323 164 HA PHE 24 HA PHE 24 -9.416 -2.634 -7.024 165 1HB PHE 24 HB2 PHE 24 -8.966 -1.436 -4.277 166 2HB PHE 24 HB3 PHE 24 -8.092 -0.936 -5.708 167 HD1 PHE 24 HD1 PHE 24 -8.991 0.703 -7.146 168 HD2 PHE 24 HD2 PHE 24 -11.605 -1.182 -4.304 169 HE1 PHE 24 HE1 PHE 24 -10.846 2.241 -7.807 170 HE2 PHE 24 HE2 PHE 24 -13.456 0.275 -5.023 171 HZ PHE 24 HZ PHE 24 -13.078 2.014 -6.763 172 H TRP 25 HN TRP 25 -7.911 -4.010 -7.701 173 HA TRP 25 HA TRP 25 -6.107 -5.411 -5.802 174 1HB TRP 25 HB2 TRP 25 -6.564 -7.476 -6.712 175 2HB TRP 25 HB3 TRP 25 -8.163 -6.772 -6.627 176 HD1 TRP 25 HD1 TRP 25 -8.953 -5.592 -9.075 177 HE1 TRP 25 HE1 TRP 25 -8.541 -6.277 -11.474 178 HE3 TRP 25 HE3 TRP 25 -5.167 -8.932 -8.262 179 HZ2 TRP 25 HZ2 TRP 25 -6.552 -7.915 -12.924 180 HZ3 TRP 25 HZ3 TRP 25 -4.002 -9.998 -10.162 181 HH2 TRP 25 HH2 TRP 25 -4.684 -9.487 -12.498 182 H ALA 26 HN ALA 26 -3.990 -5.916 -6.891 183 HA ALA 26 HA ALA 26 -3.695 -5.631 -9.713 184 1HB ALA 26 HB1 ALA 26 -1.914 -3.715 -9.488 185 2HB ALA 26 HB2 ALA 26 -3.610 -3.268 -9.466 186 3HB ALA 26 HB3 ALA 26 -2.710 -3.407 -7.933 187 HA PRO 27 HA PRO 27 -0.128 -8.122 -9.036 188 1HB PRO 27 HB2 PRO 27 1.458 -6.145 -10.682 189 2HB PRO 27 HB3 PRO 27 1.422 -7.932 -10.800 190 1HG PRO 27 HG2 PRO 27 -0.014 -6.418 -12.536 191 2HG PRO 27 HG3 PRO 27 -0.769 -7.884 -11.813 192 1HD PRO 27 HD2 PRO 27 -1.112 -5.004 -11.040 193 2HD PRO 27 HD3 PRO 27 -2.335 -6.302 -11.190 194 H TRP 28 HN TRP 28 0.161 -4.739 -8.045 195 HA TRP 28 HA TRP 28 2.735 -4.681 -6.926 196 1HB TRP 28 HB2 TRP 28 0.359 -3.292 -5.749 197 2HB TRP 28 HB3 TRP 28 2.040 -2.788 -5.735 198 HD1 TRP 28 HD1 TRP 28 -1.087 -2.251 -7.435 199 HE1 TRP 28 HE1 TRP 28 -0.899 -0.888 -9.594 200 HE3 TRP 28 HE3 TRP 28 3.972 -2.467 -7.966 201 HZ2 TRP 28 HZ2 TRP 28 1.253 -0.029 -11.354 202 HZ3 TRP 28 HZ3 TRP 28 5.082 -1.348 -9.882 203 HH2 TRP 28 HH2 TRP 28 3.736 -0.129 -11.580 204 H CYS 29 HN CYS 29 0.027 -6.590 -5.733 205 HA CYS 29 HA CYS 29 1.547 -7.010 -3.224 206 1HB CYS 29 HB2 CYS 29 -0.661 -5.251 -3.456 207 2HB CYS 29 HB3 CYS 29 -1.318 -6.693 -2.716 208 H GLY 30 HN GLY 30 0.795 -8.716 -1.888 209 1HA GLY 30 HA2 GLY 30 0.035 -11.128 -3.285 210 2HA GLY 30 HA3 GLY 30 0.337 -10.924 -1.555 211 HA PRO 31 HA PRO 31 -4.011 -10.537 -0.520 212 1HB PRO 31 HB2 PRO 31 -4.022 -7.524 -0.724 213 2HB PRO 31 HB3 PRO 31 -4.853 -8.573 0.478 214 1HG PRO 31 HG2 PRO 31 -2.475 -7.426 1.118 215 2HG PRO 31 HG3 PRO 31 -2.750 -9.155 1.507 216 1HD PRO 31 HD2 PRO 31 -1.211 -7.961 -0.791 217 2HD PRO 31 HD3 PRO 31 -0.800 -9.377 0.218 218 H SER 32 HN SER 32 -3.139 -8.500 -3.365 219 HA SER 32 HA SER 32 -5.658 -8.414 -4.588 220 1HB SER 32 HB2 SER 32 -2.986 -8.875 -5.989 221 2HB SER 32 HB3 SER 32 -4.345 -7.901 -6.559 222 HG SER 32 HG SER 32 -2.479 -6.778 -5.679 223 H LYS 33 HN LYS 33 -3.688 -11.179 -4.045 224 HA LYS 33 HA LYS 33 -5.414 -12.758 -5.898 225 1HB LYS 33 HB2 LYS 33 -2.745 -13.707 -4.864 226 2HB LYS 33 HB3 LYS 33 -3.798 -14.418 -6.085 227 1HG LYS 33 HG2 LYS 33 -2.224 -13.500 -7.439 228 2HG LYS 33 HG3 LYS 33 -3.401 -12.181 -7.417 229 1HD LYS 33 HD2 LYS 33 -2.046 -11.018 -5.693 230 2HD LYS 33 HD3 LYS 33 -0.937 -12.397 -5.621 231 1HE LYS 33 HE2 LYS 33 -0.430 -12.031 -8.073 232 2HE LYS 33 HE3 LYS 33 -1.415 -10.563 -8.013 233 1HZ LYS 33 HZ1 LYS 33 0.112 -9.741 -6.271 234 2HZ LYS 33 HZ2 LYS 33 1.046 -11.077 -6.438 235 3HZ LYS 33 HZ3 LYS 33 0.914 -10.034 -7.681 236 H MET 34 HN MET 34 -5.578 -11.871 -2.829 237 HA MET 34 HA MET 34 -6.451 -14.568 -1.859 238 1HB MET 34 HB2 MET 34 -5.334 -12.307 -0.160 239 2HB MET 34 HB3 MET 34 -5.951 -13.861 0.410 240 1HG MET 34 HG2 MET 34 -4.186 -14.997 -0.994 241 2HG MET 34 HG3 MET 34 -3.479 -13.412 -1.305 242 1HE MET 34 HE1 MET 34 -3.723 -11.896 1.538 243 2HE MET 34 HE2 MET 34 -2.161 -12.346 2.246 244 3HE MET 34 HE3 MET 34 -2.256 -11.927 0.525 245 H ILE 35 HN ILE 35 -7.008 -10.985 -1.682 246 HA ILE 35 HA ILE 35 -9.655 -11.196 -0.699 247 HB ILE 35 HB ILE 35 -7.966 -9.150 -1.022 248 1HG1 ILE 35 HG12 ILE 35 -10.111 -7.617 -0.950 249 2HG1 ILE 35 HG13 ILE 35 -10.987 -9.152 -0.863 250 1HG2 ILE 35 HG21 ILE 35 -9.721 -8.776 -3.473 251 2HG2 ILE 35 HG22 ILE 35 -8.601 -7.602 -2.751 252 3HG2 ILE 35 HG23 ILE 35 -7.966 -9.092 -3.460 253 1HD1 ILE 35 HD11 ILE 35 -8.687 -8.305 0.973 254 2HD1 ILE 35 HD12 ILE 35 -10.412 -8.195 1.386 255 3HD1 ILE 35 HD13 ILE 35 -9.659 -9.785 1.137 256 H ALA 36 HN ALA 36 -8.226 -11.411 -3.950 257 HA ALA 36 HA ALA 36 -10.529 -11.223 -5.470 258 1HB ALA 36 HB1 ALA 36 -8.415 -11.091 -6.538 259 2HB ALA 36 HB2 ALA 36 -7.906 -12.692 -6.005 260 3HB ALA 36 HB3 ALA 36 -9.208 -12.536 -7.202 261 HA PRO 37 HA PRO 37 -11.302 -15.975 -5.231 262 1HB PRO 37 HB2 PRO 37 -10.129 -17.212 -2.951 263 2HB PRO 37 HB3 PRO 37 -9.693 -17.454 -4.673 264 1HG PRO 37 HG2 PRO 37 -8.378 -15.769 -2.592 265 2HG PRO 37 HG3 PRO 37 -7.642 -16.560 -4.012 266 1HD PRO 37 HD2 PRO 37 -8.136 -13.850 -3.921 267 2HD PRO 37 HD3 PRO 37 -8.194 -14.796 -5.422 268 H VAL 38 HN VAL 38 -10.658 -14.253 -2.138 269 HA VAL 38 HA VAL 38 -12.848 -15.222 -0.658 270 HB VAL 38 HB VAL 38 -10.974 -12.901 -0.624 271 1HG1 VAL 38 HG11 VAL 38 -12.727 -11.609 0.036 272 2HG1 VAL 38 HG12 VAL 38 -13.474 -12.901 1.007 273 3HG1 VAL 38 HG13 VAL 38 -11.968 -12.109 1.552 274 1HG2 VAL 38 HG21 VAL 38 -10.387 -15.150 0.247 275 2HG2 VAL 38 HG22 VAL 38 -10.305 -13.884 1.484 276 3HG2 VAL 38 HG23 VAL 38 -11.688 -15.004 1.446 277 H LEU 39 HN LEU 39 -12.733 -12.596 -3.091 278 HA LEU 39 HA LEU 39 -15.467 -11.785 -2.614 279 1HB LEU 39 HB2 LEU 39 -13.575 -11.414 -4.967 280 2HB LEU 39 HB3 LEU 39 -15.210 -10.778 -4.964 281 HG LEU 39 HG LEU 39 -13.293 -10.155 -2.674 282 1HD1 LEU 39 HD11 LEU 39 -12.135 -9.549 -4.756 283 2HD1 LEU 39 HD12 LEU 39 -13.521 -8.537 -5.234 284 3HD1 LEU 39 HD13 LEU 39 -12.575 -8.161 -3.766 285 1HD2 LEU 39 HD21 LEU 39 -15.548 -8.456 -3.784 286 2HD2 LEU 39 HD22 LEU 39 -15.730 -9.577 -2.430 287 3HD2 LEU 39 HD23 LEU 39 -14.621 -8.197 -2.312 288 H GLU 40 HN GLU 40 -13.918 -14.101 -4.942 289 HA GLU 40 HA GLU 40 -16.363 -14.619 -6.311 290 1HB GLU 40 HB2 GLU 40 -13.921 -16.390 -6.047 291 2HB GLU 40 HB3 GLU 40 -15.286 -16.612 -7.165 292 1HG GLU 40 HG2 GLU 40 -14.794 -14.458 -8.245 293 2HG GLU 40 HG3 GLU 40 -13.415 -14.215 -7.177 294 H GLU 41 HN GLU 41 -14.866 -16.012 -3.382 295 HA GLU 41 HA GLU 41 -16.809 -18.037 -2.924 296 1HB GLU 41 HB2 GLU 41 -14.866 -16.588 -1.101 297 2HB GLU 41 HB3 GLU 41 -15.951 -17.859 -0.534 298 1HG GLU 41 HG2 GLU 41 -14.999 -19.434 -2.204 299 2HG GLU 41 HG3 GLU 41 -13.857 -18.203 -2.728 300 H LEU 42 HN LEU 42 -16.818 -14.584 -2.289 301 HA LEU 42 HA LEU 42 -19.148 -14.706 -0.525 302 1HB LEU 42 HB2 LEU 42 -17.367 -12.857 -0.499 303 2HB LEU 42 HB3 LEU 42 -17.838 -12.414 -2.129 304 HG LEU 42 HG LEU 42 -20.145 -11.846 -1.307 305 1HD1 LEU 42 HD11 LEU 42 -18.743 -12.371 1.344 306 2HD1 LEU 42 HD12 LEU 42 -20.262 -11.466 1.172 307 3HD1 LEU 42 HD13 LEU 42 -20.207 -13.187 0.743 308 1HD2 LEU 42 HD21 LEU 42 -17.908 -10.369 0.137 309 2HD2 LEU 42 HD22 LEU 42 -18.333 -10.117 -1.574 310 3HD2 LEU 42 HD23 LEU 42 -19.499 -9.734 -0.298 311 H ASP 43 HN ASP 43 -18.562 -13.951 -3.997 312 HA ASP 43 HA ASP 43 -21.303 -13.199 -4.348 313 1HB ASP 43 HB2 ASP 43 -19.622 -12.332 -5.907 314 2HB ASP 43 HB3 ASP 43 -19.090 -13.964 -6.302 315 H GLN 44 HN GLN 44 -19.530 -16.247 -4.849 316 HA GLN 44 HA GLN 44 -21.784 -17.536 -6.020 317 1HB GLN 44 HB2 GLN 44 -20.564 -19.534 -5.921 318 2HB GLN 44 HB3 GLN 44 -19.398 -18.236 -6.198 319 1HG GLN 44 HG2 GLN 44 -18.929 -18.294 -3.685 320 2HG GLN 44 HG3 GLN 44 -19.920 -19.749 -3.596 321 1HE2 GLN 44 HE22 GLN 44 -17.113 -18.351 -5.347 322 2HE2 GLN 44 HE21 GLN 44 -16.240 -19.868 -5.546 323 H GLU 45 HN GLU 45 -21.437 -16.411 -2.779 324 HA GLU 45 HA GLU 45 -23.254 -18.428 -1.784 325 1HB GLU 45 HB2 GLU 45 -21.487 -18.454 -0.372 326 2HB GLU 45 HB3 GLU 45 -21.123 -16.735 -0.580 327 1HG GLU 45 HG2 GLU 45 -22.713 -16.007 0.811 328 2HG GLU 45 HG3 GLU 45 -23.732 -17.460 0.704 329 H MET 46 HN MET 46 -22.776 -14.895 -1.876 330 HA MET 46 HA MET 46 -25.703 -14.571 -1.413 331 1HB MET 46 HB2 MET 46 -25.122 -12.545 -0.145 332 2HB MET 46 HB3 MET 46 -24.722 -14.090 0.608 333 1HG MET 46 HG2 MET 46 -22.376 -13.827 0.036 334 2HG MET 46 HG3 MET 46 -22.700 -12.353 -0.877 335 1HE MET 46 HE1 MET 46 -23.349 -10.230 0.029 336 2HE MET 46 HE2 MET 46 -24.782 -10.676 0.979 337 3HE MET 46 HE3 MET 46 -23.440 -9.718 1.735 338 H GLY 47 HN GLY 47 -23.737 -14.375 -3.899 339 1HA GLY 47 HA2 GLY 47 -24.120 -11.755 -4.941 340 2HA GLY 47 HA3 GLY 47 -23.871 -13.268 -5.864 341 H ASP 48 HN ASP 48 -26.458 -13.981 -4.142 342 HA ASP 48 HA ASP 48 -28.416 -13.460 -6.183 343 1HB ASP 48 HB2 ASP 48 -28.619 -15.403 -4.694 344 2HB ASP 48 HB3 ASP 48 -28.714 -14.337 -3.290 345 H LYS 49 HN LYS 49 -27.171 -11.696 -3.429 346 HA LYS 49 HA LYS 49 -29.291 -9.694 -3.709 347 1HB LYS 49 HB2 LYS 49 -27.503 -9.920 -1.308 348 2HB LYS 49 HB3 LYS 49 -29.138 -9.279 -1.432 349 1HG LYS 49 HG2 LYS 49 -29.633 -11.163 -0.311 350 2HG LYS 49 HG3 LYS 49 -29.694 -11.872 -1.941 351 1HD LYS 49 HD2 LYS 49 -27.650 -13.000 -1.662 352 2HD LYS 49 HD3 LYS 49 -27.071 -11.819 -0.476 353 1HE LYS 49 HE2 LYS 49 -27.416 -13.867 0.659 354 2HE LYS 49 HE3 LYS 49 -28.546 -12.646 1.231 355 1HZ LYS 49 HZ1 LYS 49 -29.655 -14.766 0.921 356 2HZ LYS 49 HZ2 LYS 49 -30.278 -13.705 -0.141 357 3HZ LYS 49 HZ3 LYS 49 -29.226 -14.854 -0.645 358 H LEU 50 HN LEU 50 -25.930 -10.245 -4.196 359 HA LEU 50 HA LEU 50 -25.244 -7.382 -3.919 360 1HB LEU 50 HB2 LEU 50 -24.391 -8.795 -2.098 361 2HB LEU 50 HB3 LEU 50 -23.728 -9.935 -3.268 362 HG LEU 50 HG LEU 50 -22.086 -8.237 -4.015 363 1HD1 LEU 50 HD11 LEU 50 -23.244 -6.579 -1.724 364 2HD1 LEU 50 HD12 LEU 50 -21.759 -6.203 -2.633 365 3HD1 LEU 50 HD13 LEU 50 -23.313 -6.165 -3.443 366 1HD2 LEU 50 HD21 LEU 50 -20.656 -8.365 -2.071 367 2HD2 LEU 50 HD22 LEU 50 -22.046 -8.727 -1.025 368 3HD2 LEU 50 HD23 LEU 50 -21.536 -9.888 -2.274 369 H LYS 51 HN LYS 51 -23.734 -6.516 -5.341 370 HA LYS 51 HA LYS 51 -22.823 -8.231 -7.631 371 1HB LYS 51 HB2 LYS 51 -24.405 -6.402 -8.338 372 2HB LYS 51 HB3 LYS 51 -23.308 -5.227 -7.611 373 1HG LYS 51 HG2 LYS 51 -21.490 -6.146 -9.207 374 2HG LYS 51 HG3 LYS 51 -22.786 -7.021 -10.020 375 1HD LYS 51 HD2 LYS 51 -22.543 -4.000 -9.653 376 2HD LYS 51 HD3 LYS 51 -22.159 -4.899 -11.121 377 1HE LYS 51 HE2 LYS 51 -24.537 -5.614 -11.310 378 2HE LYS 51 HE3 LYS 51 -24.925 -4.686 -9.849 379 1HZ LYS 51 HZ1 LYS 51 -25.390 -3.410 -11.853 380 2HZ LYS 51 HZ2 LYS 51 -24.167 -2.691 -11.008 381 3HZ LYS 51 HZ3 LYS 51 -23.825 -3.552 -12.359 382 H ILE 52 HN ILE 52 -20.531 -7.968 -8.120 383 HA ILE 52 HA ILE 52 -18.994 -6.388 -6.137 384 HB ILE 52 HB ILE 52 -18.376 -9.184 -7.185 385 1HG1 ILE 52 HG12 ILE 52 -19.007 -8.180 -4.375 386 2HG1 ILE 52 HG13 ILE 52 -20.026 -9.215 -5.375 387 1HG2 ILE 52 HG21 ILE 52 -16.316 -7.838 -7.095 388 2HG2 ILE 52 HG22 ILE 52 -16.696 -7.334 -5.432 389 3HG2 ILE 52 HG23 ILE 52 -16.307 -9.027 -5.819 390 1HD1 ILE 52 HD11 ILE 52 -18.060 -10.895 -5.325 391 2HD1 ILE 52 HD12 ILE 52 -17.470 -9.938 -3.960 392 3HD1 ILE 52 HD13 ILE 52 -19.063 -10.704 -3.873 393 H VAL 53 HN VAL 53 -17.304 -5.186 -7.141 394 HA VAL 53 HA VAL 53 -16.965 -5.614 -10.069 395 HB VAL 53 HB VAL 53 -17.409 -2.845 -8.887 396 1HG1 VAL 53 HG11 VAL 53 -17.406 -3.919 -11.730 397 2HG1 VAL 53 HG12 VAL 53 -17.746 -2.246 -11.236 398 3HG1 VAL 53 HG13 VAL 53 -16.140 -2.950 -10.936 399 1HG2 VAL 53 HG21 VAL 53 -19.515 -4.455 -10.389 400 2HG2 VAL 53 HG22 VAL 53 -19.554 -4.089 -8.663 401 3HG2 VAL 53 HG23 VAL 53 -19.630 -2.776 -9.834 402 H LYS 54 HN LYS 54 -14.771 -5.943 -10.366 403 HA LYS 54 HA LYS 54 -12.928 -4.824 -8.345 404 1HB LYS 54 HB2 LYS 54 -12.533 -6.842 -10.580 405 2HB LYS 54 HB3 LYS 54 -11.215 -6.185 -9.601 406 1HG LYS 54 HG2 LYS 54 -12.398 -6.961 -7.525 407 2HG LYS 54 HG3 LYS 54 -13.639 -7.691 -8.526 408 1HD LYS 54 HD2 LYS 54 -12.190 -9.454 -7.885 409 2HD LYS 54 HD3 LYS 54 -11.823 -9.107 -9.584 410 1HE LYS 54 HE2 LYS 54 -9.966 -7.509 -8.403 411 2HE LYS 54 HE3 LYS 54 -10.195 -8.601 -7.070 412 1HZ LYS 54 HZ1 LYS 54 -9.369 -9.353 -9.823 413 2HZ LYS 54 HZ2 LYS 54 -8.442 -9.418 -8.485 414 3HZ LYS 54 HZ3 LYS 54 -9.700 -10.455 -8.664 415 H ILE 55 HN ILE 55 -11.129 -3.544 -8.917 416 HA ILE 55 HA ILE 55 -11.044 -2.228 -11.580 417 HB ILE 55 HB ILE 55 -10.767 -1.162 -8.743 418 1HG1 ILE 55 HG12 ILE 55 -12.942 -0.826 -9.923 419 2HG1 ILE 55 HG13 ILE 55 -12.156 0.621 -9.322 420 1HG2 ILE 55 HG21 ILE 55 -9.451 0.019 -11.212 421 2HG2 ILE 55 HG22 ILE 55 -9.700 0.903 -9.687 422 3HG2 ILE 55 HG23 ILE 55 -8.696 -0.553 -9.732 423 1HD1 ILE 55 HD11 ILE 55 -13.099 1.074 -11.504 424 2HD1 ILE 55 HD12 ILE 55 -11.355 1.206 -11.588 425 3HD1 ILE 55 HD13 ILE 55 -12.147 -0.247 -12.234 426 H ASP 56 HN ASP 56 -9.067 -2.566 -12.483 427 HA ASP 56 HA ASP 56 -6.960 -4.079 -11.027 428 1HB ASP 56 HB2 ASP 56 -7.575 -4.880 -13.273 429 2HB ASP 56 HB3 ASP 56 -7.246 -3.289 -13.957 430 H VAL 57 HN VAL 57 -5.910 -2.599 -9.733 431 HA VAL 57 HA VAL 57 -5.700 0.119 -10.577 432 HB VAL 57 HB VAL 57 -4.702 0.666 -8.515 433 1HG1 VAL 57 HG11 VAL 57 -6.625 0.241 -7.108 434 2HG1 VAL 57 HG12 VAL 57 -7.106 0.607 -8.771 435 3HG1 VAL 57 HG13 VAL 57 -7.150 -1.080 -8.176 436 1HG2 VAL 57 HG21 VAL 57 -4.935 -2.263 -7.757 437 2HG2 VAL 57 HG22 VAL 57 -3.440 -1.298 -7.885 438 3HG2 VAL 57 HG23 VAL 57 -4.643 -0.945 -6.629 439 H ASP 58 HN ASP 58 -4.524 -1.159 -12.485 440 HA ASP 58 HA ASP 58 -2.076 0.409 -12.588 441 1HB ASP 58 HB2 ASP 58 -1.054 -1.715 -11.932 442 2HB ASP 58 HB3 ASP 58 -2.038 -2.602 -13.101 443 H GLU 59 HN GLU 59 -4.327 -1.942 -14.262 444 HA GLU 59 HA GLU 59 -3.828 -0.705 -16.842 445 1HB GLU 59 HB2 GLU 59 -4.267 -2.899 -17.169 446 2HB GLU 59 HB3 GLU 59 -5.263 -3.054 -15.724 447 1HG GLU 59 HG2 GLU 59 -7.144 -2.080 -16.745 448 2HG GLU 59 HG3 GLU 59 -6.243 -1.681 -18.217 449 H ASN 60 HN ASN 60 -6.386 -0.589 -14.372 450 HA ASN 60 HA ASN 60 -7.553 1.736 -15.751 451 1HB ASN 60 HB2 ASN 60 -9.835 0.949 -15.496 452 2HB ASN 60 HB3 ASN 60 -8.888 0.001 -16.618 453 1HD2 ASN 60 HD21 ASN 60 -9.771 -2.032 -16.562 454 2HD2 ASN 60 HD22 ASN 60 -10.149 -2.912 -15.106 455 H GLN 61 HN GLN 61 -5.841 1.828 -13.707 456 HA GLN 61 HA GLN 61 -7.056 1.865 -11.159 457 1HB GLN 61 HB2 GLN 61 -4.972 2.570 -10.339 458 2HB GLN 61 HB3 GLN 61 -4.621 1.578 -11.755 459 1HG GLN 61 HG2 GLN 61 -4.255 3.616 -13.111 460 2HG GLN 61 HG3 GLN 61 -4.442 4.573 -11.636 461 1HE2 GLN 61 HE22 GLN 61 -2.990 3.612 -9.668 462 2HE2 GLN 61 HE21 GLN 61 -1.338 3.306 -10.108 463 H GLU 62 HN GLU 62 -7.586 3.955 -13.666 464 HA GLU 62 HA GLU 62 -7.269 6.569 -12.759 465 1HB GLU 62 HB2 GLU 62 -9.100 5.124 -14.684 466 2HB GLU 62 HB3 GLU 62 -9.292 6.876 -14.423 467 1HG GLU 62 HG2 GLU 62 -6.906 7.219 -15.028 468 2HG GLU 62 HG3 GLU 62 -6.719 5.486 -15.298 469 H THR 63 HN THR 63 -10.213 4.449 -12.374 470 HA THR 63 HA THR 63 -11.749 6.271 -10.898 471 HB THR 63 HB THR 63 -11.554 3.248 -10.621 472 HG1 THR 63 HG1 THR 63 -13.250 3.387 -12.260 473 1HG2 THR 63 HG21 THR 63 -13.854 3.262 -9.937 474 2HG2 THR 63 HG22 THR 63 -12.981 4.320 -8.851 475 3HG2 THR 63 HG23 THR 63 -13.978 5.031 -10.144 476 H ALA 64 HN ALA 64 -9.144 4.104 -9.867 477 HA ALA 64 HA ALA 64 -9.757 4.223 -7.056 478 1HB ALA 64 HB1 ALA 64 -8.508 2.418 -8.392 479 2HB ALA 64 HB2 ALA 64 -7.117 3.481 -8.389 480 3HB ALA 64 HB3 ALA 64 -7.785 2.883 -6.843 481 H GLY 65 HN GLY 65 -7.039 5.561 -8.974 482 1HA GLY 65 HA2 GLY 65 -6.045 7.501 -7.267 483 2HA GLY 65 HA3 GLY 65 -6.163 7.685 -9.035 484 H LYS 66 HN LYS 66 -8.908 7.917 -9.452 485 HA LYS 66 HA LYS 66 -9.421 10.618 -8.840 486 1HB LYS 66 HB2 LYS 66 -10.301 9.324 -10.729 487 2HB LYS 66 HB3 LYS 66 -11.335 8.388 -9.643 488 1HG LYS 66 HG2 LYS 66 -12.543 10.513 -9.053 489 2HG LYS 66 HG3 LYS 66 -11.556 11.357 -10.258 490 1HD LYS 66 HD2 LYS 66 -13.501 9.053 -10.756 491 2HD LYS 66 HD3 LYS 66 -13.737 10.749 -11.205 492 1HE LYS 66 HE2 LYS 66 -11.780 10.609 -12.747 493 2HE LYS 66 HE3 LYS 66 -11.554 8.913 -12.304 494 1HZ LYS 66 HZ1 LYS 66 -13.737 8.428 -13.262 495 2HZ LYS 66 HZ2 LYS 66 -13.895 10.005 -13.735 496 3HZ LYS 66 HZ3 LYS 66 -12.699 9.030 -14.333 497 H TYR 67 HN TYR 67 -10.604 7.629 -7.219 498 HA TYR 67 HA TYR 67 -12.065 9.137 -5.249 499 1HB TYR 67 HB2 TYR 67 -11.659 6.234 -5.869 500 2HB TYR 67 HB3 TYR 67 -12.120 6.661 -4.236 501 HD1 TYR 67 HD1 TYR 67 -13.190 7.141 -7.811 502 HD2 TYR 67 HD2 TYR 67 -14.328 7.276 -3.651 503 HE1 TYR 67 HE1 TYR 67 -15.530 7.551 -8.477 504 HE2 TYR 67 HE2 TYR 67 -16.680 7.685 -4.308 505 HH TYR 67 HH TYR 67 -17.706 7.988 -7.738 506 H GLY 68 HN GLY 68 -8.756 8.557 -5.597 507 1HA GLY 68 HA2 GLY 68 -7.003 8.983 -4.204 508 2HA GLY 68 HA3 GLY 68 -8.139 9.550 -2.963 509 H VAL 69 HN VAL 69 -7.159 6.473 -4.605 510 HA VAL 69 HA VAL 69 -7.845 4.974 -2.078 511 HB VAL 69 HB VAL 69 -7.895 4.226 -5.005 512 1HG1 VAL 69 HG11 VAL 69 -7.581 2.292 -2.723 513 2HG1 VAL 69 HG12 VAL 69 -8.229 1.849 -4.324 514 3HG1 VAL 69 HG13 VAL 69 -6.570 2.441 -4.172 515 1HG2 VAL 69 HG21 VAL 69 -9.881 3.841 -2.762 516 2HG2 VAL 69 HG22 VAL 69 -9.943 5.077 -4.034 517 3HG2 VAL 69 HG23 VAL 69 -10.100 3.369 -4.464 518 H MET 70 HN MET 70 -5.612 4.601 -4.752 519 HA MET 70 HA MET 70 -3.466 4.473 -5.029 520 1HB MET 70 HB2 MET 70 -2.947 5.790 -2.397 521 2HB MET 70 HB3 MET 70 -1.968 5.832 -3.872 522 1HG MET 70 HG2 MET 70 -3.975 7.105 -4.919 523 2HG MET 70 HG3 MET 70 -4.537 7.306 -3.256 524 1HE MET 70 HE1 MET 70 -1.372 9.061 -1.618 525 2HE MET 70 HE2 MET 70 -2.803 8.050 -1.330 526 3HE MET 70 HE3 MET 70 -1.322 7.328 -2.021 527 H SER 71 HN SER 71 -4.852 2.569 -2.790 528 HA SER 71 HA SER 71 -2.317 1.221 -2.107 529 1HB SER 71 HB2 SER 71 -3.325 1.001 0.198 530 2HB SER 71 HB3 SER 71 -2.697 2.572 -0.315 531 HG SER 71 HG SER 71 -4.797 3.299 -0.662 532 H ILE 72 HN ILE 72 -2.564 -1.001 -1.251 533 HA ILE 72 HA ILE 72 -4.946 -2.268 -2.441 534 HB ILE 72 HB ILE 72 -2.541 -3.935 -2.378 535 1HG1 ILE 72 HG12 ILE 72 -1.458 -1.826 -3.025 536 2HG1 ILE 72 HG13 ILE 72 -1.320 -3.129 -4.179 537 1HG2 ILE 72 HG21 ILE 72 -4.704 -3.508 -4.428 538 2HG2 ILE 72 HG22 ILE 72 -3.275 -4.529 -4.696 539 3HG2 ILE 72 HG23 ILE 72 -4.376 -4.934 -3.397 540 1HD1 ILE 72 HD11 ILE 72 -1.698 -0.877 -5.156 541 2HD1 ILE 72 HD12 ILE 72 -2.837 -2.129 -5.694 542 3HD1 ILE 72 HD13 ILE 72 -3.352 -0.888 -4.526 543 HA PRO 73 HA PRO 73 -6.108 -4.004 -2.275 544 1HB PRO 73 HB2 PRO 73 -7.936 -5.509 -1.022 545 2HB PRO 73 HB3 PRO 73 -6.384 -6.228 -1.575 546 1HG PRO 73 HG2 PRO 73 -7.158 -5.301 1.188 547 2HG PRO 73 HG3 PRO 73 -6.320 -6.810 0.736 548 1HD PRO 73 HD2 PRO 73 -5.027 -4.499 1.624 549 2HD PRO 73 HD3 PRO 73 -4.252 -5.693 0.555 550 H THR 74 HN THR 74 -8.057 -2.820 -2.517 551 HA THR 74 HA THR 74 -9.093 -1.491 -0.040 552 HB THR 74 HB THR 74 -8.617 -0.152 -2.713 553 HG1 THR 74 HG1 THR 74 -6.835 0.092 -1.645 554 1HG2 THR 74 HG21 THR 74 -9.497 1.903 -1.487 555 2HG2 THR 74 HG22 THR 74 -10.716 0.741 -2.025 556 3HG2 THR 74 HG23 THR 74 -10.228 0.795 -0.320 557 H LEU 75 HN LEU 75 -11.256 -1.221 0.141 558 HA LEU 75 HA LEU 75 -13.052 -2.383 -1.932 559 1HB LEU 75 HB2 LEU 75 -13.325 -2.494 1.105 560 2HB LEU 75 HB3 LEU 75 -14.603 -2.910 -0.022 561 HG LEU 75 HG LEU 75 -11.973 -4.415 0.251 562 1HD1 LEU 75 HD11 LEU 75 -13.416 -4.636 2.243 563 2HD1 LEU 75 HD12 LEU 75 -14.787 -5.124 1.230 564 3HD1 LEU 75 HD13 LEU 75 -13.345 -6.146 1.339 565 1HD2 LEU 75 HD21 LEU 75 -12.902 -4.636 -2.007 566 2HD2 LEU 75 HD22 LEU 75 -13.078 -6.152 -1.125 567 3HD2 LEU 75 HD23 LEU 75 -14.486 -5.081 -1.357 568 H LEU 76 HN LEU 76 -14.748 -1.051 -2.388 569 HA LEU 76 HA LEU 76 -15.292 1.272 -0.670 570 1HB LEU 76 HB2 LEU 76 -15.514 1.354 -3.709 571 2HB LEU 76 HB3 LEU 76 -15.970 2.609 -2.568 572 HG LEU 76 HG LEU 76 -13.134 1.771 -3.301 573 1HD1 LEU 76 HD11 LEU 76 -13.005 4.009 -4.256 574 2HD1 LEU 76 HD12 LEU 76 -14.354 3.121 -4.978 575 3HD1 LEU 76 HD13 LEU 76 -14.673 4.360 -3.749 576 1HD2 LEU 76 HD21 LEU 76 -13.189 2.403 -0.925 577 2HD2 LEU 76 HD22 LEU 76 -12.379 3.640 -1.884 578 3HD2 LEU 76 HD23 LEU 76 -14.047 3.906 -1.328 579 H VAL 77 HN VAL 77 -17.197 0.599 0.224 580 HA VAL 77 HA VAL 77 -18.930 -1.282 -1.291 581 HB VAL 77 HB VAL 77 -19.542 -0.211 1.468 582 1HG1 VAL 77 HG11 VAL 77 -20.681 -2.341 1.721 583 2HG1 VAL 77 HG12 VAL 77 -21.239 -1.524 0.258 584 3HG1 VAL 77 HG13 VAL 77 -20.095 -2.876 0.126 585 1HG2 VAL 77 HG21 VAL 77 -17.261 -1.005 1.800 586 2HG2 VAL 77 HG22 VAL 77 -18.400 -2.161 2.492 587 3HG2 VAL 77 HG23 VAL 77 -17.619 -2.506 0.938 588 H LEU 78 HN LEU 78 -20.712 -0.453 -2.376 589 HA LEU 78 HA LEU 78 -21.497 2.351 -1.778 590 1HB LEU 78 HB2 LEU 78 -21.471 1.007 -4.520 591 2HB LEU 78 HB3 LEU 78 -22.084 2.606 -4.145 592 HG LEU 78 HG LEU 78 -19.520 2.820 -3.161 593 1HD1 LEU 78 HD11 LEU 78 -19.257 1.232 -5.746 594 2HD1 LEU 78 HD12 LEU 78 -17.955 1.838 -4.699 595 3HD1 LEU 78 HD13 LEU 78 -19.009 0.533 -4.141 596 1HD2 LEU 78 HD21 LEU 78 -20.409 3.420 -6.014 597 2HD2 LEU 78 HD22 LEU 78 -20.662 4.463 -4.601 598 3HD2 LEU 78 HD23 LEU 78 -19.022 4.139 -5.172 599 H LYS 79 HN LYS 79 -23.715 2.837 -2.058 600 HA LYS 79 HA LYS 79 -25.515 0.650 -2.775 601 1HB LYS 79 HB2 LYS 79 -27.062 1.025 -0.978 602 2HB LYS 79 HB3 LYS 79 -25.504 0.526 -0.315 603 1HG LYS 79 HG2 LYS 79 -25.045 2.946 0.234 604 2HG LYS 79 HG3 LYS 79 -26.671 3.353 -0.316 605 1HD LYS 79 HD2 LYS 79 -25.988 1.448 1.957 606 2HD LYS 79 HD3 LYS 79 -26.531 3.109 2.152 607 1HE LYS 79 HE2 LYS 79 -28.168 0.867 0.873 608 2HE LYS 79 HE3 LYS 79 -28.292 1.378 2.553 609 1HZ LYS 79 HZ1 LYS 79 -29.996 2.413 1.225 610 2HZ LYS 79 HZ2 LYS 79 -29.002 3.565 1.797 611 3HZ LYS 79 HZ3 LYS 79 -28.913 3.108 0.228 612 H ASP 80 HN ASP 80 -27.080 1.412 -4.057 613 HA ASP 80 HA ASP 80 -28.025 2.737 -5.559 614 1HB ASP 80 HB2 ASP 80 -29.418 2.856 -3.504 615 2HB ASP 80 HB3 ASP 80 -28.652 4.388 -3.089 616 H GLY 81 HN GLY 81 -25.186 3.430 -5.301 617 1HA GLY 81 HA2 GLY 81 -23.985 4.739 -6.733 618 2HA GLY 81 HA3 GLY 81 -25.293 5.932 -6.837 619 H GLU 82 HN GLU 82 -24.338 5.076 -3.602 620 HA GLU 82 HA GLU 82 -22.266 7.164 -3.529 621 1HB GLU 82 HB2 GLU 82 -23.168 8.163 -1.640 622 2HB GLU 82 HB3 GLU 82 -24.585 7.805 -2.641 623 1HG GLU 82 HG2 GLU 82 -25.020 5.779 -1.247 624 2HG GLU 82 HG3 GLU 82 -23.648 6.195 -0.222 625 H VAL 83 HN VAL 83 -20.537 6.767 -2.094 626 HA VAL 83 HA VAL 83 -20.011 3.990 -1.298 627 HB VAL 83 HB VAL 83 -18.493 6.565 -0.689 628 1HG1 VAL 83 HG11 VAL 83 -17.915 4.740 0.886 629 2HG1 VAL 83 HG12 VAL 83 -17.625 3.642 -0.478 630 3HG1 VAL 83 HG13 VAL 83 -16.577 5.049 -0.219 631 1HG2 VAL 83 HG21 VAL 83 -17.923 4.477 -2.844 632 2HG2 VAL 83 HG22 VAL 83 -18.529 6.121 -3.144 633 3HG2 VAL 83 HG23 VAL 83 -16.921 5.882 -2.456 634 H VAL 84 HN VAL 84 -20.415 3.153 0.621 635 HA VAL 84 HA VAL 84 -21.510 4.887 2.782 636 HB VAL 84 HB VAL 84 -23.286 3.778 1.552 637 1HG1 VAL 84 HG11 VAL 84 -23.593 1.319 1.618 638 2HG1 VAL 84 HG12 VAL 84 -22.192 1.794 0.668 639 3HG1 VAL 84 HG13 VAL 84 -21.973 1.133 2.309 640 1HG2 VAL 84 HG21 VAL 84 -24.464 2.763 3.422 641 2HG2 VAL 84 HG22 VAL 84 -22.947 2.564 4.314 642 3HG2 VAL 84 HG23 VAL 84 -23.566 4.192 3.950 643 H GLU 85 HN GLU 85 -19.289 2.320 1.848 644 HA GLU 85 HA GLU 85 -18.085 2.563 4.453 645 1HB GLU 85 HB2 GLU 85 -19.463 0.064 3.605 646 2HB GLU 85 HB3 GLU 85 -17.784 -0.194 4.071 647 1HG GLU 85 HG2 GLU 85 -19.827 1.253 5.748 648 2HG GLU 85 HG3 GLU 85 -19.457 -0.477 5.858 649 H THR 86 HN THR 86 -15.965 1.521 4.496 650 HA THR 86 HA THR 86 -14.594 1.273 1.899 651 HB THR 86 HB THR 86 -13.080 3.073 3.535 652 HG1 THR 86 HG1 THR 86 -14.359 4.825 3.770 653 1HG2 THR 86 HG21 THR 86 -12.820 2.925 1.195 654 2HG2 THR 86 HG22 THR 86 -14.509 3.443 0.902 655 3HG2 THR 86 HG23 THR 86 -13.308 4.580 1.576 656 H SER 87 HN SER 87 -12.566 0.190 2.148 657 HA SER 87 HA SER 87 -11.439 -0.195 4.802 658 1HB SER 87 HB2 SER 87 -12.665 -2.498 3.239 659 2HB SER 87 HB3 SER 87 -11.273 -2.751 4.308 660 HG SER 87 HG SER 87 -13.517 -1.299 5.202 661 H VAL 88 HN VAL 88 -9.264 -0.425 4.631 662 HA VAL 88 HA VAL 88 -8.047 -0.566 1.922 663 HB VAL 88 HB VAL 88 -7.653 1.612 4.023 664 1HG1 VAL 88 HG11 VAL 88 -6.208 0.951 1.432 665 2HG1 VAL 88 HG12 VAL 88 -6.171 2.585 2.153 666 3HG1 VAL 88 HG13 VAL 88 -5.519 1.222 3.049 667 1HG2 VAL 88 HG21 VAL 88 -9.686 1.972 2.673 668 2HG2 VAL 88 HG22 VAL 88 -8.433 3.118 2.203 669 3HG2 VAL 88 HG23 VAL 88 -8.751 1.696 1.187 670 H GLY 89 HN GLY 89 -7.860 -2.731 2.709 671 1HA GLY 89 HA2 GLY 89 -5.500 -3.676 3.700 672 2HA GLY 89 HA3 GLY 89 -6.459 -3.409 5.167 673 H PHE 90 HN PHE 90 -5.625 -6.006 4.226 674 HA PHE 90 HA PHE 90 -7.661 -7.334 2.738 675 1HB PHE 90 HB2 PHE 90 -5.398 -8.231 2.903 676 2HB PHE 90 HB3 PHE 90 -5.521 -8.344 4.653 677 HD1 PHE 90 HD1 PHE 90 -6.555 -10.233 5.732 678 HD2 PHE 90 HD2 PHE 90 -6.809 -9.785 1.445 679 HE1 PHE 90 HE1 PHE 90 -7.514 -12.511 5.548 680 HE2 PHE 90 HE2 PHE 90 -7.800 -12.057 1.280 681 HZ PHE 90 HZ PHE 90 -8.143 -13.425 3.321 682 H LYS 91 HN LYS 91 -9.341 -8.735 3.444 683 HA LYS 91 HA LYS 91 -9.847 -9.009 6.321 684 1HB LYS 91 HB2 LYS 91 -11.475 -7.247 4.652 685 2HB LYS 91 HB3 LYS 91 -12.399 -8.692 5.019 686 1HG LYS 91 HG2 LYS 91 -13.004 -7.413 6.783 687 2HG LYS 91 HG3 LYS 91 -11.667 -8.306 7.492 688 1HD LYS 91 HD2 LYS 91 -11.421 -6.128 8.256 689 2HD LYS 91 HD3 LYS 91 -10.206 -6.246 6.977 690 1HE LYS 91 HE2 LYS 91 -11.625 -5.029 5.424 691 2HE LYS 91 HE3 LYS 91 -13.022 -5.178 6.498 692 1HZ LYS 91 HZ1 LYS 91 -11.908 -3.729 8.080 693 2HZ LYS 91 HZ2 LYS 91 -10.614 -3.562 7.089 694 3HZ LYS 91 HZ3 LYS 91 -12.090 -2.996 6.632 695 HA PRO 92 HA PRO 92 -10.624 -13.078 4.521 696 1HB PRO 92 HB2 PRO 92 -11.813 -14.397 6.599 697 2HB PRO 92 HB3 PRO 92 -10.075 -13.966 6.598 698 1HG PRO 92 HG2 PRO 92 -12.372 -12.441 7.870 699 2HG PRO 92 HG3 PRO 92 -10.820 -12.931 8.627 700 1HD PRO 92 HD2 PRO 92 -11.148 -10.441 7.601 701 2HD PRO 92 HD3 PRO 92 -9.597 -11.302 7.412 702 H LYS 93 HN LYS 93 -12.512 -14.516 4.078 703 HA LYS 93 HA LYS 93 -14.581 -13.268 2.729 704 1HB LYS 93 HB2 LYS 93 -14.050 -15.447 2.117 705 2HB LYS 93 HB3 LYS 93 -13.986 -16.019 3.774 706 1HG LYS 93 HG2 LYS 93 -15.755 -17.106 2.672 707 2HG LYS 93 HG3 LYS 93 -16.393 -16.064 3.938 708 1HD LYS 93 HD2 LYS 93 -17.122 -14.421 2.201 709 2HD LYS 93 HD3 LYS 93 -16.399 -15.430 0.940 710 1HE LYS 93 HE2 LYS 93 -18.903 -15.669 1.217 711 2HE LYS 93 HE3 LYS 93 -17.985 -17.170 1.234 712 1HZ LYS 93 HZ1 LYS 93 -19.756 -16.946 2.961 713 2HZ LYS 93 HZ2 LYS 93 -18.288 -17.339 3.576 714 3HZ LYS 93 HZ3 LYS 93 -18.903 -15.818 3.723 715 H GLU 94 HN GLU 94 -14.851 -14.615 6.083 716 HA GLU 94 HA GLU 94 -17.579 -13.923 6.254 717 1HB GLU 94 HB2 GLU 94 -15.574 -14.130 8.554 718 2HB GLU 94 HB3 GLU 94 -17.334 -14.207 8.663 719 1HG GLU 94 HG2 GLU 94 -16.954 -16.438 8.694 720 2HG GLU 94 HG3 GLU 94 -17.005 -16.256 6.946 721 H ALA 95 HN ALA 95 -14.662 -12.056 7.214 722 HA ALA 95 HA ALA 95 -16.159 -9.919 8.410 723 1HB ALA 95 HB1 ALA 95 -14.024 -8.740 8.403 724 2HB ALA 95 HB2 ALA 95 -13.783 -10.408 8.947 725 3HB ALA 95 HB3 ALA 95 -13.339 -9.949 7.284 726 H LEU 96 HN LEU 96 -14.971 -10.640 5.158 727 HA LEU 96 HA LEU 96 -15.569 -8.199 3.867 728 1HB LEU 96 HB2 LEU 96 -14.713 -10.796 3.061 729 2HB LEU 96 HB3 LEU 96 -16.266 -10.611 2.301 730 HG LEU 96 HG LEU 96 -15.327 -8.222 1.569 731 1HD1 LEU 96 HD11 LEU 96 -12.855 -8.343 1.174 732 2HD1 LEU 96 HD12 LEU 96 -13.278 -8.293 2.892 733 3HD1 LEU 96 HD13 LEU 96 -12.791 -9.825 2.139 734 1HD2 LEU 96 HD21 LEU 96 -14.826 -10.948 0.388 735 2HD2 LEU 96 HD22 LEU 96 -15.869 -9.632 -0.153 736 3HD2 LEU 96 HD23 LEU 96 -14.123 -9.509 -0.387 737 H GLN 97 HN GLN 97 -17.571 -11.145 4.306 738 HA GLN 97 HA GLN 97 -19.821 -9.996 3.003 739 1HB GLN 97 HB2 GLN 97 -20.858 -11.905 3.253 740 2HB GLN 97 HB3 GLN 97 -19.197 -12.468 3.422 741 1HG GLN 97 HG2 GLN 97 -19.571 -12.598 5.852 742 2HG GLN 97 HG3 GLN 97 -21.288 -12.199 5.578 743 1HE2 GLN 97 HE22 GLN 97 -22.259 -13.662 3.564 744 2HE2 GLN 97 HE21 GLN 97 -21.757 -15.339 3.580 745 H GLU 98 HN GLU 98 -18.881 -10.156 6.471 746 HA GLU 98 HA GLU 98 -21.256 -8.991 7.457 747 1HB GLU 98 HB2 GLU 98 -19.593 -10.027 8.884 748 2HB GLU 98 HB3 GLU 98 -18.397 -8.787 8.473 749 1HG GLU 98 HG2 GLU 98 -19.758 -7.059 9.558 750 2HG GLU 98 HG3 GLU 98 -21.051 -8.225 9.862 751 H LEU 99 HN LEU 99 -18.284 -7.430 6.249 752 HA LEU 99 HA LEU 99 -18.876 -4.785 6.905 753 1HB LEU 99 HB2 LEU 99 -16.658 -5.519 6.255 754 2HB LEU 99 HB3 LEU 99 -17.234 -5.992 4.661 755 HG LEU 99 HG LEU 99 -17.676 -3.617 4.092 756 1HD1 LEU 99 HD11 LEU 99 -18.030 -2.599 6.265 757 2HD1 LEU 99 HD12 LEU 99 -16.394 -3.058 6.802 758 3HD1 LEU 99 HD13 LEU 99 -16.617 -1.850 5.520 759 1HD2 LEU 99 HD21 LEU 99 -15.332 -3.016 3.792 760 2HD2 LEU 99 HD22 LEU 99 -14.845 -4.202 5.025 761 3HD2 LEU 99 HD23 LEU 99 -15.579 -4.745 3.501 762 H VAL 100 HN VAL 100 -19.802 -6.630 4.001 763 HA VAL 100 HA VAL 100 -21.168 -4.226 2.948 764 HB VAL 100 HB VAL 100 -19.910 -5.463 1.410 765 1HG1 VAL 100 HG11 VAL 100 -21.824 -7.823 1.784 766 2HG1 VAL 100 HG12 VAL 100 -20.528 -7.686 0.581 767 3HG1 VAL 100 HG13 VAL 100 -20.127 -7.785 2.292 768 1HG2 VAL 100 HG21 VAL 100 -22.863 -5.840 0.738 769 2HG2 VAL 100 HG22 VAL 100 -22.040 -4.274 0.721 770 3HG2 VAL 100 HG23 VAL 100 -21.509 -5.552 -0.377 771 H ASN 101 HN ASN 101 -22.068 -7.401 4.370 772 HA ASN 101 HA ASN 101 -24.819 -7.360 3.827 773 1HB ASN 101 HB2 ASN 101 -23.718 -9.345 4.637 774 2HB ASN 101 HB3 ASN 101 -23.349 -8.560 6.182 775 1HD2 ASN 101 HD22 ASN 101 -25.017 -8.339 7.746 776 2HD2 ASN 101 HD21 ASN 101 -26.596 -9.048 7.537 777 H LYS 102 HN LYS 102 -23.012 -5.696 6.398 778 HA LYS 102 HA LYS 102 -25.352 -5.008 7.899 779 1HB LYS 102 HB2 LYS 102 -23.908 -3.738 9.289 780 2HB LYS 102 HB3 LYS 102 -23.010 -5.163 8.766 781 1HG LYS 102 HG2 LYS 102 -22.031 -3.628 6.927 782 2HG LYS 102 HG3 LYS 102 -22.682 -2.302 7.921 783 1HD LYS 102 HD2 LYS 102 -21.414 -3.218 9.901 784 2HD LYS 102 HD3 LYS 102 -20.779 -4.503 8.851 785 1HE LYS 102 HE2 LYS 102 -19.084 -2.893 8.951 786 2HE LYS 102 HE3 LYS 102 -19.851 -2.768 7.350 787 1HZ LYS 102 HZ1 LYS 102 -20.437 -0.941 9.611 788 2HZ LYS 102 HZ2 LYS 102 -19.383 -0.598 8.403 789 3HZ LYS 102 HZ3 LYS 102 -20.968 -0.792 8.053 790 H HIS 103 HN HIS 103 -24.473 -3.841 4.852 791 HA HIS 103 HA HIS 103 -26.242 -1.456 5.211 792 1HB HIS 103 HB2 HIS 103 -23.828 -1.725 3.375 793 2HB HIS 103 HB3 HIS 103 -24.934 -0.353 3.428 794 HD1 HIS 103 HD1 HIS 103 -25.007 0.908 6.003 795 HD2 HIS 103 HD2 HIS 103 -21.777 -1.607 4.996 796 HE1 HIS 103 HE1 HIS 103 -23.167 1.412 7.681 797 H LEU 104 HN LEU 104 -25.385 -4.275 3.313 798 HA LEU 104 HA LEU 104 -27.088 -3.949 1.025 799 1HB LEU 104 HB2 LEU 104 -25.311 -5.506 0.944 800 2HB LEU 104 HB3 LEU 104 -25.734 -6.154 2.520 801 HG LEU 104 HG LEU 104 -27.690 -7.257 1.677 802 1HD1 LEU 104 HD11 LEU 104 -26.828 -6.272 -1.091 803 2HD1 LEU 104 HD12 LEU 104 -28.194 -7.340 -0.729 804 3HD1 LEU 104 HD13 LEU 104 -28.243 -5.659 -0.210 805 1HD2 LEU 104 HD21 LEU 104 -26.532 -8.964 0.398 806 2HD2 LEU 104 HD22 LEU 104 -25.209 -7.834 0.018 807 3HD2 LEU 104 HD23 LEU 104 -25.504 -8.363 1.691 808 1H MET 1 H1 MET 1 9.147 27.316 -11.753 809 2H MET 1 H2 MET 1 7.975 26.653 -12.694 810 3H MET 1 H3 MET 1 8.606 25.806 -11.436 811 HA MET 1 HA MET 1 7.047 28.285 -11.180 812 1HB MET 1 HB2 MET 1 6.240 25.384 -10.636 813 2HB MET 1 HB3 MET 1 5.387 26.782 -9.990 814 1HG MET 1 HG2 MET 1 4.187 26.077 -11.885 815 2HG MET 1 HG3 MET 1 4.957 27.604 -12.292 816 1HE MET 1 HE1 MET 1 4.712 25.731 -15.731 817 2HE MET 1 HE2 MET 1 3.548 25.672 -14.389 818 3HE MET 1 HE3 MET 1 4.324 27.212 -14.829 819 H GLU 2 HN GLU 2 6.864 29.090 -9.034 820 HA GLU 2 HA GLU 2 9.146 28.364 -7.371 821 1HB GLU 2 HB2 GLU 2 7.096 30.616 -7.168 822 2HB GLU 2 HB3 GLU 2 8.522 30.452 -6.131 823 1HG GLU 2 HG2 GLU 2 9.999 30.591 -8.121 824 2HG GLU 2 HG3 GLU 2 8.588 30.838 -9.151 825 H ASN 3 HN ASN 3 6.875 26.539 -7.518 826 HA ASN 3 HA ASN 3 6.846 25.587 -4.936 827 1HB ASN 3 HB2 ASN 3 4.087 26.425 -5.953 828 2HB ASN 3 HB3 ASN 3 4.432 25.216 -4.704 829 1HD2 ASN 3 HD22 ASN 3 5.963 26.135 -2.830 830 2HD2 ASN 3 HD21 ASN 3 5.480 27.693 -2.231 831 H LYS 4 HN LYS 4 6.927 23.669 -5.284 832 HA LYS 4 HA LYS 4 5.626 22.080 -7.304 833 1HB LYS 4 HB2 LYS 4 7.991 21.021 -7.846 834 2HB LYS 4 HB3 LYS 4 7.393 22.409 -8.750 835 1HG LYS 4 HG2 LYS 4 8.772 23.951 -7.448 836 2HG LYS 4 HG3 LYS 4 9.352 22.619 -6.423 837 1HD LYS 4 HD2 LYS 4 10.473 21.596 -8.281 838 2HD LYS 4 HD3 LYS 4 9.717 22.686 -9.452 839 1HE LYS 4 HE2 LYS 4 11.447 23.749 -7.193 840 2HE LYS 4 HE3 LYS 4 12.183 23.126 -8.672 841 1HZ LYS 4 HZ1 LYS 4 10.201 25.340 -8.638 842 2HZ LYS 4 HZ2 LYS 4 11.835 25.520 -8.744 843 3HZ LYS 4 HZ3 LYS 4 11.023 24.766 -9.942 844 H ILE 5 HN ILE 5 5.680 19.834 -6.604 845 HA ILE 5 HA ILE 5 6.294 19.640 -3.694 846 HB ILE 5 HB ILE 5 3.862 18.791 -5.299 847 1HG1 ILE 5 HG12 ILE 5 4.508 21.089 -3.502 848 2HG1 ILE 5 HG13 ILE 5 3.592 21.039 -4.994 849 1HG2 ILE 5 HG21 ILE 5 2.868 17.925 -3.248 850 2HG2 ILE 5 HG22 ILE 5 4.361 17.076 -3.594 851 3HG2 ILE 5 HG23 ILE 5 4.347 18.334 -2.334 852 1HD1 ILE 5 HD11 ILE 5 2.163 21.605 -3.150 853 2HD1 ILE 5 HD12 ILE 5 1.702 19.990 -3.761 854 3HD1 ILE 5 HD13 ILE 5 2.651 20.149 -2.254 855 H ILE 6 HN ILE 6 6.958 17.672 -2.921 856 HA ILE 6 HA ILE 6 7.273 15.426 -4.803 857 HB ILE 6 HB ILE 6 9.382 16.781 -4.867 858 1HG1 ILE 6 HG12 ILE 6 9.584 13.934 -3.828 859 2HG1 ILE 6 HG13 ILE 6 9.315 14.466 -5.489 860 1HG2 ILE 6 HG21 ILE 6 9.819 15.871 -2.002 861 2HG2 ILE 6 HG22 ILE 6 10.929 16.827 -3.008 862 3HG2 ILE 6 HG23 ILE 6 9.394 17.525 -2.493 863 1HD1 ILE 6 HD11 ILE 6 11.622 13.804 -5.265 864 2HD1 ILE 6 HD12 ILE 6 11.566 15.563 -5.486 865 3HD1 ILE 6 HD13 ILE 6 11.871 14.861 -3.877 866 H TYR 7 HN TYR 7 7.140 13.416 -3.749 867 HA TYR 7 HA TYR 7 6.265 13.515 -0.900 868 1HB TYR 7 HB2 TYR 7 4.494 13.479 -2.853 869 2HB TYR 7 HB3 TYR 7 4.974 11.809 -3.051 870 HD1 TYR 7 HD1 TYR 7 3.305 14.303 -0.943 871 HD2 TYR 7 HD2 TYR 7 4.354 10.113 -1.217 872 HE1 TYR 7 HE1 TYR 7 1.641 13.748 0.804 873 HE2 TYR 7 HE2 TYR 7 2.564 9.569 0.339 874 HH TYR 7 HH TYR 7 0.531 12.075 1.916 875 H PHE 8 HN PHE 8 6.984 11.698 0.287 876 HA PHE 8 HA PHE 8 8.578 9.674 -1.238 877 1HB PHE 8 HB2 PHE 8 8.929 10.329 1.680 878 2HB PHE 8 HB3 PHE 8 9.988 9.397 0.642 879 HD1 PHE 8 HD1 PHE 8 10.740 11.689 2.531 880 HD2 PHE 8 HD2 PHE 8 9.903 11.632 -1.702 881 HE1 PHE 8 HE1 PHE 8 12.033 13.759 2.208 882 HE2 PHE 8 HE2 PHE 8 11.213 13.683 -1.997 883 HZ PHE 8 HZ PHE 8 12.232 14.800 -0.028 884 H LEU 9 HN LEU 9 8.240 7.487 -0.716 885 HA LEU 9 HA LEU 9 5.970 6.877 1.136 886 1HB LEU 9 HB2 LEU 9 6.616 5.871 -1.652 887 2HB LEU 9 HB3 LEU 9 5.827 4.804 -0.489 888 HG LEU 9 HG LEU 9 4.735 7.470 -1.469 889 1HD1 LEU 9 HD11 LEU 9 4.737 5.708 -3.185 890 2HD1 LEU 9 HD12 LEU 9 4.004 4.568 -2.067 891 3HD1 LEU 9 HD13 LEU 9 3.078 5.979 -2.624 892 1HD2 LEU 9 HD21 LEU 9 3.523 5.399 0.420 893 2HD2 LEU 9 HD22 LEU 9 3.878 7.102 0.780 894 3HD2 LEU 9 HD23 LEU 9 2.604 6.700 -0.368 895 H SER 10 HN SER 10 6.797 5.928 2.892 896 HA SER 10 HA SER 10 9.070 4.035 2.583 897 1HB SER 10 HB2 SER 10 8.826 6.289 4.614 898 2HB SER 10 HB3 SER 10 10.080 5.038 4.620 899 HG SER 10 HG SER 10 10.912 5.854 2.744 900 H THR 11 HN THR 11 8.800 2.210 3.814 901 HA THR 11 HA THR 11 6.375 1.490 4.996 902 HB THR 11 HB THR 11 9.193 0.462 5.541 903 HG1 THR 11 HG1 THR 11 8.605 0.223 3.382 904 1HG2 THR 11 HG21 THR 11 7.712 -0.328 7.303 905 2HG2 THR 11 HG22 THR 11 6.447 -0.725 6.117 906 3HG2 THR 11 HG23 THR 11 7.977 -1.637 6.152 907 H GLY 12 HN GLY 12 5.373 2.225 6.753 908 1HA GLY 12 HA2 GLY 12 4.876 3.047 8.812 909 2HA GLY 12 HA3 GLY 12 6.494 2.563 9.327 910 H ASN 13 HN ASN 13 6.882 4.693 6.770 911 HA ASN 13 HA ASN 13 8.127 6.548 6.689 912 1HB ASN 13 HB2 ASN 13 5.645 7.282 6.898 913 2HB ASN 13 HB3 ASN 13 6.131 7.941 8.476 914 1HD2 ASN 13 HD22 ASN 13 7.367 10.010 8.378 915 2HD2 ASN 13 HD21 ASN 13 7.654 10.764 6.813 916 H SER 14 HN SER 14 8.810 4.763 8.999 917 HA SER 14 HA SER 14 9.189 6.213 11.322 918 1HB SER 14 HB2 SER 14 10.853 3.822 10.471 919 2HB SER 14 HB3 SER 14 10.311 4.269 12.100 920 HG SER 14 HG SER 14 9.043 2.588 11.211 921 H ALA 15 HN ALA 15 11.614 5.668 8.705 922 HA ALA 15 HA ALA 15 13.393 7.570 10.116 923 1HB ALA 15 HB1 ALA 15 15.282 6.014 9.881 924 2HB ALA 15 HB2 ALA 15 13.991 5.308 10.863 925 3HB ALA 15 HB3 ALA 15 14.204 4.786 9.179 926 H ARG 16 HN ARG 16 13.532 5.562 7.017 927 HA ARG 16 HA ARG 16 15.397 7.304 5.831 928 1HB ARG 16 HB2 ARG 16 13.257 5.499 4.641 929 2HB ARG 16 HB3 ARG 16 14.129 6.624 3.609 930 1HG ARG 16 HG2 ARG 16 16.306 5.658 4.415 931 2HG ARG 16 HG3 ARG 16 15.374 4.413 5.247 932 1HD ARG 16 HD2 ARG 16 14.651 3.426 3.302 933 2HD ARG 16 HD3 ARG 16 14.692 4.899 2.368 934 HE ARG 16 HE ARG 16 17.030 3.145 2.979 935 1HH1 ARG 16 HH11 ARG 16 15.713 5.825 1.021 936 2HH1 ARG 16 HH12 ARG 16 16.802 5.554 -0.297 937 1HH2 ARG 16 HH21 ARG 16 18.549 2.935 1.385 938 2HH2 ARG 16 HH22 ARG 16 18.631 4.057 0.052 939 H SER 17 HN SER 17 11.849 7.555 5.684 940 HA SER 17 HA SER 17 11.491 9.743 4.001 941 1HB SER 17 HB2 SER 17 9.483 9.986 5.674 942 2HB SER 17 HB3 SER 17 9.616 8.527 4.670 943 HG SER 17 HG SER 17 9.517 8.639 7.316 944 H GLN 18 HN GLN 18 12.003 9.657 7.536 945 HA GLN 18 HA GLN 18 11.735 12.453 7.998 946 1HB GLN 18 HB2 GLN 18 13.426 10.557 9.635 947 2HB GLN 18 HB3 GLN 18 12.611 12.013 10.166 948 1HG GLN 18 HG2 GLN 18 11.219 9.420 9.355 949 2HG GLN 18 HG3 GLN 18 11.516 9.976 10.984 950 1HE2 GLN 18 HE22 GLN 18 8.931 9.656 10.945 951 2HE2 GLN 18 HE21 GLN 18 8.054 11.098 10.495 952 H MET 19 HN MET 19 14.528 10.370 7.534 953 HA MET 19 HA MET 19 16.464 12.373 7.923 954 1HB MET 19 HB2 MET 19 16.683 9.810 7.939 955 2HB MET 19 HB3 MET 19 16.600 9.857 6.173 956 1HG MET 19 HG2 MET 19 18.616 11.474 6.347 957 2HG MET 19 HG3 MET 19 18.764 10.893 8.005 958 1HE MET 19 HE1 MET 19 18.819 8.289 8.550 959 2HE MET 19 HE2 MET 19 17.820 7.579 7.247 960 3HE MET 19 HE3 MET 19 19.528 7.098 7.422 961 H ALA 20 HN ALA 20 14.783 11.134 5.013 962 HA ALA 20 HA ALA 20 16.241 12.642 3.092 963 1HB ALA 20 HB1 ALA 20 13.536 11.254 3.033 964 2HB ALA 20 HB2 ALA 20 14.259 12.047 1.630 965 3HB ALA 20 HB3 ALA 20 15.097 10.678 2.380 966 H GLU 21 HN GLU 21 13.120 13.341 4.849 967 HA GLU 21 HA GLU 21 12.788 15.651 3.193 968 1HB GLU 21 HB2 GLU 21 10.764 15.978 4.215 969 2HB GLU 21 HB3 GLU 21 11.000 14.244 4.256 970 1HG GLU 21 HG2 GLU 21 10.164 14.616 6.348 971 2HG GLU 21 HG3 GLU 21 11.893 14.580 6.654 972 H GLY 22 HN GLY 22 14.450 15.092 6.245 973 1HA GLY 22 HA2 GLY 22 14.964 17.855 6.888 974 2HA GLY 22 HA3 GLY 22 15.909 16.437 7.390 975 H TRP 23 HN TRP 23 16.869 15.332 5.103 976 HA TRP 23 HA TRP 23 18.961 16.987 4.173 977 1HB TRP 23 HB2 TRP 23 17.700 14.390 3.297 978 2HB TRP 23 HB3 TRP 23 18.709 15.229 2.129 979 HD1 TRP 23 HD1 TRP 23 18.944 13.053 5.094 980 HE1 TRP 23 HE1 TRP 23 21.353 12.684 5.809 981 HE3 TRP 23 HE3 TRP 23 21.164 16.559 2.119 982 HZ2 TRP 23 HZ2 TRP 23 23.946 13.779 5.172 983 HZ3 TRP 23 HZ3 TRP 23 23.633 16.834 2.146 984 HH2 TRP 23 HH2 TRP 23 25.036 15.460 3.670 985 H ALA 24 HN ALA 24 15.733 16.383 2.816 986 HA ALA 24 HA ALA 24 16.137 17.497 0.330 987 1HB ALA 24 HB1 ALA 24 13.659 17.792 0.267 988 2HB ALA 24 HB2 ALA 24 14.058 16.236 1.011 989 3HB ALA 24 HB3 ALA 24 13.557 17.619 2.006 990 H LYS 25 HN LYS 25 14.875 19.139 3.329 991 HA LYS 25 HA LYS 25 14.384 21.499 1.866 992 1HB LYS 25 HB2 LYS 25 14.069 20.610 4.633 993 2HB LYS 25 HB3 LYS 25 14.602 22.288 4.596 994 1HG LYS 25 HG2 LYS 25 12.334 21.273 2.835 995 2HG LYS 25 HG3 LYS 25 12.053 21.844 4.487 996 1HD LYS 25 HD2 LYS 25 12.827 24.040 4.001 997 2HD LYS 25 HD3 LYS 25 13.492 23.580 2.442 998 1HE LYS 25 HE2 LYS 25 10.504 23.563 3.113 999 2HE LYS 25 HE3 LYS 25 11.349 24.862 2.270 1000 1HZ LYS 25 HZ1 LYS 25 11.011 22.102 1.279 1001 2HZ LYS 25 HZ2 LYS 25 10.363 23.477 0.639 1002 3HZ LYS 25 HZ3 LYS 25 11.961 23.216 0.543 1003 H GLN 26 HN GLN 26 17.414 20.433 3.260 1004 HA GLN 26 HA GLN 26 18.527 23.070 3.195 1005 1HB GLN 26 HB2 GLN 26 20.550 22.231 3.802 1006 2HB GLN 26 HB3 GLN 26 19.390 21.257 4.663 1007 1HG GLN 26 HG2 GLN 26 20.046 19.330 3.666 1008 2HG GLN 26 HG3 GLN 26 20.180 20.037 2.073 1009 1HE2 GLN 26 HE22 GLN 26 22.056 18.250 3.821 1010 2HE2 GLN 26 HE21 GLN 26 23.588 19.075 3.712 1011 H TYR 27 HN TYR 27 17.776 20.923 0.618 1012 HA TYR 27 HA TYR 27 19.438 22.575 -1.234 1013 1HB TYR 27 HB2 TYR 27 19.089 19.585 -1.070 1014 2HB TYR 27 HB3 TYR 27 19.203 20.309 -2.660 1015 HD1 TYR 27 HD1 TYR 27 21.141 19.267 0.223 1016 HD2 TYR 27 HD2 TYR 27 21.138 21.759 -3.298 1017 HE1 TYR 27 HE1 TYR 27 23.587 19.550 0.440 1018 HE2 TYR 27 HE2 TYR 27 23.602 22.019 -3.116 1019 HH TYR 27 HH TYR 27 25.507 20.540 -0.448 1020 H LEU 28 HN LEU 28 16.291 21.469 -0.445 1021 HA LEU 28 HA LEU 28 15.153 22.382 -3.025 1022 1HB LEU 28 HB2 LEU 28 14.058 20.299 -1.073 1023 2HB LEU 28 HB3 LEU 28 13.286 20.833 -2.555 1024 HG LEU 28 HG LEU 28 15.882 19.261 -2.339 1025 1HD1 LEU 28 HD11 LEU 28 14.600 17.434 -3.349 1026 2HD1 LEU 28 HD12 LEU 28 13.806 17.957 -1.864 1027 3HD1 LEU 28 HD13 LEU 28 13.143 18.450 -3.425 1028 1HD2 LEU 28 HD21 LEU 28 15.898 19.075 -4.710 1029 2HD2 LEU 28 HD22 LEU 28 14.349 19.912 -4.882 1030 3HD2 LEU 28 HD23 LEU 28 15.791 20.804 -4.370 1031 H GLY 29 HN GLY 29 15.317 24.482 -2.038 1032 1HA GLY 29 HA2 GLY 29 14.553 25.181 0.593 1033 2HA GLY 29 HA3 GLY 29 14.833 26.289 -0.751 1034 H ASP 30 HN ASP 30 13.062 27.564 0.266 1035 HA ASP 30 HA ASP 30 10.420 26.680 0.632 1036 1HB ASP 30 HB2 ASP 30 11.334 28.779 1.508 1037 2HB ASP 30 HB3 ASP 30 11.471 29.426 -0.128 1038 H GLU 31 HN GLU 31 12.070 27.369 -2.321 1039 HA GLU 31 HA GLU 31 9.951 27.749 -4.173 1040 1HB GLU 31 HB2 GLU 31 12.264 28.239 -4.621 1041 2HB GLU 31 HB3 GLU 31 12.757 26.567 -4.323 1042 1HG GLU 31 HG2 GLU 31 11.603 25.800 -6.295 1043 2HG GLU 31 HG3 GLU 31 10.923 27.408 -6.590 1044 H TRP 32 HN TRP 32 10.707 24.981 -2.260 1045 HA TRP 32 HA TRP 32 9.073 23.167 -3.964 1046 1HB TRP 32 HB2 TRP 32 11.483 22.460 -2.251 1047 2HB TRP 32 HB3 TRP 32 10.509 21.340 -3.177 1048 HD1 TRP 32 HD1 TRP 32 12.939 24.278 -3.804 1049 HE1 TRP 32 HE1 TRP 32 14.338 23.770 -5.891 1050 HE3 TRP 32 HE3 TRP 32 10.700 19.897 -5.235 1051 HZ2 TRP 32 HZ2 TRP 32 14.532 21.701 -7.858 1052 HZ3 TRP 32 HZ3 TRP 32 11.565 18.641 -7.191 1053 HH2 TRP 32 HH2 TRP 32 13.478 19.526 -8.510 1054 H LYS 33 HN LYS 33 7.889 21.595 -2.737 1055 HA LYS 33 HA LYS 33 7.765 21.987 0.233 1056 1HB LYS 33 HB2 LYS 33 5.456 21.568 -1.663 1057 2HB LYS 33 HB3 LYS 33 5.403 21.330 0.083 1058 1HG LYS 33 HG2 LYS 33 6.594 23.852 -0.111 1059 2HG LYS 33 HG3 LYS 33 5.472 23.880 -1.483 1060 1HD LYS 33 HD2 LYS 33 4.800 23.078 1.369 1061 2HD LYS 33 HD3 LYS 33 4.575 24.722 0.741 1062 1HE LYS 33 HE2 LYS 33 2.957 23.983 -0.913 1063 2HE LYS 33 HE3 LYS 33 3.245 22.282 -0.530 1064 1HZ LYS 33 HZ1 LYS 33 2.095 24.214 1.396 1065 2HZ LYS 33 HZ2 LYS 33 1.216 23.184 0.487 1066 3HZ LYS 33 HZ3 LYS 33 2.248 22.585 1.595 1067 H VAL 34 HN VAL 34 7.653 20.007 1.370 1068 HA VAL 34 HA VAL 34 8.183 17.558 -0.236 1069 HB VAL 34 HB VAL 34 9.802 18.536 2.164 1070 1HG1 VAL 34 HG11 VAL 34 11.323 16.683 1.548 1071 2HG1 VAL 34 HG12 VAL 34 9.719 16.085 1.976 1072 3HG1 VAL 34 HG13 VAL 34 10.191 16.188 0.271 1073 1HG2 VAL 34 HG21 VAL 34 10.655 18.502 -0.763 1074 2HG2 VAL 34 HG22 VAL 34 10.336 19.958 0.198 1075 3HG2 VAL 34 HG23 VAL 34 11.670 18.907 0.635 1076 H TYR 35 HN TYR 35 7.243 15.748 0.606 1077 HA TYR 35 HA TYR 35 6.044 15.779 3.317 1078 1HB TYR 35 HB2 TYR 35 4.616 15.207 0.697 1079 2HB TYR 35 HB3 TYR 35 3.972 14.781 2.276 1080 HD1 TYR 35 HD1 TYR 35 4.543 17.506 -0.116 1081 HD2 TYR 35 HD2 TYR 35 3.273 16.548 3.893 1082 HE1 TYR 35 HE1 TYR 35 3.559 19.774 0.112 1083 HE2 TYR 35 HE2 TYR 35 2.301 18.808 4.137 1084 HH TYR 35 HH TYR 35 1.930 20.848 3.142 1085 H SER 36 HN SER 36 5.559 13.522 4.023 1086 HA SER 36 HA SER 36 6.541 11.365 2.332 1087 1HB SER 36 HB2 SER 36 8.072 10.499 4.033 1088 2HB SER 36 HB3 SER 36 8.600 12.055 3.405 1089 HG SER 36 HG SER 36 7.867 13.063 5.269 1090 H ALA 37 HN ALA 37 5.725 9.300 3.034 1091 HA ALA 37 HA ALA 37 3.734 9.258 5.206 1092 1HB ALA 37 HB1 ALA 37 1.955 8.703 3.639 1093 2HB ALA 37 HB2 ALA 37 2.598 10.308 3.273 1094 3HB ALA 37 HB3 ALA 37 3.063 8.916 2.259 1095 H GLY 38 HN GLY 38 2.576 7.046 5.132 1096 1HA GLY 38 HA2 GLY 38 3.729 4.838 3.706 1097 2HA GLY 38 HA3 GLY 38 4.302 4.896 5.378 1098 H ILE 39 HN ILE 39 3.104 2.754 5.172 1099 HA ILE 39 HA ILE 39 0.431 2.381 4.783 1100 HB ILE 39 HB ILE 39 1.770 0.523 4.792 1101 1HG1 ILE 39 HG12 ILE 39 0.574 -0.043 7.502 1102 2HG1 ILE 39 HG13 ILE 39 -0.508 0.370 6.182 1103 1HG2 ILE 39 HG21 ILE 39 3.119 -0.342 6.714 1104 2HG2 ILE 39 HG22 ILE 39 3.722 1.155 6.022 1105 3HG2 ILE 39 HG23 ILE 39 2.838 1.174 7.562 1106 1HD1 ILE 39 HD11 ILE 39 -0.321 -2.019 6.318 1107 2HD1 ILE 39 HD12 ILE 39 0.383 -1.437 4.799 1108 3HD1 ILE 39 HD13 ILE 39 1.445 -1.938 6.148 1109 H GLU 40 HN GLU 40 1.882 2.729 8.034 1110 HA GLU 40 HA GLU 40 -0.704 3.682 9.145 1111 1HB GLU 40 HB2 GLU 40 -0.371 2.274 11.114 1112 2HB GLU 40 HB3 GLU 40 -0.601 1.329 9.651 1113 1HG GLU 40 HG2 GLU 40 1.771 0.775 9.541 1114 2HG GLU 40 HG3 GLU 40 2.141 1.863 10.874 1115 H ALA 41 HN ALA 41 1.533 5.037 8.130 1116 HA ALA 41 HA ALA 41 3.653 5.609 9.867 1117 1HB ALA 41 HB1 ALA 41 3.811 7.620 8.249 1118 2HB ALA 41 HB2 ALA 41 3.869 5.975 7.547 1119 3HB ALA 41 HB3 ALA 41 2.382 6.938 7.465 1120 H HIS 42 HN HIS 42 4.112 7.247 11.105 1121 HA HIS 42 HA HIS 42 3.546 9.674 11.687 1122 1HB HIS 42 HB2 HIS 42 1.125 9.444 11.831 1123 2HB HIS 42 HB3 HIS 42 1.264 8.195 13.069 1124 HD1 HIS 42 HD1 HIS 42 2.755 9.409 15.363 1125 HD2 HIS 42 HD2 HIS 42 0.325 11.665 12.782 1126 HE1 HIS 42 HE1 HIS 42 2.114 11.527 16.650 1127 H GLY 43 HN GLY 43 5.752 8.584 12.069 1128 1HA GLY 43 HA2 GLY 43 6.253 8.098 14.887 1129 2HA GLY 43 HA3 GLY 43 6.523 6.677 13.860 1130 H LEU 44 HN LEU 44 8.505 8.195 15.303 1131 HA LEU 44 HA LEU 44 10.221 9.265 13.119 1132 1HB LEU 44 HB2 LEU 44 9.122 11.200 14.099 1133 2HB LEU 44 HB3 LEU 44 9.392 10.601 15.736 1134 HG LEU 44 HG LEU 44 11.826 10.944 15.519 1135 1HD1 LEU 44 HD11 LEU 44 11.100 11.663 12.677 1136 2HD1 LEU 44 HD12 LEU 44 12.569 12.304 13.431 1137 3HD1 LEU 44 HD13 LEU 44 12.360 10.557 13.256 1138 1HD2 LEU 44 HD21 LEU 44 10.428 12.761 16.360 1139 2HD2 LEU 44 HD22 LEU 44 11.809 13.389 15.454 1140 3HD2 LEU 44 HD23 LEU 44 10.193 13.374 14.715 1141 H ASN 45 HN ASN 45 11.710 7.573 13.191 1142 HA ASN 45 HA ASN 45 12.389 6.370 15.711 1143 1HB ASN 45 HB2 ASN 45 12.523 5.267 13.451 1144 2HB ASN 45 HB3 ASN 45 13.952 6.240 13.101 1145 1HD2 ASN 45 HD22 ASN 45 13.408 3.183 13.633 1146 2HD2 ASN 45 HD21 ASN 45 14.635 2.774 14.805 1147 HA PRO 46 HA PRO 46 15.211 9.701 16.866 1148 1HB PRO 46 HB2 PRO 46 16.698 8.431 18.843 1149 2HB PRO 46 HB3 PRO 46 15.084 9.171 19.067 1150 1HG PRO 46 HG2 PRO 46 15.750 6.266 18.524 1151 2HG PRO 46 HG3 PRO 46 14.616 6.938 19.742 1152 1HD PRO 46 HD2 PRO 46 13.710 5.978 17.396 1153 2HD PRO 46 HD3 PRO 46 13.011 7.476 18.074 1154 H ASN 47 HN ASN 47 16.305 6.525 15.683 1155 HA ASN 47 HA ASN 47 19.056 7.241 15.289 1156 1HB ASN 47 HB2 ASN 47 19.220 5.252 14.226 1157 2HB ASN 47 HB3 ASN 47 17.665 4.926 14.973 1158 1HD2 ASN 47 HD22 ASN 47 19.376 5.383 11.983 1159 2HD2 ASN 47 HD21 ASN 47 17.991 5.091 10.940 1160 H ALA 48 HN ALA 48 16.079 7.940 13.416 1161 HA ALA 48 HA ALA 48 17.510 8.943 11.105 1162 1HB ALA 48 HB1 ALA 48 15.311 9.662 10.356 1163 2HB ALA 48 HB2 ALA 48 15.165 8.065 11.143 1164 3HB ALA 48 HB3 ALA 48 14.630 9.533 11.984 1165 H VAL 49 HN VAL 49 16.097 10.259 14.083 1166 HA VAL 49 HA VAL 49 16.567 13.045 13.526 1167 HB VAL 49 HB VAL 49 16.590 11.677 16.251 1168 1HG1 VAL 49 HG11 VAL 49 17.539 13.949 16.334 1169 2HG1 VAL 49 HG12 VAL 49 16.117 14.592 15.481 1170 3HG1 VAL 49 HG13 VAL 49 15.953 13.909 17.110 1171 1HG2 VAL 49 HG21 VAL 49 14.448 11.255 15.047 1172 2HG2 VAL 49 HG22 VAL 49 14.232 12.334 16.426 1173 3HG2 VAL 49 HG23 VAL 49 14.275 13.005 14.785 1174 H LYS 50 HN LYS 50 18.590 10.594 15.216 1175 HA LYS 50 HA LYS 50 20.859 12.244 15.551 1176 1HB LYS 50 HB2 LYS 50 20.406 10.069 16.687 1177 2HB LYS 50 HB3 LYS 50 20.773 9.215 15.178 1178 1HG LYS 50 HG2 LYS 50 23.061 10.034 15.210 1179 2HG LYS 50 HG3 LYS 50 22.709 11.101 16.586 1180 1HD LYS 50 HD2 LYS 50 22.252 9.117 18.012 1181 2HD LYS 50 HD3 LYS 50 22.556 8.060 16.636 1182 1HE LYS 50 HE2 LYS 50 24.525 8.035 17.983 1183 2HE LYS 50 HE3 LYS 50 24.906 8.920 16.505 1184 1HZ LYS 50 HZ1 LYS 50 24.278 10.161 19.128 1185 2HZ LYS 50 HZ2 LYS 50 25.764 10.022 18.484 1186 3HZ LYS 50 HZ3 LYS 50 24.666 10.988 17.769 1187 H ALA 51 HN ALA 51 19.994 10.088 12.805 1188 HA ALA 51 HA ALA 51 22.243 10.429 11.231 1189 1HB ALA 51 HB1 ALA 51 20.813 9.874 9.342 1190 2HB ALA 51 HB2 ALA 51 20.372 8.881 10.749 1191 3HB ALA 51 HB3 ALA 51 19.360 10.257 10.281 1192 H MET 52 HN MET 52 19.578 12.816 11.749 1193 HA MET 52 HA MET 52 20.677 14.555 9.660 1194 1HB MET 52 HB2 MET 52 18.415 14.997 11.665 1195 2HB MET 52 HB3 MET 52 18.852 16.067 10.331 1196 1HG MET 52 HG2 MET 52 17.635 13.320 10.190 1197 2HG MET 52 HG3 MET 52 17.034 14.822 9.513 1198 1HE MET 52 HE1 MET 52 19.878 15.870 8.036 1199 2HE MET 52 HE2 MET 52 19.345 15.364 6.432 1200 3HE MET 52 HE3 MET 52 18.158 16.044 7.564 1201 H LYS 53 HN LYS 53 20.754 14.333 13.235 1202 HA LYS 53 HA LYS 53 22.119 16.835 13.545 1203 1HB LYS 53 HB2 LYS 53 22.402 14.355 15.298 1204 2HB LYS 53 HB3 LYS 53 22.834 16.010 15.738 1205 1HG LYS 53 HG2 LYS 53 20.040 14.977 15.254 1206 2HG LYS 53 HG3 LYS 53 20.782 15.274 16.814 1207 1HD LYS 53 HD2 LYS 53 20.811 17.680 16.436 1208 2HD LYS 53 HD3 LYS 53 20.368 17.461 14.735 1209 1HE LYS 53 HE2 LYS 53 18.351 18.055 15.747 1210 2HE LYS 53 HE3 LYS 53 18.280 16.309 15.460 1211 1HZ LYS 53 HZ1 LYS 53 17.419 16.857 17.631 1212 2HZ LYS 53 HZ2 LYS 53 18.800 16.006 17.845 1213 3HZ LYS 53 HZ3 LYS 53 18.793 17.628 18.067 1214 H GLU 54 HN GLU 54 23.285 13.680 12.388 1215 HA GLU 54 HA GLU 54 26.051 14.070 12.673 1216 1HB GLU 54 HB2 GLU 54 24.618 12.892 10.256 1217 2HB GLU 54 HB3 GLU 54 26.335 12.765 10.585 1218 1HG GLU 54 HG2 GLU 54 25.817 11.527 12.708 1219 2HG GLU 54 HG3 GLU 54 24.121 11.492 12.219 1220 H VAL 55 HN VAL 55 23.814 15.630 10.414 1221 HA VAL 55 HA VAL 55 26.053 17.218 9.263 1222 HB VAL 55 HB VAL 55 24.635 17.397 7.238 1223 1HG1 VAL 55 HG11 VAL 55 25.216 15.244 6.368 1224 2HG1 VAL 55 HG12 VAL 55 26.462 15.698 7.525 1225 3HG1 VAL 55 HG13 VAL 55 25.228 14.502 7.983 1226 1HG2 VAL 55 HG21 VAL 55 22.402 16.896 8.288 1227 2HG2 VAL 55 HG22 VAL 55 22.750 15.921 6.854 1228 3HG2 VAL 55 HG23 VAL 55 22.897 15.199 8.466 1229 H GLY 56 HN GLY 56 24.158 17.601 11.705 1230 1HA GLY 56 HA2 GLY 56 23.345 19.408 12.806 1231 2HA GLY 56 HA3 GLY 56 24.208 20.412 11.631 1232 H ILE 57 HN ILE 57 21.413 18.132 11.112 1233 HA ILE 57 HA ILE 57 19.702 20.502 10.459 1234 HB ILE 57 HB ILE 57 19.689 17.790 9.100 1235 1HG1 ILE 57 HG12 ILE 57 20.328 20.566 8.002 1236 2HG1 ILE 57 HG13 ILE 57 21.506 19.297 8.320 1237 1HG2 ILE 57 HG21 ILE 57 17.373 18.669 9.405 1238 2HG2 ILE 57 HG22 ILE 57 17.856 20.203 8.644 1239 3HG2 ILE 57 HG23 ILE 57 17.832 18.699 7.719 1240 1HD1 ILE 57 HD11 ILE 57 20.389 17.847 6.612 1241 2HD1 ILE 57 HD12 ILE 57 19.359 19.238 6.178 1242 3HD1 ILE 57 HD13 ILE 57 21.111 19.338 5.988 1243 H ASP 58 HN ASP 58 17.574 20.280 11.410 1244 HA ASP 58 HA ASP 58 17.466 18.233 13.588 1245 1HB ASP 58 HB2 ASP 58 17.952 20.387 14.551 1246 2HB ASP 58 HB3 ASP 58 16.638 21.147 13.635 1247 H ILE 59 HN ILE 59 15.687 17.161 13.850 1248 HA ILE 59 HA ILE 59 13.143 17.819 12.548 1249 HB ILE 59 HB ILE 59 12.936 15.465 11.743 1250 1HG1 ILE 59 HG12 ILE 59 15.976 15.262 11.868 1251 2HG1 ILE 59 HG13 ILE 59 14.936 14.609 13.132 1252 1HG2 ILE 59 HG21 ILE 59 14.027 15.839 9.608 1253 2HG2 ILE 59 HG22 ILE 59 13.446 17.384 10.235 1254 3HG2 ILE 59 HG23 ILE 59 15.174 16.984 10.343 1255 1HD1 ILE 59 HD11 ILE 59 13.796 13.168 11.552 1256 2HD1 ILE 59 HD12 ILE 59 14.782 13.793 10.204 1257 3HD1 ILE 59 HD13 ILE 59 15.536 12.870 11.505 1258 H SER 60 HN SER 60 14.306 17.714 15.363 1259 HA SER 60 HA SER 60 13.416 15.287 16.510 1260 1HB SER 60 HB2 SER 60 13.817 17.964 17.912 1261 2HB SER 60 HB3 SER 60 13.922 16.351 18.639 1262 HG SER 60 HG SER 60 15.644 17.598 16.745 1263 H ASN 61 HN ASN 61 11.273 16.957 14.953 1264 HA ASN 61 HA ASN 61 9.086 16.780 16.847 1265 1HB ASN 61 HB2 ASN 61 10.391 19.118 16.864 1266 2HB ASN 61 HB3 ASN 61 9.473 19.411 15.398 1267 1HD2 ASN 61 HD22 ASN 61 6.989 18.628 15.806 1268 2HD2 ASN 61 HD21 ASN 61 6.260 19.300 17.267 1269 H GLN 62 HN GLN 62 9.981 15.580 13.993 1270 HA GLN 62 HA GLN 62 8.294 16.320 12.033 1271 1HB GLN 62 HB2 GLN 62 8.663 13.420 12.885 1272 2HB GLN 62 HB3 GLN 62 8.229 13.996 11.278 1273 1HG GLN 62 HG2 GLN 62 10.865 14.498 12.692 1274 2HG GLN 62 HG3 GLN 62 10.597 13.360 11.425 1275 1HE2 GLN 62 HE22 GLN 62 10.609 14.004 9.295 1276 2HE2 GLN 62 HE21 GLN 62 11.152 15.648 8.852 1277 H THR 63 HN THR 63 6.314 15.955 11.299 1278 HA THR 63 HA THR 63 4.146 15.065 13.125 1279 HB THR 63 HB THR 63 2.853 16.936 12.004 1280 HG1 THR 63 HG1 THR 63 4.064 17.294 10.171 1281 1HG2 THR 63 HG21 THR 63 4.005 17.217 14.225 1282 2HG2 THR 63 HG22 THR 63 5.407 17.879 13.352 1283 3HG2 THR 63 HG23 THR 63 3.844 18.721 13.298 1284 H SER 64 HN SER 64 5.361 13.190 11.420 1285 HA SER 64 HA SER 64 4.290 12.946 8.852 1286 1HB SER 64 HB2 SER 64 5.164 10.723 10.725 1287 2HB SER 64 HB3 SER 64 5.147 10.689 8.949 1288 HG SER 64 HG SER 64 6.618 12.535 9.082 1289 H ASP 65 HN ASP 65 3.035 10.776 8.241 1290 HA ASP 65 HA ASP 65 0.562 10.319 9.652 1291 1HB ASP 65 HB2 ASP 65 0.348 12.731 8.790 1292 2HB ASP 65 HB3 ASP 65 0.536 12.074 7.158 1293 H ILE 66 HN ILE 66 -0.979 9.102 8.090 1294 HA ILE 66 HA ILE 66 0.388 7.115 6.551 1295 HB ILE 66 HB ILE 66 -1.977 6.489 5.936 1296 1HG1 ILE 66 HG12 ILE 66 -2.791 8.668 7.890 1297 2HG1 ILE 66 HG13 ILE 66 -2.937 8.803 6.132 1298 1HG2 ILE 66 HG21 ILE 66 -2.443 5.575 8.144 1299 2HG2 ILE 66 HG22 ILE 66 -0.709 5.566 7.829 1300 3HG2 ILE 66 HG23 ILE 66 -1.397 6.796 8.912 1301 1HD1 ILE 66 HD11 ILE 66 -4.356 6.819 7.943 1302 2HD1 ILE 66 HD12 ILE 66 -5.066 8.185 7.070 1303 3HD1 ILE 66 HD13 ILE 66 -4.435 6.792 6.159 1304 H ILE 67 HN ILE 67 -0.350 6.572 4.246 1305 HA ILE 67 HA ILE 67 0.268 8.535 2.412 1306 HB ILE 67 HB ILE 67 -0.332 7.163 0.729 1307 1HG1 ILE 67 HG12 ILE 67 -2.447 5.744 2.383 1308 2HG1 ILE 67 HG13 ILE 67 -2.729 6.937 1.110 1309 1HG2 ILE 67 HG21 ILE 67 0.532 4.995 1.223 1310 2HG2 ILE 67 HG22 ILE 67 1.334 6.129 2.308 1311 3HG2 ILE 67 HG23 ILE 67 0.024 5.080 2.917 1312 1HD1 ILE 67 HD11 ILE 67 -1.705 4.117 0.755 1313 2HD1 ILE 67 HD12 ILE 67 -3.149 4.897 0.063 1314 3HD1 ILE 67 HD13 ILE 67 -1.555 5.359 -0.521 1315 H ASP 68 HN ASP 68 -0.691 10.198 1.486 1316 HA ASP 68 HA ASP 68 -3.588 10.693 1.944 1317 1HB ASP 68 HB2 ASP 68 -2.250 11.803 3.715 1318 2HB ASP 68 HB3 ASP 68 -1.435 12.764 2.469 1319 H SER 69 HN SER 69 -4.070 10.233 -0.069 1320 HA SER 69 HA SER 69 -3.057 10.843 -2.462 1321 1HB SER 69 HB2 SER 69 -5.956 11.257 -1.702 1322 2HB SER 69 HB3 SER 69 -5.330 10.593 -3.227 1323 HG SER 69 HG SER 69 -6.186 9.113 -1.418 1324 H ASP 70 HN ASP 70 -4.296 13.358 -0.276 1325 HA ASP 70 HA ASP 70 -5.141 15.079 -2.451 1326 1HB ASP 70 HB2 ASP 70 -6.225 15.198 -0.249 1327 2HB ASP 70 HB3 ASP 70 -4.699 15.709 0.478 1328 H ILE 71 HN ILE 71 -2.180 14.392 -0.773 1329 HA ILE 71 HA ILE 71 -0.874 16.694 -2.125 1330 HB ILE 71 HB ILE 71 0.966 15.463 -0.439 1331 1HG1 ILE 71 HG12 ILE 71 -0.681 14.437 0.959 1332 2HG1 ILE 71 HG13 ILE 71 0.331 15.619 1.764 1333 1HG2 ILE 71 HG21 ILE 71 -0.466 18.122 -0.162 1334 2HG2 ILE 71 HG22 ILE 71 1.034 17.664 0.680 1335 3HG2 ILE 71 HG23 ILE 71 1.015 17.786 -1.085 1336 1HD1 ILE 71 HD11 ILE 71 -1.899 15.766 2.640 1337 2HD1 ILE 71 HD12 ILE 71 -1.563 17.256 1.743 1338 3HD1 ILE 71 HD13 ILE 71 -2.597 15.989 1.041 1339 H LEU 72 HN LEU 72 -0.727 13.106 -1.616 1340 HA LEU 72 HA LEU 72 1.623 12.737 -3.117 1341 1HB LEU 72 HB2 LEU 72 0.476 11.060 -1.661 1342 2HB LEU 72 HB3 LEU 72 -0.705 10.783 -2.935 1343 HG LEU 72 HG LEU 72 2.293 10.471 -3.404 1344 1HD1 LEU 72 HD11 LEU 72 1.338 8.946 -1.493 1345 2HD1 LEU 72 HD12 LEU 72 0.590 8.053 -2.825 1346 3HD1 LEU 72 HD13 LEU 72 2.342 8.255 -2.771 1347 1HD2 LEU 72 HD21 LEU 72 -0.187 9.488 -4.865 1348 2HD2 LEU 72 HD22 LEU 72 1.194 10.388 -5.505 1349 3HD2 LEU 72 HD23 LEU 72 1.382 8.696 -5.083 1350 H ASN 73 HN ASN 73 -1.819 12.621 -4.303 1351 HA ASN 73 HA ASN 73 -1.095 12.056 -6.974 1352 1HB ASN 73 HB2 ASN 73 -3.263 12.173 -7.490 1353 2HB ASN 73 HB3 ASN 73 -3.492 12.114 -5.755 1354 1HD2 ASN 73 HD22 ASN 73 -3.877 14.277 -4.659 1355 2HD2 ASN 73 HD21 ASN 73 -4.553 15.604 -5.590 1356 H ASN 74 HN ASN 74 -1.083 15.076 -5.176 1357 HA ASN 74 HA ASN 74 -0.968 16.802 -7.514 1358 1HB ASN 74 HB2 ASN 74 -1.134 17.192 -4.524 1359 2HB ASN 74 HB3 ASN 74 -0.457 18.492 -5.470 1360 1HD2 ASN 74 HD22 ASN 74 -3.297 17.659 -4.126 1361 2HD2 ASN 74 HD21 ASN 74 -4.384 18.425 -5.270 1362 H ALA 75 HN ALA 75 1.362 14.971 -5.779 1363 HA ALA 75 HA ALA 75 3.518 16.837 -5.822 1364 1HB ALA 75 HB1 ALA 75 3.439 14.889 -4.334 1365 2HB ALA 75 HB2 ALA 75 3.574 13.795 -5.720 1366 3HB ALA 75 HB3 ALA 75 4.909 14.894 -5.321 1367 H ASP 76 HN ASP 76 5.516 16.396 -7.074 1368 HA ASP 76 HA ASP 76 4.924 15.803 -9.945 1369 1HB ASP 76 HB2 ASP 76 5.983 18.030 -9.226 1370 2HB ASP 76 HB3 ASP 76 7.432 17.078 -8.840 1371 H LEU 77 HN LEU 77 6.364 14.389 -7.160 1372 HA LEU 77 HA LEU 77 7.215 12.152 -8.753 1373 1HB LEU 77 HB2 LEU 77 9.236 13.985 -7.931 1374 2HB LEU 77 HB3 LEU 77 9.300 12.693 -6.735 1375 HG LEU 77 HG LEU 77 9.585 12.387 -9.707 1376 1HD1 LEU 77 HD11 LEU 77 11.603 12.043 -7.477 1377 2HD1 LEU 77 HD12 LEU 77 11.907 11.796 -9.213 1378 3HD1 LEU 77 HD13 LEU 77 11.518 13.412 -8.604 1379 1HD2 LEU 77 HD21 LEU 77 10.271 10.029 -9.232 1380 2HD2 LEU 77 HD22 LEU 77 9.680 10.235 -7.570 1381 3HD2 LEU 77 HD23 LEU 77 8.568 10.355 -8.968 1382 H VAL 78 HN VAL 78 6.981 10.277 -7.601 1383 HA VAL 78 HA VAL 78 6.579 10.379 -4.655 1384 HB VAL 78 HB VAL 78 5.519 8.225 -6.482 1385 1HG1 VAL 78 HG11 VAL 78 5.923 7.608 -4.094 1386 2HG1 VAL 78 HG12 VAL 78 4.994 9.028 -3.570 1387 3HG1 VAL 78 HG13 VAL 78 4.188 7.712 -4.431 1388 1HG2 VAL 78 HG21 VAL 78 4.336 10.283 -7.064 1389 2HG2 VAL 78 HG22 VAL 78 3.297 9.211 -6.152 1390 3HG2 VAL 78 HG23 VAL 78 4.023 10.636 -5.352 1391 H VAL 79 HN VAL 79 8.556 10.138 -3.935 1392 HA VAL 79 HA VAL 79 10.521 8.418 -5.275 1393 HB VAL 79 HB VAL 79 10.660 9.866 -2.598 1394 1HG1 VAL 79 HG11 VAL 79 12.957 9.137 -4.420 1395 2HG1 VAL 79 HG12 VAL 79 13.025 9.756 -2.774 1396 3HG1 VAL 79 HG13 VAL 79 12.426 8.112 -3.067 1397 1HG2 VAL 79 HG21 VAL 79 10.195 11.574 -4.303 1398 2HG2 VAL 79 HG22 VAL 79 11.883 11.681 -3.808 1399 3HG2 VAL 79 HG23 VAL 79 11.464 10.905 -5.351 1400 H THR 80 HN THR 80 9.912 6.213 -5.063 1401 HA THR 80 HA THR 80 8.768 5.234 -2.551 1402 HB THR 80 HB THR 80 10.318 3.520 -4.515 1403 HG1 THR 80 HG1 THR 80 8.059 4.969 -5.019 1404 1HG2 THR 80 HG21 THR 80 8.660 1.839 -3.937 1405 2HG2 THR 80 HG22 THR 80 9.478 2.444 -2.484 1406 3HG2 THR 80 HG23 THR 80 7.831 3.002 -2.861 1407 H LEU 81 HN LEU 81 9.990 5.139 -0.687 1408 HA LEU 81 HA LEU 81 12.960 5.247 -0.924 1409 1HB LEU 81 HB2 LEU 81 11.776 7.507 -0.808 1410 2HB LEU 81 HB3 LEU 81 11.171 7.026 0.761 1411 HG LEU 81 HG LEU 81 13.777 6.637 1.287 1412 1HD1 LEU 81 HD11 LEU 81 13.927 8.722 -0.905 1413 2HD1 LEU 81 HD12 LEU 81 15.250 8.170 0.126 1414 3HD1 LEU 81 HD13 LEU 81 14.521 7.059 -1.054 1415 1HD2 LEU 81 HD21 LEU 81 13.900 8.835 2.198 1416 2HD2 LEU 81 HD22 LEU 81 12.630 9.442 1.099 1417 3HD2 LEU 81 HD23 LEU 81 12.241 8.263 2.374 1418 H SER 82 HN SER 82 12.001 2.819 -0.345 1419 HA SER 82 HA SER 82 13.295 2.375 2.032 1420 1HB SER 82 HB2 SER 82 11.583 1.318 3.464 1421 2HB SER 82 HB3 SER 82 11.238 3.021 3.237 1422 HG SER 82 HG SER 82 9.826 2.182 1.421 1423 H GLY 83 HN GLY 83 13.120 -0.172 2.543 1424 1HA GLY 83 HA2 GLY 83 12.263 -1.704 0.136 1425 2HA GLY 83 HA3 GLY 83 13.909 -1.881 0.739 1426 H ASP 84 HN ASP 84 11.753 -1.370 3.381 1427 HA ASP 84 HA ASP 84 11.828 -4.181 4.149 1428 1HB ASP 84 HB2 ASP 84 11.807 -2.276 5.784 1429 2HB ASP 84 HB3 ASP 84 10.137 -1.955 5.322 1430 H ALA 85 HN ALA 85 9.776 -2.128 2.257 1431 HA ALA 85 HA ALA 85 7.978 -2.439 0.994 1432 1HB ALA 85 HB1 ALA 85 7.937 -4.497 -0.305 1433 2HB ALA 85 HB2 ALA 85 9.606 -3.945 -0.070 1434 3HB ALA 85 HB3 ALA 85 8.976 -5.306 0.887 1435 H ALA 86 HN ALA 86 7.235 -2.324 3.622 1436 HA ALA 86 HA ALA 86 4.777 -4.024 3.550 1437 1HB ALA 86 HB1 ALA 86 6.174 -4.672 5.465 1438 2HB ALA 86 HB2 ALA 86 6.206 -3.002 6.040 1439 3HB ALA 86 HB3 ALA 86 4.674 -3.885 5.994 1440 H ASP 87 HN ASP 87 5.772 -1.206 2.568 1441 HA ASP 87 HA ASP 87 4.287 0.792 3.870 1442 1HB ASP 87 HB2 ASP 87 5.092 2.221 2.204 1443 2HB ASP 87 HB3 ASP 87 6.357 1.030 2.437 1444 H LYS 88 HN LYS 88 2.536 -1.524 2.878 1445 HA LYS 88 HA LYS 88 0.487 -1.888 2.062 1446 1HB LYS 88 HB2 LYS 88 0.087 0.352 3.349 1447 2HB LYS 88 HB3 LYS 88 -0.086 1.062 1.749 1448 1HG LYS 88 HG2 LYS 88 -1.906 -0.611 1.265 1449 2HG LYS 88 HG3 LYS 88 -1.719 -1.267 2.883 1450 1HD LYS 88 HD2 LYS 88 -2.352 1.675 2.345 1451 2HD LYS 88 HD3 LYS 88 -3.601 0.434 2.425 1452 1HE LYS 88 HE2 LYS 88 -1.627 0.909 4.684 1453 2HE LYS 88 HE3 LYS 88 -3.160 1.775 4.567 1454 1HZ LYS 88 HZ1 LYS 88 -2.921 -1.176 4.797 1455 2HZ LYS 88 HZ2 LYS 88 -3.361 -0.156 5.993 1456 3HZ LYS 88 HZ3 LYS 88 -4.332 -0.346 4.706 1457 H CYS 89 HN CYS 89 2.744 -1.623 0.234 1458 HA CYS 89 HA CYS 89 3.280 -1.473 -1.992 1459 1HB CYS 89 HB2 CYS 89 1.836 -3.202 -3.250 1460 2HB CYS 89 HB3 CYS 89 2.628 -3.709 -1.767 1461 HA PRO 90 HA PRO 90 -0.265 1.585 -2.686 1462 1HB PRO 90 HB2 PRO 90 1.968 3.581 -3.096 1463 2HB PRO 90 HB3 PRO 90 0.389 3.829 -2.291 1464 1HG PRO 90 HG2 PRO 90 2.567 3.476 -0.757 1465 2HG PRO 90 HG3 PRO 90 1.085 2.547 -0.375 1466 1HD PRO 90 HD2 PRO 90 3.448 1.642 -2.071 1467 2HD PRO 90 HD3 PRO 90 2.781 0.861 -0.625 1468 H MET 91 HN MET 91 -1.208 1.914 -4.723 1469 HA MET 91 HA MET 91 0.473 1.186 -7.006 1470 1HB MET 91 HB2 MET 91 -1.624 1.307 -8.321 1471 2HB MET 91 HB3 MET 91 -1.563 0.151 -7.013 1472 1HG MET 91 HG2 MET 91 -3.623 1.042 -6.777 1473 2HG MET 91 HG3 MET 91 -2.750 1.928 -5.580 1474 1HE MET 91 HE1 MET 91 -5.509 2.299 -7.202 1475 2HE MET 91 HE2 MET 91 -4.863 2.845 -5.664 1476 3HE MET 91 HE3 MET 91 -5.589 4.057 -6.842 1477 H THR 92 HN THR 92 0.071 4.218 -5.562 1478 HA THR 92 HA THR 92 0.470 6.313 -6.246 1479 HB THR 92 HB THR 92 2.475 6.589 -7.699 1480 HG1 THR 92 HG1 THR 92 2.097 4.600 -8.867 1481 1HG2 THR 92 HG21 THR 92 2.584 6.311 -5.227 1482 2HG2 THR 92 HG22 THR 92 2.758 4.562 -5.437 1483 3HG2 THR 92 HG23 THR 92 4.011 5.664 -6.053 1484 HA PRO 93 HA PRO 93 -2.488 6.116 -9.657 1485 1HB PRO 93 HB2 PRO 93 -3.858 8.455 -9.230 1486 2HB PRO 93 HB3 PRO 93 -4.065 6.992 -8.209 1487 1HG PRO 93 HG2 PRO 93 -2.279 9.371 -7.596 1488 2HG PRO 93 HG3 PRO 93 -3.532 8.586 -6.568 1489 1HD PRO 93 HD2 PRO 93 -0.917 7.896 -6.371 1490 2HD PRO 93 HD3 PRO 93 -2.185 6.636 -6.266 1491 HA PRO 94 HA PRO 94 0.114 7.909 -12.612 1492 1HB PRO 94 HB2 PRO 94 -1.477 8.145 -14.879 1493 2HB PRO 94 HB3 PRO 94 -0.899 6.606 -14.182 1494 1HG PRO 94 HG2 PRO 94 -3.561 7.986 -13.686 1495 2HG PRO 94 HG3 PRO 94 -3.270 6.277 -14.166 1496 1HD PRO 94 HD2 PRO 94 -3.659 6.878 -11.580 1497 2HD PRO 94 HD3 PRO 94 -2.336 5.754 -12.043 1498 H HIS 95 HN HIS 95 -1.910 10.003 -11.159 1499 HA HIS 95 HA HIS 95 -1.751 12.343 -12.824 1500 1HB HIS 95 HB2 HIS 95 -1.984 12.103 -9.799 1501 2HB HIS 95 HB3 HIS 95 -2.380 13.518 -10.771 1502 HD1 HIS 95 HD1 HIS 95 -4.418 12.687 -12.826 1503 HD2 HIS 95 HD2 HIS 95 -4.114 10.797 -9.077 1504 HE1 HIS 95 HE1 HIS 95 -6.633 11.498 -12.435 1505 H VAL 96 HN VAL 96 0.707 10.546 -11.153 1506 HA VAL 96 HA VAL 96 2.587 12.817 -11.315 1507 HB VAL 96 HB VAL 96 1.587 12.972 -9.128 1508 1HG1 VAL 96 HG11 VAL 96 1.811 11.197 -7.430 1509 2HG1 VAL 96 HG12 VAL 96 0.710 10.747 -8.728 1510 3HG1 VAL 96 HG13 VAL 96 2.351 10.060 -8.678 1511 1HG2 VAL 96 HG21 VAL 96 4.040 13.376 -9.363 1512 2HG2 VAL 96 HG22 VAL 96 3.514 12.923 -7.730 1513 3HG2 VAL 96 HG23 VAL 96 4.329 11.744 -8.746 1514 H LYS 97 HN LYS 97 4.808 12.201 -11.201 1515 HA LYS 97 HA LYS 97 5.536 9.700 -12.514 1516 1HB LYS 97 HB2 LYS 97 6.421 12.088 -12.891 1517 2HB LYS 97 HB3 LYS 97 7.271 11.900 -11.362 1518 1HG LYS 97 HG2 LYS 97 7.753 9.592 -13.095 1519 2HG LYS 97 HG3 LYS 97 8.072 11.087 -13.986 1520 1HD LYS 97 HD2 LYS 97 9.163 10.329 -11.304 1521 2HD LYS 97 HD3 LYS 97 10.041 10.096 -12.812 1522 1HE LYS 97 HE2 LYS 97 9.212 12.814 -11.643 1523 2HE LYS 97 HE3 LYS 97 10.846 12.142 -11.603 1524 1HZ LYS 97 HZ1 LYS 97 10.886 12.265 -14.027 1525 2HZ LYS 97 HZ2 LYS 97 9.393 12.953 -14.046 1526 3HZ LYS 97 HZ3 LYS 97 10.642 13.724 -13.308 1527 H ARG 98 HN ARG 98 7.140 8.181 -11.540 1528 HA ARG 98 HA ARG 98 7.586 8.386 -8.643 1529 1HB ARG 98 HB2 ARG 98 5.462 7.090 -8.790 1530 2HB ARG 98 HB3 ARG 98 6.234 5.967 -9.901 1531 1HG ARG 98 HG2 ARG 98 7.944 5.989 -7.611 1532 2HG ARG 98 HG3 ARG 98 6.344 6.089 -6.939 1533 1HD ARG 98 HD2 ARG 98 7.058 4.050 -9.096 1534 2HD ARG 98 HD3 ARG 98 7.544 3.795 -7.438 1535 HE ARG 98 HE ARG 98 4.713 4.091 -8.353 1536 1HH1 ARG 98 HH11 ARG 98 6.905 3.005 -5.744 1537 2HH1 ARG 98 HH12 ARG 98 5.761 1.864 -5.126 1538 1HH2 ARG 98 HH22 ARG 98 3.234 2.867 -7.409 1539 2HH2 ARG 98 HH21 ARG 98 3.512 1.871 -6.032 1540 H GLU 99 HN GLU 99 9.510 7.345 -8.065 1541 HA GLU 99 HA GLU 99 10.665 5.370 -9.789 1542 1HB GLU 99 HB2 GLU 99 11.550 7.424 -10.869 1543 2HB GLU 99 HB3 GLU 99 12.176 7.982 -9.325 1544 1HG GLU 99 HG2 GLU 99 13.945 7.015 -10.731 1545 2HG GLU 99 HG3 GLU 99 13.752 6.082 -9.257 1546 H HIS 100 HN HIS 100 12.138 4.126 -8.582 1547 HA HIS 100 HA HIS 100 11.788 4.313 -5.673 1548 1HB HIS 100 HB2 HIS 100 13.263 2.172 -7.244 1549 2HB HIS 100 HB3 HIS 100 12.612 2.052 -5.617 1550 HD1 HIS 100 HD1 HIS 100 9.536 2.963 -6.348 1551 HD2 HIS 100 HD2 HIS 100 12.011 0.230 -8.391 1552 HE1 HIS 100 HE1 HIS 100 7.988 1.381 -7.609 1553 H TRP 101 HN TRP 101 13.337 4.927 -4.305 1554 HA TRP 101 HA TRP 101 16.184 4.996 -5.112 1555 1HB TRP 101 HB2 TRP 101 14.642 7.318 -3.904 1556 2HB TRP 101 HB3 TRP 101 16.377 7.270 -4.165 1557 HD1 TRP 101 HD1 TRP 101 13.111 7.788 -6.052 1558 HE1 TRP 101 HE1 TRP 101 13.586 8.781 -8.339 1559 HE3 TRP 101 HE3 TRP 101 18.143 6.906 -6.244 1560 HZ2 TRP 101 HZ2 TRP 101 15.819 8.860 -10.192 1561 HZ3 TRP 101 HZ3 TRP 101 19.395 7.323 -8.341 1562 HH2 TRP 101 HH2 TRP 101 18.251 8.281 -10.322 1563 H GLY 102 HN GLY 102 14.439 3.238 -3.364 1564 1HA GLY 102 HA2 GLY 102 16.369 3.134 -1.194 1565 2HA GLY 102 HA3 GLY 102 14.662 3.209 -0.707 1566 H PHE 103 HN PHE 103 16.458 1.058 -0.300 1567 HA PHE 103 HA PHE 103 14.991 -1.206 -1.387 1568 1HB PHE 103 HB2 PHE 103 16.788 -0.574 -3.118 1569 2HB PHE 103 HB3 PHE 103 17.990 -0.987 -1.909 1570 HD1 PHE 103 HD1 PHE 103 18.843 -3.209 -1.970 1571 HD2 PHE 103 HD2 PHE 103 14.927 -2.412 -3.601 1572 HE1 PHE 103 HE1 PHE 103 18.691 -5.555 -2.765 1573 HE2 PHE 103 HE2 PHE 103 14.779 -4.761 -4.387 1574 HZ PHE 103 HZ PHE 103 16.660 -6.338 -3.970 1575 H ASP 104 HN ASP 104 15.661 0.240 1.162 1576 HA ASP 104 HA ASP 104 16.415 -1.749 3.058 1577 1HB ASP 104 HB2 ASP 104 18.500 -0.708 3.794 1578 2HB ASP 104 HB3 ASP 104 18.698 -1.240 2.131 1579 H ASP 105 HN ASP 105 16.683 -0.375 5.222 1580 HA ASP 105 HA ASP 105 15.999 2.351 5.219 1581 1HB ASP 105 HB2 ASP 105 13.680 1.702 4.969 1582 2HB ASP 105 HB3 ASP 105 13.820 0.462 6.202 1583 HA PRO 106 HA PRO 106 18.726 1.281 8.431 1584 1HB PRO 106 HB2 PRO 106 19.083 3.543 9.866 1585 2HB PRO 106 HB3 PRO 106 19.581 3.399 8.152 1586 1HG PRO 106 HG2 PRO 106 17.025 4.615 9.237 1587 2HG PRO 106 HG3 PRO 106 18.148 5.302 8.021 1588 1HD PRO 106 HD2 PRO 106 15.873 3.936 7.347 1589 2HD PRO 106 HD3 PRO 106 17.355 3.850 6.341 1590 H ALA 107 HN ALA 107 15.444 2.179 9.384 1591 HA ALA 107 HA ALA 107 15.749 1.373 12.126 1592 1HB ALA 107 HB1 ALA 107 13.902 2.873 11.284 1593 2HB ALA 107 HB2 ALA 107 13.217 1.468 10.437 1594 3HB ALA 107 HB3 ALA 107 13.328 1.457 12.200 1595 H ARG 108 HN ARG 108 16.434 -0.331 9.467 1596 HA ARG 108 HA ARG 108 15.389 -2.930 10.522 1597 1HB ARG 108 HB2 ARG 108 16.188 -2.530 7.665 1598 2HB ARG 108 HB3 ARG 108 15.175 -3.778 8.372 1599 1HG ARG 108 HG2 ARG 108 14.389 -0.884 7.845 1600 2HG ARG 108 HG3 ARG 108 13.928 -2.281 6.877 1601 1HD ARG 108 HD2 ARG 108 13.063 -1.606 9.695 1602 2HD ARG 108 HD3 ARG 108 12.052 -1.651 8.251 1603 HE ARG 108 HE ARG 108 12.212 -4.037 8.182 1604 1HH1 ARG 108 HH11 ARG 108 13.285 -2.611 11.307 1605 2HH1 ARG 108 HH12 ARG 108 12.919 -4.045 12.196 1606 1HH2 ARG 108 HH21 ARG 108 11.812 -5.889 9.369 1607 2HH2 ARG 108 HH22 ARG 108 12.097 -5.964 11.071 1608 H ALA 109 HN ALA 109 17.968 -1.103 10.680 1609 HA ALA 109 HA ALA 109 20.186 -2.501 9.760 1610 1HB ALA 109 HB1 ALA 109 19.786 -1.173 12.483 1611 2HB ALA 109 HB2 ALA 109 21.333 -1.482 11.670 1612 3HB ALA 109 HB3 ALA 109 20.193 -0.302 10.993 1613 H GLN 110 HN GLN 110 21.579 -3.952 10.950 1614 HA GLN 110 HA GLN 110 20.184 -6.272 11.488 1615 1HB GLN 110 HB2 GLN 110 22.614 -6.096 10.769 1616 2HB GLN 110 HB3 GLN 110 23.053 -5.690 12.435 1617 1HG GLN 110 HG2 GLN 110 21.406 -8.159 12.184 1618 2HG GLN 110 HG3 GLN 110 22.936 -8.247 11.316 1619 1HE2 GLN 110 HE22 GLN 110 21.447 -7.852 14.533 1620 2HE2 GLN 110 HE21 GLN 110 22.881 -8.308 15.436 1621 H GLY 111 HN GLY 111 21.356 -3.830 13.751 1622 1HA GLY 111 HA2 GLY 111 19.755 -3.500 15.518 1623 2HA GLY 111 HA3 GLY 111 19.895 -5.247 15.901 1624 H THR 112 HN THR 112 22.918 -4.668 15.344 1625 HA THR 112 HA THR 112 23.629 -4.262 18.156 1626 HB THR 112 HB THR 112 25.925 -4.498 17.422 1627 HG1 THR 112 HG1 THR 112 26.327 -4.774 15.175 1628 1HG2 THR 112 HG21 THR 112 24.420 -6.550 17.509 1629 2HG2 THR 112 HG22 THR 112 24.306 -6.417 15.728 1630 3HG2 THR 112 HG23 THR 112 25.884 -6.699 16.498 1631 H GLU 113 HN GLU 113 25.116 -2.443 18.750 1632 HA GLU 113 HA GLU 113 23.888 -0.030 18.029 1633 1HB GLU 113 HB2 GLU 113 26.649 -0.615 19.247 1634 2HB GLU 113 HB3 GLU 113 25.873 0.986 19.299 1635 1HG GLU 113 HG2 GLU 113 23.961 -0.014 20.571 1636 2HG GLU 113 HG3 GLU 113 24.810 -1.562 20.594 1637 H GLU 114 HN GLU 114 26.833 -1.612 16.899 1638 HA GLU 114 HA GLU 114 27.819 0.532 15.292 1639 1HB GLU 114 HB2 GLU 114 29.130 -1.417 14.224 1640 2HB GLU 114 HB3 GLU 114 29.480 -0.981 15.911 1641 1HG GLU 114 HG2 GLU 114 27.985 -2.887 16.623 1642 2HG GLU 114 HG3 GLU 114 27.839 -3.302 14.889 1643 H GLU 115 HN GLU 115 25.617 -2.373 14.676 1644 HA GLU 115 HA GLU 115 25.755 -1.801 11.863 1645 1HB GLU 115 HB2 GLU 115 24.007 -3.624 13.500 1646 2HB GLU 115 HB3 GLU 115 23.849 -3.452 11.752 1647 1HG GLU 115 HG2 GLU 115 26.580 -4.042 12.974 1648 2HG GLU 115 HG3 GLU 115 25.417 -5.338 12.696 1649 H LYS 116 HN LYS 116 23.565 -0.847 14.522 1650 HA LYS 116 HA LYS 116 21.645 0.490 12.896 1651 1HB LYS 116 HB2 LYS 116 22.659 1.077 15.723 1652 2HB LYS 116 HB3 LYS 116 21.437 2.065 14.914 1653 1HG LYS 116 HG2 LYS 116 20.066 -0.027 14.577 1654 2HG LYS 116 HG3 LYS 116 21.202 -0.867 15.660 1655 1HD LYS 116 HD2 LYS 116 20.530 0.337 17.538 1656 2HD LYS 116 HD3 LYS 116 19.924 1.714 16.592 1657 1HE LYS 116 HE2 LYS 116 18.048 0.448 15.758 1658 2HE LYS 116 HE3 LYS 116 18.636 -1.040 16.526 1659 1HZ LYS 116 HZ1 LYS 116 16.892 0.005 17.834 1660 2HZ LYS 116 HZ2 LYS 116 18.278 0.006 18.686 1661 3HZ LYS 116 HZ3 LYS 116 17.744 1.385 17.986 1662 H TRP 117 HN TRP 117 24.620 1.833 14.391 1663 HA TRP 117 HA TRP 117 24.174 4.318 13.064 1664 1HB TRP 117 HB2 TRP 117 25.654 4.001 15.072 1665 2HB TRP 117 HB3 TRP 117 26.877 3.321 13.996 1666 HD1 TRP 117 HD1 TRP 117 25.258 6.029 12.139 1667 HE1 TRP 117 HE1 TRP 117 26.622 8.180 12.187 1668 HE3 TRP 117 HE3 TRP 117 28.319 4.934 16.111 1669 HZ2 TRP 117 HZ2 TRP 117 28.361 9.460 14.052 1670 HZ3 TRP 117 HZ3 TRP 117 29.787 6.702 17.053 1671 HH2 TRP 117 HH2 TRP 117 29.816 8.980 16.049 1672 H ALA 118 HN ALA 118 26.025 1.437 12.143 1673 HA ALA 118 HA ALA 118 27.198 2.549 9.841 1674 1HB ALA 118 HB1 ALA 118 27.511 0.101 9.211 1675 2HB ALA 118 HB2 ALA 118 27.903 0.380 10.930 1676 3HB ALA 118 HB3 ALA 118 26.350 -0.329 10.494 1677 H PHE 119 HN PHE 119 24.001 0.975 10.202 1678 HA PHE 119 HA PHE 119 23.408 1.113 7.388 1679 1HB PHE 119 HB2 PHE 119 21.827 0.644 9.894 1680 2HB PHE 119 HB3 PHE 119 20.948 1.217 8.504 1681 HD1 PHE 119 HD1 PHE 119 23.570 -1.432 9.211 1682 HD2 PHE 119 HD2 PHE 119 19.964 -0.339 7.102 1683 HE1 PHE 119 HE1 PHE 119 23.415 -3.723 8.282 1684 HE2 PHE 119 HE2 PHE 119 19.830 -2.624 6.164 1685 HZ PHE 119 HZ PHE 119 21.550 -4.323 6.751 1686 H PHE 120 HN PHE 120 22.681 3.294 10.226 1687 HA PHE 120 HA PHE 120 21.286 5.006 8.404 1688 1HB PHE 120 HB2 PHE 120 20.678 6.377 10.079 1689 2HB PHE 120 HB3 PHE 120 20.751 4.770 10.781 1690 HD1 PHE 120 HD1 PHE 120 22.832 7.919 10.539 1691 HD2 PHE 120 HD2 PHE 120 21.461 4.608 12.955 1692 HE1 PHE 120 HE1 PHE 120 23.855 8.933 12.552 1693 HE2 PHE 120 HE2 PHE 120 22.509 5.632 14.949 1694 HZ PHE 120 HZ PHE 120 23.760 7.771 14.727 1695 H GLN 121 HN GLN 121 24.706 5.045 9.389 1696 HA GLN 121 HA GLN 121 25.106 7.654 8.285 1697 1HB GLN 121 HB2 GLN 121 27.403 7.384 8.596 1698 2HB GLN 121 HB3 GLN 121 26.548 6.713 9.985 1699 1HG GLN 121 HG2 GLN 121 26.913 4.445 8.981 1700 2HG GLN 121 HG3 GLN 121 27.915 5.191 7.738 1701 1HE2 GLN 121 HE22 GLN 121 27.604 5.218 11.373 1702 2HE2 GLN 121 HE21 GLN 121 29.324 5.134 11.661 1703 H ARG 122 HN ARG 122 25.462 4.351 6.973 1704 HA ARG 122 HA ARG 122 26.460 4.996 4.400 1705 1HB ARG 122 HB2 ARG 122 26.355 2.723 5.400 1706 2HB ARG 122 HB3 ARG 122 24.596 2.778 5.369 1707 1HG ARG 122 HG2 ARG 122 24.937 3.050 2.745 1708 2HG ARG 122 HG3 ARG 122 26.537 2.385 3.094 1709 1HD ARG 122 HD2 ARG 122 23.807 1.165 3.650 1710 2HD ARG 122 HD3 ARG 122 25.023 0.569 2.517 1711 HE ARG 122 HE ARG 122 26.469 0.233 4.623 1712 1HH1 ARG 122 HH11 ARG 122 22.956 -0.315 4.551 1713 2HH1 ARG 122 HH12 ARG 122 22.952 -1.377 5.914 1714 1HH2 ARG 122 HH21 ARG 122 26.462 -1.200 6.409 1715 2HH2 ARG 122 HH22 ARG 122 24.995 -1.921 6.952 1716 H VAL 123 HN VAL 123 23.095 4.459 5.545 1717 HA VAL 123 HA VAL 123 21.877 5.123 3.074 1718 HB VAL 123 HB VAL 123 20.813 4.997 5.924 1719 1HG1 VAL 123 HG11 VAL 123 19.285 6.419 4.701 1720 2HG1 VAL 123 HG12 VAL 123 19.295 5.323 3.299 1721 3HG1 VAL 123 HG13 VAL 123 18.555 4.813 4.825 1722 1HG2 VAL 123 HG21 VAL 123 20.557 3.089 3.545 1723 2HG2 VAL 123 HG22 VAL 123 21.624 2.825 4.923 1724 3HG2 VAL 123 HG23 VAL 123 19.876 2.832 5.163 1725 H ARG 124 HN ARG 124 22.671 7.217 5.942 1726 HA ARG 124 HA ARG 124 21.422 9.531 5.003 1727 1HB ARG 124 HB2 ARG 124 22.120 9.515 7.189 1728 2HB ARG 124 HB3 ARG 124 23.755 8.972 6.825 1729 1HG ARG 124 HG2 ARG 124 22.936 11.699 5.905 1730 2HG ARG 124 HG3 ARG 124 23.200 11.450 7.624 1731 1HD ARG 124 HD2 ARG 124 25.269 10.787 5.492 1732 2HD ARG 124 HD3 ARG 124 25.200 12.310 6.389 1733 HE ARG 124 HE ARG 124 25.210 10.400 8.378 1734 1HH1 ARG 124 HH21 ARG 124 27.395 11.183 5.669 1735 2HH1 ARG 124 HH22 ARG 124 28.822 10.704 6.505 1736 1HH2 ARG 124 HH11 ARG 124 27.114 9.795 9.501 1737 2HH2 ARG 124 HH12 ARG 124 28.662 9.914 8.726 1738 H ASP 125 HN ASP 125 24.725 8.383 4.195 1739 HA ASP 125 HA ASP 125 25.406 10.674 2.660 1740 1HB ASP 125 HB2 ASP 125 27.071 9.027 3.345 1741 2HB ASP 125 HB3 ASP 125 26.301 7.782 2.356 1742 H GLU 126 HN GLU 126 23.803 7.588 1.662 1743 HA GLU 126 HA GLU 126 23.636 8.408 -1.086 1744 1HB GLU 126 HB2 GLU 126 23.613 6.054 -0.468 1745 2HB GLU 126 HB3 GLU 126 22.153 6.281 0.494 1746 1HG GLU 126 HG2 GLU 126 21.557 5.188 -1.534 1747 2HG GLU 126 HG3 GLU 126 20.857 6.790 -1.564 1748 H ILE 127 HN ILE 127 21.317 8.632 1.651 1749 HA ILE 127 HA ILE 127 19.127 9.562 0.097 1750 HB ILE 127 HB ILE 127 19.825 9.361 2.996 1751 1HG1 ILE 127 HG12 ILE 127 17.429 8.744 1.212 1752 2HG1 ILE 127 HG13 ILE 127 18.642 7.603 1.792 1753 1HG2 ILE 127 HG21 ILE 127 17.988 10.680 3.815 1754 2HG2 ILE 127 HG22 ILE 127 19.160 11.680 2.995 1755 3HG2 ILE 127 HG23 ILE 127 17.646 11.256 2.150 1756 1HD1 ILE 127 HD11 ILE 127 16.490 8.991 3.437 1757 2HD1 ILE 127 HD12 ILE 127 16.567 7.296 2.970 1758 3HD1 ILE 127 HD13 ILE 127 17.750 7.952 4.134 1759 H GLY 128 HN GLY 128 21.712 11.438 1.819 1760 1HA GLY 128 HA2 GLY 128 20.692 13.977 1.000 1761 2HA GLY 128 HA3 GLY 128 22.384 13.602 1.435 1762 H ASN 129 HN ASN 129 22.943 11.676 -0.643 1763 HA ASN 129 HA ASN 129 23.570 13.330 -2.847 1764 1HB ASN 129 HB2 ASN 129 24.884 11.364 -2.463 1765 2HB ASN 129 HB3 ASN 129 23.469 10.327 -2.453 1766 1HD2 ASN 129 HD22 ASN 129 23.564 8.961 -4.194 1767 2HD2 ASN 129 HD21 ASN 129 23.950 9.498 -5.822 1768 H ARG 130 HN ARG 130 20.916 10.922 -2.538 1769 HA ARG 130 HA ARG 130 19.941 11.575 -5.197 1770 1HB ARG 130 HB2 ARG 130 18.441 10.187 -2.936 1771 2HB ARG 130 HB3 ARG 130 17.965 10.243 -4.634 1772 1HG ARG 130 HG2 ARG 130 20.333 8.786 -3.425 1773 2HG ARG 130 HG3 ARG 130 18.941 8.099 -4.243 1774 1HD ARG 130 HD2 ARG 130 19.725 9.078 -6.394 1775 2HD ARG 130 HD3 ARG 130 21.106 9.809 -5.554 1776 HE ARG 130 HE ARG 130 21.204 7.105 -4.916 1777 1HH1 ARG 130 HH21 ARG 130 21.740 9.167 -7.784 1778 2HH1 ARG 130 HH22 ARG 130 22.836 8.028 -8.503 1779 1HH2 ARG 130 HH11 ARG 130 22.670 5.811 -5.697 1780 2HH2 ARG 130 HH12 ARG 130 23.414 6.015 -7.273 1781 H LEU 131 HN LEU 131 19.132 12.883 -1.954 1782 HA LEU 131 HA LEU 131 16.964 14.447 -3.019 1783 1HB LEU 131 HB2 LEU 131 18.538 14.432 -0.448 1784 2HB LEU 131 HB3 LEU 131 17.687 15.904 -0.862 1785 HG LEU 131 HG LEU 131 16.327 14.506 0.574 1786 1HD1 LEU 131 HD11 LEU 131 14.280 14.648 -0.596 1787 2HD1 LEU 131 HD12 LEU 131 15.278 15.982 -1.203 1788 3HD1 LEU 131 HD13 LEU 131 15.029 14.520 -2.172 1789 1HD2 LEU 131 HD21 LEU 131 15.254 12.418 -0.292 1790 2HD2 LEU 131 HD22 LEU 131 16.370 12.419 -1.653 1791 3HD2 LEU 131 HD23 LEU 131 16.985 12.244 0.005 1792 H LYS 132 HN LYS 132 20.477 15.077 -2.728 1793 HA LYS 132 HA LYS 132 20.405 17.753 -3.720 1794 1HB LYS 132 HB2 LYS 132 22.412 15.586 -3.422 1795 2HB LYS 132 HB3 LYS 132 22.679 16.548 -4.868 1796 1HG LYS 132 HG2 LYS 132 22.798 18.588 -3.660 1797 2HG LYS 132 HG3 LYS 132 22.227 17.832 -2.159 1798 1HD LYS 132 HD2 LYS 132 24.789 16.922 -3.516 1799 2HD LYS 132 HD3 LYS 132 24.764 18.302 -2.399 1800 1HE LYS 132 HE2 LYS 132 23.764 16.891 -0.630 1801 2HE LYS 132 HE3 LYS 132 23.788 15.495 -1.709 1802 1HZ LYS 132 HZ1 LYS 132 25.707 15.492 -0.231 1803 2HZ LYS 132 HZ2 LYS 132 26.222 15.666 -1.768 1804 3HZ LYS 132 HZ3 LYS 132 26.195 16.952 -0.762 1805 H GLU 133 HN GLU 133 20.315 14.580 -5.477 1806 HA GLU 133 HA GLU 133 20.651 15.797 -7.966 1807 1HB GLU 133 HB2 GLU 133 19.211 13.216 -7.205 1808 2HB GLU 133 HB3 GLU 133 19.165 13.821 -8.866 1809 1HG GLU 133 HG2 GLU 133 21.575 13.849 -9.000 1810 2HG GLU 133 HG3 GLU 133 21.713 13.265 -7.324 1811 H PHE 134 HN PHE 134 17.490 15.579 -6.182 1812 HA PHE 134 HA PHE 134 16.091 16.333 -8.554 1813 1HB PHE 134 HB2 PHE 134 15.304 17.089 -5.720 1814 2HB PHE 134 HB3 PHE 134 14.243 17.010 -7.124 1815 HD1 PHE 134 HD1 PHE 134 14.583 14.608 -8.448 1816 HD2 PHE 134 HD2 PHE 134 15.183 15.352 -4.286 1817 HE1 PHE 134 HE1 PHE 134 14.149 12.183 -7.974 1818 HE2 PHE 134 HE2 PHE 134 14.594 12.945 -3.761 1819 HZ PHE 134 HZ PHE 134 14.137 11.368 -5.624 1820 H ALA 135 HN ALA 135 17.696 18.243 -6.071 1821 HA ALA 135 HA ALA 135 16.939 20.800 -7.026 1822 1HB ALA 135 HB1 ALA 135 17.950 20.478 -4.808 1823 2HB ALA 135 HB2 ALA 135 19.476 19.944 -5.565 1824 3HB ALA 135 HB3 ALA 135 18.910 21.618 -5.752 1825 H GLU 136 HN GLU 136 19.364 18.498 -8.113 1826 HA GLU 136 HA GLU 136 20.811 20.423 -9.725 1827 1HB GLU 136 HB2 GLU 136 21.113 17.438 -9.292 1828 2HB GLU 136 HB3 GLU 136 22.200 18.370 -10.302 1829 1HG GLU 136 HG2 GLU 136 21.784 19.090 -7.372 1830 2HG GLU 136 HG3 GLU 136 22.895 17.831 -7.876 1831 H THR 137 HN THR 137 18.678 17.684 -10.250 1832 HA THR 137 HA THR 137 18.987 17.742 -13.180 1833 HB THR 137 HB THR 137 17.895 15.503 -13.031 1834 HG1 THR 137 HG1 THR 137 17.900 15.884 -10.239 1835 1HG2 THR 137 HG21 THR 137 20.132 15.764 -10.971 1836 2HG2 THR 137 HG22 THR 137 19.619 14.296 -11.819 1837 3HG2 THR 137 HG23 THR 137 20.354 15.630 -12.726 1838 H GLY 138 HN GLY 138 16.719 18.767 -10.741 1839 1HA GLY 138 HA2 GLY 138 14.589 19.499 -10.765 1840 2HA GLY 138 HA3 GLY 138 14.757 19.833 -12.499 1841 H LYS 139 HN LYS 139 15.180 16.612 -11.007 1842 HA LYS 139 HA LYS 139 13.754 15.270 -12.925 1843 1HB LYS 139 HB2 LYS 139 15.201 14.549 -10.650 1844 2HB LYS 139 HB3 LYS 139 13.602 13.853 -10.361 1845 1HG LYS 139 HG2 LYS 139 13.632 12.624 -12.393 1846 2HG LYS 139 HG3 LYS 139 15.066 13.479 -13.000 1847 1HD LYS 139 HD2 LYS 139 15.029 11.581 -10.624 1848 2HD LYS 139 HD3 LYS 139 15.597 11.215 -12.264 1849 1HE LYS 139 HE2 LYS 139 17.328 13.027 -12.028 1850 2HE LYS 139 HE3 LYS 139 16.843 13.235 -10.347 1851 1HZ LYS 139 HZ1 LYS 139 17.467 10.910 -9.957 1852 2HZ LYS 139 HZ2 LYS 139 17.929 10.739 -11.523 1853 3HZ LYS 139 HZ3 LYS 139 18.755 11.730 -10.530 Start of MODEL 5 1 1H MET 1 H1 MET 1 -24.330 -10.440 -8.859 2 2H MET 1 H2 MET 1 -25.425 -11.230 -9.791 3 3H MET 1 H3 MET 1 -25.577 -11.228 -8.148 4 HA MET 1 HA MET 1 -23.606 -12.492 -7.861 5 1HB MET 1 HB2 MET 1 -25.880 -13.604 -8.273 6 2HB MET 1 HB3 MET 1 -25.353 -13.917 -9.914 7 1HG MET 1 HG2 MET 1 -23.456 -15.250 -9.050 8 2HG MET 1 HG3 MET 1 -23.892 -14.813 -7.394 9 1HE MET 1 HE1 MET 1 -24.055 -17.182 -6.420 10 2HE MET 1 HE2 MET 1 -24.809 -18.553 -7.262 11 3HE MET 1 HE3 MET 1 -23.385 -17.756 -7.969 12 H ALA 2 HN ALA 2 -21.850 -11.198 -8.824 13 HA ALA 2 HA ALA 2 -20.439 -12.525 -10.835 14 1HB ALA 2 HB1 ALA 2 -21.659 -9.860 -11.755 15 2HB ALA 2 HB2 ALA 2 -20.362 -10.734 -12.592 16 3HB ALA 2 HB3 ALA 2 -21.973 -11.450 -12.488 17 H ILE 3 HN ILE 3 -18.332 -11.685 -11.013 18 HA ILE 3 HA ILE 3 -17.615 -9.377 -9.322 19 HB ILE 3 HB ILE 3 -16.035 -11.845 -10.188 20 1HG1 ILE 3 HG12 ILE 3 -15.225 -11.698 -7.798 21 2HG1 ILE 3 HG13 ILE 3 -16.408 -10.423 -7.530 22 1HG2 ILE 3 HG21 ILE 3 -13.971 -10.688 -9.379 23 2HG2 ILE 3 HG22 ILE 3 -14.607 -9.918 -10.822 24 3HG2 ILE 3 HG23 ILE 3 -14.896 -9.174 -9.238 25 1HD1 ILE 3 HD11 ILE 3 -17.000 -13.304 -8.268 26 2HD1 ILE 3 HD12 ILE 3 -17.138 -12.516 -6.676 27 3HD1 ILE 3 HD13 ILE 3 -18.224 -12.029 -7.991 28 H VAL 4 HN VAL 4 -18.168 -7.739 -10.647 29 HA VAL 4 HA VAL 4 -17.719 -7.756 -13.538 30 HB VAL 4 HB VAL 4 -18.662 -5.617 -11.622 31 1HG1 VAL 4 HG11 VAL 4 -18.068 -4.567 -13.763 32 2HG1 VAL 4 HG12 VAL 4 -19.071 -5.753 -14.634 33 3HG1 VAL 4 HG13 VAL 4 -19.800 -4.556 -13.537 34 1HG2 VAL 4 HG21 VAL 4 -20.289 -7.633 -13.223 35 2HG2 VAL 4 HG22 VAL 4 -20.239 -7.463 -11.454 36 3HG2 VAL 4 HG23 VAL 4 -20.985 -6.209 -12.434 37 H LYS 5 HN LYS 5 -16.458 -5.790 -14.402 38 HA LYS 5 HA LYS 5 -14.294 -4.950 -12.621 39 1HB LYS 5 HB2 LYS 5 -13.365 -6.717 -14.074 40 2HB LYS 5 HB3 LYS 5 -13.832 -5.777 -15.505 41 1HG LYS 5 HG2 LYS 5 -12.324 -3.950 -14.827 42 2HG LYS 5 HG3 LYS 5 -11.977 -4.760 -13.296 43 1HD LYS 5 HD2 LYS 5 -10.118 -5.027 -14.836 44 2HD LYS 5 HD3 LYS 5 -10.853 -6.598 -14.484 45 1HE LYS 5 HE2 LYS 5 -12.037 -6.578 -16.634 46 2HE LYS 5 HE3 LYS 5 -11.473 -4.936 -16.970 47 1HZ LYS 5 HZ1 LYS 5 -9.705 -7.299 -16.718 48 2HZ LYS 5 HZ2 LYS 5 -10.145 -6.592 -18.120 49 3HZ LYS 5 HZ3 LYS 5 -9.207 -5.767 -17.063 50 H ALA 6 HN ALA 6 -14.359 -2.842 -12.440 51 HA ALA 6 HA ALA 6 -16.032 -1.161 -14.161 52 1HB ALA 6 HB1 ALA 6 -15.048 0.588 -12.473 53 2HB ALA 6 HB2 ALA 6 -16.309 -0.490 -11.961 54 3HB ALA 6 HB3 ALA 6 -14.627 -0.837 -11.511 55 H THR 7 HN THR 7 -14.912 1.094 -14.529 56 HA THR 7 HA THR 7 -12.122 1.280 -14.870 57 HB THR 7 HB THR 7 -12.529 0.074 -16.953 58 HG1 THR 7 HG1 THR 7 -11.008 1.364 -17.456 59 1HG2 THR 7 HG21 THR 7 -14.829 0.501 -17.458 60 2HG2 THR 7 HG22 THR 7 -14.535 2.249 -17.649 61 3HG2 THR 7 HG23 THR 7 -13.846 1.084 -18.802 62 H ASP 8 HN ASP 8 -12.076 3.573 -16.297 63 HA ASP 8 HA ASP 8 -12.203 5.527 -14.489 64 1HB ASP 8 HB2 ASP 8 -11.046 5.722 -16.568 65 2HB ASP 8 HB3 ASP 8 -12.540 5.619 -17.495 66 H GLN 9 HN GLN 9 -15.068 4.675 -16.404 67 HA GLN 9 HA GLN 9 -16.667 6.618 -14.857 68 1HB GLN 9 HB2 GLN 9 -16.695 6.127 -17.843 69 2HB GLN 9 HB3 GLN 9 -18.002 6.975 -16.993 70 1HG GLN 9 HG2 GLN 9 -16.611 8.807 -16.371 71 2HG GLN 9 HG3 GLN 9 -15.136 7.940 -16.749 72 1HE2 GLN 9 HE22 GLN 9 -14.137 8.608 -18.559 73 2HE2 GLN 9 HE21 GLN 9 -14.938 9.252 -19.993 74 H SER 10 HN SER 10 -16.449 3.467 -16.468 75 HA SER 10 HA SER 10 -19.081 2.605 -15.986 76 1HB SER 10 HB2 SER 10 -16.569 0.926 -15.729 77 2HB SER 10 HB3 SER 10 -18.225 0.350 -16.011 78 HG SER 10 HG SER 10 -17.182 0.505 -17.993 79 H PHE 11 HN PHE 11 -16.316 3.001 -13.637 80 HA PHE 11 HA PHE 11 -18.013 2.037 -11.463 81 1HB PHE 11 HB2 PHE 11 -15.576 2.072 -11.132 82 2HB PHE 11 HB3 PHE 11 -15.579 3.817 -11.365 83 HD1 PHE 11 HD1 PHE 11 -15.977 1.063 -8.976 84 HD2 PHE 11 HD2 PHE 11 -16.874 5.251 -9.668 85 HE1 PHE 11 HE1 PHE 11 -16.105 1.489 -6.538 86 HE2 PHE 11 HE2 PHE 11 -17.049 5.619 -7.232 87 HZ PHE 11 HZ PHE 11 -16.629 3.743 -5.661 88 H SER 12 HN SER 12 -19.481 3.180 -10.669 89 HA SER 12 HA SER 12 -20.678 5.084 -9.913 90 1HB SER 12 HB2 SER 12 -20.104 6.303 -12.670 91 2HB SER 12 HB3 SER 12 -21.198 6.959 -11.452 92 HG SER 12 HG SER 12 -18.404 6.630 -11.340 93 H ALA 13 HN ALA 13 -20.659 4.254 -13.436 94 HA ALA 13 HA ALA 13 -23.457 4.145 -13.585 95 1HB ALA 13 HB1 ALA 13 -21.968 4.399 -15.550 96 2HB ALA 13 HB2 ALA 13 -21.361 2.744 -15.311 97 3HB ALA 13 HB3 ALA 13 -23.056 3.011 -15.770 98 H GLU 14 HN GLU 14 -21.015 1.629 -13.051 99 HA GLU 14 HA GLU 14 -22.853 -0.546 -12.874 100 1HB GLU 14 HB2 GLU 14 -19.908 -0.271 -12.190 101 2HB GLU 14 HB3 GLU 14 -20.770 -1.803 -12.103 102 1HG GLU 14 HG2 GLU 14 -20.522 -0.109 -14.612 103 2HG GLU 14 HG3 GLU 14 -19.504 -1.496 -14.218 104 H THR 15 HN THR 15 -22.077 1.933 -10.589 105 HA THR 15 HA THR 15 -22.595 0.154 -8.272 106 HB THR 15 HB THR 15 -21.047 1.670 -7.084 107 HG1 THR 15 HG1 THR 15 -21.248 3.584 -8.161 108 1HG2 THR 15 HG21 THR 15 -18.960 1.161 -8.171 109 2HG2 THR 15 HG22 THR 15 -20.017 -0.247 -8.409 110 3HG2 THR 15 HG23 THR 15 -19.733 0.917 -9.734 111 H SER 16 HN SER 16 -24.190 2.515 -10.033 112 HA SER 16 HA SER 16 -24.931 4.346 -7.970 113 1HB SER 16 HB2 SER 16 -26.101 3.784 -10.711 114 2HB SER 16 HB3 SER 16 -26.661 5.080 -9.639 115 HG SER 16 HG SER 16 -23.988 4.763 -10.560 116 H GLU 17 HN GLU 17 -25.990 1.137 -8.355 117 HA GLU 17 HA GLU 17 -28.445 1.696 -6.841 118 1HB GLU 17 HB2 GLU 17 -28.310 0.125 -9.446 119 2HB GLU 17 HB3 GLU 17 -29.684 0.092 -8.330 120 1HG GLU 17 HG2 GLU 17 -29.968 2.557 -8.641 121 2HG GLU 17 HG3 GLU 17 -28.677 2.534 -9.847 122 H GLY 18 HN GLY 18 -29.275 -0.170 -5.703 123 1HA GLY 18 HA2 GLY 18 -29.162 -2.085 -4.529 124 2HA GLY 18 HA3 GLY 18 -27.987 -2.719 -5.700 125 H VAL 19 HN VAL 19 -26.886 -3.618 -3.887 126 HA VAL 19 HA VAL 19 -25.011 -1.688 -2.642 127 HB VAL 19 HB VAL 19 -25.956 -4.255 -1.308 128 1HG1 VAL 19 HG11 VAL 19 -24.065 -2.031 -0.393 129 2HG1 VAL 19 HG12 VAL 19 -24.631 -3.376 0.610 130 3HG1 VAL 19 HG13 VAL 19 -23.602 -3.696 -0.794 131 1HG2 VAL 19 HG21 VAL 19 -27.747 -2.699 -1.134 132 2HG2 VAL 19 HG22 VAL 19 -26.849 -2.504 0.379 133 3HG2 VAL 19 HG23 VAL 19 -26.647 -1.328 -0.923 134 H VAL 20 HN VAL 20 -23.062 -1.815 -3.216 135 HA VAL 20 HA VAL 20 -22.239 -4.094 -4.901 136 HB VAL 20 HB VAL 20 -21.843 -1.166 -5.641 137 1HG1 VAL 20 HG11 VAL 20 -20.171 -2.700 -6.538 138 2HG1 VAL 20 HG12 VAL 20 -21.436 -3.806 -7.101 139 3HG1 VAL 20 HG13 VAL 20 -21.270 -2.195 -7.837 140 1HG2 VAL 20 HG21 VAL 20 -24.211 -1.502 -5.846 141 2HG2 VAL 20 HG22 VAL 20 -23.543 -1.664 -7.468 142 3HG2 VAL 20 HG23 VAL 20 -24.002 -3.111 -6.561 143 H LEU 21 HN LEU 21 -20.486 -4.882 -4.133 144 HA LEU 21 HA LEU 21 -18.747 -3.389 -2.251 145 1HB LEU 21 HB2 LEU 21 -19.554 -5.616 -1.640 146 2HB LEU 21 HB3 LEU 21 -18.933 -6.294 -3.137 147 HG LEU 21 HG LEU 21 -16.596 -5.804 -2.356 148 1HD1 LEU 21 HD11 LEU 21 -16.959 -3.893 -0.911 149 2HD1 LEU 21 HD12 LEU 21 -18.101 -4.810 0.111 150 3HD1 LEU 21 HD13 LEU 21 -16.385 -5.221 0.103 151 1HD2 LEU 21 HD21 LEU 21 -18.265 -7.356 -0.322 152 2HD2 LEU 21 HD22 LEU 21 -17.695 -8.001 -1.878 153 3HD2 LEU 21 HD23 LEU 21 -16.527 -7.537 -0.637 154 H ALA 22 HN ALA 22 -17.561 -1.941 -3.612 155 HA ALA 22 HA ALA 22 -16.325 -3.071 -6.017 156 1HB ALA 22 HB1 ALA 22 -17.232 -0.748 -6.089 157 2HB ALA 22 HB2 ALA 22 -15.987 -0.276 -4.894 158 3HB ALA 22 HB3 ALA 22 -15.526 -0.848 -6.516 159 H ASP 23 HN ASP 23 -14.066 -3.224 -6.283 160 HA ASP 23 HA ASP 23 -12.408 -3.337 -3.815 161 1HB ASP 23 HB2 ASP 23 -13.371 -5.541 -3.933 162 2HB ASP 23 HB3 ASP 23 -13.098 -5.633 -5.667 163 H PHE 24 HN PHE 24 -10.169 -3.312 -4.274 164 HA PHE 24 HA PHE 24 -9.415 -2.404 -7.014 165 1HB PHE 24 HB2 PHE 24 -8.869 -1.167 -4.302 166 2HB PHE 24 HB3 PHE 24 -8.027 -0.707 -5.759 167 HD1 PHE 24 HD1 PHE 24 -11.536 -0.923 -4.330 168 HD2 PHE 24 HD2 PHE 24 -8.890 0.988 -7.132 169 HE1 PHE 24 HE1 PHE 24 -13.366 0.579 -5.019 170 HE2 PHE 24 HE2 PHE 24 -10.729 2.551 -7.773 171 HZ PHE 24 HZ PHE 24 -12.963 2.344 -6.724 172 H TRP 25 HN TRP 25 -7.960 -3.815 -7.730 173 HA TRP 25 HA TRP 25 -6.139 -5.236 -5.857 174 1HB TRP 25 HB2 TRP 25 -6.666 -7.292 -6.739 175 2HB TRP 25 HB3 TRP 25 -8.244 -6.548 -6.623 176 HD1 TRP 25 HD1 TRP 25 -9.020 -5.330 -9.086 177 HE1 TRP 25 HE1 TRP 25 -8.705 -6.097 -11.478 178 HE3 TRP 25 HE3 TRP 25 -5.424 -8.880 -8.284 179 HZ2 TRP 25 HZ2 TRP 25 -6.834 -7.852 -12.934 180 HZ3 TRP 25 HZ3 TRP 25 -4.346 -10.026 -10.186 181 HH2 TRP 25 HH2 TRP 25 -5.044 -9.514 -12.517 182 H ALA 26 HN ALA 26 -4.072 -5.799 -6.958 183 HA ALA 26 HA ALA 26 -3.799 -5.584 -9.784 184 1HB ALA 26 HB1 ALA 26 -1.967 -3.730 -9.662 185 2HB ALA 26 HB2 ALA 26 -3.640 -3.208 -9.584 186 3HB ALA 26 HB3 ALA 26 -2.685 -3.346 -8.085 187 HA PRO 27 HA PRO 27 -0.377 -8.221 -8.991 188 1HB PRO 27 HB2 PRO 27 1.307 -6.471 -10.786 189 2HB PRO 27 HB3 PRO 27 1.119 -8.251 -10.810 190 1HG PRO 27 HG2 PRO 27 -0.211 -6.690 -12.598 191 2HG PRO 27 HG3 PRO 27 -1.062 -8.071 -11.817 192 1HD PRO 27 HD2 PRO 27 -1.191 -5.147 -11.152 193 2HD PRO 27 HD3 PRO 27 -2.503 -6.362 -11.239 194 H TRP 28 HN TRP 28 0.046 -4.826 -8.148 195 HA TRP 28 HA TRP 28 2.716 -4.831 -7.285 196 1HB TRP 28 HB2 TRP 28 0.517 -3.253 -5.976 197 2HB TRP 28 HB3 TRP 28 2.215 -2.834 -6.135 198 HD1 TRP 28 HD1 TRP 28 -1.016 -2.212 -7.576 199 HE1 TRP 28 HE1 TRP 28 -0.941 -0.934 -9.804 200 HE3 TRP 28 HE3 TRP 28 3.943 -2.801 -8.565 201 HZ2 TRP 28 HZ2 TRP 28 1.081 -0.338 -11.810 202 HZ3 TRP 28 HZ3 TRP 28 4.932 -1.875 -10.643 203 HH2 TRP 28 HH2 TRP 28 3.511 -0.644 -12.272 204 H CYS 29 HN CYS 29 -0.082 -6.310 -5.660 205 HA CYS 29 HA CYS 29 1.638 -6.748 -3.282 206 1HB CYS 29 HB2 CYS 29 -0.383 -4.796 -3.440 207 2HB CYS 29 HB3 CYS 29 -1.164 -6.121 -2.620 208 H GLY 30 HN GLY 30 0.986 -8.431 -1.894 209 1HA GLY 30 HA2 GLY 30 0.153 -10.812 -3.141 210 2HA GLY 30 HA3 GLY 30 0.325 -10.543 -1.403 211 HA PRO 31 HA PRO 31 -4.010 -10.392 -0.610 212 1HB PRO 31 HB2 PRO 31 -4.244 -7.391 -0.753 213 2HB PRO 31 HB3 PRO 31 -4.991 -8.518 0.431 214 1HG PRO 31 HG2 PRO 31 -2.711 -7.185 1.094 215 2HG PRO 31 HG3 PRO 31 -2.843 -8.934 1.463 216 1HD PRO 31 HD2 PRO 31 -1.409 -7.594 -0.833 217 2HD PRO 31 HD3 PRO 31 -0.876 -8.969 0.179 218 H SER 32 HN SER 32 -3.203 -8.339 -3.451 219 HA SER 32 HA SER 32 -5.756 -8.360 -4.649 220 1HB SER 32 HB2 SER 32 -3.027 -8.659 -5.986 221 2HB SER 32 HB3 SER 32 -4.467 -7.908 -6.685 222 HG SER 32 HG SER 32 -2.704 -6.584 -5.715 223 H LYS 33 HN LYS 33 -3.576 -11.023 -4.158 224 HA LYS 33 HA LYS 33 -5.242 -12.721 -5.988 225 1HB LYS 33 HB2 LYS 33 -2.565 -13.379 -4.709 226 2HB LYS 33 HB3 LYS 33 -3.526 -14.396 -5.782 227 1HG LYS 33 HG2 LYS 33 -1.735 -13.598 -7.032 228 2HG LYS 33 HG3 LYS 33 -3.198 -12.826 -7.645 229 1HD LYS 33 HD2 LYS 33 -2.548 -10.700 -6.829 230 2HD LYS 33 HD3 LYS 33 -1.436 -11.387 -5.638 231 1HE LYS 33 HE2 LYS 33 -0.195 -10.321 -7.443 232 2HE LYS 33 HE3 LYS 33 0.128 -12.052 -7.377 233 1HZ LYS 33 HZ1 LYS 33 -0.199 -11.295 -9.644 234 2HZ LYS 33 HZ2 LYS 33 -1.361 -12.359 -9.260 235 3HZ LYS 33 HZ3 LYS 33 -1.706 -10.760 -9.320 236 H MET 34 HN MET 34 -5.518 -11.740 -2.893 237 HA MET 34 HA MET 34 -6.389 -14.442 -1.919 238 1HB MET 34 HB2 MET 34 -5.435 -12.108 -0.219 239 2HB MET 34 HB3 MET 34 -5.990 -13.688 0.343 240 1HG MET 34 HG2 MET 34 -4.109 -14.727 -1.003 241 2HG MET 34 HG3 MET 34 -3.472 -13.103 -1.255 242 1HE MET 34 HE1 MET 34 -2.451 -12.040 2.418 243 2HE MET 34 HE2 MET 34 -2.448 -11.572 0.706 244 3HE MET 34 HE3 MET 34 -3.984 -11.667 1.608 245 H ILE 35 HN ILE 35 -7.051 -10.879 -1.810 246 HA ILE 35 HA ILE 35 -9.726 -11.154 -0.926 247 HB ILE 35 HB ILE 35 -8.070 -9.085 -1.151 248 1HG1 ILE 35 HG12 ILE 35 -10.247 -7.575 -1.154 249 2HG1 ILE 35 HG13 ILE 35 -11.091 -9.129 -1.116 250 1HG2 ILE 35 HG21 ILE 35 -9.721 -8.663 -3.651 251 2HG2 ILE 35 HG22 ILE 35 -8.600 -7.529 -2.873 252 3HG2 ILE 35 HG23 ILE 35 -7.972 -9.017 -3.591 253 1HD1 ILE 35 HD11 ILE 35 -9.814 -9.757 0.920 254 2HD1 ILE 35 HD12 ILE 35 -8.875 -8.251 0.803 255 3HD1 ILE 35 HD13 ILE 35 -10.617 -8.189 1.159 256 H ALA 36 HN ALA 36 -8.174 -11.374 -4.117 257 HA ALA 36 HA ALA 36 -10.414 -11.321 -5.764 258 1HB ALA 36 HB1 ALA 36 -8.291 -11.211 -6.781 259 2HB ALA 36 HB2 ALA 36 -7.712 -12.711 -6.066 260 3HB ALA 36 HB3 ALA 36 -8.967 -12.757 -7.323 261 HA PRO 37 HA PRO 37 -11.147 -16.046 -5.383 262 1HB PRO 37 HB2 PRO 37 -9.988 -17.199 -3.028 263 2HB PRO 37 HB3 PRO 37 -9.530 -17.506 -4.736 264 1HG PRO 37 HG2 PRO 37 -8.250 -15.748 -2.697 265 2HG PRO 37 HG3 PRO 37 -7.498 -16.556 -4.098 266 1HD PRO 37 HD2 PRO 37 -8.036 -13.855 -4.052 267 2HD PRO 37 HD3 PRO 37 -8.057 -14.830 -5.538 268 H VAL 38 HN VAL 38 -10.592 -14.259 -2.310 269 HA VAL 38 HA VAL 38 -12.749 -15.301 -0.835 270 HB VAL 38 HB VAL 38 -11.031 -12.854 -0.837 271 1HG1 VAL 38 HG11 VAL 38 -13.028 -11.760 -0.315 272 2HG1 VAL 38 HG12 VAL 38 -13.527 -13.002 0.829 273 3HG1 VAL 38 HG13 VAL 38 -12.125 -11.960 1.196 274 1HG2 VAL 38 HG21 VAL 38 -10.302 -15.021 0.113 275 2HG2 VAL 38 HG22 VAL 38 -10.360 -13.726 1.329 276 3HG2 VAL 38 HG23 VAL 38 -11.649 -14.955 1.266 277 H LEU 39 HN LEU 39 -12.683 -12.554 -3.155 278 HA LEU 39 HA LEU 39 -15.397 -11.796 -2.724 279 1HB LEU 39 HB2 LEU 39 -13.516 -11.471 -5.091 280 2HB LEU 39 HB3 LEU 39 -15.154 -10.850 -5.132 281 HG LEU 39 HG LEU 39 -13.215 -10.101 -2.891 282 1HD1 LEU 39 HD11 LEU 39 -13.643 -8.604 -5.511 283 2HD1 LEU 39 HD12 LEU 39 -12.660 -8.088 -4.119 284 3HD1 LEU 39 HD13 LEU 39 -12.179 -9.507 -5.047 285 1HD2 LEU 39 HD21 LEU 39 -15.679 -8.680 -3.956 286 2HD2 LEU 39 HD22 LEU 39 -15.583 -9.590 -2.440 287 3HD2 LEU 39 HD23 LEU 39 -14.630 -8.114 -2.659 288 H GLU 40 HN GLU 40 -13.900 -14.066 -5.106 289 HA GLU 40 HA GLU 40 -16.346 -14.558 -6.467 290 1HB GLU 40 HB2 GLU 40 -13.826 -16.235 -6.328 291 2HB GLU 40 HB3 GLU 40 -15.201 -16.476 -7.438 292 1HG GLU 40 HG2 GLU 40 -14.844 -14.257 -8.419 293 2HG GLU 40 HG3 GLU 40 -13.471 -13.976 -7.354 294 H GLU 41 HN GLU 41 -14.772 -16.158 -3.663 295 HA GLU 41 HA GLU 41 -16.631 -18.297 -3.404 296 1HB GLU 41 HB2 GLU 41 -14.695 -16.959 -1.498 297 2HB GLU 41 HB3 GLU 41 -15.703 -18.309 -1.001 298 1HG GLU 41 HG2 GLU 41 -13.731 -18.386 -3.325 299 2HG GLU 41 HG3 GLU 41 -13.400 -18.978 -1.699 300 H LEU 42 HN LEU 42 -16.635 -14.981 -2.257 301 HA LEU 42 HA LEU 42 -18.972 -15.241 -0.530 302 1HB LEU 42 HB2 LEU 42 -17.494 -13.524 0.059 303 2HB LEU 42 HB3 LEU 42 -17.079 -13.138 -1.594 304 HG LEU 42 HG LEU 42 -18.956 -11.784 -1.953 305 1HD1 LEU 42 HD11 LEU 42 -20.813 -12.539 -0.970 306 2HD1 LEU 42 HD12 LEU 42 -20.030 -13.058 0.529 307 3HD1 LEU 42 HD13 LEU 42 -20.420 -11.335 0.248 308 1HD2 LEU 42 HD21 LEU 42 -17.710 -11.221 0.770 309 2HD2 LEU 42 HD22 LEU 42 -17.027 -10.795 -0.811 310 3HD2 LEU 42 HD23 LEU 42 -18.526 -10.031 -0.269 311 H ASP 43 HN ASP 43 -18.423 -14.142 -3.924 312 HA ASP 43 HA ASP 43 -21.145 -13.317 -4.178 313 1HB ASP 43 HB2 ASP 43 -19.333 -12.457 -5.655 314 2HB ASP 43 HB3 ASP 43 -19.063 -14.074 -6.288 315 H GLN 44 HN GLN 44 -19.466 -16.362 -4.964 316 HA GLN 44 HA GLN 44 -21.770 -17.489 -6.203 317 1HB GLN 44 HB2 GLN 44 -20.600 -19.518 -6.311 318 2HB GLN 44 HB3 GLN 44 -19.434 -18.209 -6.535 319 1HG GLN 44 HG2 GLN 44 -18.841 -18.469 -4.078 320 2HG GLN 44 HG3 GLN 44 -19.837 -19.924 -4.046 321 1HE2 GLN 44 HE22 GLN 44 -17.096 -18.383 -5.776 322 2HE2 GLN 44 HE21 GLN 44 -16.232 -19.879 -6.121 323 H GLU 45 HN GLU 45 -21.373 -16.640 -2.921 324 HA GLU 45 HA GLU 45 -23.185 -18.706 -2.019 325 1HB GLU 45 HB2 GLU 45 -21.459 -18.883 -0.617 326 2HB GLU 45 HB3 GLU 45 -20.954 -17.197 -0.790 327 1HG GLU 45 HG2 GLU 45 -22.564 -16.375 0.636 328 2HG GLU 45 HG3 GLU 45 -23.503 -17.889 0.668 329 H MET 46 HN MET 46 -22.758 -15.162 -1.979 330 HA MET 46 HA MET 46 -25.705 -14.923 -1.551 331 1HB MET 46 HB2 MET 46 -25.218 -13.020 -0.030 332 2HB MET 46 HB3 MET 46 -24.760 -14.614 0.589 333 1HG MET 46 HG2 MET 46 -22.423 -14.184 0.035 334 2HG MET 46 HG3 MET 46 -22.864 -12.682 -0.775 335 1HE MET 46 HE1 MET 46 -23.126 -10.580 0.213 336 2HE MET 46 HE2 MET 46 -24.688 -10.996 0.963 337 3HE MET 46 HE3 MET 46 -23.381 -10.146 1.910 338 H GLY 47 HN GLY 47 -23.737 -14.559 -3.940 339 1HA GLY 47 HA2 GLY 47 -24.034 -11.828 -4.749 340 2HA GLY 47 HA3 GLY 47 -23.768 -13.247 -5.793 341 H ASP 48 HN ASP 48 -26.405 -14.087 -4.192 342 HA ASP 48 HA ASP 48 -28.295 -13.364 -6.234 343 1HB ASP 48 HB2 ASP 48 -28.578 -15.423 -4.914 344 2HB ASP 48 HB3 ASP 48 -28.702 -14.469 -3.433 345 H LYS 49 HN LYS 49 -27.120 -11.886 -3.307 346 HA LYS 49 HA LYS 49 -29.148 -9.788 -3.502 347 1HB LYS 49 HB2 LYS 49 -27.403 -10.160 -1.096 348 2HB LYS 49 HB3 LYS 49 -29.022 -9.477 -1.228 349 1HG LYS 49 HG2 LYS 49 -29.540 -11.402 -0.172 350 2HG LYS 49 HG3 LYS 49 -29.660 -12.008 -1.840 351 1HD LYS 49 HD2 LYS 49 -27.654 -13.227 -1.673 352 2HD LYS 49 HD3 LYS 49 -27.005 -12.112 -0.459 353 1HE LYS 49 HE2 LYS 49 -27.367 -14.207 0.587 354 2HE LYS 49 HE3 LYS 49 -28.411 -12.962 1.267 355 1HZ LYS 49 HZ1 LYS 49 -29.285 -15.052 -0.667 356 2HZ LYS 49 HZ2 LYS 49 -29.622 -15.032 0.924 357 3HZ LYS 49 HZ3 LYS 49 -30.259 -13.891 -0.043 358 H LEU 50 HN LEU 50 -25.751 -10.507 -3.739 359 HA LEU 50 HA LEU 50 -24.944 -7.704 -3.364 360 1HB LEU 50 HB2 LEU 50 -23.986 -9.386 -1.847 361 2HB LEU 50 HB3 LEU 50 -23.462 -10.357 -3.215 362 HG LEU 50 HG LEU 50 -21.845 -8.600 -3.879 363 1HD1 LEU 50 HD11 LEU 50 -21.365 -6.755 -2.333 364 2HD1 LEU 50 HD12 LEU 50 -23.016 -6.604 -2.908 365 3HD1 LEU 50 HD13 LEU 50 -22.717 -7.252 -1.287 366 1HD2 LEU 50 HD21 LEU 50 -21.573 -9.503 -0.998 367 2HD2 LEU 50 HD22 LEU 50 -21.133 -10.440 -2.446 368 3HD2 LEU 50 HD23 LEU 50 -20.263 -8.947 -2.060 369 H LYS 51 HN LYS 51 -23.467 -6.704 -4.791 370 HA LYS 51 HA LYS 51 -22.727 -8.184 -7.285 371 1HB LYS 51 HB2 LYS 51 -24.502 -6.453 -7.721 372 2HB LYS 51 HB3 LYS 51 -23.430 -5.231 -7.024 373 1HG LYS 51 HG2 LYS 51 -21.753 -5.700 -8.826 374 2HG LYS 51 HG3 LYS 51 -22.868 -6.897 -9.519 375 1HD LYS 51 HD2 LYS 51 -24.568 -5.100 -9.819 376 2HD LYS 51 HD3 LYS 51 -23.434 -3.925 -9.114 377 1HE LYS 51 HE2 LYS 51 -21.805 -4.461 -10.953 378 2HE LYS 51 HE3 LYS 51 -23.012 -5.528 -11.680 379 1HZ LYS 51 HZ1 LYS 51 -23.353 -2.624 -11.201 380 2HZ LYS 51 HZ2 LYS 51 -23.038 -3.313 -12.663 381 3HZ LYS 51 HZ3 LYS 51 -24.473 -3.603 -11.918 382 H ILE 52 HN ILE 52 -20.506 -7.731 -7.941 383 HA ILE 52 HA ILE 52 -18.924 -6.064 -6.061 384 HB ILE 52 HB ILE 52 -18.432 -8.902 -7.013 385 1HG1 ILE 52 HG12 ILE 52 -17.802 -7.831 -4.262 386 2HG1 ILE 52 HG13 ILE 52 -19.489 -8.108 -4.669 387 1HG2 ILE 52 HG21 ILE 52 -16.346 -7.751 -7.581 388 2HG2 ILE 52 HG22 ILE 52 -16.293 -6.980 -5.978 389 3HG2 ILE 52 HG23 ILE 52 -16.087 -8.727 -6.146 390 1HD1 ILE 52 HD11 ILE 52 -18.422 -10.029 -3.513 391 2HD1 ILE 52 HD12 ILE 52 -19.152 -10.409 -5.081 392 3HD1 ILE 52 HD13 ILE 52 -17.385 -10.276 -4.932 393 H VAL 53 HN VAL 53 -17.329 -4.833 -7.102 394 HA VAL 53 HA VAL 53 -16.999 -5.248 -10.013 395 HB VAL 53 HB VAL 53 -17.486 -2.461 -8.889 396 1HG1 VAL 53 HG11 VAL 53 -17.789 -1.929 -11.270 397 2HG1 VAL 53 HG12 VAL 53 -16.171 -2.564 -10.877 398 3HG1 VAL 53 HG13 VAL 53 -17.361 -3.598 -11.698 399 1HG2 VAL 53 HG21 VAL 53 -19.700 -2.422 -9.834 400 2HG2 VAL 53 HG22 VAL 53 -19.554 -4.080 -10.437 401 3HG2 VAL 53 HG23 VAL 53 -19.627 -3.775 -8.705 402 H LYS 54 HN LYS 54 -14.838 -5.596 -10.241 403 HA LYS 54 HA LYS 54 -13.008 -4.536 -8.193 404 1HB LYS 54 HB2 LYS 54 -12.615 -6.490 -10.490 405 2HB LYS 54 HB3 LYS 54 -11.299 -5.885 -9.472 406 1HG LYS 54 HG2 LYS 54 -12.496 -6.734 -7.439 407 2HG LYS 54 HG3 LYS 54 -13.747 -7.398 -8.478 408 1HD LYS 54 HD2 LYS 54 -12.348 -9.224 -7.962 409 2HD LYS 54 HD3 LYS 54 -11.901 -8.757 -9.612 410 1HE LYS 54 HE2 LYS 54 -10.045 -7.303 -8.340 411 2HE LYS 54 HE3 LYS 54 -10.393 -8.347 -6.990 412 1HZ LYS 54 HZ1 LYS 54 -9.890 -10.264 -8.496 413 2HZ LYS 54 HZ2 LYS 54 -9.467 -9.219 -9.677 414 3HZ LYS 54 HZ3 LYS 54 -8.602 -9.266 -8.296 415 H ILE 55 HN ILE 55 -11.121 -3.313 -8.823 416 HA ILE 55 HA ILE 55 -11.107 -2.014 -11.493 417 HB ILE 55 HB ILE 55 -10.769 -0.885 -8.685 418 1HG1 ILE 55 HG12 ILE 55 -12.958 -0.518 -9.783 419 2HG1 ILE 55 HG13 ILE 55 -12.094 0.946 -9.328 420 1HG2 ILE 55 HG21 ILE 55 -9.702 1.153 -9.744 421 2HG2 ILE 55 HG22 ILE 55 -8.712 -0.312 -9.692 422 3HG2 ILE 55 HG23 ILE 55 -9.458 0.168 -11.210 423 1HD1 ILE 55 HD11 ILE 55 -13.129 1.251 -11.500 424 2HD1 ILE 55 HD12 ILE 55 -11.385 1.302 -11.686 425 3HD1 ILE 55 HD13 ILE 55 -12.268 -0.163 -12.159 426 H ASP 56 HN ASP 56 -9.258 -2.656 -12.483 427 HA ASP 56 HA ASP 56 -7.065 -3.968 -11.007 428 1HB ASP 56 HB2 ASP 56 -7.709 -4.794 -13.236 429 2HB ASP 56 HB3 ASP 56 -7.372 -3.213 -13.942 430 H VAL 57 HN VAL 57 -5.916 -2.471 -9.771 431 HA VAL 57 HA VAL 57 -5.732 0.240 -10.659 432 HB VAL 57 HB VAL 57 -4.634 0.784 -8.641 433 1HG1 VAL 57 HG11 VAL 57 -7.044 0.778 -8.791 434 2HG1 VAL 57 HG12 VAL 57 -7.104 -0.910 -8.199 435 3HG1 VAL 57 HG13 VAL 57 -6.505 0.396 -7.151 436 1HG2 VAL 57 HG21 VAL 57 -3.378 -1.201 -8.056 437 2HG2 VAL 57 HG22 VAL 57 -4.525 -0.822 -6.756 438 3HG2 VAL 57 HG23 VAL 57 -4.885 -2.140 -7.863 439 H ASP 58 HN ASP 58 -4.629 -1.092 -12.595 440 HA ASP 58 HA ASP 58 -2.205 0.503 -12.825 441 1HB ASP 58 HB2 ASP 58 -1.109 -1.567 -12.175 442 2HB ASP 58 HB3 ASP 58 -2.149 -2.525 -13.228 443 H GLU 59 HN GLU 59 -4.417 -1.954 -14.367 444 HA GLU 59 HA GLU 59 -4.148 -0.734 -17.001 445 1HB GLU 59 HB2 GLU 59 -4.517 -2.931 -17.305 446 2HB GLU 59 HB3 GLU 59 -5.341 -3.145 -15.768 447 1HG GLU 59 HG2 GLU 59 -7.374 -2.225 -16.613 448 2HG GLU 59 HG3 GLU 59 -6.633 -1.920 -18.199 449 H ASN 60 HN ASN 60 -6.418 -0.554 -14.298 450 HA ASN 60 HA ASN 60 -8.050 1.472 -15.729 451 1HB ASN 60 HB2 ASN 60 -8.906 -1.130 -14.415 452 2HB ASN 60 HB3 ASN 60 -10.026 0.218 -14.442 453 1HD2 ASN 60 HD22 ASN 60 -10.020 -2.489 -15.915 454 2HD2 ASN 60 HD21 ASN 60 -10.352 -2.013 -17.559 455 H GLN 61 HN GLN 61 -5.947 1.872 -13.867 456 HA GLN 61 HA GLN 61 -7.019 2.020 -11.254 457 1HB GLN 61 HB2 GLN 61 -4.913 2.711 -10.525 458 2HB GLN 61 HB3 GLN 61 -4.614 1.693 -11.933 459 1HG GLN 61 HG2 GLN 61 -4.266 3.705 -13.330 460 2HG GLN 61 HG3 GLN 61 -4.412 4.694 -11.876 461 1HE2 GLN 61 HE22 GLN 61 -2.914 3.777 -9.908 462 2HE2 GLN 61 HE21 GLN 61 -1.284 3.426 -10.383 463 H GLU 62 HN GLU 62 -7.621 4.039 -13.813 464 HA GLU 62 HA GLU 62 -7.296 6.677 -12.967 465 1HB GLU 62 HB2 GLU 62 -9.171 5.177 -14.795 466 2HB GLU 62 HB3 GLU 62 -9.399 6.921 -14.572 467 1HG GLU 62 HG2 GLU 62 -6.771 5.659 -15.474 468 2HG GLU 62 HG3 GLU 62 -8.030 6.181 -16.584 469 H THR 63 HN THR 63 -10.210 4.547 -12.473 470 HA THR 63 HA THR 63 -11.765 6.344 -10.997 471 HB THR 63 HB THR 63 -11.382 3.336 -10.768 472 HG1 THR 63 HG1 THR 63 -13.195 3.393 -12.230 473 1HG2 THR 63 HG21 THR 63 -13.623 3.171 -9.850 474 2HG2 THR 63 HG22 THR 63 -12.644 4.143 -8.779 475 3HG2 THR 63 HG23 THR 63 -13.801 4.948 -9.860 476 H ALA 64 HN ALA 64 -9.041 4.333 -9.984 477 HA ALA 64 HA ALA 64 -9.610 4.502 -7.161 478 1HB ALA 64 HB1 ALA 64 -7.007 3.703 -8.546 479 2HB ALA 64 HB2 ALA 64 -7.630 3.145 -6.972 480 3HB ALA 64 HB3 ALA 64 -8.409 2.651 -8.479 481 H GLY 65 HN GLY 65 -6.896 5.754 -9.145 482 1HA GLY 65 HA2 GLY 65 -5.893 7.744 -7.494 483 2HA GLY 65 HA3 GLY 65 -5.982 7.859 -9.267 484 H LYS 66 HN LYS 66 -8.774 8.075 -9.670 485 HA LYS 66 HA LYS 66 -9.228 10.822 -9.193 486 1HB LYS 66 HB2 LYS 66 -10.169 9.509 -11.028 487 2HB LYS 66 HB3 LYS 66 -11.175 8.586 -9.900 488 1HG LYS 66 HG2 LYS 66 -12.357 10.736 -9.305 489 2HG LYS 66 HG3 LYS 66 -11.409 11.548 -10.561 490 1HD LYS 66 HD2 LYS 66 -13.387 9.250 -10.937 491 2HD LYS 66 HD3 LYS 66 -13.631 10.940 -11.402 492 1HE LYS 66 HE2 LYS 66 -11.726 10.758 -13.012 493 2HE LYS 66 HE3 LYS 66 -11.515 9.064 -12.560 494 1HZ LYS 66 HZ1 LYS 66 -13.747 8.616 -13.428 495 2HZ LYS 66 HZ2 LYS 66 -13.887 10.191 -13.914 496 3HZ LYS 66 HZ3 LYS 66 -12.734 9.185 -14.541 497 H TYR 67 HN TYR 67 -10.477 7.912 -7.434 498 HA TYR 67 HA TYR 67 -12.080 9.471 -5.645 499 1HB TYR 67 HB2 TYR 67 -12.502 7.097 -6.203 500 2HB TYR 67 HB3 TYR 67 -11.008 6.640 -5.408 501 HD1 TYR 67 HD1 TYR 67 -10.833 6.774 -2.882 502 HD2 TYR 67 HD2 TYR 67 -14.507 7.687 -4.959 503 HE1 TYR 67 HE1 TYR 67 -12.068 6.577 -0.760 504 HE2 TYR 67 HE2 TYR 67 -15.752 7.515 -2.825 505 HH TYR 67 HH TYR 67 -14.134 6.756 0.298 506 H GLY 68 HN GLY 68 -8.742 8.320 -5.697 507 1HA GLY 68 HA2 GLY 68 -6.929 9.187 -4.422 508 2HA GLY 68 HA3 GLY 68 -8.062 9.778 -3.188 509 H VAL 69 HN VAL 69 -6.927 6.744 -4.798 510 HA VAL 69 HA VAL 69 -7.682 5.212 -2.303 511 HB VAL 69 HB VAL 69 -7.885 4.452 -5.211 512 1HG1 VAL 69 HG11 VAL 69 -8.112 2.067 -4.493 513 2HG1 VAL 69 HG12 VAL 69 -6.459 2.689 -4.481 514 3HG1 VAL 69 HG13 VAL 69 -7.343 2.544 -2.956 515 1HG2 VAL 69 HG21 VAL 69 -9.695 4.087 -2.832 516 2HG2 VAL 69 HG22 VAL 69 -9.865 5.220 -4.182 517 3HG2 VAL 69 HG23 VAL 69 -10.000 3.489 -4.483 518 H MET 70 HN MET 70 -5.471 4.778 -4.990 519 HA MET 70 HA MET 70 -3.301 4.629 -5.230 520 1HB MET 70 HB2 MET 70 -2.763 5.977 -2.629 521 2HB MET 70 HB3 MET 70 -1.833 6.029 -4.135 522 1HG MET 70 HG2 MET 70 -3.828 7.330 -5.122 523 2HG MET 70 HG3 MET 70 -4.409 7.477 -3.459 524 1HE MET 70 HE1 MET 70 -1.319 9.245 -1.722 525 2HE MET 70 HE2 MET 70 -2.736 8.201 -1.492 526 3HE MET 70 HE3 MET 70 -1.225 7.526 -2.162 527 H SER 71 HN SER 71 -4.772 2.767 -2.996 528 HA SER 71 HA SER 71 -2.267 1.428 -2.212 529 1HB SER 71 HB2 SER 71 -3.356 1.270 0.087 530 2HB SER 71 HB3 SER 71 -2.639 2.795 -0.439 531 HG SER 71 HG SER 71 -4.696 3.611 -0.883 532 H ILE 72 HN ILE 72 -2.578 -0.774 -1.253 533 HA ILE 72 HA ILE 72 -4.850 -2.096 -2.591 534 HB ILE 72 HB ILE 72 -2.317 -3.606 -2.357 535 1HG1 ILE 72 HG12 ILE 72 -1.398 -1.465 -3.111 536 2HG1 ILE 72 HG13 ILE 72 -1.161 -2.797 -4.213 537 1HG2 ILE 72 HG21 ILE 72 -2.973 -4.402 -4.626 538 2HG2 ILE 72 HG22 ILE 72 -4.140 -4.754 -3.364 539 3HG2 ILE 72 HG23 ILE 72 -4.443 -3.416 -4.505 540 1HD1 ILE 72 HD11 ILE 72 -1.749 -0.584 -5.233 541 2HD1 ILE 72 HD12 ILE 72 -2.710 -1.976 -5.777 542 3HD1 ILE 72 HD13 ILE 72 -3.401 -0.797 -4.638 543 HA PRO 73 HA PRO 73 -6.078 -3.778 -2.419 544 1HB PRO 73 HB2 PRO 73 -7.930 -5.321 -1.234 545 2HB PRO 73 HB3 PRO 73 -6.362 -6.019 -1.755 546 1HG PRO 73 HG2 PRO 73 -7.203 -5.151 1.014 547 2HG PRO 73 HG3 PRO 73 -6.346 -6.639 0.544 548 1HD PRO 73 HD2 PRO 73 -5.089 -4.323 1.489 549 2HD PRO 73 HD3 PRO 73 -4.282 -5.507 0.435 550 H THR 74 HN THR 74 -7.747 -2.280 -2.691 551 HA THR 74 HA THR 74 -8.830 -1.019 -0.183 552 HB THR 74 HB THR 74 -8.441 0.298 -2.871 553 HG1 THR 74 HG1 THR 74 -6.594 0.431 -1.852 554 1HG2 THR 74 HG21 THR 74 -9.188 2.350 -1.514 555 2HG2 THR 74 HG22 THR 74 -10.471 1.250 -2.046 556 3HG2 THR 74 HG23 THR 74 -9.900 1.218 -0.365 557 H LEU 75 HN LEU 75 -10.990 -0.645 -0.032 558 HA LEU 75 HA LEU 75 -12.797 -2.249 -1.778 559 1HB LEU 75 HB2 LEU 75 -11.707 -3.349 0.413 560 2HB LEU 75 HB3 LEU 75 -12.786 -2.250 1.257 561 HG LEU 75 HG LEU 75 -14.684 -3.318 -0.163 562 1HD1 LEU 75 HD11 LEU 75 -13.234 -4.518 -1.784 563 2HD1 LEU 75 HD12 LEU 75 -12.497 -5.461 -0.479 564 3HD1 LEU 75 HD13 LEU 75 -14.217 -5.666 -0.870 565 1HD2 LEU 75 HD21 LEU 75 -14.780 -5.191 1.546 566 2HD2 LEU 75 HD22 LEU 75 -13.115 -4.785 2.005 567 3HD2 LEU 75 HD23 LEU 75 -14.420 -3.599 2.221 568 H LEU 76 HN LEU 76 -14.567 -0.981 -2.216 569 HA LEU 76 HA LEU 76 -15.240 1.228 -0.381 570 1HB LEU 76 HB2 LEU 76 -15.560 1.408 -3.393 571 2HB LEU 76 HB3 LEU 76 -15.936 2.625 -2.183 572 HG LEU 76 HG LEU 76 -13.137 1.781 -3.088 573 1HD1 LEU 76 HD11 LEU 76 -14.378 3.158 -4.687 574 2HD1 LEU 76 HD12 LEU 76 -14.703 4.364 -3.424 575 3HD1 LEU 76 HD13 LEU 76 -13.040 4.055 -3.962 576 1HD2 LEU 76 HD21 LEU 76 -12.300 3.580 -1.655 577 2HD2 LEU 76 HD22 LEU 76 -13.941 3.902 -1.056 578 3HD2 LEU 76 HD23 LEU 76 -13.126 2.368 -0.669 579 H VAL 77 HN VAL 77 -17.042 0.411 0.583 580 HA VAL 77 HA VAL 77 -18.821 -1.422 -0.917 581 HB VAL 77 HB VAL 77 -19.302 -0.412 1.912 582 1HG1 VAL 77 HG11 VAL 77 -21.153 -1.536 0.728 583 2HG1 VAL 77 HG12 VAL 77 -20.110 -2.950 0.458 584 3HG1 VAL 77 HG13 VAL 77 -20.576 -2.469 2.110 585 1HG2 VAL 77 HG21 VAL 77 -17.074 -1.346 2.071 586 2HG2 VAL 77 HG22 VAL 77 -18.236 -2.488 2.750 587 3HG2 VAL 77 HG23 VAL 77 -17.557 -2.769 1.134 588 H LEU 78 HN LEU 78 -20.165 -0.379 -2.313 589 HA LEU 78 HA LEU 78 -21.167 2.324 -1.593 590 1HB LEU 78 HB2 LEU 78 -21.180 0.918 -4.297 591 2HB LEU 78 HB3 LEU 78 -21.874 2.492 -3.942 592 HG LEU 78 HG LEU 78 -19.268 2.762 -2.974 593 1HD1 LEU 78 HD11 LEU 78 -18.746 0.568 -4.136 594 2HD1 LEU 78 HD12 LEU 78 -19.066 1.378 -5.677 595 3HD1 LEU 78 HD13 LEU 78 -17.747 1.940 -4.623 596 1HD2 LEU 78 HD21 LEU 78 -20.303 3.551 -5.726 597 2HD2 LEU 78 HD22 LEU 78 -20.530 4.467 -4.220 598 3HD2 LEU 78 HD23 LEU 78 -18.905 4.251 -4.882 599 H LYS 79 HN LYS 79 -23.364 2.726 -1.659 600 HA LYS 79 HA LYS 79 -25.247 0.529 -2.185 601 1HB LYS 79 HB2 LYS 79 -24.968 0.144 0.071 602 2HB LYS 79 HB3 LYS 79 -24.743 1.857 0.455 603 1HG LYS 79 HG2 LYS 79 -27.044 2.341 0.327 604 2HG LYS 79 HG3 LYS 79 -27.421 0.762 -0.410 605 1HD LYS 79 HD2 LYS 79 -26.712 -0.381 1.656 606 2HD LYS 79 HD3 LYS 79 -26.289 1.175 2.401 607 1HE LYS 79 HE2 LYS 79 -28.596 1.925 2.293 608 2HE LYS 79 HE3 LYS 79 -29.070 0.482 1.376 609 1HZ LYS 79 HZ1 LYS 79 -28.417 -0.849 3.342 610 2HZ LYS 79 HZ2 LYS 79 -28.177 0.534 4.196 611 3HZ LYS 79 HZ3 LYS 79 -29.667 0.169 3.650 612 H ASP 80 HN ASP 80 -26.877 1.299 -3.216 613 HA ASP 80 HA ASP 80 -27.990 2.659 -4.617 614 1HB ASP 80 HB2 ASP 80 -29.229 2.754 -2.470 615 2HB ASP 80 HB3 ASP 80 -28.408 4.264 -2.073 616 H GLY 81 HN GLY 81 -25.130 3.290 -4.570 617 1HA GLY 81 HA2 GLY 81 -24.051 4.577 -6.103 618 2HA GLY 81 HA3 GLY 81 -25.326 5.810 -6.056 619 H GLU 82 HN GLU 82 -24.235 5.046 -2.910 620 HA GLU 82 HA GLU 82 -21.991 6.940 -3.014 621 1HB GLU 82 HB2 GLU 82 -22.799 8.131 -1.169 622 2HB GLU 82 HB3 GLU 82 -24.199 7.884 -2.235 623 1HG GLU 82 HG2 GLU 82 -24.983 6.045 -0.789 624 2HG GLU 82 HG3 GLU 82 -23.609 6.299 0.293 625 H VAL 83 HN VAL 83 -20.370 6.622 -1.334 626 HA VAL 83 HA VAL 83 -19.981 3.811 -0.598 627 HB VAL 83 HB VAL 83 -18.398 6.309 0.168 628 1HG1 VAL 83 HG11 VAL 83 -17.613 3.359 0.211 629 2HG1 VAL 83 HG12 VAL 83 -16.542 4.720 0.596 630 3HG1 VAL 83 HG13 VAL 83 -17.914 4.369 1.642 631 1HG2 VAL 83 HG21 VAL 83 -16.807 5.618 -1.611 632 2HG2 VAL 83 HG22 VAL 83 -17.910 4.333 -2.112 633 3HG2 VAL 83 HG23 VAL 83 -18.376 6.039 -2.296 634 H VAL 84 HN VAL 84 -20.510 2.867 1.195 635 HA VAL 84 HA VAL 84 -21.545 4.484 3.472 636 HB VAL 84 HB VAL 84 -23.006 2.556 3.955 637 1HG1 VAL 84 HG11 VAL 84 -23.831 4.590 2.800 638 2HG1 VAL 84 HG12 VAL 84 -23.537 3.809 1.234 639 3HG1 VAL 84 HG13 VAL 84 -24.743 3.142 2.357 640 1HG2 VAL 84 HG21 VAL 84 -22.358 1.553 1.153 641 2HG2 VAL 84 HG22 VAL 84 -21.821 0.783 2.664 642 3HG2 VAL 84 HG23 VAL 84 -23.542 0.883 2.289 643 H GLU 85 HN GLU 85 -19.292 1.981 2.418 644 HA GLU 85 HA GLU 85 -18.005 2.246 4.977 645 1HB GLU 85 HB2 GLU 85 -19.337 -0.294 4.178 646 2HB GLU 85 HB3 GLU 85 -17.630 -0.506 4.550 647 1HG GLU 85 HG2 GLU 85 -19.635 0.866 6.337 648 2HG GLU 85 HG3 GLU 85 -19.143 -0.831 6.473 649 H THR 86 HN THR 86 -15.788 1.370 4.899 650 HA THR 86 HA THR 86 -14.601 1.277 2.185 651 HB THR 86 HB THR 86 -13.346 3.251 4.030 652 HG1 THR 86 HG1 THR 86 -15.438 3.945 4.335 653 1HG2 THR 86 HG21 THR 86 -14.133 3.333 1.113 654 2HG2 THR 86 HG22 THR 86 -13.037 4.477 1.933 655 3HG2 THR 86 HG23 THR 86 -12.548 2.785 1.738 656 H SER 87 HN SER 87 -12.484 0.309 2.260 657 HA SER 87 HA SER 87 -11.131 0.025 4.827 658 1HB SER 87 HB2 SER 87 -12.057 -2.425 3.260 659 2HB SER 87 HB3 SER 87 -10.769 -2.444 4.470 660 HG SER 87 HG SER 87 -13.095 -1.217 5.280 661 H VAL 88 HN VAL 88 -8.939 -0.357 4.555 662 HA VAL 88 HA VAL 88 -7.842 -0.446 1.804 663 HB VAL 88 HB VAL 88 -7.066 1.571 3.957 664 1HG1 VAL 88 HG11 VAL 88 -5.138 0.811 2.586 665 2HG1 VAL 88 HG12 VAL 88 -6.066 1.088 1.115 666 3HG1 VAL 88 HG13 VAL 88 -5.582 2.462 2.147 667 1HG2 VAL 88 HG21 VAL 88 -9.154 2.268 2.886 668 2HG2 VAL 88 HG22 VAL 88 -7.824 3.267 2.300 669 3HG2 VAL 88 HG23 VAL 88 -8.455 1.955 1.282 670 H GLY 89 HN GLY 89 -7.914 -2.656 2.627 671 1HA GLY 89 HA2 GLY 89 -5.596 -3.798 3.597 672 2HA GLY 89 HA3 GLY 89 -6.543 -3.467 5.054 673 H PHE 90 HN PHE 90 -5.824 -6.050 4.053 674 HA PHE 90 HA PHE 90 -7.805 -7.352 2.523 675 1HB PHE 90 HB2 PHE 90 -5.534 -8.196 2.792 676 2HB PHE 90 HB3 PHE 90 -5.738 -8.330 4.530 677 HD1 PHE 90 HD1 PHE 90 -6.481 -10.350 5.515 678 HD2 PHE 90 HD2 PHE 90 -7.044 -9.720 1.280 679 HE1 PHE 90 HE1 PHE 90 -7.327 -12.668 5.279 680 HE2 PHE 90 HE2 PHE 90 -7.945 -12.025 1.072 681 HZ PHE 90 HZ PHE 90 -8.063 -13.508 3.056 682 H LYS 91 HN LYS 91 -9.232 -9.152 3.266 683 HA LYS 91 HA LYS 91 -9.926 -9.399 6.055 684 1HB LYS 91 HB2 LYS 91 -11.625 -7.806 4.228 685 2HB LYS 91 HB3 LYS 91 -12.514 -9.125 4.966 686 1HG LYS 91 HG2 LYS 91 -12.285 -8.303 7.129 687 2HG LYS 91 HG3 LYS 91 -10.853 -7.372 6.779 688 1HD LYS 91 HD2 LYS 91 -13.699 -6.722 5.912 689 2HD LYS 91 HD3 LYS 91 -12.781 -5.923 7.190 690 1HE LYS 91 HE2 LYS 91 -12.220 -5.874 4.203 691 2HE LYS 91 HE3 LYS 91 -12.773 -4.533 5.194 692 1HZ LYS 91 HZ1 LYS 91 -10.144 -5.855 5.678 693 2HZ LYS 91 HZ2 LYS 91 -10.289 -4.608 4.660 694 3HZ LYS 91 HZ3 LYS 91 -10.665 -4.408 6.254 695 HA PRO 92 HA PRO 92 -10.480 -13.396 4.043 696 1HB PRO 92 HB2 PRO 92 -11.585 -14.880 6.063 697 2HB PRO 92 HB3 PRO 92 -9.877 -14.348 6.077 698 1HG PRO 92 HG2 PRO 92 -12.255 -13.008 7.409 699 2HG PRO 92 HG3 PRO 92 -10.686 -13.460 8.155 700 1HD PRO 92 HD2 PRO 92 -11.077 -10.934 7.257 701 2HD PRO 92 HD3 PRO 92 -9.516 -11.751 6.987 702 H LYS 93 HN LYS 93 -12.286 -14.981 3.661 703 HA LYS 93 HA LYS 93 -14.456 -14.075 2.271 704 1HB LYS 93 HB2 LYS 93 -13.727 -16.303 2.084 705 2HB LYS 93 HB3 LYS 93 -13.831 -16.591 3.812 706 1HG LYS 93 HG2 LYS 93 -15.474 -17.856 2.644 707 2HG LYS 93 HG3 LYS 93 -16.230 -16.710 3.747 708 1HD LYS 93 HD2 LYS 93 -16.951 -15.302 1.893 709 2HD LYS 93 HD3 LYS 93 -15.966 -16.220 0.741 710 1HE LYS 93 HE2 LYS 93 -18.396 -16.816 0.653 711 2HE LYS 93 HE3 LYS 93 -17.333 -18.182 0.963 712 1HZ LYS 93 HZ1 LYS 93 -19.329 -18.141 2.362 713 2HZ LYS 93 HZ2 LYS 93 -17.965 -18.147 3.262 714 3HZ LYS 93 HZ3 LYS 93 -18.832 -16.760 3.097 715 H GLU 94 HN GLU 94 -14.674 -15.101 5.719 716 HA GLU 94 HA GLU 94 -17.405 -14.359 5.771 717 1HB GLU 94 HB2 GLU 94 -15.405 -14.861 8.028 718 2HB GLU 94 HB3 GLU 94 -17.153 -14.656 8.272 719 1HG GLU 94 HG2 GLU 94 -17.590 -16.623 6.806 720 2HG GLU 94 HG3 GLU 94 -15.853 -16.863 6.607 721 H ALA 95 HN ALA 95 -14.466 -12.626 6.910 722 HA ALA 95 HA ALA 95 -15.930 -10.542 8.209 723 1HB ALA 95 HB1 ALA 95 -13.169 -10.409 6.977 724 2HB ALA 95 HB2 ALA 95 -13.830 -9.373 8.268 725 3HB ALA 95 HB3 ALA 95 -13.504 -11.084 8.601 726 H LEU 96 HN LEU 96 -14.807 -11.031 4.876 727 HA LEU 96 HA LEU 96 -15.394 -8.357 4.041 728 1HB LEU 96 HB2 LEU 96 -13.924 -10.312 2.906 729 2HB LEU 96 HB3 LEU 96 -15.453 -10.692 2.124 730 HG LEU 96 HG LEU 96 -15.551 -8.185 1.451 731 1HD1 LEU 96 HD11 LEU 96 -13.878 -7.285 3.041 732 2HD1 LEU 96 HD12 LEU 96 -12.653 -8.393 2.381 733 3HD1 LEU 96 HD13 LEU 96 -13.275 -7.074 1.387 734 1HD2 LEU 96 HD21 LEU 96 -14.068 -8.439 -0.443 735 2HD2 LEU 96 HD22 LEU 96 -13.139 -9.693 0.383 736 3HD2 LEU 96 HD23 LEU 96 -14.819 -10.016 -0.124 737 H GLN 97 HN GLN 97 -17.187 -11.449 3.768 738 HA GLN 97 HA GLN 97 -19.460 -10.264 2.506 739 1HB GLN 97 HB2 GLN 97 -20.486 -12.207 2.608 740 2HB GLN 97 HB3 GLN 97 -18.813 -12.725 2.600 741 1HG GLN 97 HG2 GLN 97 -19.013 -13.108 5.067 742 2HG GLN 97 HG3 GLN 97 -20.723 -12.668 4.977 743 1HE2 GLN 97 HE22 GLN 97 -22.046 -13.998 3.256 744 2HE2 GLN 97 HE21 GLN 97 -21.692 -15.719 3.269 745 H GLU 98 HN GLU 98 -18.529 -10.655 5.943 746 HA GLU 98 HA GLU 98 -20.970 -9.696 6.999 747 1HB GLU 98 HB2 GLU 98 -19.352 -10.887 8.348 748 2HB GLU 98 HB3 GLU 98 -18.161 -9.589 8.146 749 1HG GLU 98 HG2 GLU 98 -19.608 -8.033 9.365 750 2HG GLU 98 HG3 GLU 98 -20.880 -9.253 9.478 751 H LEU 99 HN LEU 99 -17.953 -7.909 6.130 752 HA LEU 99 HA LEU 99 -18.733 -5.425 7.026 753 1HB LEU 99 HB2 LEU 99 -16.469 -5.991 6.338 754 2HB LEU 99 HB3 LEU 99 -16.993 -6.176 4.662 755 HG LEU 99 HG LEU 99 -17.501 -3.782 4.504 756 1HD1 LEU 99 HD11 LEU 99 -18.158 -3.194 6.783 757 2HD1 LEU 99 HD12 LEU 99 -16.546 -3.637 7.402 758 3HD1 LEU 99 HD13 LEU 99 -16.751 -2.232 6.335 759 1HD2 LEU 99 HD21 LEU 99 -15.219 -2.996 4.511 760 2HD2 LEU 99 HD22 LEU 99 -14.757 -4.198 5.735 761 3HD2 LEU 99 HD23 LEU 99 -15.194 -4.719 4.095 762 H VAL 100 HN VAL 100 -19.536 -6.982 3.937 763 HA VAL 100 HA VAL 100 -20.989 -4.560 3.081 764 HB VAL 100 HB VAL 100 -19.819 -5.717 1.431 765 1HG1 VAL 100 HG11 VAL 100 -20.553 -7.860 0.464 766 2HG1 VAL 100 HG12 VAL 100 -19.988 -8.068 2.121 767 3HG1 VAL 100 HG13 VAL 100 -21.730 -8.072 1.777 768 1HG2 VAL 100 HG21 VAL 100 -21.456 -5.546 -0.272 769 2HG2 VAL 100 HG22 VAL 100 -22.779 -5.985 0.835 770 3HG2 VAL 100 HG23 VAL 100 -21.958 -4.425 0.990 771 H ASN 101 HN ASN 101 -21.847 -7.759 4.456 772 HA ASN 101 HA ASN 101 -24.646 -7.585 4.125 773 1HB ASN 101 HB2 ASN 101 -23.541 -9.642 4.718 774 2HB ASN 101 HB3 ASN 101 -23.008 -8.965 6.264 775 1HD2 ASN 101 HD22 ASN 101 -24.545 -8.727 7.979 776 2HD2 ASN 101 HD21 ASN 101 -26.142 -9.423 7.889 777 H LYS 102 HN LYS 102 -22.569 -5.961 6.474 778 HA LYS 102 HA LYS 102 -24.474 -5.092 8.378 779 1HB LYS 102 HB2 LYS 102 -22.039 -3.754 7.165 780 2HB LYS 102 HB3 LYS 102 -22.942 -3.024 8.493 781 1HG LYS 102 HG2 LYS 102 -22.371 -4.757 10.009 782 2HG LYS 102 HG3 LYS 102 -21.798 -5.825 8.725 783 1HD LYS 102 HD2 LYS 102 -19.986 -4.185 8.181 784 2HD LYS 102 HD3 LYS 102 -20.524 -3.183 9.558 785 1HE LYS 102 HE2 LYS 102 -20.229 -5.320 10.970 786 2HE LYS 102 HE3 LYS 102 -19.406 -6.002 9.555 787 1HZ LYS 102 HZ1 LYS 102 -17.769 -4.192 9.749 788 2HZ LYS 102 HZ2 LYS 102 -18.545 -3.587 11.055 789 3HZ LYS 102 HZ3 LYS 102 -17.835 -5.046 11.136 790 H HIS 103 HN HIS 103 -24.131 -4.115 5.012 791 HA HIS 103 HA HIS 103 -26.054 -1.857 5.426 792 1HB HIS 103 HB2 HIS 103 -23.742 -2.118 3.456 793 2HB HIS 103 HB3 HIS 103 -24.851 -0.752 3.581 794 HD1 HIS 103 HD1 HIS 103 -24.563 0.833 5.797 795 HD2 HIS 103 HD2 HIS 103 -21.843 -2.373 5.406 796 HE1 HIS 103 HE1 HIS 103 -22.778 1.177 7.577 797 H LEU 104 HN LEU 104 -25.223 -4.691 3.548 798 HA LEU 104 HA LEU 104 -27.068 -4.346 1.353 799 1HB LEU 104 HB2 LEU 104 -25.143 -5.648 0.995 800 2HB LEU 104 HB3 LEU 104 -25.347 -6.512 2.512 801 HG LEU 104 HG LEU 104 -27.232 -7.759 1.665 802 1HD1 LEU 104 HD11 LEU 104 -26.738 -6.349 -1.007 803 2HD1 LEU 104 HD12 LEU 104 -27.926 -7.614 -0.683 804 3HD1 LEU 104 HD13 LEU 104 -28.132 -6.029 0.045 805 1HD2 LEU 104 HD21 LEU 104 -25.934 -9.116 0.101 806 2HD2 LEU 104 HD22 LEU 104 -24.841 -7.755 -0.221 807 3HD2 LEU 104 HD23 LEU 104 -24.898 -8.500 1.392 808 1H MET 1 H1 MET 1 7.868 26.161 -11.691 809 2H MET 1 H2 MET 1 8.168 27.745 -11.937 810 3H MET 1 H3 MET 1 6.995 26.999 -12.806 811 HA MET 1 HA MET 1 6.037 28.378 -11.072 812 1HB MET 1 HB2 MET 1 5.704 25.370 -10.631 813 2HB MET 1 HB3 MET 1 4.719 26.604 -9.846 814 1HG MET 1 HG2 MET 1 4.882 26.115 -12.841 815 2HG MET 1 HG3 MET 1 3.565 25.669 -11.765 816 1HE MET 1 HE1 MET 1 1.810 26.780 -13.371 817 2HE MET 1 HE2 MET 1 1.930 28.448 -13.972 818 3HE MET 1 HE3 MET 1 3.125 27.234 -14.480 819 H GLU 2 HN GLU 2 6.151 29.151 -8.946 820 HA GLU 2 HA GLU 2 8.614 28.467 -7.533 821 1HB GLU 2 HB2 GLU 2 6.475 30.584 -7.031 822 2HB GLU 2 HB3 GLU 2 8.005 30.460 -6.148 823 1HG GLU 2 HG2 GLU 2 9.263 30.778 -8.264 824 2HG GLU 2 HG3 GLU 2 7.743 30.993 -9.134 825 H ASN 3 HN ASN 3 6.505 26.475 -7.539 826 HA ASN 3 HA ASN 3 6.770 25.536 -4.990 827 1HB ASN 3 HB2 ASN 3 3.863 26.168 -5.719 828 2HB ASN 3 HB3 ASN 3 4.394 24.952 -4.547 829 1HD2 ASN 3 HD22 ASN 3 6.068 25.948 -2.803 830 2HD2 ASN 3 HD21 ASN 3 5.530 27.446 -2.112 831 H LYS 4 HN LYS 4 6.983 23.638 -5.305 832 HA LYS 4 HA LYS 4 5.930 21.972 -7.478 833 1HB LYS 4 HB2 LYS 4 8.871 22.562 -6.857 834 2HB LYS 4 HB3 LYS 4 8.350 21.217 -7.880 835 1HG LYS 4 HG2 LYS 4 7.419 22.704 -9.531 836 2HG LYS 4 HG3 LYS 4 7.656 24.125 -8.513 837 1HD LYS 4 HD2 LYS 4 9.947 22.431 -9.506 838 2HD LYS 4 HD3 LYS 4 9.297 23.853 -10.354 839 1HE LYS 4 HE2 LYS 4 9.792 25.288 -8.424 840 2HE LYS 4 HE3 LYS 4 10.442 23.908 -7.530 841 1HZ LYS 4 HZ1 LYS 4 11.555 24.882 -10.099 842 2HZ LYS 4 HZ2 LYS 4 12.179 25.254 -8.636 843 3HZ LYS 4 HZ3 LYS 4 12.183 23.701 -9.142 844 H ILE 5 HN ILE 5 5.852 19.734 -6.712 845 HA ILE 5 HA ILE 5 6.552 19.457 -3.833 846 HB ILE 5 HB ILE 5 4.031 18.654 -5.312 847 1HG1 ILE 5 HG12 ILE 5 4.773 20.905 -3.482 848 2HG1 ILE 5 HG13 ILE 5 3.788 20.908 -4.930 849 1HG2 ILE 5 HG21 ILE 5 4.665 16.917 -3.685 850 2HG2 ILE 5 HG22 ILE 5 4.755 18.152 -2.401 851 3HG2 ILE 5 HG23 ILE 5 3.206 17.748 -3.199 852 1HD1 ILE 5 HD11 ILE 5 1.959 19.786 -3.633 853 2HD1 ILE 5 HD12 ILE 5 2.978 19.920 -2.174 854 3HD1 ILE 5 HD13 ILE 5 2.422 21.387 -3.002 855 H ILE 6 HN ILE 6 7.283 17.535 -3.136 856 HA ILE 6 HA ILE 6 7.493 15.269 -5.015 857 HB ILE 6 HB ILE 6 9.626 16.469 -5.199 858 1HG1 ILE 6 HG12 ILE 6 9.901 13.799 -3.753 859 2HG1 ILE 6 HG13 ILE 6 9.479 14.009 -5.459 860 1HG2 ILE 6 HG21 ILE 6 9.694 17.505 -2.929 861 2HG2 ILE 6 HG22 ILE 6 10.035 15.906 -2.234 862 3HG2 ILE 6 HG23 ILE 6 11.197 16.681 -3.322 863 1HD1 ILE 6 HD11 ILE 6 11.649 15.069 -5.880 864 2HD1 ILE 6 HD12 ILE 6 12.116 14.810 -4.173 865 3HD1 ILE 6 HD13 ILE 6 11.817 13.438 -5.241 866 H TYR 7 HN TYR 7 7.598 13.250 -3.931 867 HA TYR 7 HA TYR 7 6.555 13.296 -1.141 868 1HB TYR 7 HB2 TYR 7 4.977 13.100 -3.304 869 2HB TYR 7 HB3 TYR 7 5.546 11.449 -3.310 870 HD1 TYR 7 HD1 TYR 7 3.792 14.066 -1.363 871 HD2 TYR 7 HD2 TYR 7 4.597 9.843 -1.717 872 HE1 TYR 7 HE1 TYR 7 2.017 13.585 0.285 873 HE2 TYR 7 HE2 TYR 7 2.740 9.359 -0.162 874 HH TYR 7 HH TYR 7 0.784 11.970 1.349 875 H PHE 8 HN PHE 8 7.064 11.365 0.046 876 HA PHE 8 HA PHE 8 8.985 9.476 -1.247 877 1HB PHE 8 HB2 PHE 8 8.882 10.387 1.635 878 2HB PHE 8 HB3 PHE 8 10.104 9.359 0.914 879 HD1 PHE 8 HD1 PHE 8 10.651 10.975 -1.631 880 HD2 PHE 8 HD2 PHE 8 10.154 12.191 2.466 881 HE1 PHE 8 HE1 PHE 8 12.029 12.987 -2.062 882 HE2 PHE 8 HE2 PHE 8 11.531 14.162 2.038 883 HZ PHE 8 HZ PHE 8 12.456 14.607 -0.194 884 H LEU 9 HN LEU 9 8.761 7.264 -0.651 885 HA LEU 9 HA LEU 9 6.513 6.545 1.153 886 1HB LEU 9 HB2 LEU 9 6.998 5.598 -1.693 887 2HB LEU 9 HB3 LEU 9 6.236 4.535 -0.520 888 HG LEU 9 HG LEU 9 5.139 7.245 -1.359 889 1HD1 LEU 9 HD11 LEU 9 5.051 5.501 -3.133 890 2HD1 LEU 9 HD12 LEU 9 4.246 4.398 -2.016 891 3HD1 LEU 9 HD13 LEU 9 3.430 5.894 -2.529 892 1HD2 LEU 9 HD21 LEU 9 3.072 6.489 -0.168 893 2HD2 LEU 9 HD22 LEU 9 3.958 5.075 0.447 894 3HD2 LEU 9 HD23 LEU 9 4.431 6.711 0.937 895 H SER 10 HN SER 10 7.043 5.132 2.622 896 HA SER 10 HA SER 10 9.152 3.130 2.158 897 1HB SER 10 HB2 SER 10 9.062 4.782 4.719 898 2HB SER 10 HB3 SER 10 10.301 3.656 4.213 899 HG SER 10 HG SER 10 9.685 6.170 3.013 900 H THR 11 HN THR 11 8.829 1.230 3.447 901 HA THR 11 HA THR 11 6.261 0.681 4.548 902 HB THR 11 HB THR 11 9.023 -0.606 4.859 903 HG1 THR 11 HG1 THR 11 8.060 -0.843 2.838 904 1HG2 THR 11 HG21 THR 11 7.698 -2.588 5.736 905 2HG2 THR 11 HG22 THR 11 7.827 -1.234 6.856 906 3HG2 THR 11 HG23 THR 11 6.326 -1.454 5.930 907 H GLY 12 HN GLY 12 5.435 1.132 6.462 908 1HA GLY 12 HA2 GLY 12 5.070 2.146 8.491 909 2HA GLY 12 HA3 GLY 12 6.483 1.198 8.974 910 H ASN 13 HN ASN 13 6.414 3.919 6.702 911 HA ASN 13 HA ASN 13 8.775 4.972 7.173 912 1HB ASN 13 HB2 ASN 13 7.353 5.773 5.376 913 2HB ASN 13 HB3 ASN 13 6.329 6.629 6.506 914 1HD2 ASN 13 HD22 ASN 13 6.834 8.755 6.882 915 2HD2 ASN 13 HD21 ASN 13 8.464 9.401 6.791 916 H SER 14 HN SER 14 9.620 5.023 9.175 917 HA SER 14 HA SER 14 8.855 7.341 10.874 918 1HB SER 14 HB2 SER 14 9.529 4.537 11.853 919 2HB SER 14 HB3 SER 14 9.137 5.942 12.855 920 HG SER 14 HG SER 14 7.487 4.516 11.047 921 H ALA 15 HN ALA 15 11.202 6.293 8.920 922 HA ALA 15 HA ALA 15 13.147 7.798 10.355 923 1HB ALA 15 HB1 ALA 15 13.669 5.566 11.260 924 2HB ALA 15 HB2 ALA 15 13.889 4.933 9.611 925 3HB ALA 15 HB3 ALA 15 14.988 6.179 10.259 926 H ARG 16 HN ARG 16 12.854 5.681 7.339 927 HA ARG 16 HA ARG 16 14.901 7.045 5.989 928 1HB ARG 16 HB2 ARG 16 12.532 5.407 5.142 929 2HB ARG 16 HB3 ARG 16 13.265 6.389 3.905 930 1HG ARG 16 HG2 ARG 16 15.159 4.735 5.543 931 2HG ARG 16 HG3 ARG 16 14.081 3.872 4.461 932 1HD ARG 16 HD2 ARG 16 14.813 5.440 2.596 933 2HD ARG 16 HD3 ARG 16 16.059 6.036 3.703 934 HE ARG 16 HE ARG 16 16.144 3.155 3.400 935 1HH1 ARG 16 HH11 ARG 16 16.587 5.944 1.328 936 2HH1 ARG 16 HH12 ARG 16 17.922 5.296 0.452 937 1HH2 ARG 16 HH21 ARG 16 18.068 2.294 2.342 938 2HH2 ARG 16 HH22 ARG 16 18.652 3.123 0.945 939 H SER 17 HN SER 17 11.344 7.866 5.689 940 HA SER 17 HA SER 17 12.124 9.936 3.818 941 1HB SER 17 HB2 SER 17 9.450 9.724 5.144 942 2HB SER 17 HB3 SER 17 9.845 10.471 3.607 943 HG SER 17 HG SER 17 9.829 7.739 4.301 944 H GLN 18 HN GLN 18 11.545 9.843 7.281 945 HA GLN 18 HA GLN 18 11.325 12.530 8.033 946 1HB GLN 18 HB2 GLN 18 12.961 10.269 9.231 947 2HB GLN 18 HB3 GLN 18 12.753 11.800 9.995 948 1HG GLN 18 HG2 GLN 18 11.358 10.044 10.957 949 2HG GLN 18 HG3 GLN 18 10.407 11.417 10.388 950 1HE2 GLN 18 HE22 GLN 18 8.394 10.399 9.997 951 2HE2 GLN 18 HE21 GLN 18 8.218 8.960 9.014 952 H MET 19 HN MET 19 14.173 10.563 7.330 953 HA MET 19 HA MET 19 16.085 12.636 7.753 954 1HB MET 19 HB2 MET 19 16.267 10.027 7.849 955 2HB MET 19 HB3 MET 19 16.369 10.079 6.086 956 1HG MET 19 HG2 MET 19 18.335 11.696 6.460 957 2HG MET 19 HG3 MET 19 18.293 11.157 8.140 958 1HE MET 19 HE1 MET 19 17.394 7.854 7.127 959 2HE MET 19 HE2 MET 19 19.027 7.265 7.525 960 3HE MET 19 HE3 MET 19 18.214 8.414 8.620 961 H ALA 20 HN ALA 20 14.542 11.179 4.842 962 HA ALA 20 HA ALA 20 15.915 12.635 2.876 963 1HB ALA 20 HB1 ALA 20 13.063 11.611 2.751 964 2HB ALA 20 HB2 ALA 20 14.113 12.005 1.383 965 3HB ALA 20 HB3 ALA 20 14.521 10.639 2.437 966 H GLU 21 HN GLU 21 12.877 13.534 4.623 967 HA GLU 21 HA GLU 21 12.581 15.858 3.002 968 1HB GLU 21 HB2 GLU 21 10.670 16.362 4.260 969 2HB GLU 21 HB3 GLU 21 10.735 14.599 4.128 970 1HG GLU 21 HG2 GLU 21 11.537 14.408 6.412 971 2HG GLU 21 HG3 GLU 21 11.570 16.177 6.564 972 H GLY 22 HN GLY 22 14.229 15.290 6.097 973 1HA GLY 22 HA2 GLY 22 14.871 18.041 6.652 974 2HA GLY 22 HA3 GLY 22 15.771 16.605 7.177 975 H TRP 23 HN TRP 23 16.624 15.429 4.857 976 HA TRP 23 HA TRP 23 18.828 16.985 4.003 977 1HB TRP 23 HB2 TRP 23 17.515 14.408 3.162 978 2HB TRP 23 HB3 TRP 23 18.569 15.182 1.988 979 HD1 TRP 23 HD1 TRP 23 18.680 13.124 5.047 980 HE1 TRP 23 HE1 TRP 23 21.088 12.604 5.713 981 HE3 TRP 23 HE3 TRP 23 21.057 16.430 1.970 982 HZ2 TRP 23 HZ2 TRP 23 23.711 13.593 5.085 983 HZ3 TRP 23 HZ3 TRP 23 23.543 16.570 1.970 984 HH2 TRP 23 HH2 TRP 23 24.879 15.170 3.526 985 H ALA 24 HN ALA 24 15.640 16.450 2.477 986 HA ALA 24 HA ALA 24 16.230 17.592 0.023 987 1HB ALA 24 HB1 ALA 24 14.113 16.354 0.506 988 2HB ALA 24 HB2 ALA 24 13.577 17.675 1.571 989 3HB ALA 24 HB3 ALA 24 13.751 17.957 -0.160 990 H LYS 25 HN LYS 25 14.896 19.204 2.986 991 HA LYS 25 HA LYS 25 14.456 21.594 1.562 992 1HB LYS 25 HB2 LYS 25 13.884 20.628 4.204 993 2HB LYS 25 HB3 LYS 25 14.746 22.151 4.408 994 1HG LYS 25 HG2 LYS 25 12.387 22.646 4.262 995 2HG LYS 25 HG3 LYS 25 13.170 23.225 2.785 996 1HD LYS 25 HD2 LYS 25 12.414 21.017 1.686 997 2HD LYS 25 HD3 LYS 25 11.513 20.698 3.159 998 1HE LYS 25 HE2 LYS 25 10.059 21.641 1.396 999 2HE LYS 25 HE3 LYS 25 10.130 22.727 2.779 1000 1HZ LYS 25 HZ1 LYS 25 11.487 24.201 1.578 1001 2HZ LYS 25 HZ2 LYS 25 11.900 23.119 0.426 1002 3HZ LYS 25 HZ3 LYS 25 10.391 23.729 0.454 1003 H GLN 26 HN GLN 26 17.428 20.498 3.043 1004 HA GLN 26 HA GLN 26 18.561 23.114 3.090 1005 1HB GLN 26 HB2 GLN 26 20.580 22.195 3.698 1006 2HB GLN 26 HB3 GLN 26 19.369 21.205 4.461 1007 1HG GLN 26 HG2 GLN 26 20.148 19.340 3.501 1008 2HG GLN 26 HG3 GLN 26 20.010 20.005 1.890 1009 1HE2 GLN 26 HE22 GLN 26 22.126 18.240 3.034 1010 2HE2 GLN 26 HE21 GLN 26 23.618 19.096 2.732 1011 H TYR 27 HN TYR 27 17.810 21.129 0.400 1012 HA TYR 27 HA TYR 27 19.506 22.844 -1.351 1013 1HB TYR 27 HB2 TYR 27 19.155 19.861 -1.277 1014 2HB TYR 27 HB3 TYR 27 19.165 20.602 -2.859 1015 HD1 TYR 27 HD1 TYR 27 21.248 19.683 -0.014 1016 HD2 TYR 27 HD2 TYR 27 21.080 21.958 -3.671 1017 HE1 TYR 27 HE1 TYR 27 23.706 19.955 0.058 1018 HE2 TYR 27 HE2 TYR 27 23.550 22.196 -3.642 1019 HH TYR 27 HH TYR 27 25.588 20.861 -0.994 1020 H LEU 28 HN LEU 28 16.333 22.045 -0.502 1021 HA LEU 28 HA LEU 28 15.219 22.871 -3.130 1022 1HB LEU 28 HB2 LEU 28 14.295 20.643 -1.273 1023 2HB LEU 28 HB3 LEU 28 13.361 21.244 -2.622 1024 HG LEU 28 HG LEU 28 16.182 20.243 -3.105 1025 1HD1 LEU 28 HD11 LEU 28 15.141 18.492 -1.845 1026 2HD1 LEU 28 HD12 LEU 28 13.727 18.477 -2.932 1027 3HD1 LEU 28 HD13 LEU 28 15.362 18.018 -3.516 1028 1HD2 LEU 28 HD21 LEU 28 13.656 20.289 -4.813 1029 2HD2 LEU 28 HD22 LEU 28 15.044 21.390 -4.966 1030 3HD2 LEU 28 HD23 LEU 28 15.230 19.666 -5.323 1031 H GLY 29 HN GLY 29 15.178 24.964 -2.201 1032 1HA GLY 29 HA2 GLY 29 14.337 25.624 0.435 1033 2HA GLY 29 HA3 GLY 29 14.589 26.739 -0.910 1034 H ASP 30 HN ASP 30 12.726 27.900 0.059 1035 HA ASP 30 HA ASP 30 10.141 26.879 0.411 1036 1HB ASP 30 HB2 ASP 30 10.932 29.036 1.261 1037 2HB ASP 30 HB3 ASP 30 11.041 29.668 -0.384 1038 H GLU 31 HN GLU 31 11.751 27.630 -2.550 1039 HA GLU 31 HA GLU 31 9.620 27.874 -4.405 1040 1HB GLU 31 HB2 GLU 31 11.902 28.479 -4.865 1041 2HB GLU 31 HB3 GLU 31 12.483 26.844 -4.544 1042 1HG GLU 31 HG2 GLU 31 11.374 25.986 -6.502 1043 2HG GLU 31 HG3 GLU 31 10.617 27.556 -6.836 1044 H TRP 32 HN TRP 32 10.451 25.181 -2.437 1045 HA TRP 32 HA TRP 32 8.919 23.281 -4.117 1046 1HB TRP 32 HB2 TRP 32 11.399 22.538 -2.566 1047 2HB TRP 32 HB3 TRP 32 10.537 21.572 -3.746 1048 HD1 TRP 32 HD1 TRP 32 12.880 24.597 -3.510 1049 HE1 TRP 32 HE1 TRP 32 14.363 24.725 -5.596 1050 HE3 TRP 32 HE3 TRP 32 10.691 20.897 -6.297 1051 HZ2 TRP 32 HZ2 TRP 32 14.685 23.303 -8.047 1052 HZ3 TRP 32 HZ3 TRP 32 11.614 20.318 -8.527 1053 HH2 TRP 32 HH2 TRP 32 13.632 21.469 -9.397 1054 H LYS 33 HN LYS 33 8.002 21.520 -2.833 1055 HA LYS 33 HA LYS 33 8.068 21.845 0.111 1056 1HB LYS 33 HB2 LYS 33 5.565 21.411 -1.560 1057 2HB LYS 33 HB3 LYS 33 5.620 21.250 0.179 1058 1HG LYS 33 HG2 LYS 33 6.274 23.825 -1.324 1059 2HG LYS 33 HG3 LYS 33 4.685 23.435 -0.686 1060 1HD LYS 33 HD2 LYS 33 7.200 23.764 1.010 1061 2HD LYS 33 HD3 LYS 33 5.971 25.000 0.734 1062 1HE LYS 33 HE2 LYS 33 4.240 23.485 1.724 1063 2HE LYS 33 HE3 LYS 33 5.503 22.306 2.092 1064 1HZ LYS 33 HZ1 LYS 33 5.002 23.693 3.998 1065 2HZ LYS 33 HZ2 LYS 33 6.537 23.974 3.534 1066 3HZ LYS 33 HZ3 LYS 33 5.361 25.057 3.188 1067 H VAL 34 HN VAL 34 7.652 19.809 1.211 1068 HA VAL 34 HA VAL 34 8.266 17.429 -0.456 1069 HB VAL 34 HB VAL 34 9.820 18.327 2.026 1070 1HG1 VAL 34 HG11 VAL 34 10.241 16.073 0.033 1071 2HG1 VAL 34 HG12 VAL 34 11.396 16.549 1.290 1072 3HG1 VAL 34 HG13 VAL 34 9.807 15.917 1.747 1073 1HG2 VAL 34 HG21 VAL 34 10.404 19.870 0.176 1074 2HG2 VAL 34 HG22 VAL 34 11.722 18.807 0.584 1075 3HG2 VAL 34 HG23 VAL 34 10.752 18.476 -0.871 1076 H TYR 35 HN TYR 35 7.381 15.507 0.447 1077 HA TYR 35 HA TYR 35 6.164 15.648 3.129 1078 1HB TYR 35 HB2 TYR 35 4.551 16.344 1.124 1079 2HB TYR 35 HB3 TYR 35 4.490 14.618 0.851 1080 HD1 TYR 35 HD1 TYR 35 3.294 13.139 2.491 1081 HD2 TYR 35 HD2 TYR 35 3.673 17.391 3.144 1082 HE1 TYR 35 HE1 TYR 35 1.536 13.021 4.217 1083 HE2 TYR 35 HE2 TYR 35 1.906 17.284 4.874 1084 HH TYR 35 HH TYR 35 0.247 14.212 5.762 1085 H SER 36 HN SER 36 5.415 13.466 3.819 1086 HA SER 36 HA SER 36 7.102 11.257 2.741 1087 1HB SER 36 HB2 SER 36 6.867 12.347 5.589 1088 2HB SER 36 HB3 SER 36 7.707 10.862 5.148 1089 HG SER 36 HG SER 36 8.738 13.194 5.297 1090 H ALA 37 HN ALA 37 6.165 9.173 3.066 1091 HA ALA 37 HA ALA 37 3.675 8.947 4.632 1092 1HB ALA 37 HB1 ALA 37 2.650 7.988 2.471 1093 2HB ALA 37 HB2 ALA 37 2.820 9.754 2.578 1094 3HB ALA 37 HB3 ALA 37 3.974 8.792 1.625 1095 H GLY 38 HN GLY 38 2.843 6.775 4.639 1096 1HA GLY 38 HA2 GLY 38 4.036 4.506 3.511 1097 2HA GLY 38 HA3 GLY 38 4.638 4.681 5.170 1098 H ILE 39 HN ILE 39 3.247 2.529 5.023 1099 HA ILE 39 HA ILE 39 0.477 2.517 4.860 1100 HB ILE 39 HB ILE 39 1.540 0.496 4.694 1101 1HG1 ILE 39 HG12 ILE 39 0.548 0.099 7.518 1102 2HG1 ILE 39 HG13 ILE 39 -0.588 0.645 6.283 1103 1HG2 ILE 39 HG21 ILE 39 2.885 0.826 7.417 1104 2HG2 ILE 39 HG22 ILE 39 2.954 -0.608 6.407 1105 3HG2 ILE 39 HG23 ILE 39 3.678 0.883 5.822 1106 1HD1 ILE 39 HD11 ILE 39 -0.792 -1.704 6.354 1107 2HD1 ILE 39 HD12 ILE 39 0.100 -1.309 4.870 1108 3HD1 ILE 39 HD13 ILE 39 0.963 -1.946 6.297 1109 H GLU 40 HN GLU 40 2.348 2.625 7.894 1110 HA GLU 40 HA GLU 40 0.022 3.724 9.411 1111 1HB GLU 40 HB2 GLU 40 1.780 1.295 9.871 1112 2HB GLU 40 HB3 GLU 40 1.100 2.127 11.265 1113 1HG GLU 40 HG2 GLU 40 -0.681 1.199 8.992 1114 2HG GLU 40 HG3 GLU 40 -0.164 0.111 10.270 1115 H ALA 41 HN ALA 41 2.310 4.918 8.093 1116 HA ALA 41 HA ALA 41 4.563 5.469 9.701 1117 1HB ALA 41 HB1 ALA 41 4.794 7.313 7.991 1118 2HB ALA 41 HB2 ALA 41 4.500 5.688 7.291 1119 3HB ALA 41 HB3 ALA 41 3.193 6.879 7.376 1120 H HIS 42 HN HIS 42 4.583 6.576 11.554 1121 HA HIS 42 HA HIS 42 3.696 9.296 11.526 1122 1HB HIS 42 HB2 HIS 42 1.642 7.729 12.345 1123 2HB HIS 42 HB3 HIS 42 2.489 7.814 13.876 1124 HD1 HIS 42 HD1 HIS 42 3.307 11.050 13.478 1125 HD2 HIS 42 HD2 HIS 42 -0.435 9.162 13.010 1126 HE1 HIS 42 HE1 HIS 42 1.554 12.860 13.754 1127 H GLY 43 HN GLY 43 5.902 6.977 12.407 1128 1HA GLY 43 HA2 GLY 43 6.591 7.942 15.073 1129 2HA GLY 43 HA3 GLY 43 7.398 6.693 14.119 1130 H LEU 44 HN LEU 44 8.905 8.515 15.415 1131 HA LEU 44 HA LEU 44 10.322 9.872 13.227 1132 1HB LEU 44 HB2 LEU 44 8.907 11.663 14.125 1133 2HB LEU 44 HB3 LEU 44 9.378 11.261 15.776 1134 HG LEU 44 HG LEU 44 11.714 11.972 15.306 1135 1HD1 LEU 44 HD11 LEU 44 10.644 12.644 12.534 1136 2HD1 LEU 44 HD12 LEU 44 12.176 13.251 13.195 1137 3HD1 LEU 44 HD13 LEU 44 11.964 11.518 12.938 1138 1HD2 LEU 44 HD21 LEU 44 11.252 14.374 15.136 1139 2HD2 LEU 44 HD22 LEU 44 9.608 14.030 14.556 1140 3HD2 LEU 44 HD23 LEU 44 10.091 13.573 16.201 1141 H ASN 45 HN ASN 45 11.550 7.899 13.542 1142 HA ASN 45 HA ASN 45 12.320 6.974 16.116 1143 1HB ASN 45 HB2 ASN 45 12.284 5.667 13.981 1144 2HB ASN 45 HB3 ASN 45 13.718 6.540 13.446 1145 1HD2 ASN 45 HD22 ASN 45 13.133 3.574 14.176 1146 2HD2 ASN 45 HD21 ASN 45 14.415 3.177 15.291 1147 HA PRO 46 HA PRO 46 15.365 10.146 16.995 1148 1HB PRO 46 HB2 PRO 46 16.938 8.836 18.888 1149 2HB PRO 46 HB3 PRO 46 15.397 9.687 19.206 1150 1HG PRO 46 HG2 PRO 46 15.837 6.731 18.722 1151 2HG PRO 46 HG3 PRO 46 14.828 7.513 19.982 1152 1HD PRO 46 HD2 PRO 46 13.712 6.534 17.737 1153 2HD PRO 46 HD3 PRO 46 13.156 8.100 18.393 1154 H ASN 47 HN ASN 47 16.259 6.913 15.811 1155 HA ASN 47 HA ASN 47 18.982 7.524 15.174 1156 1HB ASN 47 HB2 ASN 47 19.009 5.549 14.091 1157 2HB ASN 47 HB3 ASN 47 17.544 5.258 15.012 1158 1HD2 ASN 47 HD22 ASN 47 18.890 5.847 11.793 1159 2HD2 ASN 47 HD21 ASN 47 17.420 5.343 10.963 1160 H ALA 48 HN ALA 48 15.903 8.325 13.492 1161 HA ALA 48 HA ALA 48 17.259 9.292 11.102 1162 1HB ALA 48 HB1 ALA 48 15.014 10.066 10.447 1163 2HB ALA 48 HB2 ALA 48 14.978 8.410 11.094 1164 3HB ALA 48 HB3 ALA 48 14.394 9.766 12.081 1165 H VAL 49 HN VAL 49 15.992 10.643 14.120 1166 HA VAL 49 HA VAL 49 16.457 13.403 13.475 1167 HB VAL 49 HB VAL 49 16.582 12.123 16.237 1168 1HG1 VAL 49 HG11 VAL 49 15.964 14.984 15.365 1169 2HG1 VAL 49 HG12 VAL 49 15.907 14.367 17.028 1170 3HG1 VAL 49 HG13 VAL 49 17.451 14.438 16.173 1171 1HG2 VAL 49 HG21 VAL 49 14.199 12.736 16.464 1172 2HG2 VAL 49 HG22 VAL 49 14.160 13.265 14.772 1173 3HG2 VAL 49 HG23 VAL 49 14.413 11.556 15.173 1174 H LYS 50 HN LYS 50 18.508 10.980 15.172 1175 HA LYS 50 HA LYS 50 20.812 12.582 15.395 1176 1HB LYS 50 HB2 LYS 50 20.365 10.466 16.600 1177 2HB LYS 50 HB3 LYS 50 20.594 9.553 15.100 1178 1HG LYS 50 HG2 LYS 50 22.931 10.227 14.983 1179 2HG LYS 50 HG3 LYS 50 22.725 11.349 16.344 1180 1HD LYS 50 HD2 LYS 50 22.254 9.502 17.871 1181 2HD LYS 50 HD3 LYS 50 22.312 8.330 16.538 1182 1HE LYS 50 HE2 LYS 50 24.675 8.872 16.127 1183 2HE LYS 50 HE3 LYS 50 24.636 10.114 17.386 1184 1HZ LYS 50 HZ1 LYS 50 25.606 8.059 18.202 1185 2HZ LYS 50 HZ2 LYS 50 24.232 8.367 19.017 1186 3HZ LYS 50 HZ3 LYS 50 24.257 7.210 17.861 1187 H ALA 51 HN ALA 51 19.813 10.369 12.721 1188 HA ALA 51 HA ALA 51 22.037 10.639 11.086 1189 1HB ALA 51 HB1 ALA 51 20.527 10.073 9.238 1190 2HB ALA 51 HB2 ALA 51 20.183 9.078 10.666 1191 3HB ALA 51 HB3 ALA 51 19.116 10.434 10.256 1192 H MET 52 HN MET 52 19.418 13.063 11.613 1193 HA MET 52 HA MET 52 20.497 14.742 9.458 1194 1HB MET 52 HB2 MET 52 18.254 15.247 11.466 1195 2HB MET 52 HB3 MET 52 18.688 16.272 10.095 1196 1HG MET 52 HG2 MET 52 17.449 13.537 10.031 1197 2HG MET 52 HG3 MET 52 16.849 15.036 9.348 1198 1HE MET 52 HE1 MET 52 19.222 15.518 6.259 1199 2HE MET 52 HE2 MET 52 17.975 16.220 7.317 1200 3HE MET 52 HE3 MET 52 19.669 16.055 7.878 1201 H LYS 53 HN LYS 53 20.605 14.578 13.029 1202 HA LYS 53 HA LYS 53 22.017 17.048 13.343 1203 1HB LYS 53 HB2 LYS 53 22.200 14.510 15.023 1204 2HB LYS 53 HB3 LYS 53 22.807 16.086 15.506 1205 1HG LYS 53 HG2 LYS 53 19.872 15.528 14.918 1206 2HG LYS 53 HG3 LYS 53 20.595 15.404 16.514 1207 1HD LYS 53 HD2 LYS 53 21.080 17.771 16.568 1208 2HD LYS 53 HD3 LYS 53 20.590 17.970 14.867 1209 1HE LYS 53 HE2 LYS 53 18.306 17.363 15.355 1210 2HE LYS 53 HE3 LYS 53 18.704 16.894 17.009 1211 1HZ LYS 53 HZ1 LYS 53 19.048 19.670 16.064 1212 2HZ LYS 53 HZ2 LYS 53 17.630 19.117 16.671 1213 3HZ LYS 53 HZ3 LYS 53 18.984 19.131 17.609 1214 H GLU 54 HN GLU 54 23.133 13.857 12.193 1215 HA GLU 54 HA GLU 54 25.907 14.230 12.430 1216 1HB GLU 54 HB2 GLU 54 24.368 12.957 10.134 1217 2HB GLU 54 HB3 GLU 54 26.111 12.887 10.313 1218 1HG GLU 54 HG2 GLU 54 25.852 11.714 12.492 1219 2HG GLU 54 HG3 GLU 54 24.109 11.645 12.222 1220 H VAL 55 HN VAL 55 23.647 15.776 10.190 1221 HA VAL 55 HA VAL 55 25.881 17.322 8.980 1222 HB VAL 55 HB VAL 55 24.409 17.520 6.993 1223 1HG1 VAL 55 HG11 VAL 55 24.942 15.353 6.114 1224 2HG1 VAL 55 HG12 VAL 55 26.231 15.813 7.223 1225 3HG1 VAL 55 HG13 VAL 55 25.010 14.625 7.732 1226 1HG2 VAL 55 HG21 VAL 55 22.509 16.049 6.654 1227 2HG2 VAL 55 HG22 VAL 55 22.690 15.331 8.264 1228 3HG2 VAL 55 HG23 VAL 55 22.201 17.030 8.093 1229 H GLY 56 HN GLY 56 24.062 17.735 11.469 1230 1HA GLY 56 HA2 GLY 56 23.339 19.555 12.603 1231 2HA GLY 56 HA3 GLY 56 24.180 20.541 11.397 1232 H ILE 57 HN ILE 57 21.314 18.338 10.921 1233 HA ILE 57 HA ILE 57 19.670 20.764 10.271 1234 HB ILE 57 HB ILE 57 19.619 18.009 8.987 1235 1HG1 ILE 57 HG12 ILE 57 20.223 20.748 7.786 1236 2HG1 ILE 57 HG13 ILE 57 21.423 19.518 8.166 1237 1HG2 ILE 57 HG21 ILE 57 17.301 18.910 9.303 1238 2HG2 ILE 57 HG22 ILE 57 17.777 20.393 8.447 1239 3HG2 ILE 57 HG23 ILE 57 17.742 18.838 7.604 1240 1HD1 ILE 57 HD11 ILE 57 21.032 19.444 5.824 1241 2HD1 ILE 57 HD12 ILE 57 20.347 17.970 6.524 1242 3HD1 ILE 57 HD13 ILE 57 19.280 19.310 6.028 1243 H ASP 58 HN ASP 58 17.944 20.950 11.683 1244 HA ASP 58 HA ASP 58 17.571 18.767 13.658 1245 1HB ASP 58 HB2 ASP 58 17.602 20.995 14.621 1246 2HB ASP 58 HB3 ASP 58 16.329 21.543 13.509 1247 H ILE 59 HN ILE 59 15.908 17.397 13.595 1248 HA ILE 59 HA ILE 59 13.467 18.179 12.128 1249 HB ILE 59 HB ILE 59 13.062 16.021 11.325 1250 1HG1 ILE 59 HG12 ILE 59 15.896 15.130 12.035 1251 2HG1 ILE 59 HG13 ILE 59 14.485 14.739 13.018 1252 1HG2 ILE 59 HG21 ILE 59 14.259 17.692 9.919 1253 2HG2 ILE 59 HG22 ILE 59 15.811 16.973 10.396 1254 3HG2 ILE 59 HG23 ILE 59 14.655 16.034 9.430 1255 1HD1 ILE 59 HD11 ILE 59 13.415 13.650 11.059 1256 2HD1 ILE 59 HD12 ILE 59 14.917 13.873 10.136 1257 3HD1 ILE 59 HD13 ILE 59 14.906 12.859 11.587 1258 H SER 60 HN SER 60 14.555 17.922 15.100 1259 HA SER 60 HA SER 60 12.901 15.938 16.253 1260 1HB SER 60 HB2 SER 60 13.602 18.603 17.557 1261 2HB SER 60 HB3 SER 60 13.369 17.033 18.342 1262 HG SER 60 HG SER 60 15.510 18.006 16.767 1263 H ASN 61 HN ASN 61 12.217 18.918 14.758 1264 HA ASN 61 HA ASN 61 9.666 19.540 15.922 1265 1HB ASN 61 HB2 ASN 61 9.603 21.268 14.187 1266 2HB ASN 61 HB3 ASN 61 11.156 21.273 15.006 1267 1HD2 ASN 61 HD22 ASN 61 13.101 20.694 13.795 1268 2HD2 ASN 61 HD21 ASN 61 13.036 20.460 12.070 1269 H GLN 62 HN GLN 62 10.575 17.094 13.568 1270 HA GLN 62 HA GLN 62 8.405 17.320 11.808 1271 1HB GLN 62 HB2 GLN 62 10.325 15.130 12.536 1272 2HB GLN 62 HB3 GLN 62 8.906 14.743 11.563 1273 1HG GLN 62 HG2 GLN 62 9.454 16.560 9.973 1274 2HG GLN 62 HG3 GLN 62 10.894 16.944 10.921 1275 1HE2 GLN 62 HE22 GLN 62 12.127 16.539 9.042 1276 2HE2 GLN 62 HE21 GLN 62 12.523 14.896 8.528 1277 H THR 63 HN THR 63 6.708 15.822 11.526 1278 HA THR 63 HA THR 63 5.318 14.907 14.004 1279 HB THR 63 HB THR 63 3.255 15.629 12.716 1280 HG1 THR 63 HG1 THR 63 3.561 16.902 10.919 1281 1HG2 THR 63 HG21 THR 63 4.345 17.084 14.455 1282 2HG2 THR 63 HG22 THR 63 5.313 17.841 13.169 1283 3HG2 THR 63 HG23 THR 63 3.544 18.016 13.178 1284 H SER 64 HN SER 64 5.849 14.265 10.538 1285 HA SER 64 HA SER 64 5.685 12.471 9.228 1286 1HB SER 64 HB2 SER 64 5.340 10.793 11.723 1287 2HB SER 64 HB3 SER 64 5.819 10.223 10.121 1288 HG SER 64 HG SER 64 7.501 10.616 11.754 1289 H ASP 65 HN ASP 65 4.107 10.775 8.353 1290 HA ASP 65 HA ASP 65 1.366 10.815 9.242 1291 1HB ASP 65 HB2 ASP 65 1.624 13.131 8.221 1292 2HB ASP 65 HB3 ASP 65 2.100 12.361 6.711 1293 H ILE 66 HN ILE 66 -0.004 9.606 7.680 1294 HA ILE 66 HA ILE 66 1.366 7.379 6.377 1295 HB ILE 66 HB ILE 66 -1.027 6.652 6.038 1296 1HG1 ILE 66 HG12 ILE 66 -1.748 8.960 7.887 1297 2HG1 ILE 66 HG13 ILE 66 -1.987 9.013 6.137 1298 1HG2 ILE 66 HG21 ILE 66 -0.211 7.246 8.906 1299 2HG2 ILE 66 HG22 ILE 66 -1.317 5.963 8.352 1300 3HG2 ILE 66 HG23 ILE 66 0.381 5.911 7.890 1301 1HD1 ILE 66 HD11 ILE 66 -4.053 8.423 7.216 1302 2HD1 ILE 66 HD12 ILE 66 -3.463 7.006 6.318 1303 3HD1 ILE 66 HD13 ILE 66 -3.288 7.089 8.092 1304 H ILE 67 HN ILE 67 0.153 6.693 4.182 1305 HA ILE 67 HA ILE 67 0.648 8.659 2.221 1306 HB ILE 67 HB ILE 67 0.131 7.186 0.667 1307 1HG1 ILE 67 HG12 ILE 67 -2.223 6.021 2.184 1308 2HG1 ILE 67 HG13 ILE 67 -2.298 7.247 0.914 1309 1HG2 ILE 67 HG21 ILE 67 0.657 4.912 1.213 1310 2HG2 ILE 67 HG22 ILE 67 1.582 5.945 2.287 1311 3HG2 ILE 67 HG23 ILE 67 0.127 5.110 2.890 1312 1HD1 ILE 67 HD11 ILE 67 -2.889 5.239 -0.156 1313 2HD1 ILE 67 HD12 ILE 67 -1.237 5.569 -0.678 1314 3HD1 ILE 67 HD13 ILE 67 -1.540 4.337 0.573 1315 H ASP 68 HN ASP 68 -0.512 10.227 1.339 1316 HA ASP 68 HA ASP 68 -3.386 10.568 1.973 1317 1HB ASP 68 HB2 ASP 68 -2.144 11.740 3.765 1318 2HB ASP 68 HB3 ASP 68 -1.348 12.739 2.547 1319 H SER 69 HN SER 69 -4.048 10.334 0.004 1320 HA SER 69 HA SER 69 -3.009 10.977 -2.406 1321 1HB SER 69 HB2 SER 69 -5.915 11.341 -1.634 1322 2HB SER 69 HB3 SER 69 -5.275 10.752 -3.182 1323 HG SER 69 HG SER 69 -6.128 9.181 -1.475 1324 H ASP 70 HN ASP 70 -4.309 13.348 -0.100 1325 HA ASP 70 HA ASP 70 -5.058 15.308 -2.049 1326 1HB ASP 70 HB2 ASP 70 -5.848 15.319 0.299 1327 2HB ASP 70 HB3 ASP 70 -4.203 15.706 0.834 1328 H ILE 71 HN ILE 71 -1.969 14.306 -0.798 1329 HA ILE 71 HA ILE 71 -0.661 16.704 -2.028 1330 HB ILE 71 HB ILE 71 0.414 14.942 0.142 1331 1HG1 ILE 71 HG12 ILE 71 -0.088 17.477 1.322 1332 2HG1 ILE 71 HG13 ILE 71 -1.554 17.137 0.406 1333 1HG2 ILE 71 HG21 ILE 71 2.159 16.139 -1.073 1334 2HG2 ILE 71 HG22 ILE 71 1.332 17.685 -0.765 1335 3HG2 ILE 71 HG23 ILE 71 1.995 16.733 0.587 1336 1HD1 ILE 71 HD11 ILE 71 -1.671 16.244 2.698 1337 2HD1 ILE 71 HD12 ILE 71 -1.711 14.922 1.503 1338 3HD1 ILE 71 HD13 ILE 71 -0.203 15.281 2.390 1339 H LEU 72 HN LEU 72 -0.567 13.077 -1.631 1340 HA LEU 72 HA LEU 72 1.725 12.735 -3.257 1341 1HB LEU 72 HB2 LEU 72 0.554 10.959 -1.885 1342 2HB LEU 72 HB3 LEU 72 -0.625 10.820 -3.180 1343 HG LEU 72 HG LEU 72 2.380 10.481 -3.605 1344 1HD1 LEU 72 HD11 LEU 72 2.268 8.164 -3.355 1345 2HD1 LEU 72 HD12 LEU 72 1.347 8.764 -1.972 1346 3HD1 LEU 72 HD13 LEU 72 0.502 8.125 -3.398 1347 1HD2 LEU 72 HD21 LEU 72 1.540 10.690 -5.759 1348 2HD2 LEU 72 HD22 LEU 72 1.413 8.959 -5.551 1349 3HD2 LEU 72 HD23 LEU 72 -0.032 9.960 -5.351 1350 H ASN 73 HN ASN 73 -1.794 12.799 -4.244 1351 HA ASN 73 HA ASN 73 -1.227 12.432 -6.980 1352 1HB ASN 73 HB2 ASN 73 -3.410 12.670 -7.394 1353 2HB ASN 73 HB3 ASN 73 -3.565 12.484 -5.658 1354 1HD2 ASN 73 HD22 ASN 73 -3.752 14.586 -4.380 1355 2HD2 ASN 73 HD21 ASN 73 -4.406 16.013 -5.170 1356 H ASN 74 HN ASN 74 -0.942 15.312 -4.991 1357 HA ASN 74 HA ASN 74 -0.809 17.143 -7.253 1358 1HB ASN 74 HB2 ASN 74 -0.793 17.452 -4.245 1359 2HB ASN 74 HB3 ASN 74 -0.144 18.742 -5.238 1360 1HD2 ASN 74 HD22 ASN 74 -2.993 17.825 -3.755 1361 2HD2 ASN 74 HD21 ASN 74 -4.086 18.702 -4.801 1362 H ALA 75 HN ALA 75 1.461 15.219 -5.379 1363 HA ALA 75 HA ALA 75 3.798 16.709 -5.834 1364 1HB ALA 75 HB1 ALA 75 3.595 14.730 -4.334 1365 2HB ALA 75 HB2 ALA 75 3.569 13.678 -5.773 1366 3HB ALA 75 HB3 ALA 75 4.991 14.674 -5.424 1367 H ASP 76 HN ASP 76 5.483 16.324 -7.285 1368 HA ASP 76 HA ASP 76 4.660 15.753 -10.088 1369 1HB ASP 76 HB2 ASP 76 6.064 17.724 -9.647 1370 2HB ASP 76 HB3 ASP 76 7.291 16.702 -8.890 1371 H LEU 77 HN LEU 77 6.538 14.349 -7.411 1372 HA LEU 77 HA LEU 77 7.083 11.928 -8.941 1373 1HB LEU 77 HB2 LEU 77 9.052 13.121 -9.470 1374 2HB LEU 77 HB3 LEU 77 9.123 13.883 -7.888 1375 HG LEU 77 HG LEU 77 9.855 11.786 -6.844 1376 1HD1 LEU 77 HD11 LEU 77 10.167 9.769 -7.830 1377 2HD1 LEU 77 HD12 LEU 77 8.829 10.305 -8.869 1378 3HD1 LEU 77 HD13 LEU 77 10.509 10.427 -9.411 1379 1HD2 LEU 77 HD21 LEU 77 11.502 12.620 -9.259 1380 2HD2 LEU 77 HD22 LEU 77 11.496 13.412 -7.681 1381 3HD2 LEU 77 HD23 LEU 77 12.114 11.758 -7.827 1382 H VAL 78 HN VAL 78 7.006 10.150 -7.679 1383 HA VAL 78 HA VAL 78 7.077 10.388 -4.710 1384 HB VAL 78 HB VAL 78 5.894 8.141 -6.356 1385 1HG1 VAL 78 HG11 VAL 78 6.584 7.479 -4.098 1386 2HG1 VAL 78 HG12 VAL 78 5.767 8.889 -3.400 1387 3HG1 VAL 78 HG13 VAL 78 4.821 7.595 -4.161 1388 1HG2 VAL 78 HG21 VAL 78 4.496 9.976 -6.846 1389 2HG2 VAL 78 HG22 VAL 78 3.684 9.067 -5.586 1390 3HG2 VAL 78 HG23 VAL 78 4.515 10.591 -5.183 1391 H VAL 79 HN VAL 79 9.113 10.085 -4.068 1392 HA VAL 79 HA VAL 79 10.859 8.201 -5.514 1393 HB VAL 79 HB VAL 79 11.563 9.465 -2.857 1394 1HG1 VAL 79 HG11 VAL 79 13.251 8.940 -5.319 1395 2HG1 VAL 79 HG12 VAL 79 13.808 9.301 -3.675 1396 3HG1 VAL 79 HG13 VAL 79 13.027 7.748 -4.020 1397 1HG2 VAL 79 HG21 VAL 79 12.564 11.396 -4.048 1398 2HG2 VAL 79 HG22 VAL 79 11.754 10.882 -5.543 1399 3HG2 VAL 79 HG23 VAL 79 10.802 11.413 -4.136 1400 H THR 80 HN THR 80 10.115 6.111 -5.217 1401 HA THR 80 HA THR 80 9.225 5.218 -2.524 1402 HB THR 80 HB THR 80 9.792 3.712 -5.127 1403 HG1 THR 80 HG1 THR 80 7.954 5.285 -4.857 1404 1HG2 THR 80 HG21 THR 80 8.460 1.889 -4.060 1405 2HG2 THR 80 HG22 THR 80 9.993 2.195 -3.225 1406 3HG2 THR 80 HG23 THR 80 8.469 2.807 -2.533 1407 H LEU 81 HN LEU 81 10.987 5.409 -1.113 1408 HA LEU 81 HA LEU 81 13.690 4.945 -2.318 1409 1HB LEU 81 HB2 LEU 81 14.540 6.770 -1.247 1410 2HB LEU 81 HB3 LEU 81 12.974 7.306 -1.820 1411 HG LEU 81 HG LEU 81 13.727 6.622 1.054 1412 1HD1 LEU 81 HD11 LEU 81 13.294 8.994 1.439 1413 2HD1 LEU 81 HD12 LEU 81 14.563 8.783 0.218 1414 3HD1 LEU 81 HD13 LEU 81 12.918 9.238 -0.278 1415 1HD2 LEU 81 HD21 LEU 81 11.405 5.967 0.771 1416 2HD2 LEU 81 HD22 LEU 81 11.468 7.476 1.657 1417 3HD2 LEU 81 HD23 LEU 81 11.031 7.488 -0.069 1418 H SER 82 HN SER 82 11.874 3.133 -0.371 1419 HA SER 82 HA SER 82 14.144 2.522 1.430 1420 1HB SER 82 HB2 SER 82 11.246 2.734 2.207 1421 2HB SER 82 HB3 SER 82 12.630 2.437 3.283 1422 HG SER 82 HG SER 82 11.689 4.744 2.785 1423 H GLY 83 HN GLY 83 10.860 1.112 1.065 1424 1HA GLY 83 HA2 GLY 83 11.558 -1.244 -0.278 1425 2HA GLY 83 HA3 GLY 83 11.785 -1.530 1.460 1426 H ASP 84 HN ASP 84 9.885 -2.910 0.058 1427 HA ASP 84 HA ASP 84 7.273 -1.655 0.637 1428 1HB ASP 84 HB2 ASP 84 6.451 -2.692 -1.322 1429 2HB ASP 84 HB3 ASP 84 8.005 -2.015 -1.781 1430 H ALA 85 HN ALA 85 8.951 -3.338 2.467 1431 HA ALA 85 HA ALA 85 8.113 -6.031 2.539 1432 1HB ALA 85 HB1 ALA 85 9.077 -4.236 4.806 1433 2HB ALA 85 HB2 ALA 85 8.993 -6.008 4.848 1434 3HB ALA 85 HB3 ALA 85 10.099 -5.205 3.718 1435 H ALA 86 HN ALA 86 6.531 -3.114 3.866 1436 HA ALA 86 HA ALA 86 4.099 -4.727 4.250 1437 1HB ALA 86 HB1 ALA 86 5.196 -4.897 6.459 1438 2HB ALA 86 HB2 ALA 86 5.279 -3.145 6.596 1439 3HB ALA 86 HB3 ALA 86 3.706 -3.941 6.559 1440 H ASP 87 HN ASP 87 5.383 -2.051 2.869 1441 HA ASP 87 HA ASP 87 3.864 0.104 3.723 1442 1HB ASP 87 HB2 ASP 87 4.763 1.302 1.943 1443 2HB ASP 87 HB3 ASP 87 5.982 0.110 2.320 1444 H LYS 88 HN LYS 88 2.113 -2.335 2.644 1445 HA LYS 88 HA LYS 88 0.392 -2.810 1.317 1446 1HB LYS 88 HB2 LYS 88 -1.567 -1.451 1.407 1447 2HB LYS 88 HB3 LYS 88 -0.825 -1.615 2.970 1448 1HG LYS 88 HG2 LYS 88 -0.038 0.715 2.887 1449 2HG LYS 88 HG3 LYS 88 -0.508 0.833 1.191 1450 1HD LYS 88 HD2 LYS 88 -2.172 1.986 2.258 1451 2HD LYS 88 HD3 LYS 88 -2.926 0.417 1.977 1452 1HE LYS 88 HE2 LYS 88 -1.589 1.112 4.613 1453 2HE LYS 88 HE3 LYS 88 -3.227 1.639 4.266 1454 1HZ LYS 88 HZ1 LYS 88 -3.982 -0.598 4.145 1455 2HZ LYS 88 HZ2 LYS 88 -2.464 -1.227 4.225 1456 3HZ LYS 88 HZ3 LYS 88 -3.132 -0.462 5.507 1457 H CYS 89 HN CYS 89 2.669 -1.794 -0.130 1458 HA CYS 89 HA CYS 89 3.305 -1.341 -2.211 1459 1HB CYS 89 HB2 CYS 89 0.939 -2.989 -3.076 1460 2HB CYS 89 HB3 CYS 89 2.556 -2.961 -3.742 1461 HA PRO 90 HA PRO 90 -0.261 1.710 -2.766 1462 1HB PRO 90 HB2 PRO 90 1.977 3.724 -2.959 1463 2HB PRO 90 HB3 PRO 90 0.393 3.900 -2.148 1464 1HG PRO 90 HG2 PRO 90 2.587 3.418 -0.652 1465 2HG PRO 90 HG3 PRO 90 1.082 2.501 -0.321 1466 1HD PRO 90 HD2 PRO 90 3.451 1.644 -2.023 1467 2HD PRO 90 HD3 PRO 90 2.684 0.759 -0.687 1468 H MET 91 HN MET 91 -1.123 2.072 -4.843 1469 HA MET 91 HA MET 91 0.673 1.422 -7.023 1470 1HB MET 91 HB2 MET 91 -1.393 1.436 -8.439 1471 2HB MET 91 HB3 MET 91 -1.324 0.303 -7.113 1472 1HG MET 91 HG2 MET 91 -3.437 1.141 -6.997 1473 2HG MET 91 HG3 MET 91 -2.642 2.026 -5.743 1474 1HE MET 91 HE1 MET 91 -4.711 3.027 -5.869 1475 2HE MET 91 HE2 MET 91 -5.390 4.234 -7.071 1476 3HE MET 91 HE3 MET 91 -5.350 2.471 -7.411 1477 H THR 92 HN THR 92 0.255 4.436 -5.675 1478 HA THR 92 HA THR 92 0.653 6.526 -6.384 1479 HB THR 92 HB THR 92 2.658 6.777 -7.839 1480 HG1 THR 92 HG1 THR 92 2.299 4.813 -9.010 1481 1HG2 THR 92 HG21 THR 92 2.911 4.797 -5.532 1482 2HG2 THR 92 HG22 THR 92 4.208 5.809 -6.208 1483 3HG2 THR 92 HG23 THR 92 2.836 6.564 -5.387 1484 HA PRO 93 HA PRO 93 -2.318 6.368 -9.769 1485 1HB PRO 93 HB2 PRO 93 -3.550 8.824 -9.420 1486 2HB PRO 93 HB3 PRO 93 -3.878 7.366 -8.419 1487 1HG PRO 93 HG2 PRO 93 -2.003 9.638 -7.732 1488 2HG PRO 93 HG3 PRO 93 -3.300 8.878 -6.742 1489 1HD PRO 93 HD2 PRO 93 -0.721 8.096 -6.493 1490 2HD PRO 93 HD3 PRO 93 -2.030 6.878 -6.452 1491 HA PRO 94 HA PRO 94 0.369 7.780 -12.813 1492 1HB PRO 94 HB2 PRO 94 -1.215 8.010 -15.089 1493 2HB PRO 94 HB3 PRO 94 -0.709 6.478 -14.320 1494 1HG PRO 94 HG2 PRO 94 -3.292 8.013 -13.891 1495 2HG PRO 94 HG3 PRO 94 -3.090 6.265 -14.263 1496 1HD PRO 94 HD2 PRO 94 -3.439 7.050 -11.722 1497 2HD PRO 94 HD3 PRO 94 -2.176 5.834 -12.108 1498 H HIS 95 HN HIS 95 -1.716 10.148 -11.667 1499 HA HIS 95 HA HIS 95 -1.040 12.289 -13.479 1500 1HB HIS 95 HB2 HIS 95 -2.970 12.252 -11.848 1501 2HB HIS 95 HB3 HIS 95 -1.806 12.412 -10.532 1502 HD1 HIS 95 HD1 HIS 95 -1.425 14.917 -9.842 1503 HD2 HIS 95 HD2 HIS 95 -2.745 14.370 -13.811 1504 HE1 HIS 95 HE1 HIS 95 -1.759 17.242 -10.814 1505 H VAL 96 HN VAL 96 0.869 10.408 -11.331 1506 HA VAL 96 HA VAL 96 2.869 12.578 -10.925 1507 HB VAL 96 HB VAL 96 2.271 10.285 -9.014 1508 1HG1 VAL 96 HG11 VAL 96 4.395 11.428 -8.640 1509 2HG1 VAL 96 HG12 VAL 96 3.609 13.000 -8.708 1510 3HG1 VAL 96 HG13 VAL 96 3.266 11.900 -7.363 1511 1HG2 VAL 96 HG21 VAL 96 0.985 13.046 -8.927 1512 2HG2 VAL 96 HG22 VAL 96 0.137 11.492 -9.162 1513 3HG2 VAL 96 HG23 VAL 96 0.931 11.816 -7.648 1514 H LYS 97 HN LYS 97 5.061 11.975 -11.067 1515 HA LYS 97 HA LYS 97 5.720 9.503 -12.520 1516 1HB LYS 97 HB2 LYS 97 6.717 11.789 -12.948 1517 2HB LYS 97 HB3 LYS 97 7.528 11.692 -11.388 1518 1HG LYS 97 HG2 LYS 97 7.943 9.362 -13.206 1519 2HG LYS 97 HG3 LYS 97 8.573 10.895 -13.814 1520 1HD LYS 97 HD2 LYS 97 9.191 9.887 -11.057 1521 2HD LYS 97 HD3 LYS 97 10.109 9.346 -12.446 1522 1HE LYS 97 HE2 LYS 97 9.802 12.331 -11.974 1523 2HE LYS 97 HE3 LYS 97 10.997 11.425 -11.037 1524 1HZ LYS 97 HZ1 LYS 97 12.069 10.699 -12.962 1525 2HZ LYS 97 HZ2 LYS 97 10.961 11.392 -13.982 1526 3HZ LYS 97 HZ3 LYS 97 11.943 12.336 -13.068 1527 H ARG 98 HN ARG 98 7.259 7.899 -11.588 1528 HA ARG 98 HA ARG 98 7.876 8.172 -8.739 1529 1HB ARG 98 HB2 ARG 98 5.721 6.863 -8.773 1530 2HB ARG 98 HB3 ARG 98 6.503 5.676 -9.813 1531 1HG ARG 98 HG2 ARG 98 8.256 5.883 -7.590 1532 2HG ARG 98 HG3 ARG 98 6.678 6.052 -6.870 1533 1HD ARG 98 HD2 ARG 98 7.480 3.820 -8.796 1534 2HD ARG 98 HD3 ARG 98 7.678 3.698 -7.061 1535 HE ARG 98 HE ARG 98 5.057 4.025 -8.475 1536 1HH1 ARG 98 HH11 ARG 98 6.713 3.076 -5.462 1537 2HH1 ARG 98 HH12 ARG 98 5.429 2.024 -4.964 1538 1HH2 ARG 98 HH21 ARG 98 3.348 2.990 -7.651 1539 2HH2 ARG 98 HH22 ARG 98 3.389 2.073 -6.193 1540 H GLU 99 HN GLU 99 9.826 7.149 -8.257 1541 HA GLU 99 HA GLU 99 10.995 5.273 -10.178 1542 1HB GLU 99 HB2 GLU 99 12.307 7.894 -9.353 1543 2HB GLU 99 HB3 GLU 99 13.268 6.450 -9.724 1544 1HG GLU 99 HG2 GLU 99 12.273 6.289 -11.957 1545 2HG GLU 99 HG3 GLU 99 11.245 7.675 -11.622 1546 H HIS 100 HN HIS 100 12.080 3.703 -9.089 1547 HA HIS 100 HA HIS 100 11.807 3.605 -6.166 1548 1HB HIS 100 HB2 HIS 100 12.609 1.521 -8.244 1549 2HB HIS 100 HB3 HIS 100 12.531 1.234 -6.510 1550 HD1 HIS 100 HD1 HIS 100 10.138 1.832 -9.488 1551 HD2 HIS 100 HD2 HIS 100 10.184 0.739 -5.425 1552 HE1 HIS 100 HE1 HIS 100 7.793 1.012 -8.940 1553 H TRP 101 HN TRP 101 13.505 3.822 -4.856 1554 HA TRP 101 HA TRP 101 16.302 3.516 -5.818 1555 1HB TRP 101 HB2 TRP 101 15.234 5.805 -4.114 1556 2HB TRP 101 HB3 TRP 101 16.906 5.558 -4.583 1557 HD1 TRP 101 HD1 TRP 101 13.552 6.689 -6.025 1558 HE1 TRP 101 HE1 TRP 101 13.979 8.259 -7.995 1559 HE3 TRP 101 HE3 TRP 101 18.566 5.851 -6.634 1560 HZ2 TRP 101 HZ2 TRP 101 16.168 8.880 -9.778 1561 HZ3 TRP 101 HZ3 TRP 101 19.776 6.879 -8.539 1562 HH2 TRP 101 HH2 TRP 101 18.599 8.404 -10.105 1563 H GLY 102 HN GLY 102 14.184 2.007 -4.046 1564 1HA GLY 102 HA2 GLY 102 15.095 2.249 -1.323 1565 2HA GLY 102 HA3 GLY 102 13.967 1.053 -1.967 1566 H PHE 103 HN PHE 103 15.600 0.273 -0.078 1567 HA PHE 103 HA PHE 103 17.027 -1.903 -1.159 1568 1HB PHE 103 HB2 PHE 103 18.851 -0.271 -1.533 1569 2HB PHE 103 HB3 PHE 103 18.723 0.282 0.129 1570 HD1 PHE 103 HD1 PHE 103 20.271 -0.584 1.681 1571 HD2 PHE 103 HD2 PHE 103 19.292 -2.905 -1.823 1572 HE1 PHE 103 HE1 PHE 103 21.940 -2.294 2.345 1573 HE2 PHE 103 HE2 PHE 103 20.968 -4.610 -1.155 1574 HZ PHE 103 HZ PHE 103 22.293 -4.310 0.930 1575 H ASP 104 HN ASP 104 16.608 0.303 1.567 1576 HA ASP 104 HA ASP 104 15.804 -1.716 3.482 1577 1HB ASP 104 HB2 ASP 104 17.646 -1.575 4.941 1578 2HB ASP 104 HB3 ASP 104 18.372 -1.878 3.372 1579 H ASP 105 HN ASP 105 15.746 -0.548 5.743 1580 HA ASP 105 HA ASP 105 15.478 2.351 5.628 1581 1HB ASP 105 HB2 ASP 105 13.167 1.792 5.313 1582 2HB ASP 105 HB3 ASP 105 13.232 0.502 6.497 1583 HA PRO 106 HA PRO 106 18.003 1.273 8.984 1584 1HB PRO 106 HB2 PRO 106 18.483 3.604 10.243 1585 2HB PRO 106 HB3 PRO 106 18.999 3.305 8.556 1586 1HG PRO 106 HG2 PRO 106 16.519 4.767 9.480 1587 2HG PRO 106 HG3 PRO 106 17.698 5.277 8.231 1588 1HD PRO 106 HD2 PRO 106 15.322 3.978 7.666 1589 2HD PRO 106 HD3 PRO 106 16.787 3.771 6.659 1590 H ALA 107 HN ALA 107 14.756 2.397 9.790 1591 HA ALA 107 HA ALA 107 15.028 1.731 12.586 1592 1HB ALA 107 HB1 ALA 107 13.293 3.339 11.802 1593 2HB ALA 107 HB2 ALA 107 12.499 2.015 10.916 1594 3HB ALA 107 HB3 ALA 107 12.605 1.957 12.677 1595 H ARG 108 HN ARG 108 15.541 -0.085 9.974 1596 HA ARG 108 HA ARG 108 14.371 -2.574 11.172 1597 1HB ARG 108 HB2 ARG 108 15.252 -2.377 8.312 1598 2HB ARG 108 HB3 ARG 108 14.212 -3.566 9.074 1599 1HG ARG 108 HG2 ARG 108 13.470 -0.701 8.368 1600 2HG ARG 108 HG3 ARG 108 12.995 -2.150 7.483 1601 1HD ARG 108 HD2 ARG 108 12.111 -1.261 10.223 1602 2HD ARG 108 HD3 ARG 108 11.101 -1.485 8.787 1603 HE ARG 108 HE ARG 108 11.389 -3.877 8.974 1604 1HH1 ARG 108 HH21 ARG 108 12.270 -2.061 11.944 1605 2HH1 ARG 108 HH22 ARG 108 11.845 -3.365 12.989 1606 1HH2 ARG 108 HH11 ARG 108 10.925 -5.598 10.398 1607 2HH2 ARG 108 HH12 ARG 108 11.123 -5.418 12.098 1608 H ALA 109 HN ALA 109 17.071 -0.860 11.243 1609 HA ALA 109 HA ALA 109 19.181 -2.498 10.442 1610 1HB ALA 109 HB1 ALA 109 19.384 -0.194 11.428 1611 2HB ALA 109 HB2 ALA 109 18.938 -0.870 13.009 1612 3HB ALA 109 HB3 ALA 109 20.439 -1.384 12.215 1613 H GLN 110 HN GLN 110 20.472 -3.932 11.707 1614 HA GLN 110 HA GLN 110 18.938 -6.071 12.537 1615 1HB GLN 110 HB2 GLN 110 21.340 -6.157 11.730 1616 2HB GLN 110 HB3 GLN 110 21.875 -5.590 13.318 1617 1HG GLN 110 HG2 GLN 110 20.073 -7.969 13.395 1618 2HG GLN 110 HG3 GLN 110 21.580 -8.239 12.528 1619 1HE2 GLN 110 HE22 GLN 110 20.182 -7.381 15.702 1620 2HE2 GLN 110 HE21 GLN 110 21.607 -7.815 16.627 1621 H GLY 111 HN GLY 111 20.402 -3.508 14.478 1622 1HA GLY 111 HA2 GLY 111 18.797 -2.913 16.239 1623 2HA GLY 111 HA3 GLY 111 19.013 -4.580 16.863 1624 H THR 112 HN THR 112 21.972 -4.240 16.140 1625 HA THR 112 HA THR 112 22.774 -3.511 18.823 1626 HB THR 112 HB THR 112 25.033 -4.010 18.051 1627 HG1 THR 112 HG1 THR 112 25.293 -4.588 15.834 1628 1HG2 THR 112 HG21 THR 112 24.762 -6.289 17.402 1629 2HG2 THR 112 HG22 THR 112 23.366 -5.894 18.439 1630 3HG2 THR 112 HG23 THR 112 23.180 -5.963 16.659 1631 H GLU 113 HN GLU 113 24.537 -1.861 19.163 1632 HA GLU 113 HA GLU 113 23.614 0.653 18.362 1633 1HB GLU 113 HB2 GLU 113 26.375 -0.229 19.362 1634 2HB GLU 113 HB3 GLU 113 25.807 1.457 19.351 1635 1HG GLU 113 HG2 GLU 113 23.902 0.768 20.846 1636 2HG GLU 113 HG3 GLU 113 24.602 -0.849 20.939 1637 H GLU 114 HN GLU 114 26.208 -1.417 17.124 1638 HA GLU 114 HA GLU 114 27.275 0.461 15.254 1639 1HB GLU 114 HB2 GLU 114 28.343 -1.673 14.314 1640 2HB GLU 114 HB3 GLU 114 28.820 -1.144 15.941 1641 1HG GLU 114 HG2 GLU 114 27.213 -2.846 16.878 1642 2HG GLU 114 HG3 GLU 114 26.928 -3.382 15.200 1643 H GLU 115 HN GLU 115 24.777 -2.256 15.068 1644 HA GLU 115 HA GLU 115 24.814 -1.993 12.202 1645 1HB GLU 115 HB2 GLU 115 23.005 -3.480 14.100 1646 2HB GLU 115 HB3 GLU 115 22.786 -3.490 12.351 1647 1HG GLU 115 HG2 GLU 115 25.505 -4.177 13.547 1648 2HG GLU 115 HG3 GLU 115 24.230 -5.388 13.452 1649 H LYS 116 HN LYS 116 22.786 -0.650 14.829 1650 HA LYS 116 HA LYS 116 20.919 0.713 13.173 1651 1HB LYS 116 HB2 LYS 116 22.152 1.350 15.892 1652 2HB LYS 116 HB3 LYS 116 20.965 2.420 15.156 1653 1HG LYS 116 HG2 LYS 116 20.277 -0.497 15.502 1654 2HG LYS 116 HG3 LYS 116 20.230 0.607 16.888 1655 1HD LYS 116 HD2 LYS 116 18.665 2.105 15.731 1656 2HD LYS 116 HD3 LYS 116 18.805 1.168 14.244 1657 1HE LYS 116 HE2 LYS 116 16.749 0.574 15.265 1658 2HE LYS 116 HE3 LYS 116 17.850 -0.805 15.397 1659 1HZ LYS 116 HZ1 LYS 116 16.637 -0.399 17.467 1660 2HZ LYS 116 HZ2 LYS 116 18.231 -0.181 17.727 1661 3HZ LYS 116 HZ3 LYS 116 17.234 1.108 17.587 1662 H TRP 117 HN TRP 117 24.054 1.926 14.439 1663 HA TRP 117 HA TRP 117 23.749 4.335 12.946 1664 1HB TRP 117 HB2 TRP 117 25.295 3.957 14.932 1665 2HB TRP 117 HB3 TRP 117 26.429 3.225 13.797 1666 HD1 TRP 117 HD1 TRP 117 24.950 5.911 11.885 1667 HE1 TRP 117 HE1 TRP 117 26.262 8.123 12.027 1668 HE3 TRP 117 HE3 TRP 117 27.859 4.855 15.973 1669 HZ2 TRP 117 HZ2 TRP 117 28.126 9.322 13.804 1670 HZ3 TRP 117 HZ3 TRP 117 29.373 6.589 16.902 1671 HH2 TRP 117 HH2 TRP 117 29.516 8.836 15.837 1672 H ALA 118 HN ALA 118 25.350 1.266 12.180 1673 HA ALA 118 HA ALA 118 26.508 2.025 9.744 1674 1HB ALA 118 HB1 ALA 118 25.339 -0.656 10.644 1675 2HB ALA 118 HB2 ALA 118 26.455 -0.459 9.271 1676 3HB ALA 118 HB3 ALA 118 26.993 -0.121 10.937 1677 H PHE 119 HN PHE 119 23.184 0.771 10.335 1678 HA PHE 119 HA PHE 119 22.459 0.828 7.558 1679 1HB PHE 119 HB2 PHE 119 20.909 0.762 10.150 1680 2HB PHE 119 HB3 PHE 119 20.087 1.171 8.666 1681 HD1 PHE 119 HD1 PHE 119 18.773 -0.542 7.870 1682 HD2 PHE 119 HD2 PHE 119 22.685 -1.491 9.444 1683 HE1 PHE 119 HE1 PHE 119 18.447 -2.914 7.271 1684 HE2 PHE 119 HE2 PHE 119 22.342 -3.863 8.845 1685 HZ PHE 119 HZ PHE 119 20.226 -4.586 7.753 1686 H PHE 120 HN PHE 120 22.039 3.255 10.257 1687 HA PHE 120 HA PHE 120 20.754 4.983 8.363 1688 1HB PHE 120 HB2 PHE 120 20.336 6.513 9.956 1689 2HB PHE 120 HB3 PHE 120 20.234 4.949 10.742 1690 HD1 PHE 120 HD1 PHE 120 21.013 4.756 12.891 1691 HD2 PHE 120 HD2 PHE 120 22.553 7.894 10.352 1692 HE1 PHE 120 HE1 PHE 120 22.133 5.786 14.842 1693 HE2 PHE 120 HE2 PHE 120 23.643 8.921 12.322 1694 HZ PHE 120 HZ PHE 120 23.483 7.854 14.544 1695 H GLN 121 HN GLN 121 24.154 4.649 9.169 1696 HA GLN 121 HA GLN 121 25.049 7.093 8.004 1697 1HB GLN 121 HB2 GLN 121 26.412 5.709 9.462 1698 2HB GLN 121 HB3 GLN 121 26.342 4.349 8.334 1699 1HG GLN 121 HG2 GLN 121 27.602 5.623 6.654 1700 2HG GLN 121 HG3 GLN 121 27.614 7.043 7.715 1701 1HE2 GLN 121 HE22 GLN 121 28.426 6.340 10.139 1702 2HE2 GLN 121 HE21 GLN 121 29.935 5.464 10.117 1703 H ARG 122 HN ARG 122 24.673 3.748 6.679 1704 HA ARG 122 HA ARG 122 25.450 4.324 4.030 1705 1HB ARG 122 HB2 ARG 122 25.252 2.043 4.839 1706 2HB ARG 122 HB3 ARG 122 23.551 2.266 5.246 1707 1HG ARG 122 HG2 ARG 122 22.980 2.455 2.826 1708 2HG ARG 122 HG3 ARG 122 24.691 2.249 2.421 1709 1HD ARG 122 HD2 ARG 122 23.480 0.148 2.141 1710 2HD ARG 122 HD3 ARG 122 24.672 0.009 3.434 1711 HE ARG 122 HE ARG 122 21.756 0.539 3.951 1712 1HH1 ARG 122 HH11 ARG 122 24.637 -1.446 4.635 1713 2HH1 ARG 122 HH12 ARG 122 23.868 -2.355 5.880 1714 1HH2 ARG 122 HH21 ARG 122 20.765 -0.622 5.593 1715 2HH2 ARG 122 HH22 ARG 122 21.605 -1.868 6.454 1716 H VAL 123 HN VAL 123 22.186 4.242 5.523 1717 HA VAL 123 HA VAL 123 20.744 5.042 3.238 1718 HB VAL 123 HB VAL 123 20.190 5.306 6.217 1719 1HG1 VAL 123 HG11 VAL 123 18.805 6.963 5.117 1720 2HG1 VAL 123 HG12 VAL 123 18.342 5.817 3.864 1721 3HG1 VAL 123 HG13 VAL 123 17.782 5.584 5.542 1722 1HG2 VAL 123 HG21 VAL 123 20.363 2.959 5.179 1723 2HG2 VAL 123 HG22 VAL 123 18.817 3.325 5.926 1724 3HG2 VAL 123 HG23 VAL 123 18.993 3.387 4.170 1725 H ARG 124 HN ARG 124 22.112 7.110 5.908 1726 HA ARG 124 HA ARG 124 21.055 9.514 5.023 1727 1HB ARG 124 HB2 ARG 124 21.957 9.328 7.187 1728 2HB ARG 124 HB3 ARG 124 23.530 8.786 6.617 1729 1HG ARG 124 HG2 ARG 124 22.701 11.533 5.794 1730 2HG ARG 124 HG3 ARG 124 22.982 11.294 7.513 1731 1HD ARG 124 HD2 ARG 124 25.008 10.559 5.363 1732 2HD ARG 124 HD3 ARG 124 24.996 12.091 6.249 1733 HE ARG 124 HE ARG 124 24.972 10.293 8.285 1734 1HH1 ARG 124 HH11 ARG 124 27.122 10.652 5.465 1735 2HH1 ARG 124 HH12 ARG 124 28.517 10.063 6.284 1736 1HH2 ARG 124 HH21 ARG 124 26.828 9.573 9.392 1737 2HH2 ARG 124 HH22 ARG 124 28.353 9.459 8.572 1738 H ASP 125 HN ASP 125 24.239 8.133 4.116 1739 HA ASP 125 HA ASP 125 25.001 10.335 2.502 1740 1HB ASP 125 HB2 ASP 125 26.589 8.612 3.209 1741 2HB ASP 125 HB3 ASP 125 25.728 7.385 2.274 1742 H GLU 126 HN GLU 126 23.168 7.346 1.650 1743 HA GLU 126 HA GLU 126 23.037 7.933 -1.147 1744 1HB GLU 126 HB2 GLU 126 22.669 5.683 -0.003 1745 2HB GLU 126 HB3 GLU 126 21.104 6.273 0.528 1746 1HG GLU 126 HG2 GLU 126 20.770 4.933 -1.427 1747 2HG GLU 126 HG3 GLU 126 20.423 6.605 -1.849 1748 H ILE 127 HN ILE 127 20.707 8.488 1.542 1749 HA ILE 127 HA ILE 127 18.634 9.660 0.015 1750 HB ILE 127 HB ILE 127 19.301 9.267 2.854 1751 1HG1 ILE 127 HG12 ILE 127 16.708 9.465 1.278 1752 2HG1 ILE 127 HG13 ILE 127 17.649 7.996 1.551 1753 1HG2 ILE 127 HG21 ILE 127 19.296 11.633 3.041 1754 2HG2 ILE 127 HG22 ILE 127 17.746 11.746 2.165 1755 3HG2 ILE 127 HG23 ILE 127 17.862 11.002 3.796 1756 1HD1 ILE 127 HD11 ILE 127 17.206 8.207 4.020 1757 2HD1 ILE 127 HD12 ILE 127 16.200 9.621 3.678 1758 3HD1 ILE 127 HD13 ILE 127 15.723 8.060 3.036 1759 H GLY 128 HN GLY 128 21.401 11.259 1.691 1760 1HA GLY 128 HA2 GLY 128 20.537 13.881 1.003 1761 2HA GLY 128 HA3 GLY 128 22.202 13.392 1.446 1762 H ASN 129 HN ASN 129 22.786 11.590 -0.670 1763 HA ASN 129 HA ASN 129 23.434 13.403 -2.742 1764 1HB ASN 129 HB2 ASN 129 24.753 11.359 -2.392 1765 2HB ASN 129 HB3 ASN 129 23.348 10.354 -2.777 1766 1HD2 ASN 129 HD22 ASN 129 23.099 9.759 -4.958 1767 2HD2 ASN 129 HD21 ASN 129 23.747 10.684 -6.308 1768 H ARG 130 HN ARG 130 20.727 11.042 -2.548 1769 HA ARG 130 HA ARG 130 19.919 11.689 -5.268 1770 1HB ARG 130 HB2 ARG 130 18.273 10.378 -3.061 1771 2HB ARG 130 HB3 ARG 130 17.824 10.483 -4.764 1772 1HG ARG 130 HG2 ARG 130 20.123 8.911 -3.571 1773 2HG ARG 130 HG3 ARG 130 18.687 8.277 -4.357 1774 1HD ARG 130 HD2 ARG 130 19.454 9.062 -6.531 1775 2HD ARG 130 HD3 ARG 130 20.797 9.955 -5.790 1776 HE ARG 130 HE ARG 130 20.997 7.254 -4.986 1777 1HH1 ARG 130 HH21 ARG 130 21.652 9.360 -7.818 1778 2HH1 ARG 130 HH22 ARG 130 22.819 8.258 -8.469 1779 1HH2 ARG 130 HH11 ARG 130 22.533 6.008 -5.692 1780 2HH2 ARG 130 HH12 ARG 130 23.377 6.244 -7.211 1781 H LEU 131 HN LEU 131 18.907 13.054 -2.091 1782 HA LEU 131 HA LEU 131 16.927 14.646 -3.489 1783 1HB LEU 131 HB2 LEU 131 17.947 14.543 -0.658 1784 2HB LEU 131 HB3 LEU 131 17.179 16.021 -1.205 1785 HG LEU 131 HG LEU 131 15.559 14.597 -0.117 1786 1HD1 LEU 131 HD11 LEU 131 13.794 14.624 -1.806 1787 2HD1 LEU 131 HD12 LEU 131 14.800 16.059 -1.984 1788 3HD1 LEU 131 HD13 LEU 131 14.935 14.695 -3.115 1789 1HD2 LEU 131 HD21 LEU 131 16.530 12.383 -0.604 1790 2HD2 LEU 131 HD22 LEU 131 14.807 12.462 -0.997 1791 3HD2 LEU 131 HD23 LEU 131 16.008 12.522 -2.299 1792 H LYS 132 HN LYS 132 20.365 15.211 -2.639 1793 HA LYS 132 HA LYS 132 20.377 17.934 -3.523 1794 1HB LYS 132 HB2 LYS 132 22.090 16.761 -2.170 1795 2HB LYS 132 HB3 LYS 132 22.521 15.768 -3.578 1796 1HG LYS 132 HG2 LYS 132 23.148 17.910 -4.777 1797 2HG LYS 132 HG3 LYS 132 22.848 18.780 -3.265 1798 1HD LYS 132 HD2 LYS 132 24.855 16.544 -3.732 1799 2HD LYS 132 HD3 LYS 132 25.232 18.273 -3.524 1800 1HE LYS 132 HE2 LYS 132 24.301 18.124 -1.196 1801 2HE LYS 132 HE3 LYS 132 24.079 16.384 -1.430 1802 1HZ LYS 132 HZ1 LYS 132 26.689 17.793 -1.526 1803 2HZ LYS 132 HZ2 LYS 132 26.163 16.860 -0.299 1804 3HZ LYS 132 HZ3 LYS 132 26.481 16.188 -1.748 1805 H GLU 133 HN GLU 133 20.893 14.762 -5.238 1806 HA GLU 133 HA GLU 133 21.257 15.897 -7.793 1807 1HB GLU 133 HB2 GLU 133 20.131 13.219 -6.897 1808 2HB GLU 133 HB3 GLU 133 20.109 13.693 -8.609 1809 1HG GLU 133 HG2 GLU 133 22.430 13.895 -8.744 1810 2HG GLU 133 HG3 GLU 133 22.655 13.763 -6.989 1811 H PHE 134 HN PHE 134 18.087 15.176 -6.083 1812 HA PHE 134 HA PHE 134 16.618 15.697 -8.430 1813 1HB PHE 134 HB2 PHE 134 15.479 14.744 -6.554 1814 2HB PHE 134 HB3 PHE 134 15.942 16.077 -5.501 1815 HD1 PHE 134 HD1 PHE 134 13.903 16.905 -4.712 1816 HD2 PHE 134 HD2 PHE 134 14.384 16.309 -8.941 1817 HE1 PHE 134 HE1 PHE 134 11.760 18.086 -5.126 1818 HE2 PHE 134 HE2 PHE 134 12.196 17.383 -9.348 1819 HZ PHE 134 HZ PHE 134 10.872 18.274 -7.437 1820 H ALA 135 HN ALA 135 17.811 17.979 -5.947 1821 HA ALA 135 HA ALA 135 16.746 20.330 -7.110 1822 1HB ALA 135 HB1 ALA 135 19.253 19.968 -5.408 1823 2HB ALA 135 HB2 ALA 135 18.492 21.526 -5.805 1824 3HB ALA 135 HB3 ALA 135 17.610 20.350 -4.840 1825 H GLU 136 HN GLU 136 19.675 18.500 -7.909 1826 HA GLU 136 HA GLU 136 20.760 20.536 -9.628 1827 1HB GLU 136 HB2 GLU 136 21.479 17.628 -9.121 1828 2HB GLU 136 HB3 GLU 136 22.435 18.677 -10.148 1829 1HG GLU 136 HG2 GLU 136 21.904 19.430 -7.253 1830 2HG GLU 136 HG3 GLU 136 23.143 18.263 -7.690 1831 H THR 137 HN THR 137 19.040 17.506 -10.074 1832 HA THR 137 HA THR 137 19.429 17.504 -12.997 1833 HB THR 137 HB THR 137 18.741 15.159 -12.849 1834 HG1 THR 137 HG1 THR 137 18.500 15.571 -10.069 1835 1HG2 THR 137 HG21 THR 137 20.803 15.763 -10.688 1836 2HG2 THR 137 HG22 THR 137 20.605 14.261 -11.601 1837 3HG2 THR 137 HG23 THR 137 21.122 15.735 -12.433 1838 H GLY 138 HN GLY 138 16.952 18.266 -10.682 1839 1HA GLY 138 HA2 GLY 138 14.725 18.623 -10.811 1840 2HA GLY 138 HA3 GLY 138 14.894 18.901 -12.569 1841 H LYS 139 HN LYS 139 16.032 15.960 -11.190 1842 HA LYS 139 HA LYS 139 15.810 13.945 -11.993 1843 1HB LYS 139 HB2 LYS 139 14.396 14.340 -9.774 1844 2HB LYS 139 HB3 LYS 139 13.047 13.876 -10.786 1845 1HG LYS 139 HG2 LYS 139 13.822 11.935 -9.700 1846 2HG LYS 139 HG3 LYS 139 14.385 11.773 -11.364 1847 1HD LYS 139 HD2 LYS 139 16.266 13.122 -9.426 1848 2HD LYS 139 HD3 LYS 139 15.962 11.401 -9.131 1849 1HE LYS 139 HE2 LYS 139 16.896 10.739 -11.186 1850 2HE LYS 139 HE3 LYS 139 16.724 12.342 -11.899 1851 1HZ LYS 139 HZ1 LYS 139 19.015 11.837 -11.309 1852 2HZ LYS 139 HZ2 LYS 139 18.462 13.171 -10.543 1853 3HZ LYS 139 HZ3 LYS 139 18.630 11.742 -9.724 Start of MODEL 6 1 1H MET 1 H1 MET 1 -23.947 -10.085 -8.179 2 2H MET 1 H2 MET 1 -22.997 -11.089 -7.273 3 3H MET 1 H3 MET 1 -24.633 -11.151 -7.125 4 HA MET 1 HA MET 1 -23.656 -12.986 -8.382 5 1HB MET 1 HB2 MET 1 -26.023 -12.366 -8.733 6 2HB MET 1 HB3 MET 1 -25.550 -11.196 -9.973 7 1HG MET 1 HG2 MET 1 -26.343 -13.319 -10.941 8 2HG MET 1 HG3 MET 1 -24.670 -12.989 -11.382 9 1HE MET 1 HE1 MET 1 -26.027 -15.792 -11.840 10 2HE MET 1 HE2 MET 1 -24.326 -15.444 -12.230 11 3HE MET 1 HE3 MET 1 -24.744 -16.891 -11.286 12 H ALA 2 HN ALA 2 -21.805 -13.362 -9.308 13 HA ALA 2 HA ALA 2 -20.003 -13.364 -10.542 14 1HB ALA 2 HB1 ALA 2 -19.831 -12.375 -12.741 15 2HB ALA 2 HB2 ALA 2 -21.421 -13.138 -12.559 16 3HB ALA 2 HB3 ALA 2 -21.258 -11.367 -12.457 17 H ILE 3 HN ILE 3 -18.072 -12.109 -11.078 18 HA ILE 3 HA ILE 3 -17.752 -9.733 -9.366 19 HB ILE 3 HB ILE 3 -15.896 -11.963 -10.251 20 1HG1 ILE 3 HG12 ILE 3 -15.116 -11.757 -7.886 21 2HG1 ILE 3 HG13 ILE 3 -16.355 -10.539 -7.610 22 1HG2 ILE 3 HG21 ILE 3 -14.673 -9.918 -10.936 23 2HG2 ILE 3 HG22 ILE 3 -15.013 -9.179 -9.358 24 3HG2 ILE 3 HG23 ILE 3 -13.954 -10.605 -9.490 25 1HD1 ILE 3 HD11 ILE 3 -18.103 -12.224 -8.004 26 2HD1 ILE 3 HD12 ILE 3 -16.836 -13.450 -8.320 27 3HD1 ILE 3 HD13 ILE 3 -16.970 -12.663 -6.731 28 H VAL 4 HN VAL 4 -18.356 -8.034 -10.507 29 HA VAL 4 HA VAL 4 -18.065 -7.769 -13.386 30 HB VAL 4 HB VAL 4 -18.914 -5.800 -11.227 31 1HG1 VAL 4 HG11 VAL 4 -19.368 -5.678 -14.232 32 2HG1 VAL 4 HG12 VAL 4 -20.184 -4.648 -13.038 33 3HG1 VAL 4 HG13 VAL 4 -18.451 -4.522 -13.226 34 1HG2 VAL 4 HG21 VAL 4 -21.253 -6.381 -11.948 35 2HG2 VAL 4 HG22 VAL 4 -20.589 -7.676 -12.959 36 3HG2 VAL 4 HG23 VAL 4 -20.430 -7.733 -11.190 37 H LYS 5 HN LYS 5 -16.946 -5.725 -14.189 38 HA LYS 5 HA LYS 5 -14.648 -4.929 -12.587 39 1HB LYS 5 HB2 LYS 5 -13.789 -6.647 -14.171 40 2HB LYS 5 HB3 LYS 5 -14.391 -5.671 -15.525 41 1HG LYS 5 HG2 LYS 5 -12.878 -3.815 -14.860 42 2HG LYS 5 HG3 LYS 5 -12.354 -4.733 -13.444 43 1HD LYS 5 HD2 LYS 5 -10.666 -4.830 -15.173 44 2HD LYS 5 HD3 LYS 5 -11.342 -6.446 -14.908 45 1HE LYS 5 HE2 LYS 5 -12.738 -6.232 -16.920 46 2HE LYS 5 HE3 LYS 5 -12.225 -4.552 -17.137 47 1HZ LYS 5 HZ1 LYS 5 -10.413 -6.889 -17.305 48 2HZ LYS 5 HZ2 LYS 5 -11.006 -6.060 -18.579 49 3HZ LYS 5 HZ3 LYS 5 -9.980 -5.317 -17.543 50 H ALA 6 HN ALA 6 -14.368 -2.743 -12.666 51 HA ALA 6 HA ALA 6 -16.303 -1.183 -14.299 52 1HB ALA 6 HB1 ALA 6 -16.767 -0.795 -12.055 53 2HB ALA 6 HB2 ALA 6 -15.052 -0.666 -11.589 54 3HB ALA 6 HB3 ALA 6 -15.826 0.592 -12.560 55 H THR 7 HN THR 7 -15.363 1.158 -14.654 56 HA THR 7 HA THR 7 -12.500 1.227 -15.371 57 HB THR 7 HB THR 7 -13.048 2.150 -17.546 58 HG1 THR 7 HG1 THR 7 -15.056 2.572 -18.200 59 1HG2 THR 7 HG21 THR 7 -13.038 -0.328 -17.378 60 2HG2 THR 7 HG22 THR 7 -14.815 -0.290 -17.231 61 3HG2 THR 7 HG23 THR 7 -14.019 0.312 -18.711 62 H ASP 8 HN ASP 8 -12.396 3.570 -16.432 63 HA ASP 8 HA ASP 8 -12.310 5.632 -14.569 64 1HB ASP 8 HB2 ASP 8 -11.186 5.717 -16.682 65 2HB ASP 8 HB3 ASP 8 -12.704 5.596 -17.570 66 H GLN 9 HN GLN 9 -15.173 4.516 -16.357 67 HA GLN 9 HA GLN 9 -16.825 6.539 -14.981 68 1HB GLN 9 HB2 GLN 9 -16.816 5.876 -17.935 69 2HB GLN 9 HB3 GLN 9 -18.131 6.766 -17.139 70 1HG GLN 9 HG2 GLN 9 -16.762 8.647 -16.642 71 2HG GLN 9 HG3 GLN 9 -15.278 7.773 -16.963 72 1HE2 GLN 9 HE22 GLN 9 -14.276 8.423 -18.767 73 2HE2 GLN 9 HE21 GLN 9 -15.074 8.923 -20.258 74 H SER 10 HN SER 10 -16.568 3.290 -16.432 75 HA SER 10 HA SER 10 -19.259 2.543 -15.942 76 1HB SER 10 HB2 SER 10 -16.899 0.691 -15.547 77 2HB SER 10 HB3 SER 10 -18.576 0.263 -15.897 78 HG SER 10 HG SER 10 -16.628 1.467 -17.541 79 H PHE 11 HN PHE 11 -16.497 3.031 -13.635 80 HA PHE 11 HA PHE 11 -18.159 2.128 -11.415 81 1HB PHE 11 HB2 PHE 11 -15.671 2.194 -11.185 82 2HB PHE 11 HB3 PHE 11 -15.759 3.946 -11.352 83 HD1 PHE 11 HD1 PHE 11 -16.095 1.084 -9.047 84 HD2 PHE 11 HD2 PHE 11 -17.038 5.287 -9.605 85 HE1 PHE 11 HE1 PHE 11 -16.328 1.418 -6.603 86 HE2 PHE 11 HE2 PHE 11 -17.362 5.531 -7.166 87 HZ PHE 11 HZ PHE 11 -16.968 3.601 -5.657 88 H SER 12 HN SER 12 -19.629 3.290 -10.675 89 HA SER 12 HA SER 12 -20.814 5.230 -9.958 90 1HB SER 12 HB2 SER 12 -20.234 6.348 -12.760 91 2HB SER 12 HB3 SER 12 -21.335 7.052 -11.572 92 HG SER 12 HG SER 12 -18.542 6.719 -11.436 93 H ALA 13 HN ALA 13 -20.829 4.282 -13.445 94 HA ALA 13 HA ALA 13 -23.633 4.196 -13.573 95 1HB ALA 13 HB1 ALA 13 -21.555 2.747 -15.281 96 2HB ALA 13 HB2 ALA 13 -23.253 3.008 -15.734 97 3HB ALA 13 HB3 ALA 13 -22.160 4.398 -15.555 98 H GLU 14 HN GLU 14 -21.195 1.696 -12.977 99 HA GLU 14 HA GLU 14 -23.032 -0.476 -12.727 100 1HB GLU 14 HB2 GLU 14 -20.073 -0.180 -12.093 101 2HB GLU 14 HB3 GLU 14 -20.928 -1.701 -11.943 102 1HG GLU 14 HG2 GLU 14 -20.726 -0.086 -14.513 103 2HG GLU 14 HG3 GLU 14 -19.696 -1.457 -14.095 104 H THR 15 HN THR 15 -22.178 2.060 -10.517 105 HA THR 15 HA THR 15 -22.581 0.289 -8.167 106 HB THR 15 HB THR 15 -21.021 1.790 -7.048 107 HG1 THR 15 HG1 THR 15 -20.238 3.550 -8.043 108 1HG2 THR 15 HG21 THR 15 -18.990 1.233 -8.170 109 2HG2 THR 15 HG22 THR 15 -20.097 -0.099 -8.548 110 3HG2 THR 15 HG23 THR 15 -19.768 1.167 -9.758 111 H SER 16 HN SER 16 -24.197 2.798 -9.795 112 HA SER 16 HA SER 16 -24.983 4.307 -7.461 113 1HB SER 16 HB2 SER 16 -26.001 4.315 -10.330 114 2HB SER 16 HB3 SER 16 -26.479 5.480 -9.082 115 HG SER 16 HG SER 16 -23.878 5.029 -10.127 116 H GLU 17 HN GLU 17 -25.988 1.230 -8.270 117 HA GLU 17 HA GLU 17 -28.577 1.623 -6.954 118 1HB GLU 17 HB2 GLU 17 -28.183 0.194 -9.622 119 2HB GLU 17 HB3 GLU 17 -29.631 0.043 -8.618 120 1HG GLU 17 HG2 GLU 17 -29.994 2.513 -8.813 121 2HG GLU 17 HG3 GLU 17 -28.618 2.606 -9.917 122 H GLY 18 HN GLY 18 -29.282 -0.203 -5.784 123 1HA GLY 18 HA2 GLY 18 -29.101 -2.124 -4.579 124 2HA GLY 18 HA3 GLY 18 -27.917 -2.743 -5.741 125 H VAL 19 HN VAL 19 -27.142 -3.518 -3.532 126 HA VAL 19 HA VAL 19 -25.205 -1.555 -2.401 127 HB VAL 19 HB VAL 19 -26.032 -4.217 -1.129 128 1HG1 VAL 19 HG11 VAL 19 -23.724 -3.515 -0.624 129 2HG1 VAL 19 HG12 VAL 19 -24.295 -1.880 -0.229 130 3HG1 VAL 19 HG13 VAL 19 -24.758 -3.266 0.780 131 1HG2 VAL 19 HG21 VAL 19 -27.929 -2.780 -1.002 132 2HG2 VAL 19 HG22 VAL 19 -27.111 -2.667 0.554 133 3HG2 VAL 19 HG23 VAL 19 -26.930 -1.372 -0.632 134 H VAL 20 HN VAL 20 -23.155 -1.703 -2.901 135 HA VAL 20 HA VAL 20 -22.324 -3.916 -4.685 136 HB VAL 20 HB VAL 20 -21.935 -0.950 -5.274 137 1HG1 VAL 20 HG11 VAL 20 -21.384 -3.502 -6.854 138 2HG1 VAL 20 HG12 VAL 20 -21.253 -1.868 -7.520 139 3HG1 VAL 20 HG13 VAL 20 -20.190 -2.369 -6.197 140 1HG2 VAL 20 HG21 VAL 20 -23.552 -1.383 -7.190 141 2HG2 VAL 20 HG22 VAL 20 -24.024 -2.875 -6.369 142 3HG2 VAL 20 HG23 VAL 20 -24.281 -1.304 -5.590 143 H LEU 21 HN LEU 21 -20.573 -4.733 -3.985 144 HA LEU 21 HA LEU 21 -18.621 -3.314 -2.252 145 1HB LEU 21 HB2 LEU 21 -19.456 -5.656 -1.794 146 2HB LEU 21 HB3 LEU 21 -18.759 -6.179 -3.308 147 HG LEU 21 HG LEU 21 -17.457 -6.856 -1.384 148 1HD1 LEU 21 HD11 LEU 21 -15.254 -6.230 -2.039 149 2HD1 LEU 21 HD12 LEU 21 -16.232 -6.372 -3.504 150 3HD1 LEU 21 HD13 LEU 21 -15.815 -4.771 -2.857 151 1HD2 LEU 21 HD21 LEU 21 -18.074 -4.895 0.080 152 2HD2 LEU 21 HD22 LEU 21 -16.371 -5.349 0.128 153 3HD2 LEU 21 HD23 LEU 21 -16.873 -3.930 -0.812 154 H ALA 22 HN ALA 22 -17.240 -1.945 -3.493 155 HA ALA 22 HA ALA 22 -16.291 -3.073 -6.065 156 1HB ALA 22 HB1 ALA 22 -17.190 -0.707 -6.099 157 2HB ALA 22 HB2 ALA 22 -15.762 -0.255 -5.096 158 3HB ALA 22 HB3 ALA 22 -15.562 -0.933 -6.728 159 H ASP 23 HN ASP 23 -14.146 -3.492 -6.303 160 HA ASP 23 HA ASP 23 -12.346 -3.286 -3.951 161 1HB ASP 23 HB2 ASP 23 -13.220 -5.519 -3.921 162 2HB ASP 23 HB3 ASP 23 -13.055 -5.679 -5.668 163 H PHE 24 HN PHE 24 -10.100 -3.329 -4.526 164 HA PHE 24 HA PHE 24 -9.501 -2.416 -7.308 165 1HB PHE 24 HB2 PHE 24 -8.854 -1.158 -4.630 166 2HB PHE 24 HB3 PHE 24 -8.025 -0.728 -6.104 167 HD1 PHE 24 HD1 PHE 24 -8.850 1.025 -7.423 168 HD2 PHE 24 HD2 PHE 24 -11.544 -0.903 -4.675 169 HE1 PHE 24 HE1 PHE 24 -10.674 2.589 -8.084 170 HE2 PHE 24 HE2 PHE 24 -13.354 0.613 -5.375 171 HZ PHE 24 HZ PHE 24 -12.924 2.378 -7.072 172 H TRP 25 HN TRP 25 -8.006 -3.744 -8.108 173 HA TRP 25 HA TRP 25 -6.126 -5.212 -6.342 174 1HB TRP 25 HB2 TRP 25 -6.726 -7.257 -7.136 175 2HB TRP 25 HB3 TRP 25 -8.291 -6.480 -6.968 176 HD1 TRP 25 HD1 TRP 25 -9.087 -5.260 -9.455 177 HE1 TRP 25 HE1 TRP 25 -8.915 -6.128 -11.824 178 HE3 TRP 25 HE3 TRP 25 -5.646 -8.957 -8.656 179 HZ2 TRP 25 HZ2 TRP 25 -7.194 -8.020 -13.287 180 HZ3 TRP 25 HZ3 TRP 25 -4.695 -10.218 -10.561 181 HH2 TRP 25 HH2 TRP 25 -5.464 -9.753 -12.880 182 H ALA 26 HN ALA 26 -4.129 -5.827 -7.582 183 HA ALA 26 HA ALA 26 -4.023 -5.661 -10.412 184 1HB ALA 26 HB1 ALA 26 -2.773 -3.390 -8.845 185 2HB ALA 26 HB2 ALA 26 -2.196 -3.812 -10.467 186 3HB ALA 26 HB3 ALA 26 -3.850 -3.266 -10.254 187 HA PRO 27 HA PRO 27 -0.724 -8.391 -9.733 188 1HB PRO 27 HB2 PRO 27 1.075 -6.748 -11.516 189 2HB PRO 27 HB3 PRO 27 0.775 -8.516 -11.538 190 1HG PRO 27 HG2 PRO 27 -0.476 -6.895 -13.320 191 2HG PRO 27 HG3 PRO 27 -1.406 -8.202 -12.504 192 1HD PRO 27 HD2 PRO 27 -1.320 -5.266 -11.868 193 2HD PRO 27 HD3 PRO 27 -2.719 -6.378 -11.931 194 H TRP 28 HN TRP 28 -0.001 -5.068 -8.860 195 HA TRP 28 HA TRP 28 2.658 -5.200 -8.060 196 1HB TRP 28 HB2 TRP 28 0.574 -3.592 -6.619 197 2HB TRP 28 HB3 TRP 28 2.269 -3.215 -6.868 198 HD1 TRP 28 HD1 TRP 28 -1.025 -2.501 -8.123 199 HE1 TRP 28 HE1 TRP 28 -1.039 -1.192 -10.337 200 HE3 TRP 28 HE3 TRP 28 3.856 -3.192 -9.394 201 HZ2 TRP 28 HZ2 TRP 28 0.882 -0.609 -12.440 202 HZ3 TRP 28 HZ3 TRP 28 4.750 -2.263 -11.514 203 HH2 TRP 28 HH2 TRP 28 3.273 -0.972 -13.042 204 H CYS 29 HN CYS 29 -0.085 -6.629 -6.292 205 HA CYS 29 HA CYS 29 1.781 -7.133 -4.032 206 1HB CYS 29 HB2 CYS 29 -0.234 -5.190 -4.029 207 2HB CYS 29 HB3 CYS 29 -1.012 -6.540 -3.254 208 H GLY 30 HN GLY 30 1.130 -8.775 -2.544 209 1HA GLY 30 HA2 GLY 30 0.217 -11.191 -3.736 210 2HA GLY 30 HA3 GLY 30 0.476 -10.884 -2.014 211 HA PRO 31 HA PRO 31 -3.852 -10.359 -1.033 212 1HB PRO 31 HB2 PRO 31 -3.755 -7.369 -1.478 213 2HB PRO 31 HB3 PRO 31 -4.646 -8.286 -0.209 214 1HG PRO 31 HG2 PRO 31 -2.238 -7.191 0.391 215 2HG PRO 31 HG3 PRO 31 -2.579 -8.879 0.894 216 1HD PRO 31 HD2 PRO 31 -0.958 -7.898 -1.442 217 2HD PRO 31 HD3 PRO 31 -0.633 -9.272 -0.349 218 H SER 32 HN SER 32 -3.011 -8.457 -4.012 219 HA SER 32 HA SER 32 -5.590 -8.422 -5.108 220 1HB SER 32 HB2 SER 32 -3.013 -8.909 -6.657 221 2HB SER 32 HB3 SER 32 -4.413 -7.943 -7.151 222 HG SER 32 HG SER 32 -2.553 -6.763 -6.429 223 H LYS 33 HN LYS 33 -3.434 -11.134 -4.720 224 HA LYS 33 HA LYS 33 -5.182 -12.788 -6.462 225 1HB LYS 33 HB2 LYS 33 -2.515 -13.658 -5.350 226 2HB LYS 33 HB3 LYS 33 -3.528 -14.414 -6.580 227 1HG LYS 33 HG2 LYS 33 -1.935 -13.484 -7.916 228 2HG LYS 33 HG3 LYS 33 -3.149 -12.199 -7.947 229 1HD LYS 33 HD2 LYS 33 -1.863 -10.981 -6.192 230 2HD LYS 33 HD3 LYS 33 -0.700 -12.310 -6.117 231 1HE LYS 33 HE2 LYS 33 -0.176 -11.904 -8.562 232 2HE LYS 33 HE3 LYS 33 -1.251 -10.499 -8.508 233 1HZ LYS 33 HZ1 LYS 33 0.979 -9.735 -8.115 234 2HZ LYS 33 HZ2 LYS 33 0.192 -9.649 -6.684 235 3HZ LYS 33 HZ3 LYS 33 1.253 -10.871 -6.968 236 H MET 34 HN MET 34 -5.357 -11.841 -3.384 237 HA MET 34 HA MET 34 -6.216 -14.529 -2.373 238 1HB MET 34 HB2 MET 34 -5.129 -12.215 -0.731 239 2HB MET 34 HB3 MET 34 -5.735 -13.758 -0.120 240 1HG MET 34 HG2 MET 34 -3.953 -14.912 -1.492 241 2HG MET 34 HG3 MET 34 -3.261 -13.326 -1.831 242 1HE MET 34 HE1 MET 34 -2.031 -12.167 1.736 243 2HE MET 34 HE2 MET 34 -2.137 -11.758 0.012 244 3HE MET 34 HE3 MET 34 -3.607 -11.783 1.021 245 H ILE 35 HN ILE 35 -6.805 -10.956 -2.242 246 HA ILE 35 HA ILE 35 -9.453 -11.151 -1.281 247 HB ILE 35 HB ILE 35 -7.743 -9.120 -1.626 248 1HG1 ILE 35 HG12 ILE 35 -9.877 -7.571 -1.516 249 2HG1 ILE 35 HG13 ILE 35 -10.757 -9.101 -1.408 250 1HG2 ILE 35 HG21 ILE 35 -9.557 -8.718 -4.015 251 2HG2 ILE 35 HG22 ILE 35 -8.376 -7.579 -3.352 252 3HG2 ILE 35 HG23 ILE 35 -7.807 -9.089 -4.074 253 1HD1 ILE 35 HD11 ILE 35 -10.150 -8.156 0.827 254 2HD1 ILE 35 HD12 ILE 35 -9.380 -9.737 0.564 255 3HD1 ILE 35 HD13 ILE 35 -8.433 -8.241 0.391 256 H ALA 36 HN ALA 36 -8.016 -11.480 -4.527 257 HA ALA 36 HA ALA 36 -10.372 -11.426 -6.051 258 1HB ALA 36 HB1 ALA 36 -7.695 -12.802 -6.532 259 2HB ALA 36 HB2 ALA 36 -9.042 -12.871 -7.690 260 3HB ALA 36 HB3 ALA 36 -8.334 -11.315 -7.242 261 HA PRO 37 HA PRO 37 -11.029 -16.148 -5.529 262 1HB PRO 37 HB2 PRO 37 -9.743 -17.187 -3.183 263 2HB PRO 37 HB3 PRO 37 -9.401 -17.592 -4.899 264 1HG PRO 37 HG2 PRO 37 -7.981 -15.763 -3.042 265 2HG PRO 37 HG3 PRO 37 -7.333 -16.613 -4.472 266 1HD PRO 37 HD2 PRO 37 -7.869 -13.904 -4.449 267 2HD PRO 37 HD3 PRO 37 -7.972 -14.914 -5.908 268 H VAL 38 HN VAL 38 -10.336 -14.253 -2.529 269 HA VAL 38 HA VAL 38 -12.442 -15.267 -0.974 270 HB VAL 38 HB VAL 38 -10.781 -12.777 -1.052 271 1HG1 VAL 38 HG11 VAL 38 -13.261 -12.977 0.642 272 2HG1 VAL 38 HG12 VAL 38 -11.863 -11.944 1.062 273 3HG1 VAL 38 HG13 VAL 38 -12.758 -11.673 -0.441 274 1HG2 VAL 38 HG21 VAL 38 -9.993 -14.932 -0.093 275 2HG2 VAL 38 HG22 VAL 38 -10.015 -13.606 1.090 276 3HG2 VAL 38 HG23 VAL 38 -11.295 -14.844 1.112 277 H LEU 39 HN LEU 39 -12.482 -12.630 -3.420 278 HA LEU 39 HA LEU 39 -15.221 -11.967 -2.819 279 1HB LEU 39 HB2 LEU 39 -13.436 -11.378 -5.209 280 2HB LEU 39 HB3 LEU 39 -15.120 -10.878 -5.154 281 HG LEU 39 HG LEU 39 -13.001 -10.087 -3.091 282 1HD1 LEU 39 HD11 LEU 39 -14.232 -8.406 -5.312 283 2HD1 LEU 39 HD12 LEU 39 -13.031 -7.898 -4.104 284 3HD1 LEU 39 HD13 LEU 39 -12.597 -9.101 -5.319 285 1HD2 LEU 39 HD21 LEU 39 -15.862 -9.099 -3.391 286 2HD2 LEU 39 HD22 LEU 39 -15.185 -10.013 -2.025 287 3HD2 LEU 39 HD23 LEU 39 -14.616 -8.387 -2.344 288 H GLU 40 HN GLU 40 -13.722 -14.172 -5.267 289 HA GLU 40 HA GLU 40 -16.223 -14.712 -6.528 290 1HB GLU 40 HB2 GLU 40 -13.719 -16.417 -6.413 291 2HB GLU 40 HB3 GLU 40 -15.131 -16.658 -7.475 292 1HG GLU 40 HG2 GLU 40 -14.747 -14.472 -8.529 293 2HG GLU 40 HG3 GLU 40 -13.331 -14.207 -7.519 294 H GLU 41 HN GLU 41 -14.537 -16.140 -3.707 295 HA GLU 41 HA GLU 41 -16.424 -18.211 -3.181 296 1HB GLU 41 HB2 GLU 41 -14.310 -16.814 -1.523 297 2HB GLU 41 HB3 GLU 41 -15.325 -18.077 -0.854 298 1HG GLU 41 HG2 GLU 41 -13.532 -18.411 -3.297 299 2HG GLU 41 HG3 GLU 41 -13.105 -18.890 -1.656 300 H LEU 42 HN LEU 42 -16.412 -14.787 -2.483 301 HA LEU 42 HA LEU 42 -18.551 -14.925 -0.486 302 1HB LEU 42 HB2 LEU 42 -16.771 -13.118 -0.552 303 2HB LEU 42 HB3 LEU 42 -17.325 -12.654 -2.150 304 HG LEU 42 HG LEU 42 -19.546 -11.991 -1.181 305 1HD1 LEU 42 HD11 LEU 42 -19.500 -13.325 0.891 306 2HD1 LEU 42 HD12 LEU 42 -18.006 -12.504 1.401 307 3HD1 LEU 42 HD13 LEU 42 -19.530 -11.597 1.285 308 1HD2 LEU 42 HD21 LEU 42 -17.067 -10.646 -0.016 309 2HD2 LEU 42 HD22 LEU 42 -17.740 -10.340 -1.628 310 3HD2 LEU 42 HD23 LEU 42 -18.677 -9.905 -0.190 311 H ASP 43 HN ASP 43 -18.259 -14.126 -3.977 312 HA ASP 43 HA ASP 43 -20.982 -13.315 -4.119 313 1HB ASP 43 HB2 ASP 43 -19.227 -12.639 -5.812 314 2HB ASP 43 HB3 ASP 43 -19.104 -14.309 -6.332 315 H GLN 44 HN GLN 44 -19.356 -16.413 -4.769 316 HA GLN 44 HA GLN 44 -21.735 -17.669 -5.708 317 1HB GLN 44 HB2 GLN 44 -20.528 -19.688 -5.693 318 2HB GLN 44 HB3 GLN 44 -19.402 -18.399 -6.129 319 1HG GLN 44 HG2 GLN 44 -18.633 -18.400 -3.700 320 2HG GLN 44 HG3 GLN 44 -19.617 -19.842 -3.447 321 1HE2 GLN 44 HE22 GLN 44 -16.994 -18.510 -5.511 322 2HE2 GLN 44 HE21 GLN 44 -16.174 -20.047 -5.773 323 H GLU 45 HN GLU 45 -21.030 -16.563 -2.510 324 HA GLU 45 HA GLU 45 -22.774 -18.554 -1.345 325 1HB GLU 45 HB2 GLU 45 -20.961 -18.619 -0.036 326 2HB GLU 45 HB3 GLU 45 -20.485 -16.947 -0.365 327 1HG GLU 45 HG2 GLU 45 -21.985 -16.032 1.108 328 2HG GLU 45 HG3 GLU 45 -22.953 -17.515 1.268 329 H MET 46 HN MET 46 -22.338 -15.022 -1.586 330 HA MET 46 HA MET 46 -25.215 -14.706 -0.863 331 1HB MET 46 HB2 MET 46 -24.523 -12.739 0.442 332 2HB MET 46 HB3 MET 46 -24.013 -14.293 1.097 333 1HG MET 46 HG2 MET 46 -21.743 -13.953 0.289 334 2HG MET 46 HG3 MET 46 -22.193 -12.472 -0.548 335 1HE MET 46 HE1 MET 46 -22.732 -9.915 2.205 336 2HE MET 46 HE2 MET 46 -22.632 -10.340 0.478 337 3HE MET 46 HE3 MET 46 -24.057 -10.862 1.411 338 H GLY 47 HN GLY 47 -23.467 -14.501 -3.478 339 1HA GLY 47 HA2 GLY 47 -23.812 -11.775 -4.321 340 2HA GLY 47 HA3 GLY 47 -23.545 -13.210 -5.361 341 H ASP 48 HN ASP 48 -26.122 -13.976 -3.579 342 HA ASP 48 HA ASP 48 -28.117 -13.352 -5.562 343 1HB ASP 48 HB2 ASP 48 -28.280 -15.407 -4.224 344 2HB ASP 48 HB3 ASP 48 -28.321 -14.460 -2.737 345 H LYS 49 HN LYS 49 -26.832 -11.808 -2.692 346 HA LYS 49 HA LYS 49 -29.021 -9.857 -2.721 347 1HB LYS 49 HB2 LYS 49 -26.989 -10.103 -0.510 348 2HB LYS 49 HB3 LYS 49 -28.630 -9.475 -0.459 349 1HG LYS 49 HG2 LYS 49 -29.026 -11.406 0.617 350 2HG LYS 49 HG3 LYS 49 -29.212 -12.060 -1.025 351 1HD LYS 49 HD2 LYS 49 -27.154 -13.186 -0.950 352 2HD LYS 49 HD3 LYS 49 -26.471 -12.015 0.194 353 1HE LYS 49 HE2 LYS 49 -26.681 -14.023 1.383 354 2HE LYS 49 HE3 LYS 49 -27.836 -12.856 2.010 355 1HZ LYS 49 HZ1 LYS 49 -28.514 -15.110 0.187 356 2HZ LYS 49 HZ2 LYS 49 -28.851 -15.036 1.777 357 3HZ LYS 49 HZ3 LYS 49 -29.590 -14.011 0.753 358 H LEU 50 HN LEU 50 -25.621 -10.278 -3.321 359 HA LEU 50 HA LEU 50 -25.098 -7.383 -3.102 360 1HB LEU 50 HB2 LEU 50 -24.077 -8.773 -1.340 361 2HB LEU 50 HB3 LEU 50 -23.357 -9.816 -2.566 362 HG LEU 50 HG LEU 50 -21.928 -7.967 -3.334 363 1HD1 LEU 50 HD11 LEU 50 -21.762 -5.882 -2.026 364 2HD1 LEU 50 HD12 LEU 50 -23.363 -6.039 -2.712 365 3HD1 LEU 50 HD13 LEU 50 -23.125 -6.401 -1.000 366 1HD2 LEU 50 HD21 LEU 50 -20.419 -7.945 -1.436 367 2HD2 LEU 50 HD22 LEU 50 -21.740 -8.422 -0.344 368 3HD2 LEU 50 HD23 LEU 50 -21.157 -9.545 -1.592 369 H LYS 51 HN LYS 51 -23.762 -6.425 -4.606 370 HA LYS 51 HA LYS 51 -23.019 -7.997 -7.044 371 1HB LYS 51 HB2 LYS 51 -24.591 -6.130 -7.467 372 2HB LYS 51 HB3 LYS 51 -23.492 -5.013 -6.650 373 1HG LYS 51 HG2 LYS 51 -21.772 -5.359 -8.398 374 2HG LYS 51 HG3 LYS 51 -22.808 -6.585 -9.174 375 1HD LYS 51 HD2 LYS 51 -24.582 -4.798 -9.439 376 2HD LYS 51 HD3 LYS 51 -23.406 -3.616 -8.820 377 1HE LYS 51 HE2 LYS 51 -21.867 -4.186 -10.693 378 2HE LYS 51 HE3 LYS 51 -23.042 -5.365 -11.299 379 1HZ LYS 51 HZ1 LYS 51 -24.603 -3.551 -11.646 380 2HZ LYS 51 HZ2 LYS 51 -23.530 -2.464 -11.020 381 3HZ LYS 51 HZ3 LYS 51 -23.200 -3.228 -12.441 382 H ILE 52 HN ILE 52 -20.782 -7.864 -7.647 383 HA ILE 52 HA ILE 52 -19.016 -6.381 -5.803 384 HB ILE 52 HB ILE 52 -18.827 -9.269 -6.716 385 1HG1 ILE 52 HG12 ILE 52 -18.302 -8.339 -3.883 386 2HG1 ILE 52 HG13 ILE 52 -19.971 -8.359 -4.421 387 1HG2 ILE 52 HG21 ILE 52 -16.625 -8.275 -7.084 388 2HG2 ILE 52 HG22 ILE 52 -16.657 -7.518 -5.478 389 3HG2 ILE 52 HG23 ILE 52 -16.575 -9.284 -5.637 390 1HD1 ILE 52 HD11 ILE 52 -19.856 -10.705 -4.983 391 2HD1 ILE 52 HD12 ILE 52 -18.134 -10.774 -4.508 392 3HD1 ILE 52 HD13 ILE 52 -19.399 -10.448 -3.301 393 H VAL 53 HN VAL 53 -17.432 -5.291 -6.897 394 HA VAL 53 HA VAL 53 -17.084 -5.696 -9.803 395 HB VAL 53 HB VAL 53 -18.477 -3.915 -9.987 396 1HG1 VAL 53 HG11 VAL 53 -19.318 -3.757 -7.874 397 2HG1 VAL 53 HG12 VAL 53 -17.911 -2.818 -7.306 398 3HG1 VAL 53 HG13 VAL 53 -19.004 -2.154 -8.531 399 1HG2 VAL 53 HG21 VAL 53 -16.047 -2.296 -9.252 400 2HG2 VAL 53 HG22 VAL 53 -16.359 -3.057 -10.837 401 3HG2 VAL 53 HG23 VAL 53 -17.440 -1.794 -10.230 402 H LYS 54 HN LYS 54 -14.938 -5.449 -10.450 403 HA LYS 54 HA LYS 54 -13.012 -4.607 -8.333 404 1HB LYS 54 HB2 LYS 54 -12.660 -6.536 -10.647 405 2HB LYS 54 HB3 LYS 54 -11.329 -5.899 -9.673 406 1HG LYS 54 HG2 LYS 54 -12.401 -6.827 -7.607 407 2HG LYS 54 HG3 LYS 54 -13.682 -7.504 -8.604 408 1HD LYS 54 HD2 LYS 54 -12.253 -9.328 -8.296 409 2HD LYS 54 HD3 LYS 54 -11.826 -8.739 -9.897 410 1HE LYS 54 HE2 LYS 54 -9.706 -9.021 -9.026 411 2HE LYS 54 HE3 LYS 54 -9.971 -7.341 -8.546 412 1HZ LYS 54 HZ1 LYS 54 -10.572 -9.573 -6.734 413 2HZ LYS 54 HZ2 LYS 54 -9.117 -8.804 -6.782 414 3HZ LYS 54 HZ3 LYS 54 -10.453 -7.959 -6.387 415 H ILE 55 HN ILE 55 -11.178 -3.332 -9.043 416 HA ILE 55 HA ILE 55 -11.372 -2.031 -11.694 417 HB ILE 55 HB ILE 55 -10.888 -0.874 -8.909 418 1HG1 ILE 55 HG12 ILE 55 -13.169 -0.716 -10.080 419 2HG1 ILE 55 HG13 ILE 55 -12.474 0.742 -9.391 420 1HG2 ILE 55 HG21 ILE 55 -9.950 1.182 -10.002 421 2HG2 ILE 55 HG22 ILE 55 -8.915 -0.248 -10.034 422 3HG2 ILE 55 HG23 ILE 55 -9.772 0.228 -11.499 423 1HD1 ILE 55 HD11 ILE 55 -11.747 1.532 -11.583 424 2HD1 ILE 55 HD12 ILE 55 -12.339 0.045 -12.343 425 3HD1 ILE 55 HD13 ILE 55 -13.474 1.194 -11.586 426 H ASP 56 HN ASP 56 -9.565 -2.665 -12.797 427 HA ASP 56 HA ASP 56 -7.287 -3.947 -11.456 428 1HB ASP 56 HB2 ASP 56 -8.043 -4.721 -13.668 429 2HB ASP 56 HB3 ASP 56 -7.699 -3.134 -14.357 430 H VAL 57 HN VAL 57 -6.117 -2.483 -10.226 431 HA VAL 57 HA VAL 57 -5.893 0.234 -11.064 432 HB VAL 57 HB VAL 57 -4.707 0.701 -9.076 433 1HG1 VAL 57 HG11 VAL 57 -7.214 -0.934 -8.594 434 2HG1 VAL 57 HG12 VAL 57 -6.555 0.346 -7.547 435 3HG1 VAL 57 HG13 VAL 57 -7.134 0.756 -9.168 436 1HG2 VAL 57 HG21 VAL 57 -3.487 -1.310 -8.566 437 2HG2 VAL 57 HG22 VAL 57 -4.584 -0.943 -7.221 438 3HG2 VAL 57 HG23 VAL 57 -5.000 -2.226 -8.351 439 H ASP 58 HN ASP 58 -4.907 -1.019 -13.071 440 HA ASP 58 HA ASP 58 -2.457 0.516 -13.338 441 1HB ASP 58 HB2 ASP 58 -1.389 -1.606 -12.789 442 2HB ASP 58 HB3 ASP 58 -2.485 -2.498 -13.845 443 H GLU 59 HN GLU 59 -4.781 -1.854 -14.865 444 HA GLU 59 HA GLU 59 -4.587 -0.572 -17.471 445 1HB GLU 59 HB2 GLU 59 -5.032 -2.775 -17.768 446 2HB GLU 59 HB3 GLU 59 -5.843 -2.957 -16.217 447 1HG GLU 59 HG2 GLU 59 -7.825 -1.902 -17.025 448 2HG GLU 59 HG3 GLU 59 -7.111 -1.688 -18.641 449 H ASN 60 HN ASN 60 -6.742 -0.412 -14.671 450 HA ASN 60 HA ASN 60 -8.356 1.720 -15.959 451 1HB ASN 60 HB2 ASN 60 -9.215 -0.997 -15.014 452 2HB ASN 60 HB3 ASN 60 -10.259 0.316 -14.527 453 1HD2 ASN 60 HD22 ASN 60 -9.923 -1.896 -16.995 454 2HD2 ASN 60 HD21 ASN 60 -10.725 -0.984 -18.247 455 H GLN 61 HN GLN 61 -6.201 1.944 -14.148 456 HA GLN 61 HA GLN 61 -7.170 2.094 -11.500 457 1HB GLN 61 HB2 GLN 61 -4.995 2.731 -10.862 458 2HB GLN 61 HB3 GLN 61 -4.802 1.699 -12.277 459 1HG GLN 61 HG2 GLN 61 -4.488 3.709 -13.702 460 2HG GLN 61 HG3 GLN 61 -4.488 4.682 -12.226 461 1HE2 GLN 61 HE22 GLN 61 -2.888 3.530 -10.388 462 2HE2 GLN 61 HE21 GLN 61 -1.304 3.214 -11.028 463 H GLU 62 HN GLU 62 -7.761 4.156 -14.029 464 HA GLU 62 HA GLU 62 -7.331 6.781 -13.207 465 1HB GLU 62 HB2 GLU 62 -9.358 5.355 -14.963 466 2HB GLU 62 HB3 GLU 62 -9.414 7.124 -14.761 467 1HG GLU 62 HG2 GLU 62 -7.056 7.283 -15.530 468 2HG GLU 62 HG3 GLU 62 -7.003 5.534 -15.747 469 H THR 63 HN THR 63 -10.290 4.762 -12.655 470 HA THR 63 HA THR 63 -11.675 6.653 -11.076 471 HB THR 63 HB THR 63 -11.694 3.649 -11.351 472 HG1 THR 63 HG1 THR 63 -13.456 4.171 -12.627 473 1HG2 THR 63 HG21 THR 63 -13.757 3.443 -10.159 474 2HG2 THR 63 HG22 THR 63 -12.606 4.148 -9.046 475 3HG2 THR 63 HG23 THR 63 -13.823 5.195 -9.814 476 H ALA 64 HN ALA 64 -9.014 4.475 -10.217 477 HA ALA 64 HA ALA 64 -9.591 4.477 -7.388 478 1HB ALA 64 HB1 ALA 64 -6.941 3.858 -8.765 479 2HB ALA 64 HB2 ALA 64 -7.521 3.274 -7.194 480 3HB ALA 64 HB3 ALA 64 -8.286 2.726 -8.697 481 H GLY 65 HN GLY 65 -6.789 5.855 -9.129 482 1HA GLY 65 HA2 GLY 65 -5.951 7.866 -7.487 483 2HA GLY 65 HA3 GLY 65 -6.046 8.054 -9.251 484 H LYS 66 HN LYS 66 -8.805 8.198 -9.704 485 HA LYS 66 HA LYS 66 -9.386 10.895 -9.140 486 1HB LYS 66 HB2 LYS 66 -10.233 9.588 -11.029 487 2HB LYS 66 HB3 LYS 66 -11.216 8.599 -9.940 488 1HG LYS 66 HG2 LYS 66 -12.506 10.681 -9.325 489 2HG LYS 66 HG3 LYS 66 -11.584 11.551 -10.561 490 1HD LYS 66 HD2 LYS 66 -13.454 9.171 -10.977 491 2HD LYS 66 HD3 LYS 66 -13.755 10.850 -11.446 492 1HE LYS 66 HE2 LYS 66 -11.802 10.730 -13.019 493 2HE LYS 66 HE3 LYS 66 -11.574 9.033 -12.580 494 1HZ LYS 66 HZ1 LYS 66 -12.774 9.165 -14.589 495 2HZ LYS 66 HZ2 LYS 66 -13.790 8.567 -13.496 496 3HZ LYS 66 HZ3 LYS 66 -13.941 10.145 -13.958 497 H TYR 67 HN TYR 67 -10.530 7.897 -7.478 498 HA TYR 67 HA TYR 67 -12.183 9.469 -5.701 499 1HB TYR 67 HB2 TYR 67 -11.824 6.543 -6.238 500 2HB TYR 67 HB3 TYR 67 -12.456 7.023 -4.683 501 HD1 TYR 67 HD1 TYR 67 -14.709 7.617 -4.371 502 HD2 TYR 67 HD2 TYR 67 -13.077 7.565 -8.365 503 HE1 TYR 67 HE1 TYR 67 -16.961 8.050 -5.298 504 HE2 TYR 67 HE2 TYR 67 -15.319 7.992 -9.301 505 HH TYR 67 HH TYR 67 -17.577 8.373 -8.825 506 H GLY 68 HN GLY 68 -8.885 8.771 -5.702 507 1HA GLY 68 HA2 GLY 68 -7.342 9.386 -4.079 508 2HA GLY 68 HA3 GLY 68 -8.632 9.591 -2.877 509 H VAL 69 HN VAL 69 -6.939 7.092 -4.849 510 HA VAL 69 HA VAL 69 -6.920 5.128 -2.711 511 HB VAL 69 HB VAL 69 -8.204 4.619 -5.445 512 1HG1 VAL 69 HG11 VAL 69 -7.432 2.670 -3.281 513 2HG1 VAL 69 HG12 VAL 69 -8.495 2.280 -4.662 514 3HG1 VAL 69 HG13 VAL 69 -6.816 2.741 -4.937 515 1HG2 VAL 69 HG21 VAL 69 -10.195 3.851 -4.232 516 2HG2 VAL 69 HG22 VAL 69 -9.474 4.428 -2.706 517 3HG2 VAL 69 HG23 VAL 69 -9.884 5.571 -4.006 518 H MET 70 HN MET 70 -4.865 4.321 -2.888 519 HA MET 70 HA MET 70 -3.493 4.310 -5.479 520 1HB MET 70 HB2 MET 70 -1.618 5.578 -4.771 521 2HB MET 70 HB3 MET 70 -3.080 6.572 -4.737 522 1HG MET 70 HG2 MET 70 -3.222 6.365 -2.310 523 2HG MET 70 HG3 MET 70 -1.873 5.224 -2.343 524 1HE MET 70 HE1 MET 70 0.332 6.507 -4.266 525 2HE MET 70 HE2 MET 70 1.276 7.162 -2.928 526 3HE MET 70 HE3 MET 70 0.461 5.608 -2.729 527 H SER 71 HN SER 71 -4.541 2.364 -3.376 528 HA SER 71 HA SER 71 -2.054 0.972 -2.667 529 1HB SER 71 HB2 SER 71 -3.553 0.541 -0.509 530 2HB SER 71 HB3 SER 71 -2.584 1.999 -0.697 531 HG SER 71 HG SER 71 -5.397 1.704 -1.049 532 H ILE 72 HN ILE 72 -2.380 -1.311 -2.037 533 HA ILE 72 HA ILE 72 -4.840 -2.413 -3.197 534 HB ILE 72 HB ILE 72 -2.606 -4.277 -3.285 535 1HG1 ILE 72 HG12 ILE 72 -1.273 -2.290 -3.829 536 2HG1 ILE 72 HG13 ILE 72 -1.324 -3.521 -5.067 537 1HG2 ILE 72 HG21 ILE 72 -4.570 -4.962 -4.291 538 2HG2 ILE 72 HG22 ILE 72 -4.757 -3.437 -5.214 539 3HG2 ILE 72 HG23 ILE 72 -3.477 -4.597 -5.623 540 1HD1 ILE 72 HD11 ILE 72 -1.421 -1.189 -5.902 541 2HD1 ILE 72 HD12 ILE 72 -2.719 -2.248 -6.489 542 3HD1 ILE 72 HD13 ILE 72 -3.056 -1.017 -5.258 543 HA PRO 73 HA PRO 73 -6.204 -3.901 -2.915 544 1HB PRO 73 HB2 PRO 73 -8.080 -5.289 -1.609 545 2HB PRO 73 HB3 PRO 73 -6.634 -6.107 -2.287 546 1HG PRO 73 HG2 PRO 73 -7.192 -5.321 0.558 547 2HG PRO 73 HG3 PRO 73 -6.424 -6.813 -0.054 548 1HD PRO 73 HD2 PRO 73 -5.075 -4.499 0.895 549 2HD PRO 73 HD3 PRO 73 -4.328 -5.772 -0.088 550 H THR 74 HN THR 74 -7.886 -2.400 -3.011 551 HA THR 74 HA THR 74 -8.675 -1.071 -0.416 552 HB THR 74 HB THR 74 -8.459 0.226 -3.145 553 HG1 THR 74 HG1 THR 74 -6.517 0.191 -2.283 554 1HG2 THR 74 HG21 THR 74 -10.357 1.264 -2.227 555 2HG2 THR 74 HG22 THR 74 -9.737 1.168 -0.570 556 3HG2 THR 74 HG23 THR 74 -9.025 2.313 -1.711 557 H LEU 75 HN LEU 75 -10.852 -0.771 -0.028 558 HA LEU 75 HA LEU 75 -12.777 -1.970 -1.960 559 1HB LEU 75 HB2 LEU 75 -12.898 -2.040 1.086 560 2HB LEU 75 HB3 LEU 75 -14.183 -2.540 -0.004 561 HG LEU 75 HG LEU 75 -11.494 -3.910 0.362 562 1HD1 LEU 75 HD11 LEU 75 -14.351 -4.799 0.997 563 2HD1 LEU 75 HD12 LEU 75 -12.866 -5.721 1.298 564 3HD1 LEU 75 HD13 LEU 75 -13.177 -4.213 2.177 565 1HD2 LEU 75 HD21 LEU 75 -12.101 -4.182 -1.950 566 2HD2 LEU 75 HD22 LEU 75 -12.451 -5.696 -1.125 567 3HD2 LEU 75 HD23 LEU 75 -13.778 -4.565 -1.536 568 H LEU 76 HN LEU 76 -14.426 -0.640 -2.430 569 HA LEU 76 HA LEU 76 -14.999 1.671 -0.701 570 1HB LEU 76 HB2 LEU 76 -15.394 1.768 -3.712 571 2HB LEU 76 HB3 LEU 76 -15.616 3.060 -2.537 572 HG LEU 76 HG LEU 76 -12.977 1.841 -3.429 573 1HD1 LEU 76 HD11 LEU 76 -14.192 4.595 -3.969 574 2HD1 LEU 76 HD12 LEU 76 -12.620 4.005 -4.552 575 3HD1 LEU 76 HD13 LEU 76 -14.117 3.258 -5.129 576 1HD2 LEU 76 HD21 LEU 76 -11.880 3.661 -2.169 577 2HD2 LEU 76 HD22 LEU 76 -13.459 4.247 -1.606 578 3HD2 LEU 76 HD23 LEU 76 -12.845 2.672 -1.070 579 H VAL 77 HN VAL 77 -16.897 1.037 0.213 580 HA VAL 77 HA VAL 77 -18.557 -0.886 -1.340 581 HB VAL 77 HB VAL 77 -19.005 -0.388 1.580 582 1HG1 VAL 77 HG11 VAL 77 -19.228 -2.777 -0.278 583 2HG1 VAL 77 HG12 VAL 77 -19.661 -2.754 1.433 584 3HG1 VAL 77 HG13 VAL 77 -20.528 -1.703 0.286 585 1HG2 VAL 77 HG21 VAL 77 -16.602 -0.781 1.660 586 2HG2 VAL 77 HG22 VAL 77 -17.429 -2.259 2.145 587 3HG2 VAL 77 HG23 VAL 77 -16.736 -2.125 0.513 588 H LEU 78 HN LEU 78 -20.412 -0.162 -2.158 589 HA LEU 78 HA LEU 78 -21.334 2.565 -1.428 590 1HB LEU 78 HB2 LEU 78 -20.746 1.267 -4.094 591 2HB LEU 78 HB3 LEU 78 -22.108 2.370 -3.976 592 HG LEU 78 HG LEU 78 -20.649 4.163 -3.139 593 1HD1 LEU 78 HD11 LEU 78 -18.197 4.020 -3.427 594 2HD1 LEU 78 HD12 LEU 78 -18.770 2.940 -2.168 595 3HD1 LEU 78 HD13 LEU 78 -18.342 2.270 -3.755 596 1HD2 LEU 78 HD21 LEU 78 -21.202 3.921 -5.548 597 2HD2 LEU 78 HD22 LEU 78 -19.661 4.735 -5.249 598 3HD2 LEU 78 HD23 LEU 78 -19.669 3.036 -5.770 599 H LYS 79 HN LYS 79 -23.621 2.941 -1.657 600 HA LYS 79 HA LYS 79 -25.261 0.668 -2.415 601 1HB LYS 79 HB2 LYS 79 -26.772 0.791 -0.562 602 2HB LYS 79 HB3 LYS 79 -25.159 0.315 -0.015 603 1HG LYS 79 HG2 LYS 79 -24.853 2.725 0.772 604 2HG LYS 79 HG3 LYS 79 -26.557 2.996 0.400 605 1HD LYS 79 HD2 LYS 79 -25.506 0.893 2.343 606 2HD LYS 79 HD3 LYS 79 -26.182 2.468 2.796 607 1HE LYS 79 HE2 LYS 79 -28.340 1.856 1.815 608 2HE LYS 79 HE3 LYS 79 -27.683 0.307 1.261 609 1HZ LYS 79 HZ1 LYS 79 -27.468 -0.419 3.517 610 2HZ LYS 79 HZ2 LYS 79 -27.891 1.063 4.116 611 3HZ LYS 79 HZ3 LYS 79 -28.979 0.148 3.326 612 H ASP 80 HN ASP 80 -26.781 1.326 -3.670 613 HA ASP 80 HA ASP 80 -28.020 2.619 -5.000 614 1HB ASP 80 HB2 ASP 80 -29.315 1.990 -2.972 615 2HB ASP 80 HB3 ASP 80 -28.988 3.585 -2.294 616 H GLY 81 HN GLY 81 -25.463 3.991 -4.655 617 1HA GLY 81 HA2 GLY 81 -25.307 6.056 -6.111 618 2HA GLY 81 HA3 GLY 81 -26.327 6.833 -4.891 619 H GLU 82 HN GLU 82 -24.710 5.327 -2.694 620 HA GLU 82 HA GLU 82 -22.503 7.297 -2.706 621 1HB GLU 82 HB2 GLU 82 -23.209 8.178 -0.655 622 2HB GLU 82 HB3 GLU 82 -24.688 8.006 -1.614 623 1HG GLU 82 HG2 GLU 82 -25.153 5.842 -0.388 624 2HG GLU 82 HG3 GLU 82 -23.740 6.134 0.616 625 H VAL 83 HN VAL 83 -20.718 6.899 -1.377 626 HA VAL 83 HA VAL 83 -20.089 4.144 -0.694 627 HB VAL 83 HB VAL 83 -18.434 5.769 -1.524 628 1HG1 VAL 83 HG11 VAL 83 -19.174 7.829 -0.362 629 2HG1 VAL 83 HG12 VAL 83 -18.635 7.140 1.185 630 3HG1 VAL 83 HG13 VAL 83 -17.462 7.481 -0.100 631 1HG2 VAL 83 HG21 VAL 83 -17.700 3.785 -0.288 632 2HG2 VAL 83 HG22 VAL 83 -16.621 5.153 -0.017 633 3HG2 VAL 83 HG23 VAL 83 -17.790 4.688 1.239 634 H VAL 84 HN VAL 84 -20.182 3.177 1.179 635 HA VAL 84 HA VAL 84 -21.465 4.527 3.495 636 HB VAL 84 HB VAL 84 -23.203 3.490 2.334 637 1HG1 VAL 84 HG11 VAL 84 -22.155 2.102 0.724 638 2HG1 VAL 84 HG12 VAL 84 -21.502 0.981 1.950 639 3HG1 VAL 84 HG13 VAL 84 -23.247 1.090 1.640 640 1HG2 VAL 84 HG21 VAL 84 -23.187 3.059 4.760 641 2HG2 VAL 84 HG22 VAL 84 -24.054 1.820 3.849 642 3HG2 VAL 84 HG23 VAL 84 -22.428 1.475 4.464 643 H GLU 85 HN GLU 85 -19.070 2.245 2.255 644 HA GLU 85 HA GLU 85 -17.780 2.390 4.830 645 1HB GLU 85 HB2 GLU 85 -18.645 -0.264 3.653 646 2HB GLU 85 HB3 GLU 85 -17.147 -0.164 4.552 647 1HG GLU 85 HG2 GLU 85 -19.896 0.554 5.639 648 2HG GLU 85 HG3 GLU 85 -19.068 -0.973 5.869 649 H THR 86 HN THR 86 -15.458 1.865 4.581 650 HA THR 86 HA THR 86 -14.355 1.787 1.849 651 HB THR 86 HB THR 86 -13.615 4.112 3.654 652 HG1 THR 86 HG1 THR 86 -15.905 3.876 2.080 653 1HG2 THR 86 HG21 THR 86 -12.277 3.503 1.609 654 2HG2 THR 86 HG22 THR 86 -13.748 3.786 0.644 655 3HG2 THR 86 HG23 THR 86 -12.983 5.131 1.525 656 H SER 87 HN SER 87 -12.333 0.707 2.053 657 HA SER 87 HA SER 87 -10.954 0.663 4.636 658 1HB SER 87 HB2 SER 87 -12.798 -1.010 4.898 659 2HB SER 87 HB3 SER 87 -12.198 -1.861 3.472 660 HG SER 87 HG SER 87 -10.995 -1.527 6.023 661 H VAL 88 HN VAL 88 -8.829 -0.204 4.424 662 HA VAL 88 HA VAL 88 -7.804 -0.522 1.650 663 HB VAL 88 HB VAL 88 -7.047 1.653 3.653 664 1HG1 VAL 88 HG11 VAL 88 -5.700 0.770 1.080 665 2HG1 VAL 88 HG12 VAL 88 -5.499 2.412 1.740 666 3HG1 VAL 88 HG13 VAL 88 -4.991 1.038 2.701 667 1HG2 VAL 88 HG21 VAL 88 -7.652 3.219 1.856 668 2HG2 VAL 88 HG22 VAL 88 -8.114 1.861 0.816 669 3HG2 VAL 88 HG23 VAL 88 -9.040 2.233 2.291 670 H GLY 89 HN GLY 89 -7.460 -2.722 2.217 671 1HA GLY 89 HA2 GLY 89 -5.072 -3.605 3.103 672 2HA GLY 89 HA3 GLY 89 -5.965 -3.475 4.629 673 H PHE 90 HN PHE 90 -5.042 -5.986 3.625 674 HA PHE 90 HA PHE 90 -7.060 -7.362 2.141 675 1HB PHE 90 HB2 PHE 90 -4.765 -8.168 2.187 676 2HB PHE 90 HB3 PHE 90 -4.807 -8.334 3.937 677 HD1 PHE 90 HD1 PHE 90 -5.437 -10.389 4.933 678 HD2 PHE 90 HD2 PHE 90 -6.496 -9.625 0.817 679 HE1 PHE 90 HE1 PHE 90 -6.366 -12.679 4.743 680 HE2 PHE 90 HE2 PHE 90 -7.478 -11.899 0.662 681 HZ PHE 90 HZ PHE 90 -7.392 -13.436 2.608 682 H LYS 91 HN LYS 91 -8.669 -8.821 2.826 683 HA LYS 91 HA LYS 91 -9.157 -9.166 5.717 684 1HB LYS 91 HB2 LYS 91 -11.116 -8.055 3.686 685 2HB LYS 91 HB3 LYS 91 -11.705 -9.167 4.876 686 1HG LYS 91 HG2 LYS 91 -12.183 -7.195 5.912 687 2HG LYS 91 HG3 LYS 91 -10.666 -7.644 6.680 688 1HD LYS 91 HD2 LYS 91 -10.647 -5.275 6.195 689 2HD LYS 91 HD3 LYS 91 -9.477 -6.062 5.137 690 1HE LYS 91 HE2 LYS 91 -11.344 -6.127 3.355 691 2HE LYS 91 HE3 LYS 91 -12.272 -5.073 4.432 692 1HZ LYS 91 HZ1 LYS 91 -10.953 -3.850 2.750 693 2HZ LYS 91 HZ2 LYS 91 -10.485 -3.456 4.276 694 3HZ LYS 91 HZ3 LYS 91 -9.569 -4.468 3.356 695 HA PRO 92 HA PRO 92 -9.781 -13.298 3.905 696 1HB PRO 92 HB2 PRO 92 -10.736 -14.635 6.095 697 2HB PRO 92 HB3 PRO 92 -9.014 -14.177 5.918 698 1HG PRO 92 HG2 PRO 92 -11.192 -12.689 7.419 699 2HG PRO 92 HG3 PRO 92 -9.561 -13.149 8.010 700 1HD PRO 92 HD2 PRO 92 -10.053 -10.665 7.029 701 2HD PRO 92 HD3 PRO 92 -8.510 -11.493 6.684 702 H LYS 93 HN LYS 93 -11.718 -14.792 3.730 703 HA LYS 93 HA LYS 93 -13.888 -13.598 2.528 704 1HB LYS 93 HB2 LYS 93 -13.359 -15.879 2.116 705 2HB LYS 93 HB3 LYS 93 -13.419 -16.293 3.823 706 1HG LYS 93 HG2 LYS 93 -15.253 -17.304 2.730 707 2HG LYS 93 HG3 LYS 93 -15.849 -16.090 3.848 708 1HD LYS 93 HD2 LYS 93 -16.186 -14.529 1.881 709 2HD LYS 93 HD3 LYS 93 -15.733 -15.854 0.789 710 1HE LYS 93 HE2 LYS 93 -17.905 -16.095 2.928 711 2HE LYS 93 HE3 LYS 93 -18.268 -15.516 1.310 712 1HZ LYS 93 HZ1 LYS 93 -17.011 -18.155 1.788 713 2HZ LYS 93 HZ2 LYS 93 -18.626 -17.930 1.720 714 3HZ LYS 93 HZ3 LYS 93 -17.722 -17.607 0.394 715 H GLU 94 HN GLU 94 -13.845 -14.718 5.960 716 HA GLU 94 HA GLU 94 -16.560 -14.002 6.322 717 1HB GLU 94 HB2 GLU 94 -14.324 -14.367 8.365 718 2HB GLU 94 HB3 GLU 94 -16.043 -14.193 8.767 719 1HG GLU 94 HG2 GLU 94 -16.562 -16.228 7.429 720 2HG GLU 94 HG3 GLU 94 -14.846 -16.431 7.070 721 H ALA 95 HN ALA 95 -13.533 -12.179 7.002 722 HA ALA 95 HA ALA 95 -14.841 -9.980 8.284 723 1HB ALA 95 HB1 ALA 95 -12.198 -10.119 6.794 724 2HB ALA 95 HB2 ALA 95 -12.713 -8.793 7.855 725 3HB ALA 95 HB3 ALA 95 -12.427 -10.409 8.536 726 H LEU 96 HN LEU 96 -14.045 -10.754 4.911 727 HA LEU 96 HA LEU 96 -14.759 -8.281 3.743 728 1HB LEU 96 HB2 LEU 96 -13.784 -10.690 2.800 729 2HB LEU 96 HB3 LEU 96 -15.439 -10.813 2.272 730 HG LEU 96 HG LEU 96 -14.245 -9.920 0.467 731 1HD1 LEU 96 HD11 LEU 96 -15.138 -7.721 0.020 732 2HD1 LEU 96 HD12 LEU 96 -16.366 -8.636 0.906 733 3HD1 LEU 96 HD13 LEU 96 -15.407 -7.399 1.739 734 1HD2 LEU 96 HD21 LEU 96 -13.008 -7.872 2.345 735 2HD2 LEU 96 HD22 LEU 96 -12.209 -9.329 1.725 736 3HD2 LEU 96 HD23 LEU 96 -12.683 -8.044 0.600 737 H GLN 97 HN GLN 97 -16.672 -11.273 4.232 738 HA GLN 97 HA GLN 97 -19.036 -10.144 3.161 739 1HB GLN 97 HB2 GLN 97 -20.001 -12.089 3.436 740 2HB GLN 97 HB3 GLN 97 -18.329 -12.633 3.508 741 1HG GLN 97 HG2 GLN 97 -18.510 -12.802 5.918 742 2HG GLN 97 HG3 GLN 97 -20.220 -12.301 5.831 743 1HE2 GLN 97 HE22 GLN 97 -21.369 -13.710 3.774 744 2HE2 GLN 97 HE21 GLN 97 -21.159 -15.434 4.007 745 H GLU 98 HN GLU 98 -17.794 -10.316 6.522 746 HA GLU 98 HA GLU 98 -20.099 -9.253 7.755 747 1HB GLU 98 HB2 GLU 98 -18.306 -10.298 9.001 748 2HB GLU 98 HB3 GLU 98 -17.167 -9.027 8.521 749 1HG GLU 98 HG2 GLU 98 -18.444 -7.356 9.776 750 2HG GLU 98 HG3 GLU 98 -19.694 -8.547 10.154 751 H LEU 99 HN LEU 99 -17.259 -7.570 6.342 752 HA LEU 99 HA LEU 99 -17.905 -4.987 7.193 753 1HB LEU 99 HB2 LEU 99 -15.731 -5.580 6.272 754 2HB LEU 99 HB3 LEU 99 -16.451 -5.920 4.698 755 HG LEU 99 HG LEU 99 -17.040 -3.540 4.404 756 1HD1 LEU 99 HD11 LEU 99 -16.054 -1.842 5.979 757 2HD1 LEU 99 HD12 LEU 99 -17.372 -2.771 6.688 758 3HD1 LEU 99 HD13 LEU 99 -15.686 -3.157 7.116 759 1HD2 LEU 99 HD21 LEU 99 -14.879 -4.442 3.653 760 2HD2 LEU 99 HD22 LEU 99 -14.781 -2.721 4.064 761 3HD2 LEU 99 HD23 LEU 99 -14.131 -3.942 5.190 762 H VAL 100 HN VAL 100 -18.993 -6.727 4.290 763 HA VAL 100 HA VAL 100 -20.488 -4.365 3.388 764 HB VAL 100 HB VAL 100 -19.274 -5.649 1.835 765 1HG1 VAL 100 HG11 VAL 100 -21.225 -7.964 2.216 766 2HG1 VAL 100 HG12 VAL 100 -19.881 -7.857 1.055 767 3HG1 VAL 100 HG13 VAL 100 -19.545 -7.949 2.776 768 1HG2 VAL 100 HG21 VAL 100 -20.915 -5.731 0.091 769 2HG2 VAL 100 HG22 VAL 100 -22.247 -5.910 1.257 770 3HG2 VAL 100 HG23 VAL 100 -21.336 -4.394 1.169 771 H ASN 101 HN ASN 101 -21.262 -7.596 4.813 772 HA ASN 101 HA ASN 101 -24.070 -7.508 4.676 773 1HB ASN 101 HB2 ASN 101 -22.876 -9.515 5.283 774 2HB ASN 101 HB3 ASN 101 -22.245 -8.751 6.749 775 1HD2 ASN 101 HD22 ASN 101 -23.571 -8.604 8.592 776 2HD2 ASN 101 HD21 ASN 101 -25.177 -9.281 8.661 777 H LYS 102 HN LYS 102 -21.887 -5.789 6.842 778 HA LYS 102 HA LYS 102 -23.547 -4.997 8.954 779 1HB LYS 102 HB2 LYS 102 -21.176 -3.906 7.494 780 2HB LYS 102 HB3 LYS 102 -22.058 -2.743 8.469 781 1HG LYS 102 HG2 LYS 102 -21.577 -3.768 10.469 782 2HG LYS 102 HG3 LYS 102 -21.338 -5.368 9.753 783 1HD LYS 102 HD2 LYS 102 -19.258 -4.226 10.667 784 2HD LYS 102 HD3 LYS 102 -19.182 -4.895 9.046 785 1HE LYS 102 HE2 LYS 102 -18.067 -2.810 8.949 786 2HE LYS 102 HE3 LYS 102 -19.599 -2.643 8.088 787 1HZ LYS 102 HZ1 LYS 102 -20.473 -1.516 10.095 788 2HZ LYS 102 HZ2 LYS 102 -18.989 -1.599 10.789 789 3HZ LYS 102 HZ3 LYS 102 -19.209 -0.735 9.406 790 H HIS 103 HN HIS 103 -23.557 -3.799 5.590 791 HA HIS 103 HA HIS 103 -25.901 -2.079 6.304 792 1HB HIS 103 HB2 HIS 103 -24.932 -0.287 5.049 793 2HB HIS 103 HB3 HIS 103 -23.730 -0.871 6.207 794 HD1 HIS 103 HD1 HIS 103 -24.536 -1.278 2.442 795 HD2 HIS 103 HD2 HIS 103 -21.414 -1.774 5.222 796 HE1 HIS 103 HE1 HIS 103 -22.453 -1.827 1.107 797 H LEU 104 HN LEU 104 -24.823 -4.558 4.280 798 HA LEU 104 HA LEU 104 -26.433 -4.141 1.883 799 1HB LEU 104 HB2 LEU 104 -24.584 -5.578 1.701 800 2HB LEU 104 HB3 LEU 104 -24.922 -6.339 3.249 801 HG LEU 104 HG LEU 104 -26.845 -7.513 2.371 802 1HD1 LEU 104 HD11 LEU 104 -26.031 -6.400 -0.362 803 2HD1 LEU 104 HD12 LEU 104 -27.357 -7.524 -0.018 804 3HD1 LEU 104 HD13 LEU 104 -27.465 -5.859 0.539 805 1HD2 LEU 104 HD21 LEU 104 -24.683 -8.560 2.364 806 2HD2 LEU 104 HD22 LEU 104 -25.569 -9.049 0.915 807 3HD2 LEU 104 HD23 LEU 104 -24.272 -7.836 0.793 808 1H MET 1 H1 MET 1 6.604 27.488 -9.221 809 2H MET 1 H2 MET 1 8.165 27.312 -8.704 810 3H MET 1 H3 MET 1 7.862 27.964 -10.173 811 HA MET 1 HA MET 1 8.520 29.574 -8.488 812 1HB MET 1 HB2 MET 1 7.230 30.267 -10.481 813 2HB MET 1 HB3 MET 1 5.715 29.998 -9.610 814 1HG MET 1 HG2 MET 1 6.396 31.702 -7.933 815 2HG MET 1 HG3 MET 1 7.906 31.964 -8.802 816 1HE MET 1 HE1 MET 1 8.165 33.300 -11.006 817 2HE MET 1 HE2 MET 1 7.145 32.136 -11.884 818 3HE MET 1 HE3 MET 1 6.815 33.874 -12.008 819 H GLU 2 HN GLU 2 8.717 29.124 -6.350 820 HA GLU 2 HA GLU 2 8.221 29.043 -4.163 821 1HB GLU 2 HB2 GLU 2 6.085 31.031 -5.001 822 2HB GLU 2 HB3 GLU 2 6.719 30.810 -3.364 823 1HG GLU 2 HG2 GLU 2 9.006 31.384 -4.193 824 2HG GLU 2 HG3 GLU 2 8.326 31.722 -5.787 825 H ASN 3 HN ASN 3 7.311 26.794 -5.244 826 HA ASN 3 HA ASN 3 6.498 25.162 -3.623 827 1HB ASN 3 HB2 ASN 3 3.814 26.495 -4.051 828 2HB ASN 3 HB3 ASN 3 4.053 24.828 -3.541 829 1HD2 ASN 3 HD22 ASN 3 6.607 26.480 -1.947 830 2HD2 ASN 3 HD21 ASN 3 5.740 26.740 -0.472 831 H LYS 4 HN LYS 4 6.481 23.433 -4.490 832 HA LYS 4 HA LYS 4 4.913 22.376 -6.650 833 1HB LYS 4 HB2 LYS 4 7.980 22.464 -6.600 834 2HB LYS 4 HB3 LYS 4 7.101 21.185 -7.446 835 1HG LYS 4 HG2 LYS 4 6.771 22.468 -9.229 836 2HG LYS 4 HG3 LYS 4 5.928 23.656 -8.244 837 1HD LYS 4 HD2 LYS 4 7.727 24.675 -9.503 838 2HD LYS 4 HD3 LYS 4 7.998 24.832 -7.757 839 1HE LYS 4 HE2 LYS 4 9.730 23.221 -7.750 840 2HE LYS 4 HE3 LYS 4 9.276 22.574 -9.337 841 1HZ LYS 4 HZ1 LYS 4 10.098 24.538 -10.373 842 2HZ LYS 4 HZ2 LYS 4 10.287 25.326 -8.949 843 3HZ LYS 4 HZ3 LYS 4 11.264 24.053 -9.340 844 H ILE 5 HN ILE 5 5.018 19.885 -6.280 845 HA ILE 5 HA ILE 5 5.657 19.420 -3.398 846 HB ILE 5 HB ILE 5 3.217 18.624 -5.013 847 1HG1 ILE 5 HG12 ILE 5 3.824 20.746 -2.957 848 2HG1 ILE 5 HG13 ILE 5 2.941 20.875 -4.470 849 1HG2 ILE 5 HG21 ILE 5 3.882 18.015 -2.121 850 2HG2 ILE 5 HG22 ILE 5 2.378 17.563 -2.987 851 3HG2 ILE 5 HG23 ILE 5 3.899 16.829 -3.455 852 1HD1 ILE 5 HD11 ILE 5 1.058 19.608 -3.414 853 2HD1 ILE 5 HD12 ILE 5 1.973 19.628 -1.879 854 3HD1 ILE 5 HD13 ILE 5 1.449 21.158 -2.612 855 H ILE 6 HN ILE 6 6.458 17.515 -2.799 856 HA ILE 6 HA ILE 6 6.926 15.374 -4.762 857 HB ILE 6 HB ILE 6 8.865 16.836 -5.029 858 1HG1 ILE 6 HG12 ILE 6 9.533 14.235 -3.586 859 2HG1 ILE 6 HG13 ILE 6 9.172 14.441 -5.306 860 1HG2 ILE 6 HG21 ILE 6 9.488 16.430 -2.079 861 2HG2 ILE 6 HG22 ILE 6 10.442 17.358 -3.257 862 3HG2 ILE 6 HG23 ILE 6 8.855 17.932 -2.790 863 1HD1 ILE 6 HD11 ILE 6 11.184 15.963 -5.446 864 2HD1 ILE 6 HD12 ILE 6 11.609 15.465 -3.795 865 3HD1 ILE 6 HD13 ILE 6 11.551 14.267 -5.094 866 H TYR 7 HN TYR 7 7.193 13.342 -3.719 867 HA TYR 7 HA TYR 7 6.512 13.336 -0.813 868 1HB TYR 7 HB2 TYR 7 4.776 12.807 -3.050 869 2HB TYR 7 HB3 TYR 7 5.132 11.264 -2.317 870 HD1 TYR 7 HD1 TYR 7 3.375 14.428 -1.957 871 HD2 TYR 7 HD2 TYR 7 4.674 10.899 0.158 872 HE1 TYR 7 HE1 TYR 7 1.739 14.884 -0.192 873 HE2 TYR 7 HE2 TYR 7 3.009 11.371 1.939 874 HH TYR 7 HH TYR 7 0.825 14.188 1.869 875 H PHE 8 HN PHE 8 7.565 11.799 0.331 876 HA PHE 8 HA PHE 8 9.119 9.710 -1.103 877 1HB PHE 8 HB2 PHE 8 8.930 10.381 1.849 878 2HB PHE 8 HB3 PHE 8 10.034 9.208 1.128 879 HD1 PHE 8 HD1 PHE 8 11.377 10.367 -1.019 880 HD2 PHE 8 HD2 PHE 8 10.014 12.343 2.553 881 HE1 PHE 8 HE1 PHE 8 12.851 12.295 -1.530 882 HE2 PHE 8 HE2 PHE 8 11.572 14.187 2.104 883 HZ PHE 8 HZ PHE 8 12.959 14.217 0.074 884 H LEU 9 HN LEU 9 8.520 7.514 -0.918 885 HA LEU 9 HA LEU 9 6.122 6.904 0.729 886 1HB LEU 9 HB2 LEU 9 5.598 7.329 -1.693 887 2HB LEU 9 HB3 LEU 9 6.612 5.954 -2.123 888 HG LEU 9 HG LEU 9 5.086 4.412 -1.029 889 1HD1 LEU 9 HD11 LEU 9 2.905 5.236 -0.040 890 2HD1 LEU 9 HD12 LEU 9 4.320 5.624 0.930 891 3HD1 LEU 9 HD13 LEU 9 3.566 6.888 -0.075 892 1HD2 LEU 9 HD21 LEU 9 4.505 5.098 -3.303 893 2HD2 LEU 9 HD22 LEU 9 3.011 4.918 -2.363 894 3HD2 LEU 9 HD23 LEU 9 3.641 6.528 -2.690 895 H SER 10 HN SER 10 6.814 5.507 2.239 896 HA SER 10 HA SER 10 8.993 3.586 1.611 897 1HB SER 10 HB2 SER 10 8.885 5.412 4.041 898 2HB SER 10 HB3 SER 10 10.179 4.288 3.643 899 HG SER 10 HG SER 10 10.934 5.637 2.164 900 H THR 11 HN THR 11 8.774 1.683 2.786 901 HA THR 11 HA THR 11 6.481 0.653 3.755 902 HB THR 11 HB THR 11 9.190 -0.036 4.920 903 HG1 THR 11 HG1 THR 11 8.579 -1.120 2.447 904 1HG2 THR 11 HG21 THR 11 8.405 -2.309 4.755 905 2HG2 THR 11 HG22 THR 11 7.134 -1.369 5.531 906 3HG2 THR 11 HG23 THR 11 6.981 -1.809 3.815 907 H GLY 12 HN GLY 12 5.221 1.887 4.955 908 1HA GLY 12 HA2 GLY 12 4.231 2.547 6.937 909 2HA GLY 12 HA3 GLY 12 5.363 1.478 7.793 910 H ASN 13 HN ASN 13 6.177 4.123 5.673 911 HA ASN 13 HA ASN 13 8.174 5.267 6.141 912 1HB ASN 13 HB2 ASN 13 7.245 6.858 5.025 913 2HB ASN 13 HB3 ASN 13 5.696 6.646 5.791 914 1HD2 ASN 13 HD22 ASN 13 8.950 8.008 6.803 915 2HD2 ASN 13 HD21 ASN 13 8.207 9.355 7.663 916 H SER 14 HN SER 14 9.549 5.026 7.484 917 HA SER 14 HA SER 14 9.430 6.232 10.182 918 1HB SER 14 HB2 SER 14 9.230 3.750 10.302 919 2HB SER 14 HB3 SER 14 10.722 3.580 9.370 920 HG SER 14 HG SER 14 10.619 3.583 11.865 921 H ALA 15 HN ALA 15 12.298 5.363 10.198 922 HA ALA 15 HA ALA 15 13.425 7.686 9.925 923 1HB ALA 15 HB1 ALA 15 15.653 6.529 9.717 924 2HB ALA 15 HB2 ALA 15 14.575 5.766 10.900 925 3HB ALA 15 HB3 ALA 15 14.780 5.035 9.292 926 H ARG 16 HN ARG 16 13.482 5.597 6.960 927 HA ARG 16 HA ARG 16 15.313 7.218 5.563 928 1HB ARG 16 HB2 ARG 16 12.983 5.528 4.521 929 2HB ARG 16 HB3 ARG 16 14.046 6.446 3.456 930 1HG ARG 16 HG2 ARG 16 16.025 5.241 4.521 931 2HG ARG 16 HG3 ARG 16 14.834 4.208 5.313 932 1HD ARG 16 HD2 ARG 16 15.673 3.112 3.327 933 2HD ARG 16 HD3 ARG 16 13.963 3.490 3.129 934 HE ARG 16 HE ARG 16 14.564 5.358 1.746 935 1HH1 ARG 16 HH11 ARG 16 17.012 2.765 1.956 936 2HH1 ARG 16 HH12 ARG 16 18.000 3.434 0.701 937 1HH2 ARG 16 HH21 ARG 16 15.885 6.201 0.053 938 2HH2 ARG 16 HH22 ARG 16 17.106 5.222 -0.636 939 H SER 17 HN SER 17 11.712 7.549 5.563 940 HA SER 17 HA SER 17 11.822 9.661 3.667 941 1HB SER 17 HB2 SER 17 9.477 9.670 5.382 942 2HB SER 17 HB3 SER 17 9.600 9.404 3.650 943 HG SER 17 HG SER 17 9.913 7.253 3.955 944 H GLN 18 HN GLN 18 11.597 9.692 7.256 945 HA GLN 18 HA GLN 18 11.241 12.449 7.686 946 1HB GLN 18 HB2 GLN 18 13.059 10.807 9.429 947 2HB GLN 18 HB3 GLN 18 11.990 12.126 9.864 948 1HG GLN 18 HG2 GLN 18 11.110 9.333 9.125 949 2HG GLN 18 HG3 GLN 18 11.197 9.996 10.736 950 1HE2 GLN 18 HE22 GLN 18 8.818 8.998 10.284 951 2HE2 GLN 18 HE21 GLN 18 7.642 10.220 9.913 952 H MET 19 HN MET 19 14.188 10.528 7.397 953 HA MET 19 HA MET 19 16.052 12.603 7.771 954 1HB MET 19 HB2 MET 19 16.339 10.113 8.010 955 2HB MET 19 HB3 MET 19 16.165 9.945 6.263 956 1HG MET 19 HG2 MET 19 18.248 11.509 6.172 957 2HG MET 19 HG3 MET 19 18.468 11.019 7.855 958 1HE MET 19 HE1 MET 19 17.155 7.793 7.378 959 2HE MET 19 HE2 MET 19 18.769 7.052 7.338 960 3HE MET 19 HE3 MET 19 18.415 8.326 8.527 961 H ALA 20 HN ALA 20 14.625 11.145 4.791 962 HA ALA 20 HA ALA 20 16.003 12.773 2.937 963 1HB ALA 20 HB1 ALA 20 14.929 10.679 2.346 964 2HB ALA 20 HB2 ALA 20 13.325 11.396 2.652 965 3HB ALA 20 HB3 ALA 20 14.358 12.016 1.345 966 H GLU 21 HN GLU 21 13.019 13.499 4.872 967 HA GLU 21 HA GLU 21 12.324 15.771 3.306 968 1HB GLU 21 HB2 GLU 21 11.873 15.463 6.297 969 2HB GLU 21 HB3 GLU 21 11.053 16.546 5.144 970 1HG GLU 21 HG2 GLU 21 10.415 14.186 4.031 971 2HG GLU 21 HG3 GLU 21 10.700 13.646 5.700 972 H GLY 22 HN GLY 22 14.376 15.398 6.180 973 1HA GLY 22 HA2 GLY 22 15.186 18.123 6.434 974 2HA GLY 22 HA3 GLY 22 16.093 16.707 6.999 975 H TRP 23 HN TRP 23 16.744 15.365 4.684 976 HA TRP 23 HA TRP 23 18.926 16.863 3.671 977 1HB TRP 23 HB2 TRP 23 17.618 14.244 3.003 978 2HB TRP 23 HB3 TRP 23 18.655 14.959 1.774 979 HD1 TRP 23 HD1 TRP 23 18.831 13.043 4.913 980 HE1 TRP 23 HE1 TRP 23 21.235 12.761 5.698 981 HE3 TRP 23 HE3 TRP 23 21.084 16.365 1.751 982 HZ2 TRP 23 HZ2 TRP 23 23.848 13.727 4.942 983 HZ3 TRP 23 HZ3 TRP 23 23.560 16.588 1.731 984 HH2 TRP 23 HH2 TRP 23 24.952 15.291 3.329 985 H ALA 24 HN ALA 24 15.683 16.262 2.205 986 HA ALA 24 HA ALA 24 16.302 17.492 -0.254 987 1HB ALA 24 HB1 ALA 24 13.617 17.557 1.243 988 2HB ALA 24 HB2 ALA 24 13.869 17.850 -0.482 989 3HB ALA 24 HB3 ALA 24 14.160 16.229 0.184 990 H LYS 25 HN LYS 25 14.998 18.859 2.847 991 HA LYS 25 HA LYS 25 14.552 21.371 1.658 992 1HB LYS 25 HB2 LYS 25 14.583 20.333 4.492 993 2HB LYS 25 HB3 LYS 25 14.559 22.079 4.263 994 1HG LYS 25 HG2 LYS 25 12.580 20.261 2.828 995 2HG LYS 25 HG3 LYS 25 12.270 20.897 4.450 996 1HD LYS 25 HD2 LYS 25 12.311 23.163 3.717 997 2HD LYS 25 HD3 LYS 25 12.989 22.748 2.142 998 1HE LYS 25 HE2 LYS 25 10.889 21.495 1.579 999 2HE LYS 25 HE3 LYS 25 10.183 22.034 3.109 1000 1HZ LYS 25 HZ1 LYS 25 10.361 24.312 2.331 1001 2HZ LYS 25 HZ2 LYS 25 11.100 23.841 0.930 1002 3HZ LYS 25 HZ3 LYS 25 9.577 23.436 1.176 1003 H GLN 26 HN GLN 26 17.534 20.092 3.078 1004 HA GLN 26 HA GLN 26 18.725 22.688 3.191 1005 1HB GLN 26 HB2 GLN 26 20.665 21.721 3.863 1006 2HB GLN 26 HB3 GLN 26 19.449 20.644 4.483 1007 1HG GLN 26 HG2 GLN 26 20.350 18.877 3.412 1008 2HG GLN 26 HG3 GLN 26 20.291 19.664 1.861 1009 1HE2 GLN 26 HE22 GLN 26 22.454 17.992 3.418 1010 2HE2 GLN 26 HE21 GLN 26 23.895 18.958 3.232 1011 H TYR 27 HN TYR 27 18.030 20.662 0.481 1012 HA TYR 27 HA TYR 27 19.980 22.181 -1.174 1013 1HB TYR 27 HB2 TYR 27 19.354 19.278 -1.008 1014 2HB TYR 27 HB3 TYR 27 19.400 19.910 -2.639 1015 HD1 TYR 27 HD1 TYR 27 21.393 21.319 -3.392 1016 HD2 TYR 27 HD2 TYR 27 21.457 18.762 0.079 1017 HE1 TYR 27 HE1 TYR 27 23.865 21.492 -3.320 1018 HE2 TYR 27 HE2 TYR 27 23.923 18.950 0.183 1019 HH TYR 27 HH TYR 27 25.807 20.929 -2.157 1020 H LEU 28 HN LEU 28 16.631 21.728 -0.634 1021 HA LEU 28 HA LEU 28 15.929 22.702 -3.342 1022 1HB LEU 28 HB2 LEU 28 14.266 21.406 -1.144 1023 2HB LEU 28 HB3 LEU 28 13.632 22.033 -2.656 1024 HG LEU 28 HG LEU 28 15.484 19.660 -2.303 1025 1HD1 LEU 28 HD11 LEU 28 12.731 19.860 -3.587 1026 2HD1 LEU 28 HD12 LEU 28 13.647 18.387 -3.204 1027 3HD1 LEU 28 HD13 LEU 28 13.000 19.399 -1.900 1028 1HD2 LEU 28 HD21 LEU 28 16.235 20.843 -4.325 1029 2HD2 LEU 28 HD22 LEU 28 15.440 19.344 -4.726 1030 3HD2 LEU 28 HD23 LEU 28 14.566 20.878 -4.941 1031 H GLY 29 HN GLY 29 13.523 23.547 -1.250 1032 1HA GLY 29 HA2 GLY 29 14.321 25.755 0.220 1033 2HA GLY 29 HA3 GLY 29 14.157 26.350 -1.445 1034 H ASP 30 HN ASP 30 12.407 27.636 -0.209 1035 HA ASP 30 HA ASP 30 9.856 26.452 0.339 1036 1HB ASP 30 HB2 ASP 30 10.510 28.686 1.128 1037 2HB ASP 30 HB3 ASP 30 10.619 29.258 -0.539 1038 H GLU 31 HN GLU 31 11.583 27.035 -2.558 1039 HA GLU 31 HA GLU 31 9.609 27.153 -4.570 1040 1HB GLU 31 HB2 GLU 31 12.058 27.465 -4.822 1041 2HB GLU 31 HB3 GLU 31 12.280 25.739 -4.543 1042 1HG GLU 31 HG2 GLU 31 12.323 26.189 -6.919 1043 2HG GLU 31 HG3 GLU 31 10.906 25.229 -6.492 1044 H TRP 32 HN TRP 32 10.452 24.519 -2.377 1045 HA TRP 32 HA TRP 32 8.535 22.741 -3.794 1046 1HB TRP 32 HB2 TRP 32 11.121 21.919 -2.442 1047 2HB TRP 32 HB3 TRP 32 9.996 20.870 -3.292 1048 HD1 TRP 32 HD1 TRP 32 12.659 23.539 -3.930 1049 HE1 TRP 32 HE1 TRP 32 13.517 23.358 -6.334 1050 HE3 TRP 32 HE3 TRP 32 9.265 20.159 -5.746 1051 HZ2 TRP 32 HZ2 TRP 32 12.851 21.920 -8.720 1052 HZ3 TRP 32 HZ3 TRP 32 9.352 19.464 -8.125 1053 HH2 TRP 32 HH2 TRP 32 11.151 20.313 -9.620 1054 H LYS 33 HN LYS 33 7.498 21.185 -2.442 1055 HA LYS 33 HA LYS 33 7.528 21.676 0.508 1056 1HB LYS 33 HB2 LYS 33 5.130 21.135 -1.269 1057 2HB LYS 33 HB3 LYS 33 5.153 21.122 0.495 1058 1HG LYS 33 HG2 LYS 33 6.382 23.574 -0.117 1059 2HG LYS 33 HG3 LYS 33 5.132 23.441 -1.358 1060 1HD LYS 33 HD2 LYS 33 4.730 23.087 1.635 1061 2HD LYS 33 HD3 LYS 33 4.486 24.623 0.785 1062 1HE LYS 33 HE2 LYS 33 2.751 23.561 -0.662 1063 2HE LYS 33 HE3 LYS 33 2.942 22.044 0.232 1064 1HZ LYS 33 HZ1 LYS 33 1.070 23.315 1.051 1065 2HZ LYS 33 HZ2 LYS 33 2.193 23.208 2.224 1066 3HZ LYS 33 HZ3 LYS 33 2.004 24.606 1.392 1067 H VAL 34 HN VAL 34 7.990 19.798 1.559 1068 HA VAL 34 HA VAL 34 8.231 17.329 -0.091 1069 HB VAL 34 HB VAL 34 10.007 18.397 2.163 1070 1HG1 VAL 34 HG11 VAL 34 10.172 15.874 0.483 1071 2HG1 VAL 34 HG12 VAL 34 11.509 16.529 1.446 1072 3HG1 VAL 34 HG13 VAL 34 10.026 16.012 2.259 1073 1HG2 VAL 34 HG21 VAL 34 11.711 18.737 0.494 1074 2HG2 VAL 34 HG22 VAL 34 10.654 18.136 -0.795 1075 3HG2 VAL 34 HG23 VAL 34 10.299 19.669 0.025 1076 H TYR 35 HN TYR 35 7.304 15.512 0.699 1077 HA TYR 35 HA TYR 35 6.062 15.496 3.411 1078 1HB TYR 35 HB2 TYR 35 4.768 14.898 0.753 1079 2HB TYR 35 HB3 TYR 35 4.053 14.560 2.326 1080 HD1 TYR 35 HD1 TYR 35 3.202 16.351 3.776 1081 HD2 TYR 35 HD2 TYR 35 4.799 17.168 -0.146 1082 HE1 TYR 35 HE1 TYR 35 2.090 18.561 3.799 1083 HE2 TYR 35 HE2 TYR 35 3.660 19.376 -0.147 1084 HH TYR 35 HH TYR 35 1.660 20.506 2.617 1085 H SER 36 HN SER 36 5.255 13.180 3.883 1086 HA SER 36 HA SER 36 6.597 11.053 2.374 1087 1HB SER 36 HB2 SER 36 7.398 10.122 4.619 1088 2HB SER 36 HB3 SER 36 8.314 11.462 3.908 1089 HG SER 36 HG SER 36 7.480 12.869 5.318 1090 H ALA 37 HN ALA 37 5.664 8.990 2.696 1091 HA ALA 37 HA ALA 37 3.292 8.698 4.416 1092 1HB ALA 37 HB1 ALA 37 2.098 9.463 2.563 1093 2HB ALA 37 HB2 ALA 37 3.305 8.855 1.389 1094 3HB ALA 37 HB3 ALA 37 2.208 7.735 2.188 1095 H GLY 38 HN GLY 38 2.475 6.441 4.300 1096 1HA GLY 38 HA2 GLY 38 3.727 4.340 2.924 1097 2HA GLY 38 HA3 GLY 38 4.418 4.416 4.551 1098 H ILE 39 HN ILE 39 3.171 2.183 4.164 1099 HA ILE 39 HA ILE 39 0.449 1.900 4.249 1100 HB ILE 39 HB ILE 39 1.700 0.017 3.933 1101 1HG1 ILE 39 HG12 ILE 39 0.800 -0.579 6.745 1102 2HG1 ILE 39 HG13 ILE 39 -0.400 -0.125 5.531 1103 1HG2 ILE 39 HG21 ILE 39 3.236 -1.069 5.530 1104 2HG2 ILE 39 HG22 ILE 39 3.797 0.522 5.077 1105 3HG2 ILE 39 HG23 ILE 39 3.044 0.264 6.665 1106 1HD1 ILE 39 HD11 ILE 39 1.438 -2.522 5.475 1107 2HD1 ILE 39 HD12 ILE 39 -0.330 -2.503 5.575 1108 3HD1 ILE 39 HD13 ILE 39 0.469 -1.986 4.074 1109 H GLU 40 HN GLU 40 2.418 2.119 7.207 1110 HA GLU 40 HA GLU 40 0.019 2.746 8.877 1111 1HB GLU 40 HB2 GLU 40 2.182 0.632 9.057 1112 2HB GLU 40 HB3 GLU 40 1.470 1.227 10.555 1113 1HG GLU 40 HG2 GLU 40 -0.349 0.256 8.352 1114 2HG GLU 40 HG3 GLU 40 0.545 -0.907 9.319 1115 H ALA 41 HN ALA 41 1.888 4.504 7.603 1116 HA ALA 41 HA ALA 41 4.148 5.198 9.224 1117 1HB ALA 41 HB1 ALA 41 4.243 7.046 7.555 1118 2HB ALA 41 HB2 ALA 41 3.994 5.451 6.776 1119 3HB ALA 41 HB3 ALA 41 2.645 6.565 6.959 1120 H HIS 42 HN HIS 42 4.407 6.787 10.619 1121 HA HIS 42 HA HIS 42 3.466 9.201 11.072 1122 1HB HIS 42 HB2 HIS 42 1.762 9.112 12.898 1123 2HB HIS 42 HB3 HIS 42 1.168 8.788 11.297 1124 HD1 HIS 42 HD1 HIS 42 2.412 6.503 14.203 1125 HD2 HIS 42 HD2 HIS 42 -0.602 6.889 11.302 1126 HE1 HIS 42 HE1 HIS 42 0.826 4.520 14.549 1127 H GLY 43 HN GLY 43 5.843 8.389 11.426 1128 1HA GLY 43 HA2 GLY 43 6.355 7.960 14.310 1129 2HA GLY 43 HA3 GLY 43 6.851 6.684 13.195 1130 H LEU 44 HN LEU 44 7.444 9.956 14.318 1131 HA LEU 44 HA LEU 44 9.739 10.388 12.562 1132 1HB LEU 44 HB2 LEU 44 8.638 12.366 13.435 1133 2HB LEU 44 HB3 LEU 44 8.875 11.820 15.101 1134 HG LEU 44 HG LEU 44 11.327 12.008 14.865 1135 1HD1 LEU 44 HD11 LEU 44 12.223 13.162 12.751 1136 2HD1 LEU 44 HD12 LEU 44 11.815 11.453 12.608 1137 3HD1 LEU 44 HD13 LEU 44 10.704 12.688 11.972 1138 1HD2 LEU 44 HD21 LEU 44 11.532 14.387 14.722 1139 2HD2 LEU 44 HD22 LEU 44 9.984 14.528 13.873 1140 3HD2 LEU 44 HD23 LEU 44 10.028 13.982 15.562 1141 H ASN 45 HN ASN 45 10.898 8.509 12.771 1142 HA ASN 45 HA ASN 45 11.609 7.225 15.186 1143 1HB ASN 45 HB2 ASN 45 11.597 6.223 12.948 1144 2HB ASN 45 HB3 ASN 45 12.955 7.239 12.452 1145 1HD2 ASN 45 HD22 ASN 45 12.743 4.263 12.554 1146 2HD2 ASN 45 HD21 ASN 45 14.202 3.850 13.463 1147 HA PRO 46 HA PRO 46 14.601 10.311 16.516 1148 1HB PRO 46 HB2 PRO 46 15.852 8.977 18.579 1149 2HB PRO 46 HB3 PRO 46 14.242 9.752 18.683 1150 1HG PRO 46 HG2 PRO 46 14.879 6.838 18.145 1151 2HG PRO 46 HG3 PRO 46 13.683 7.517 19.298 1152 1HD PRO 46 HD2 PRO 46 12.940 6.622 16.853 1153 2HD PRO 46 HD3 PRO 46 12.193 8.092 17.547 1154 H ASN 47 HN ASN 47 15.617 7.018 15.487 1155 HA ASN 47 HA ASN 47 18.405 7.780 15.266 1156 1HB ASN 47 HB2 ASN 47 18.848 5.813 14.262 1157 2HB ASN 47 HB3 ASN 47 17.530 5.399 15.353 1158 1HD2 ASN 47 HD21 ASN 47 18.100 6.225 11.819 1159 2HD2 ASN 47 HD22 ASN 47 17.070 4.897 11.285 1160 H ALA 48 HN ALA 48 15.612 8.559 13.401 1161 HA ALA 48 HA ALA 48 17.129 9.238 10.979 1162 1HB ALA 48 HB1 ALA 48 14.292 10.076 11.674 1163 2HB ALA 48 HB2 ALA 48 15.001 9.745 10.084 1164 3HB ALA 48 HB3 ALA 48 14.726 8.407 11.257 1165 H VAL 49 HN VAL 49 15.660 10.803 13.813 1166 HA VAL 49 HA VAL 49 16.350 13.503 13.124 1167 HB VAL 49 HB VAL 49 16.198 12.320 15.932 1168 1HG1 VAL 49 HG11 VAL 49 15.821 15.176 14.913 1169 2HG1 VAL 49 HG12 VAL 49 15.571 14.635 16.582 1170 3HG1 VAL 49 HG13 VAL 49 17.191 14.573 15.879 1171 1HG2 VAL 49 HG21 VAL 49 14.079 11.847 14.708 1172 2HG2 VAL 49 HG22 VAL 49 13.851 13.052 15.973 1173 3HG2 VAL 49 HG23 VAL 49 13.962 13.564 14.280 1174 H LYS 50 HN LYS 50 18.135 11.022 15.070 1175 HA LYS 50 HA LYS 50 20.531 12.507 15.304 1176 1HB LYS 50 HB2 LYS 50 19.751 10.423 16.563 1177 2HB LYS 50 HB3 LYS 50 20.347 9.471 15.193 1178 1HG LYS 50 HG2 LYS 50 22.614 10.204 15.582 1179 2HG LYS 50 HG3 LYS 50 22.082 11.525 16.621 1180 1HD LYS 50 HD2 LYS 50 23.042 9.849 18.023 1181 2HD LYS 50 HD3 LYS 50 21.301 9.926 18.326 1182 1HE LYS 50 HE2 LYS 50 21.002 7.906 16.855 1183 2HE LYS 50 HE3 LYS 50 22.765 7.825 16.673 1184 1HZ LYS 50 HZ1 LYS 50 21.989 6.345 18.419 1185 2HZ LYS 50 HZ2 LYS 50 22.934 7.500 19.069 1186 3HZ LYS 50 HZ3 LYS 50 21.311 7.574 19.244 1187 H ALA 51 HN ALA 51 19.539 10.279 12.655 1188 HA ALA 51 HA ALA 51 21.876 10.423 11.144 1189 1HB ALA 51 HB1 ALA 51 19.904 9.010 10.616 1190 2HB ALA 51 HB2 ALA 51 19.013 10.454 10.113 1191 3HB ALA 51 HB3 ALA 51 20.449 9.950 9.219 1192 H MET 52 HN MET 52 19.312 12.970 11.466 1193 HA MET 52 HA MET 52 20.576 14.604 9.422 1194 1HB MET 52 HB2 MET 52 18.462 15.350 11.501 1195 2HB MET 52 HB3 MET 52 18.939 16.290 10.094 1196 1HG MET 52 HG2 MET 52 17.376 13.743 10.194 1197 2HG MET 52 HG3 MET 52 16.972 15.255 9.416 1198 1HE MET 52 HE1 MET 52 18.201 16.193 7.464 1199 2HE MET 52 HE2 MET 52 19.910 15.665 7.582 1200 3HE MET 52 HE3 MET 52 18.930 15.246 6.163 1201 H LYS 53 HN LYS 53 20.699 14.407 12.996 1202 HA LYS 53 HA LYS 53 22.226 16.802 13.295 1203 1HB LYS 53 HB2 LYS 53 22.425 14.305 15.038 1204 2HB LYS 53 HB3 LYS 53 22.917 15.933 15.481 1205 1HG LYS 53 HG2 LYS 53 20.079 14.976 15.019 1206 2HG LYS 53 HG3 LYS 53 20.825 15.310 16.566 1207 1HD LYS 53 HD2 LYS 53 20.904 17.679 16.129 1208 2HD LYS 53 HD3 LYS 53 20.425 17.450 14.430 1209 1HE LYS 53 HE2 LYS 53 18.264 16.585 15.052 1210 2HE LYS 53 HE3 LYS 53 18.675 16.606 16.773 1211 1HZ LYS 53 HZ1 LYS 53 17.297 18.525 15.860 1212 2HZ LYS 53 HZ2 LYS 53 18.585 18.933 16.800 1213 3HZ LYS 53 HZ3 LYS 53 18.671 19.082 15.174 1214 H GLU 54 HN GLU 54 23.205 13.601 12.103 1215 HA GLU 54 HA GLU 54 25.990 13.868 12.501 1216 1HB GLU 54 HB2 GLU 54 24.595 12.594 10.113 1217 2HB GLU 54 HB3 GLU 54 26.285 12.405 10.553 1218 1HG GLU 54 HG2 GLU 54 25.472 11.441 12.791 1219 2HG GLU 54 HG3 GLU 54 23.878 11.329 12.048 1220 H VAL 55 HN VAL 55 23.868 15.497 10.205 1221 HA VAL 55 HA VAL 55 26.204 16.912 9.021 1222 HB VAL 55 HB VAL 55 24.789 17.139 6.985 1223 1HG1 VAL 55 HG11 VAL 55 25.296 14.236 7.761 1224 2HG1 VAL 55 HG12 VAL 55 25.294 14.955 6.134 1225 3HG1 VAL 55 HG13 VAL 55 26.560 15.387 7.278 1226 1HG2 VAL 55 HG21 VAL 55 22.549 16.717 8.066 1227 2HG2 VAL 55 HG22 VAL 55 22.845 15.743 6.623 1228 3HG2 VAL 55 HG23 VAL 55 22.984 15.003 8.229 1229 H GLY 56 HN GLY 56 24.298 17.435 11.436 1230 1HA GLY 56 HA2 GLY 56 23.539 19.295 12.488 1231 2HA GLY 56 HA3 GLY 56 24.472 20.240 11.316 1232 H ILE 57 HN ILE 57 21.586 18.081 10.813 1233 HA ILE 57 HA ILE 57 20.013 20.495 10.005 1234 HB ILE 57 HB ILE 57 19.946 17.719 8.763 1235 1HG1 ILE 57 HG12 ILE 57 20.589 20.399 7.468 1236 2HG1 ILE 57 HG13 ILE 57 21.797 19.225 7.981 1237 1HG2 ILE 57 HG21 ILE 57 17.629 18.580 8.911 1238 2HG2 ILE 57 HG22 ILE 57 18.138 20.129 8.196 1239 3HG2 ILE 57 HG23 ILE 57 18.156 18.643 7.249 1240 1HD1 ILE 57 HD11 ILE 57 20.828 17.537 6.416 1241 2HD1 ILE 57 HD12 ILE 57 19.747 18.798 5.777 1242 3HD1 ILE 57 HD13 ILE 57 21.502 18.976 5.641 1243 H ASP 58 HN ASP 58 17.723 20.263 10.640 1244 HA ASP 58 HA ASP 58 17.310 18.362 12.899 1245 1HB ASP 58 HB2 ASP 58 17.699 20.578 13.860 1246 2HB ASP 58 HB3 ASP 58 16.515 21.296 12.757 1247 H ILE 59 HN ILE 59 15.379 17.432 12.986 1248 HA ILE 59 HA ILE 59 13.163 18.263 11.237 1249 HB ILE 59 HB ILE 59 12.706 15.912 10.602 1250 1HG1 ILE 59 HG12 ILE 59 15.582 15.326 11.524 1251 2HG1 ILE 59 HG13 ILE 59 14.131 14.848 12.404 1252 1HG2 ILE 59 HG21 ILE 59 13.784 17.534 9.085 1253 2HG2 ILE 59 HG22 ILE 59 15.381 16.933 9.580 1254 3HG2 ILE 59 HG23 ILE 59 14.239 15.861 8.728 1255 1HD1 ILE 59 HD11 ILE 59 14.988 13.866 9.665 1256 2HD1 ILE 59 HD12 ILE 59 14.809 12.939 11.170 1257 3HD1 ILE 59 HD13 ILE 59 13.380 13.606 10.363 1258 H SER 60 HN SER 60 13.946 18.266 14.260 1259 HA SER 60 HA SER 60 12.280 16.332 15.449 1260 1HB SER 60 HB2 SER 60 12.952 19.096 16.537 1261 2HB SER 60 HB3 SER 60 12.472 17.662 17.471 1262 HG SER 60 HG SER 60 14.865 18.124 16.000 1263 H ASN 61 HN ASN 61 11.460 19.057 13.613 1264 HA ASN 61 HA ASN 61 8.812 19.698 14.418 1265 1HB ASN 61 HB2 ASN 61 9.883 21.237 13.006 1266 2HB ASN 61 HB3 ASN 61 10.567 19.988 11.974 1267 1HD2 ASN 61 HD22 ASN 61 9.403 19.139 10.227 1268 2HD2 ASN 61 HD21 ASN 61 7.913 19.881 9.671 1269 H GLN 62 HN GLN 62 10.090 16.984 12.490 1270 HA GLN 62 HA GLN 62 7.888 16.570 10.864 1271 1HB GLN 62 HB2 GLN 62 10.336 15.038 11.550 1272 2HB GLN 62 HB3 GLN 62 8.992 14.105 10.947 1273 1HG GLN 62 HG2 GLN 62 10.420 14.738 9.121 1274 2HG GLN 62 HG3 GLN 62 8.821 15.435 8.948 1275 1HE2 GLN 62 HE22 GLN 62 10.196 16.613 7.277 1276 2HE2 GLN 62 HE21 GLN 62 11.033 18.083 7.785 1277 H THR 63 HN THR 63 6.436 14.756 10.835 1278 HA THR 63 HA THR 63 5.669 13.524 13.396 1279 HB THR 63 HB THR 63 4.693 15.800 13.427 1280 HG1 THR 63 HG1 THR 63 3.630 14.267 14.582 1281 1HG2 THR 63 HG21 THR 63 2.950 14.908 11.094 1282 2HG2 THR 63 HG22 THR 63 2.792 16.405 12.033 1283 3HG2 THR 63 HG23 THR 63 4.222 16.151 11.030 1284 H SER 64 HN SER 64 5.162 13.772 9.882 1285 HA SER 64 HA SER 64 4.485 12.395 8.314 1286 1HB SER 64 HB2 SER 64 4.823 9.856 8.778 1287 2HB SER 64 HB3 SER 64 6.186 10.962 8.574 1288 HG SER 64 HG SER 64 5.343 10.745 11.167 1289 H ASP 65 HN ASP 65 3.081 10.347 7.736 1290 HA ASP 65 HA ASP 65 0.664 9.894 9.194 1291 1HB ASP 65 HB2 ASP 65 0.299 12.280 8.335 1292 2HB ASP 65 HB3 ASP 65 0.526 11.653 6.697 1293 H ILE 66 HN ILE 66 -0.830 8.540 7.670 1294 HA ILE 66 HA ILE 66 0.709 6.674 6.104 1295 HB ILE 66 HB ILE 66 -1.565 5.739 5.640 1296 1HG1 ILE 66 HG12 ILE 66 -2.591 7.844 7.580 1297 2HG1 ILE 66 HG13 ILE 66 -2.785 7.958 5.825 1298 1HG2 ILE 66 HG21 ILE 66 -1.852 4.861 7.888 1299 2HG2 ILE 66 HG22 ILE 66 -0.144 5.034 7.502 1300 3HG2 ILE 66 HG23 ILE 66 -0.926 6.220 8.573 1301 1HD1 ILE 66 HD11 ILE 66 -3.905 5.804 7.645 1302 2HD1 ILE 66 HD12 ILE 66 -4.800 7.078 6.800 1303 3HD1 ILE 66 HD13 ILE 66 -4.013 5.785 5.862 1304 H ILE 67 HN ILE 67 -0.223 6.045 3.863 1305 HA ILE 67 HA ILE 67 0.160 8.044 1.986 1306 HB ILE 67 HB ILE 67 -0.306 6.551 0.380 1307 1HG1 ILE 67 HG12 ILE 67 -2.631 5.431 1.968 1308 2HG1 ILE 67 HG13 ILE 67 -2.688 6.495 0.557 1309 1HG2 ILE 67 HG21 ILE 67 -0.182 4.518 2.628 1310 2HG2 ILE 67 HG22 ILE 67 0.370 4.332 0.958 1311 3HG2 ILE 67 HG23 ILE 67 1.220 5.443 2.020 1312 1HD1 ILE 67 HD11 ILE 67 -2.270 3.567 0.685 1313 2HD1 ILE 67 HD12 ILE 67 -3.127 4.573 -0.526 1314 3HD1 ILE 67 HD13 ILE 67 -1.355 4.420 -0.567 1315 H ASP 68 HN ASP 68 -0.990 9.650 1.121 1316 HA ASP 68 HA ASP 68 -3.903 9.794 1.514 1317 1HB ASP 68 HB2 ASP 68 -2.982 10.885 3.529 1318 2HB ASP 68 HB3 ASP 68 -2.112 12.034 2.507 1319 H SER 69 HN SER 69 -4.196 9.595 -0.603 1320 HA SER 69 HA SER 69 -2.904 10.711 -2.723 1321 1HB SER 69 HB2 SER 69 -5.898 10.395 -2.408 1322 2HB SER 69 HB3 SER 69 -4.973 10.295 -3.922 1323 HG SER 69 HG SER 69 -3.962 8.418 -3.073 1324 H ASP 70 HN ASP 70 -4.896 12.578 -0.424 1325 HA ASP 70 HA ASP 70 -5.813 14.546 -2.274 1326 1HB ASP 70 HB2 ASP 70 -6.722 14.221 0.018 1327 2HB ASP 70 HB3 ASP 70 -5.210 14.887 0.672 1328 H ILE 71 HN ILE 71 -2.701 14.014 -0.842 1329 HA ILE 71 HA ILE 71 -1.710 16.630 -1.919 1330 HB ILE 71 HB ILE 71 -0.388 15.043 0.236 1331 1HG1 ILE 71 HG12 ILE 71 -1.523 17.186 1.657 1332 2HG1 ILE 71 HG13 ILE 71 -2.849 16.681 0.616 1333 1HG2 ILE 71 HG21 ILE 71 0.729 17.024 0.888 1334 2HG2 ILE 71 HG22 ILE 71 0.936 16.854 -0.866 1335 3HG2 ILE 71 HG23 ILE 71 -0.231 18.032 -0.230 1336 1HD1 ILE 71 HD11 ILE 71 -2.501 14.325 1.401 1337 2HD1 ILE 71 HD12 ILE 71 -1.174 14.930 2.437 1338 3HD1 ILE 71 HD13 ILE 71 -2.852 15.449 2.740 1339 H LEU 72 HN LEU 72 -1.120 13.084 -1.416 1340 HA LEU 72 HA LEU 72 1.347 13.106 -2.816 1341 1HB LEU 72 HB2 LEU 72 0.497 11.421 -1.177 1342 2HB LEU 72 HB3 LEU 72 -0.520 10.732 -2.439 1343 HG LEU 72 HG LEU 72 2.484 11.085 -2.834 1344 1HD1 LEU 72 HD11 LEU 72 2.238 9.929 -0.715 1345 2HD1 LEU 72 HD12 LEU 72 1.107 8.778 -1.411 1346 3HD1 LEU 72 HD13 LEU 72 2.812 8.800 -1.940 1347 1HD2 LEU 72 HD21 LEU 72 0.382 9.295 -4.115 1348 2HD2 LEU 72 HD22 LEU 72 1.492 10.429 -4.888 1349 3HD2 LEU 72 HD23 LEU 72 2.118 8.940 -4.206 1350 H ASN 73 HN ASN 73 -2.030 12.526 -4.034 1351 HA ASN 73 HA ASN 73 -1.094 11.996 -6.685 1352 1HB ASN 73 HB2 ASN 73 -3.181 11.619 -7.250 1353 2HB ASN 73 HB3 ASN 73 -3.568 11.716 -5.550 1354 1HD2 ASN 73 HD22 ASN 73 -4.233 14.006 -4.771 1355 2HD2 ASN 73 HD21 ASN 73 -5.102 15.029 -5.902 1356 H ASN 74 HN ASN 74 -1.463 14.931 -4.829 1357 HA ASN 74 HA ASN 74 -1.398 16.695 -7.145 1358 1HB ASN 74 HB2 ASN 74 -1.548 17.131 -4.156 1359 2HB ASN 74 HB3 ASN 74 -1.007 18.433 -5.191 1360 1HD2 ASN 74 HD22 ASN 74 -3.805 17.255 -3.762 1361 2HD2 ASN 74 HD21 ASN 74 -4.940 17.924 -4.901 1362 H ALA 75 HN ALA 75 0.983 14.984 -5.235 1363 HA ALA 75 HA ALA 75 3.185 16.682 -5.613 1364 1HB ALA 75 HB1 ALA 75 3.249 13.645 -5.738 1365 2HB ALA 75 HB2 ALA 75 4.557 14.757 -5.295 1366 3HB ALA 75 HB3 ALA 75 3.150 14.595 -4.236 1367 H ASP 76 HN ASP 76 4.922 16.470 -7.058 1368 HA ASP 76 HA ASP 76 4.152 16.044 -9.906 1369 1HB ASP 76 HB2 ASP 76 5.480 18.042 -9.307 1370 2HB ASP 76 HB3 ASP 76 6.749 17.005 -8.640 1371 H LEU 77 HN LEU 77 6.111 14.591 -7.317 1372 HA LEU 77 HA LEU 77 6.775 12.291 -8.992 1373 1HB LEU 77 HB2 LEU 77 8.688 13.673 -9.383 1374 2HB LEU 77 HB3 LEU 77 8.729 14.213 -7.710 1375 HG LEU 77 HG LEU 77 9.457 11.980 -6.968 1376 1HD1 LEU 77 HD11 LEU 77 9.937 10.170 -8.253 1377 2HD1 LEU 77 HD12 LEU 77 8.535 10.776 -9.154 1378 3HD1 LEU 77 HD13 LEU 77 10.191 11.098 -9.719 1379 1HD2 LEU 77 HD21 LEU 77 11.766 12.125 -7.896 1380 2HD2 LEU 77 HD22 LEU 77 11.175 13.259 -9.128 1381 3HD2 LEU 77 HD23 LEU 77 11.115 13.701 -7.411 1382 H VAL 78 HN VAL 78 6.551 10.471 -7.881 1383 HA VAL 78 HA VAL 78 6.548 10.470 -4.911 1384 HB VAL 78 HB VAL 78 5.677 8.223 -6.736 1385 1HG1 VAL 78 HG11 VAL 78 6.257 7.650 -4.382 1386 2HG1 VAL 78 HG12 VAL 78 5.116 8.889 -3.805 1387 3HG1 VAL 78 HG13 VAL 78 4.528 7.466 -4.687 1388 1HG2 VAL 78 HG21 VAL 78 4.007 10.519 -5.631 1389 2HG2 VAL 78 HG22 VAL 78 4.192 9.962 -7.313 1390 3HG2 VAL 78 HG23 VAL 78 3.329 8.953 -6.175 1391 H VAL 79 HN VAL 79 8.551 10.344 -4.230 1392 HA VAL 79 HA VAL 79 10.641 8.804 -5.623 1393 HB VAL 79 HB VAL 79 10.567 10.316 -2.974 1394 1HG1 VAL 79 HG11 VAL 79 12.433 8.569 -3.226 1395 2HG1 VAL 79 HG12 VAL 79 13.039 9.559 -4.574 1396 3HG1 VAL 79 HG13 VAL 79 12.972 10.235 -2.951 1397 1HG2 VAL 79 HG21 VAL 79 11.863 12.088 -4.121 1398 2HG2 VAL 79 HG22 VAL 79 11.590 11.259 -5.668 1399 3HG2 VAL 79 HG23 VAL 79 10.223 11.927 -4.742 1400 H THR 80 HN THR 80 10.034 6.601 -5.473 1401 HA THR 80 HA THR 80 8.946 5.505 -2.977 1402 HB THR 80 HB THR 80 10.250 4.091 -5.342 1403 HG1 THR 80 HG1 THR 80 8.208 5.413 -5.521 1404 1HG2 THR 80 HG21 THR 80 8.503 3.076 -3.056 1405 2HG2 THR 80 HG22 THR 80 8.984 2.123 -4.489 1406 3HG2 THR 80 HG23 THR 80 10.212 2.666 -3.333 1407 H LEU 81 HN LEU 81 10.159 5.231 -1.177 1408 HA LEU 81 HA LEU 81 13.132 5.423 -1.387 1409 1HB LEU 81 HB2 LEU 81 11.859 7.636 -1.087 1410 2HB LEU 81 HB3 LEU 81 11.297 7.013 0.444 1411 HG LEU 81 HG LEU 81 13.977 6.638 0.782 1412 1HD1 LEU 81 HD11 LEU 81 13.814 9.090 -0.997 1413 2HD1 LEU 81 HD12 LEU 81 15.248 8.506 -0.152 1414 3HD1 LEU 81 HD13 LEU 81 14.536 7.543 -1.471 1415 1HD2 LEU 81 HD21 LEU 81 12.429 7.895 2.249 1416 2HD2 LEU 81 HD22 LEU 81 14.024 8.643 2.083 1417 3HD2 LEU 81 HD23 LEU 81 12.633 9.317 1.205 1418 H SER 82 HN SER 82 12.237 2.967 -1.025 1419 HA SER 82 HA SER 82 13.364 2.183 1.432 1420 1HB SER 82 HB2 SER 82 11.041 2.747 2.269 1421 2HB SER 82 HB3 SER 82 10.380 1.565 1.123 1422 HG SER 82 HG SER 82 10.615 0.358 2.870 1423 H GLY 83 HN GLY 83 12.488 -0.500 1.378 1424 1HA GLY 83 HA2 GLY 83 12.310 -1.482 -1.359 1425 2HA GLY 83 HA3 GLY 83 13.884 -1.768 -0.602 1426 H ASP 84 HN ASP 84 10.601 -1.766 0.928 1427 HA ASP 84 HA ASP 84 10.767 -4.700 1.244 1428 1HB ASP 84 HB2 ASP 84 11.648 -3.773 3.331 1429 2HB ASP 84 HB3 ASP 84 10.205 -2.789 3.530 1430 H ALA 85 HN ALA 85 8.919 -5.628 0.720 1431 HA ALA 85 HA ALA 85 6.962 -4.090 -0.618 1432 1HB ALA 85 HB1 ALA 85 6.961 -7.052 0.109 1433 2HB ALA 85 HB2 ALA 85 5.977 -6.277 -1.149 1434 3HB ALA 85 HB3 ALA 85 7.739 -6.332 -1.325 1435 H ALA 86 HN ALA 86 7.013 -4.651 2.781 1436 HA ALA 86 HA ALA 86 4.256 -5.227 3.208 1437 1HB ALA 86 HB1 ALA 86 5.876 -5.454 5.028 1438 2HB ALA 86 HB2 ALA 86 6.189 -3.709 5.018 1439 3HB ALA 86 HB3 ALA 86 4.599 -4.308 5.494 1440 H ASP 87 HN ASP 87 5.583 -2.356 1.840 1441 HA ASP 87 HA ASP 87 4.058 -0.437 3.193 1442 1HB ASP 87 HB2 ASP 87 6.185 -0.157 1.772 1443 2HB ASP 87 HB3 ASP 87 5.102 -0.028 0.393 1444 H LYS 88 HN LYS 88 2.355 -2.628 1.835 1445 HA LYS 88 HA LYS 88 0.290 -2.843 0.981 1446 1HB LYS 88 HB2 LYS 88 0.044 -0.591 2.366 1447 2HB LYS 88 HB3 LYS 88 -0.178 0.134 0.779 1448 1HG LYS 88 HG2 LYS 88 -2.061 -1.367 0.338 1449 2HG LYS 88 HG3 LYS 88 -1.820 -2.195 1.883 1450 1HD LYS 88 HD2 LYS 88 -2.491 0.761 1.534 1451 2HD LYS 88 HD3 LYS 88 -3.674 -0.515 1.834 1452 1HE LYS 88 HE2 LYS 88 -1.374 0.084 3.737 1453 2HE LYS 88 HE3 LYS 88 -2.896 0.961 3.812 1454 1HZ LYS 88 HZ1 LYS 88 -2.862 -0.909 5.352 1455 2HZ LYS 88 HZ2 LYS 88 -4.068 -1.060 4.282 1456 3HZ LYS 88 HZ3 LYS 88 -2.707 -1.983 4.129 1457 H CYS 89 HN CYS 89 2.675 -2.480 -0.704 1458 HA CYS 89 HA CYS 89 3.445 -1.871 -2.760 1459 1HB CYS 89 HB2 CYS 89 1.130 -3.525 -3.744 1460 2HB CYS 89 HB3 CYS 89 2.752 -3.447 -4.380 1461 HA PRO 90 HA PRO 90 -0.040 1.244 -3.286 1462 1HB PRO 90 HB2 PRO 90 2.270 3.151 -3.564 1463 2HB PRO 90 HB3 PRO 90 0.715 3.393 -2.708 1464 1HG PRO 90 HG2 PRO 90 2.934 2.849 -1.270 1465 2HG PRO 90 HG3 PRO 90 1.396 2.012 -0.889 1466 1HD PRO 90 HD2 PRO 90 3.701 1.014 -2.608 1467 2HD PRO 90 HD3 PRO 90 2.900 0.178 -1.264 1468 H MET 91 HN MET 91 -0.959 1.714 -5.311 1469 HA MET 91 HA MET 91 0.723 0.931 -7.569 1470 1HB MET 91 HB2 MET 91 -1.361 1.161 -8.934 1471 2HB MET 91 HB3 MET 91 -1.333 -0.020 -7.650 1472 1HG MET 91 HG2 MET 91 -3.378 0.929 -7.452 1473 2HG MET 91 HG3 MET 91 -2.505 1.718 -6.180 1474 1HE MET 91 HE1 MET 91 -5.226 2.293 -7.801 1475 2HE MET 91 HE2 MET 91 -4.562 2.751 -6.241 1476 3HE MET 91 HE3 MET 91 -5.215 4.031 -7.388 1477 H THR 92 HN THR 92 0.422 3.911 -6.182 1478 HA THR 92 HA THR 92 0.590 6.050 -6.742 1479 HB THR 92 HB THR 92 2.451 6.620 -8.366 1480 HG1 THR 92 HG1 THR 92 2.319 4.568 -9.465 1481 1HG2 THR 92 HG21 THR 92 4.175 5.912 -6.761 1482 2HG2 THR 92 HG22 THR 92 2.739 6.518 -5.928 1483 3HG2 THR 92 HG23 THR 92 3.032 4.773 -6.009 1484 HA PRO 93 HA PRO 93 -2.466 6.197 -9.975 1485 1HB PRO 93 HB2 PRO 93 -3.589 8.658 -9.493 1486 2HB PRO 93 HB3 PRO 93 -3.887 7.219 -8.466 1487 1HG PRO 93 HG2 PRO 93 -1.903 9.452 -7.959 1488 2HG PRO 93 HG3 PRO 93 -3.100 8.726 -6.831 1489 1HD PRO 93 HD2 PRO 93 -0.494 7.934 -6.862 1490 2HD PRO 93 HD3 PRO 93 -1.822 6.764 -6.594 1491 HA PRO 94 HA PRO 94 0.065 7.847 -13.085 1492 1HB PRO 94 HB2 PRO 94 -1.673 8.311 -15.215 1493 2HB PRO 94 HB3 PRO 94 -1.129 6.704 -14.652 1494 1HG PRO 94 HG2 PRO 94 -3.674 8.178 -13.897 1495 2HG PRO 94 HG3 PRO 94 -3.500 6.478 -14.453 1496 1HD PRO 94 HD2 PRO 94 -3.684 6.995 -11.828 1497 2HD PRO 94 HD3 PRO 94 -2.448 5.835 -12.414 1498 H HIS 95 HN HIS 95 -2.103 9.974 -11.631 1499 HA HIS 95 HA HIS 95 -1.650 12.404 -13.042 1500 1HB HIS 95 HB2 HIS 95 -2.049 12.043 -10.051 1501 2HB HIS 95 HB3 HIS 95 -2.464 13.447 -11.027 1502 HD1 HIS 95 HD1 HIS 95 -4.246 12.075 -13.292 1503 HD2 HIS 95 HD2 HIS 95 -4.322 11.130 -9.192 1504 HE1 HIS 95 HE1 HIS 95 -6.480 10.936 -12.855 1505 H VAL 96 HN VAL 96 0.596 10.393 -11.307 1506 HA VAL 96 HA VAL 96 2.454 12.682 -10.898 1507 HB VAL 96 HB VAL 96 2.364 10.291 -9.041 1508 1HG1 VAL 96 HG11 VAL 96 4.266 11.796 -8.815 1509 2HG1 VAL 96 HG12 VAL 96 3.213 13.202 -8.808 1510 3HG1 VAL 96 HG13 VAL 96 3.197 12.081 -7.439 1511 1HG2 VAL 96 HG21 VAL 96 0.052 11.072 -8.893 1512 2HG2 VAL 96 HG22 VAL 96 0.955 11.519 -7.454 1513 3HG2 VAL 96 HG23 VAL 96 0.622 12.753 -8.692 1514 H LYS 97 HN LYS 97 4.664 12.243 -11.128 1515 HA LYS 97 HA LYS 97 5.482 9.919 -12.755 1516 1HB LYS 97 HB2 LYS 97 6.230 12.320 -13.066 1517 2HB LYS 97 HB3 LYS 97 7.082 12.197 -11.531 1518 1HG LYS 97 HG2 LYS 97 7.712 10.011 -13.444 1519 2HG LYS 97 HG3 LYS 97 8.080 11.616 -14.076 1520 1HD LYS 97 HD2 LYS 97 9.009 10.524 -11.433 1521 2HD LYS 97 HD3 LYS 97 9.978 10.475 -12.899 1522 1HE LYS 97 HE2 LYS 97 9.030 13.031 -11.490 1523 2HE LYS 97 HE3 LYS 97 10.658 12.363 -11.416 1524 1HZ LYS 97 HZ1 LYS 97 10.684 14.055 -12.997 1525 2HZ LYS 97 HZ2 LYS 97 10.778 12.687 -13.864 1526 3HZ LYS 97 HZ3 LYS 97 9.356 13.512 -13.806 1527 H ARG 98 HN ARG 98 7.208 8.421 -11.889 1528 HA ARG 98 HA ARG 98 7.700 8.582 -8.995 1529 1HB ARG 98 HB2 ARG 98 5.678 7.090 -9.212 1530 2HB ARG 98 HB3 ARG 98 6.605 6.056 -10.292 1531 1HG ARG 98 HG2 ARG 98 8.260 6.130 -8.033 1532 2HG ARG 98 HG3 ARG 98 6.688 6.288 -7.302 1533 1HD ARG 98 HD2 ARG 98 7.369 4.138 -9.367 1534 2HD ARG 98 HD3 ARG 98 7.769 3.940 -7.681 1535 HE ARG 98 HE ARG 98 4.989 4.275 -8.750 1536 1HH1 ARG 98 HH11 ARG 98 6.999 3.219 -6.003 1537 2HH1 ARG 98 HH12 ARG 98 5.856 2.022 -5.485 1538 1HH2 ARG 98 HH21 ARG 98 3.468 2.991 -7.932 1539 2HH2 ARG 98 HH22 ARG 98 3.686 1.962 -6.556 1540 H GLU 99 HN GLU 99 9.662 7.651 -8.423 1541 HA GLU 99 HA GLU 99 11.009 5.848 -10.191 1542 1HB GLU 99 HB2 GLU 99 11.808 8.032 -11.104 1543 2HB GLU 99 HB3 GLU 99 12.370 8.497 -9.499 1544 1HG GLU 99 HG2 GLU 99 14.200 7.687 -10.961 1545 2HG GLU 99 HG3 GLU 99 14.034 6.704 -9.515 1546 H HIS 100 HN HIS 100 12.641 4.735 -8.961 1547 HA HIS 100 HA HIS 100 12.101 4.843 -6.047 1548 1HB HIS 100 HB2 HIS 100 12.364 2.507 -5.958 1549 2HB HIS 100 HB3 HIS 100 11.271 2.837 -7.290 1550 HD1 HIS 100 HD1 HIS 100 13.294 3.141 -9.752 1551 HD2 HIS 100 HD2 HIS 100 13.685 0.405 -6.553 1552 HE1 HIS 100 HE1 HIS 100 14.725 1.237 -10.602 1553 H TRP 101 HN TRP 101 13.685 4.856 -4.602 1554 HA TRP 101 HA TRP 101 16.530 4.950 -5.477 1555 1HB TRP 101 HB2 TRP 101 14.988 7.077 -3.928 1556 2HB TRP 101 HB3 TRP 101 16.717 7.101 -4.248 1557 HD1 TRP 101 HD1 TRP 101 13.400 7.885 -5.865 1558 HE1 TRP 101 HE1 TRP 101 13.781 9.102 -8.086 1559 HE3 TRP 101 HE3 TRP 101 18.395 6.935 -6.460 1560 HZ2 TRP 101 HZ2 TRP 101 15.910 9.462 -9.945 1561 HZ3 TRP 101 HZ3 TRP 101 19.565 7.670 -8.522 1562 HH2 TRP 101 HH2 TRP 101 18.342 8.945 -10.274 1563 H GLY 102 HN GLY 102 14.861 2.986 -3.835 1564 1HA GLY 102 HA2 GLY 102 16.649 2.926 -1.494 1565 2HA GLY 102 HA3 GLY 102 14.903 2.814 -1.221 1566 H PHE 103 HN PHE 103 16.451 0.832 -0.407 1567 HA PHE 103 HA PHE 103 15.894 -1.528 -2.040 1568 1HB PHE 103 HB2 PHE 103 18.764 -0.791 -1.307 1569 2HB PHE 103 HB3 PHE 103 18.246 -2.283 -2.066 1570 HD1 PHE 103 HD1 PHE 103 19.248 1.169 -2.620 1571 HD2 PHE 103 HD2 PHE 103 17.305 -2.230 -4.440 1572 HE1 PHE 103 HE1 PHE 103 19.567 2.183 -4.862 1573 HE2 PHE 103 HE2 PHE 103 17.632 -1.211 -6.680 1574 HZ PHE 103 HZ PHE 103 18.757 0.997 -6.896 1575 H ASP 104 HN ASP 104 17.199 0.019 0.823 1576 HA ASP 104 HA ASP 104 16.080 -1.961 2.630 1577 1HB ASP 104 HB2 ASP 104 18.097 -2.307 3.873 1578 2HB ASP 104 HB3 ASP 104 18.438 -2.763 2.208 1579 H ASP 105 HN ASP 105 16.291 -1.013 4.914 1580 HA ASP 105 HA ASP 105 16.219 1.937 4.941 1581 1HB ASP 105 HB2 ASP 105 13.980 1.335 4.365 1582 2HB ASP 105 HB3 ASP 105 13.954 -0.005 5.493 1583 HA PRO 106 HA PRO 106 18.417 0.896 8.520 1584 1HB PRO 106 HB2 PRO 106 18.822 3.286 9.731 1585 2HB PRO 106 HB3 PRO 106 19.433 2.935 8.078 1586 1HG PRO 106 HG2 PRO 106 16.936 4.443 8.837 1587 2HG PRO 106 HG3 PRO 106 18.184 4.889 7.634 1588 1HD PRO 106 HD2 PRO 106 15.821 3.584 7.018 1589 2HD PRO 106 HD3 PRO 106 17.318 3.407 6.050 1590 H ALA 107 HN ALA 107 15.156 2.079 9.009 1591 HA ALA 107 HA ALA 107 15.165 1.666 11.860 1592 1HB ALA 107 HB1 ALA 107 12.748 1.881 11.679 1593 2HB ALA 107 HB2 ALA 107 13.516 3.155 10.706 1594 3HB ALA 107 HB3 ALA 107 12.818 1.726 9.919 1595 H ARG 108 HN ARG 108 15.805 -0.382 9.372 1596 HA ARG 108 HA ARG 108 14.464 -2.749 10.648 1597 1HB ARG 108 HB2 ARG 108 15.567 -2.869 7.887 1598 2HB ARG 108 HB3 ARG 108 14.302 -3.842 8.615 1599 1HG ARG 108 HG2 ARG 108 14.163 -1.025 7.514 1600 2HG ARG 108 HG3 ARG 108 13.421 -2.437 6.804 1601 1HD ARG 108 HD2 ARG 108 11.560 -2.317 8.145 1602 2HD ARG 108 HD3 ARG 108 12.450 -1.669 9.538 1603 HE ARG 108 HE ARG 108 12.720 0.431 8.030 1604 1HH1 ARG 108 HH11 ARG 108 9.685 -1.413 8.394 1605 2HH1 ARG 108 HH12 ARG 108 8.716 -0.117 7.759 1606 1HH2 ARG 108 HH21 ARG 108 11.432 2.010 7.022 1607 2HH2 ARG 108 HH22 ARG 108 9.691 1.801 7.006 1608 H ALA 109 HN ALA 109 17.239 -1.182 10.819 1609 HA ALA 109 HA ALA 109 19.357 -2.824 10.117 1610 1HB ALA 109 HB1 ALA 109 19.490 -0.542 11.190 1611 2HB ALA 109 HB2 ALA 109 19.041 -1.304 12.736 1612 3HB ALA 109 HB3 ALA 109 20.556 -1.749 11.929 1613 H GLN 110 HN GLN 110 20.646 -4.208 11.454 1614 HA GLN 110 HA GLN 110 19.193 -6.446 12.056 1615 1HB GLN 110 HB2 GLN 110 21.669 -6.343 11.508 1616 2HB GLN 110 HB3 GLN 110 22.001 -5.816 13.164 1617 1HG GLN 110 HG2 GLN 110 20.364 -8.307 12.957 1618 2HG GLN 110 HG3 GLN 110 21.965 -8.443 12.239 1619 1HE2 GLN 110 HE22 GLN 110 20.201 -7.831 15.283 1620 2HE2 GLN 110 HE21 GLN 110 21.550 -8.218 16.333 1621 H GLY 111 HN GLY 111 20.281 -3.910 14.254 1622 1HA GLY 111 HA2 GLY 111 18.521 -3.453 15.849 1623 2HA GLY 111 HA3 GLY 111 18.660 -5.158 16.395 1624 H THR 112 HN THR 112 21.701 -4.592 15.992 1625 HA THR 112 HA THR 112 22.217 -4.031 18.804 1626 HB THR 112 HB THR 112 24.566 -4.282 18.209 1627 HG1 THR 112 HG1 THR 112 25.058 -4.703 15.992 1628 1HG2 THR 112 HG21 THR 112 23.058 -6.328 18.342 1629 2HG2 THR 112 HG22 THR 112 23.027 -6.297 16.551 1630 3HG2 THR 112 HG23 THR 112 24.566 -6.530 17.410 1631 H GLU 113 HN GLU 113 23.735 -2.247 19.409 1632 HA GLU 113 HA GLU 113 22.669 0.215 18.602 1633 1HB GLU 113 HB2 GLU 113 25.360 -0.477 19.903 1634 2HB GLU 113 HB3 GLU 113 24.651 1.156 19.889 1635 1HG GLU 113 HG2 GLU 113 22.647 0.237 21.107 1636 2HG GLU 113 HG3 GLU 113 23.472 -1.319 21.222 1637 H GLU 114 HN GLU 114 25.590 -1.543 17.639 1638 HA GLU 114 HA GLU 114 26.711 0.494 15.994 1639 1HB GLU 114 HB2 GLU 114 28.039 -1.505 15.085 1640 2HB GLU 114 HB3 GLU 114 28.276 -1.043 16.785 1641 1HG GLU 114 HG2 GLU 114 26.687 -2.897 17.422 1642 2HG GLU 114 HG3 GLU 114 26.655 -3.347 15.694 1643 H GLU 115 HN GLU 115 24.461 -2.370 15.348 1644 HA GLU 115 HA GLU 115 24.826 -1.921 12.523 1645 1HB GLU 115 HB2 GLU 115 22.906 -3.634 14.099 1646 2HB GLU 115 HB3 GLU 115 22.900 -3.551 12.338 1647 1HG GLU 115 HG2 GLU 115 25.509 -4.130 13.802 1648 2HG GLU 115 HG3 GLU 115 24.331 -5.413 13.536 1649 H LYS 116 HN LYS 116 22.430 -0.889 14.961 1650 HA LYS 116 HA LYS 116 20.653 0.422 13.152 1651 1HB LYS 116 HB2 LYS 116 21.451 0.934 16.057 1652 2HB LYS 116 HB3 LYS 116 20.292 1.976 15.241 1653 1HG LYS 116 HG2 LYS 116 19.800 -0.999 15.311 1654 2HG LYS 116 HG3 LYS 116 19.467 0.011 16.729 1655 1HD LYS 116 HD2 LYS 116 17.978 1.474 15.410 1656 2HD LYS 116 HD3 LYS 116 18.388 0.613 13.931 1657 1HE LYS 116 HE2 LYS 116 16.269 -0.176 14.600 1658 2HE LYS 116 HE3 LYS 116 17.432 -1.474 14.909 1659 1HZ LYS 116 HZ1 LYS 116 16.315 0.362 16.962 1660 2HZ LYS 116 HZ2 LYS 116 15.874 -1.187 16.751 1661 3HZ LYS 116 HZ3 LYS 116 17.379 -0.842 17.271 1662 H TRP 117 HN TRP 117 23.500 1.721 14.889 1663 HA TRP 117 HA TRP 117 23.228 4.247 13.622 1664 1HB TRP 117 HB2 TRP 117 24.576 3.806 15.687 1665 2HB TRP 117 HB3 TRP 117 25.808 3.052 14.675 1666 HD1 TRP 117 HD1 TRP 117 24.482 5.945 12.836 1667 HE1 TRP 117 HE1 TRP 117 25.996 7.993 13.060 1668 HE3 TRP 117 HE3 TRP 117 27.379 4.381 16.778 1669 HZ2 TRP 117 HZ2 TRP 117 28.033 8.913 14.833 1670 HZ3 TRP 117 HZ3 TRP 117 29.103 5.895 17.728 1671 HH2 TRP 117 HH2 TRP 117 29.445 8.169 16.772 1672 H ALA 118 HN ALA 118 25.146 1.382 12.779 1673 HA ALA 118 HA ALA 118 26.484 2.494 10.581 1674 1HB ALA 118 HB1 ALA 118 27.117 0.343 11.714 1675 2HB ALA 118 HB2 ALA 118 25.594 -0.382 11.215 1676 3HB ALA 118 HB3 ALA 118 26.821 0.025 9.984 1677 H PHE 119 HN PHE 119 23.294 0.835 10.659 1678 HA PHE 119 HA PHE 119 22.993 0.931 7.801 1679 1HB PHE 119 HB2 PHE 119 21.069 0.557 10.104 1680 2HB PHE 119 HB3 PHE 119 20.477 0.896 8.502 1681 HD1 PHE 119 HD1 PHE 119 23.236 -1.447 9.651 1682 HD2 PHE 119 HD2 PHE 119 19.503 -0.940 7.536 1683 HE1 PHE 119 HE1 PHE 119 23.234 -3.846 9.067 1684 HE2 PHE 119 HE2 PHE 119 19.523 -3.336 6.941 1685 HZ PHE 119 HZ PHE 119 21.379 -4.804 7.714 1686 H PHE 120 HN PHE 120 21.938 3.148 10.508 1687 HA PHE 120 HA PHE 120 20.635 4.836 8.610 1688 1HB PHE 120 HB2 PHE 120 19.979 6.213 10.244 1689 2HB PHE 120 HB3 PHE 120 20.132 4.680 11.078 1690 HD1 PHE 120 HD1 PHE 120 20.786 4.820 13.243 1691 HD2 PHE 120 HD2 PHE 120 22.202 7.812 10.473 1692 HE1 PHE 120 HE1 PHE 120 21.803 6.072 15.115 1693 HE2 PHE 120 HE2 PHE 120 23.227 9.041 12.355 1694 HZ PHE 120 HZ PHE 120 23.057 8.186 14.659 1695 H GLN 121 HN GLN 121 23.980 4.973 9.912 1696 HA GLN 121 HA GLN 121 24.621 7.456 8.783 1697 1HB GLN 121 HB2 GLN 121 25.932 6.301 10.461 1698 2HB GLN 121 HB3 GLN 121 26.349 5.007 9.325 1699 1HG GLN 121 HG2 GLN 121 27.656 6.480 7.961 1700 2HG GLN 121 HG3 GLN 121 26.995 7.918 8.753 1701 1HE2 GLN 121 HE22 GLN 121 27.357 8.064 11.221 1702 2HE2 GLN 121 HE21 GLN 121 28.948 7.577 11.786 1703 H ARG 122 HN ARG 122 24.944 4.127 7.393 1704 HA ARG 122 HA ARG 122 26.092 5.003 4.956 1705 1HB ARG 122 HB2 ARG 122 26.275 2.687 5.583 1706 2HB ARG 122 HB3 ARG 122 24.523 2.517 5.764 1707 1HG ARG 122 HG2 ARG 122 24.206 2.769 3.337 1708 2HG ARG 122 HG3 ARG 122 25.948 2.977 3.102 1709 1HD ARG 122 HD2 ARG 122 26.399 0.747 3.494 1710 2HD ARG 122 HD3 ARG 122 25.019 0.518 4.571 1711 HE ARG 122 HE ARG 122 25.069 0.288 1.655 1712 1HH1 ARG 122 HH11 ARG 122 22.976 0.522 4.530 1713 2HH1 ARG 122 HH12 ARG 122 21.536 0.020 3.694 1714 1HH2 ARG 122 HH21 ARG 122 23.123 -0.367 0.564 1715 2HH2 ARG 122 HH22 ARG 122 21.620 -0.434 1.449 1716 H VAL 123 HN VAL 123 22.648 4.210 5.788 1717 HA VAL 123 HA VAL 123 21.707 4.790 3.163 1718 HB VAL 123 HB VAL 123 20.227 4.710 5.824 1719 1HG1 VAL 123 HG11 VAL 123 18.199 4.328 4.322 1720 2HG1 VAL 123 HG12 VAL 123 18.850 5.971 4.297 1721 3HG1 VAL 123 HG13 VAL 123 19.190 4.857 2.956 1722 1HG2 VAL 123 HG21 VAL 123 19.507 2.471 5.076 1723 2HG2 VAL 123 HG22 VAL 123 20.412 2.653 3.561 1724 3HG2 VAL 123 HG23 VAL 123 21.268 2.529 5.105 1725 H ARG 124 HN ARG 124 22.193 6.924 6.026 1726 HA ARG 124 HA ARG 124 20.912 9.192 4.947 1727 1HB ARG 124 HB2 ARG 124 21.448 8.895 7.260 1728 2HB ARG 124 HB3 ARG 124 23.182 8.859 6.953 1729 1HG ARG 124 HG2 ARG 124 21.431 11.272 6.427 1730 2HG ARG 124 HG3 ARG 124 22.100 10.925 8.008 1731 1HD ARG 124 HD2 ARG 124 23.793 11.430 5.545 1732 2HD ARG 124 HD3 ARG 124 23.459 12.581 6.853 1733 HE ARG 124 HE ARG 124 24.461 10.588 8.310 1734 1HH1 ARG 124 HH21 ARG 124 25.801 11.973 5.291 1735 2HH1 ARG 124 HH22 ARG 124 27.423 11.591 5.725 1736 1HH2 ARG 124 HH11 ARG 124 26.449 10.123 8.830 1737 2HH2 ARG 124 HH12 ARG 124 27.849 10.511 7.835 1738 H ASP 125 HN ASP 125 24.333 8.183 4.589 1739 HA ASP 125 HA ASP 125 25.176 10.408 3.073 1740 1HB ASP 125 HB2 ASP 125 26.724 8.701 3.898 1741 2HB ASP 125 HB3 ASP 125 26.007 7.485 2.840 1742 H GLU 126 HN GLU 126 23.594 7.357 1.953 1743 HA GLU 126 HA GLU 126 23.648 8.187 -0.798 1744 1HB GLU 126 HB2 GLU 126 23.611 5.834 -0.173 1745 2HB GLU 126 HB3 GLU 126 22.067 6.038 0.651 1746 1HG GLU 126 HG2 GLU 126 21.681 4.926 -1.410 1747 2HG GLU 126 HG3 GLU 126 20.957 6.518 -1.518 1748 H ILE 127 HN ILE 127 21.109 8.379 1.741 1749 HA ILE 127 HA ILE 127 19.013 9.294 0.071 1750 HB ILE 127 HB ILE 127 19.601 9.205 3.002 1751 1HG1 ILE 127 HG12 ILE 127 17.296 8.442 1.162 1752 2HG1 ILE 127 HG13 ILE 127 18.521 7.365 1.832 1753 1HG2 ILE 127 HG21 ILE 127 18.863 11.507 2.898 1754 2HG2 ILE 127 HG22 ILE 127 17.397 11.013 2.006 1755 3HG2 ILE 127 HG23 ILE 127 17.689 10.498 3.700 1756 1HD1 ILE 127 HD11 ILE 127 17.549 7.830 4.130 1757 2HD1 ILE 127 HD12 ILE 127 16.264 8.756 3.321 1758 3HD1 ILE 127 HD13 ILE 127 16.445 7.029 2.992 1759 H GLY 128 HN GLY 128 21.524 11.187 1.848 1760 1HA GLY 128 HA2 GLY 128 20.562 13.725 0.934 1761 2HA GLY 128 HA3 GLY 128 22.228 13.336 1.469 1762 H ASN 129 HN ASN 129 22.967 11.425 -0.487 1763 HA ASN 129 HA ASN 129 23.658 13.080 -2.670 1764 1HB ASN 129 HB2 ASN 129 25.035 11.160 -2.138 1765 2HB ASN 129 HB3 ASN 129 23.660 10.069 -2.222 1766 1HD2 ASN 129 HD22 ASN 129 23.874 8.694 -3.935 1767 2HD2 ASN 129 HD21 ASN 129 24.398 9.206 -5.533 1768 H ARG 130 HN ARG 130 21.002 10.665 -2.441 1769 HA ARG 130 HA ARG 130 20.278 11.199 -5.215 1770 1HB ARG 130 HB2 ARG 130 18.610 9.848 -3.054 1771 2HB ARG 130 HB3 ARG 130 18.261 9.877 -4.786 1772 1HG ARG 130 HG2 ARG 130 20.545 8.461 -3.381 1773 2HG ARG 130 HG3 ARG 130 19.245 7.754 -4.324 1774 1HD ARG 130 HD2 ARG 130 20.209 8.785 -6.391 1775 2HD ARG 130 HD3 ARG 130 21.503 9.500 -5.416 1776 HE ARG 130 HE ARG 130 21.552 6.779 -4.839 1777 1HH1 ARG 130 HH11 ARG 130 22.380 8.971 -7.545 1778 2HH1 ARG 130 HH12 ARG 130 23.556 7.867 -8.186 1779 1HH2 ARG 130 HH21 ARG 130 23.142 5.558 -5.481 1780 2HH2 ARG 130 HH22 ARG 130 24.045 5.825 -6.961 1781 H LEU 131 HN LEU 131 19.151 12.627 -2.108 1782 HA LEU 131 HA LEU 131 17.146 14.143 -3.545 1783 1HB LEU 131 HB2 LEU 131 18.212 14.171 -0.735 1784 2HB LEU 131 HB3 LEU 131 17.518 15.665 -1.328 1785 HG LEU 131 HG LEU 131 15.838 14.390 -0.164 1786 1HD1 LEU 131 HD11 LEU 131 14.047 14.521 -1.772 1787 2HD1 LEU 131 HD12 LEU 131 15.197 15.801 -2.167 1788 3HD1 LEU 131 HD13 LEU 131 15.124 14.313 -3.135 1789 1HD2 LEU 131 HD21 LEU 131 16.169 12.196 -2.259 1790 2HD2 LEU 131 HD22 LEU 131 16.742 12.116 -0.578 1791 3HD2 LEU 131 HD23 LEU 131 15.017 12.227 -0.914 1792 H LYS 132 HN LYS 132 20.583 14.810 -2.719 1793 HA LYS 132 HA LYS 132 20.378 17.487 -3.715 1794 1HB LYS 132 HB2 LYS 132 22.523 17.764 -3.305 1795 2HB LYS 132 HB3 LYS 132 22.224 16.385 -2.252 1796 1HG LYS 132 HG2 LYS 132 23.167 14.932 -4.151 1797 2HG LYS 132 HG3 LYS 132 23.683 16.434 -4.920 1798 1HD LYS 132 HD2 LYS 132 24.451 15.439 -2.146 1799 2HD LYS 132 HD3 LYS 132 25.486 15.397 -3.592 1800 1HE LYS 132 HE2 LYS 132 25.345 17.909 -3.701 1801 2HE LYS 132 HE3 LYS 132 24.388 17.887 -2.216 1802 1HZ LYS 132 HZ1 LYS 132 26.321 16.876 -1.095 1803 2HZ LYS 132 HZ2 LYS 132 27.204 17.005 -2.467 1804 3HZ LYS 132 HZ3 LYS 132 26.660 18.348 -1.711 1805 H GLU 133 HN GLU 133 21.146 14.343 -5.305 1806 HA GLU 133 HA GLU 133 21.458 15.512 -7.873 1807 1HB GLU 133 HB2 GLU 133 20.545 12.756 -6.952 1808 2HB GLU 133 HB3 GLU 133 20.269 13.223 -8.644 1809 1HG GLU 133 HG2 GLU 133 22.562 13.700 -9.012 1810 2HG GLU 133 HG3 GLU 133 22.993 13.324 -7.328 1811 H PHE 134 HN PHE 134 18.349 14.541 -6.214 1812 HA PHE 134 HA PHE 134 16.775 15.181 -8.476 1813 1HB PHE 134 HB2 PHE 134 15.778 14.080 -6.580 1814 2HB PHE 134 HB3 PHE 134 16.227 15.389 -5.489 1815 HD1 PHE 134 HD1 PHE 134 13.996 14.488 -8.303 1816 HD2 PHE 134 HD2 PHE 134 14.855 17.327 -5.209 1817 HE1 PHE 134 HE1 PHE 134 11.962 15.780 -8.946 1818 HE2 PHE 134 HE2 PHE 134 12.825 18.636 -5.838 1819 HZ PHE 134 HZ PHE 134 11.394 17.862 -7.721 1820 H ALA 135 HN ALA 135 18.068 17.326 -5.943 1821 HA ALA 135 HA ALA 135 16.880 19.727 -6.840 1822 1HB ALA 135 HB1 ALA 135 18.035 19.346 -4.630 1823 2HB ALA 135 HB2 ALA 135 19.594 19.404 -5.486 1824 3HB ALA 135 HB3 ALA 135 18.540 20.830 -5.461 1825 H GLU 136 HN GLU 136 19.746 18.005 -7.984 1826 HA GLU 136 HA GLU 136 20.803 20.223 -9.505 1827 1HB GLU 136 HB2 GLU 136 21.574 17.305 -9.195 1828 2HB GLU 136 HB3 GLU 136 22.452 18.395 -10.249 1829 1HG GLU 136 HG2 GLU 136 22.095 19.116 -7.327 1830 2HG GLU 136 HG3 GLU 136 23.278 17.909 -7.816 1831 H THR 137 HN THR 137 19.190 17.155 -10.086 1832 HA THR 137 HA THR 137 19.487 17.319 -12.986 1833 HB THR 137 HB THR 137 18.580 15.014 -12.896 1834 HG1 THR 137 HG1 THR 137 18.497 15.311 -10.109 1835 1HG2 THR 137 HG21 THR 137 20.966 15.279 -12.596 1836 2HG2 THR 137 HG22 THR 137 20.782 15.535 -10.856 1837 3HG2 THR 137 HG23 THR 137 20.365 13.964 -11.571 1838 H GLY 138 HN GLY 138 17.006 18.010 -10.589 1839 1HA GLY 138 HA2 GLY 138 14.798 18.522 -10.706 1840 2HA GLY 138 HA3 GLY 138 15.092 19.202 -12.336 1841 H LYS 139 HN LYS 139 15.287 16.053 -10.753 1842 HA LYS 139 HA LYS 139 15.168 14.358 -12.692 1843 1HB LYS 139 HB2 LYS 139 15.181 13.822 -10.228 1844 2HB LYS 139 HB3 LYS 139 13.405 13.959 -10.285 1845 1HG LYS 139 HG2 LYS 139 13.771 11.710 -10.362 1846 2HG LYS 139 HG3 LYS 139 13.402 12.137 -12.021 1847 1HD LYS 139 HD2 LYS 139 16.144 11.552 -10.842 1848 2HD LYS 139 HD3 LYS 139 15.195 10.460 -11.847 1849 1HE LYS 139 HE2 LYS 139 16.540 13.053 -12.688 1850 2HE LYS 139 HE3 LYS 139 17.025 11.420 -13.116 1851 1HZ LYS 139 HZ1 LYS 139 15.823 12.403 -14.936 1852 2HZ LYS 139 HZ2 LYS 139 14.942 11.168 -14.356 1853 3HZ LYS 139 HZ3 LYS 139 14.498 12.720 -14.031 Start of MODEL 7 1 1H MET 1 H1 MET 1 -24.129 -13.648 -8.323 2 2H MET 1 H2 MET 1 -24.918 -12.338 -7.707 3 3H MET 1 H3 MET 1 -23.266 -12.352 -7.821 4 HA MET 1 HA MET 1 -25.101 -12.474 -10.111 5 1HB MET 1 HB2 MET 1 -23.466 -10.080 -9.152 6 2HB MET 1 HB3 MET 1 -24.370 -10.191 -10.668 7 1HG MET 1 HG2 MET 1 -26.469 -10.531 -9.306 8 2HG MET 1 HG3 MET 1 -25.504 -10.226 -7.854 9 1HE MET 1 HE1 MET 1 -26.773 -8.282 -6.876 10 2HE MET 1 HE2 MET 1 -27.439 -6.938 -7.830 11 3HE MET 1 HE3 MET 1 -28.018 -8.596 -8.107 12 H ALA 2 HN ALA 2 -21.905 -10.924 -9.982 13 HA ALA 2 HA ALA 2 -20.302 -13.163 -10.692 14 1HB ALA 2 HB1 ALA 2 -19.619 -12.302 -12.932 15 2HB ALA 2 HB2 ALA 2 -21.324 -12.774 -12.957 16 3HB ALA 2 HB3 ALA 2 -20.879 -11.054 -12.849 17 H ILE 3 HN ILE 3 -18.036 -12.250 -11.045 18 HA ILE 3 HA ILE 3 -17.593 -9.833 -9.441 19 HB ILE 3 HB ILE 3 -15.867 -12.100 -10.475 20 1HG1 ILE 3 HG12 ILE 3 -14.954 -12.009 -8.182 21 2HG1 ILE 3 HG13 ILE 3 -16.014 -10.655 -7.805 22 1HG2 ILE 3 HG21 ILE 3 -14.610 -10.149 -11.249 23 2HG2 ILE 3 HG22 ILE 3 -14.853 -9.333 -9.690 24 3HG2 ILE 3 HG23 ILE 3 -13.834 -10.794 -9.810 25 1HD1 ILE 3 HD11 ILE 3 -16.876 -13.489 -8.465 26 2HD1 ILE 3 HD12 ILE 3 -16.845 -12.673 -6.885 27 3HD1 ILE 3 HD13 ILE 3 -17.982 -12.123 -8.104 28 H VAL 4 HN VAL 4 -18.350 -8.146 -10.542 29 HA VAL 4 HA VAL 4 -18.158 -7.874 -13.430 30 HB VAL 4 HB VAL 4 -18.983 -5.920 -11.255 31 1HG1 VAL 4 HG11 VAL 4 -18.672 -4.672 -13.334 32 2HG1 VAL 4 HG12 VAL 4 -19.641 -5.872 -14.230 33 3HG1 VAL 4 HG13 VAL 4 -20.382 -4.825 -13.004 34 1HG2 VAL 4 HG21 VAL 4 -20.716 -7.850 -12.857 35 2HG2 VAL 4 HG22 VAL 4 -20.449 -7.868 -11.100 36 3HG2 VAL 4 HG23 VAL 4 -21.344 -6.545 -11.825 37 H LYS 5 HN LYS 5 -17.146 -5.820 -14.286 38 HA LYS 5 HA LYS 5 -14.713 -5.061 -12.843 39 1HB LYS 5 HB2 LYS 5 -13.339 -5.010 -14.727 40 2HB LYS 5 HB3 LYS 5 -14.027 -6.617 -14.618 41 1HG LYS 5 HG2 LYS 5 -14.809 -4.431 -16.598 42 2HG LYS 5 HG3 LYS 5 -13.812 -5.843 -16.919 43 1HD LYS 5 HD2 LYS 5 -15.779 -7.315 -16.341 44 2HD LYS 5 HD3 LYS 5 -16.792 -5.865 -16.276 45 1HE LYS 5 HE2 LYS 5 -15.188 -6.790 -18.697 46 2HE LYS 5 HE3 LYS 5 -16.907 -7.093 -18.443 47 1HZ LYS 5 HZ1 LYS 5 -16.584 -5.192 -19.860 48 2HZ LYS 5 HZ2 LYS 5 -17.274 -4.691 -18.474 49 3HZ LYS 5 HZ3 LYS 5 -15.683 -4.412 -18.752 50 H ALA 6 HN ALA 6 -14.739 -3.024 -12.405 51 HA ALA 6 HA ALA 6 -16.680 -1.149 -13.592 52 1HB ALA 6 HB1 ALA 6 -15.355 0.395 -11.971 53 2HB ALA 6 HB2 ALA 6 -16.475 -0.771 -11.307 54 3HB ALA 6 HB3 ALA 6 -14.732 -1.115 -11.295 55 H THR 7 HN THR 7 -15.566 1.072 -14.168 56 HA THR 7 HA THR 7 -12.825 1.129 -14.821 57 HB THR 7 HB THR 7 -13.523 -0.072 -16.828 58 HG1 THR 7 HG1 THR 7 -11.880 1.381 -17.022 59 1HG2 THR 7 HG21 THR 7 -14.913 1.047 -18.570 60 2HG2 THR 7 HG22 THR 7 -15.809 0.514 -17.147 61 3HG2 THR 7 HG23 THR 7 -15.415 2.242 -17.354 62 H ASP 8 HN ASP 8 -12.678 3.396 -16.182 63 HA ASP 8 HA ASP 8 -12.528 5.325 -14.381 64 1HB ASP 8 HB2 ASP 8 -11.553 5.489 -16.552 65 2HB ASP 8 HB3 ASP 8 -13.132 5.564 -17.332 66 H GLN 9 HN GLN 9 -15.597 4.770 -16.088 67 HA GLN 9 HA GLN 9 -16.905 6.702 -14.286 68 1HB GLN 9 HB2 GLN 9 -17.161 6.542 -17.306 69 2HB GLN 9 HB3 GLN 9 -18.372 7.342 -16.292 70 1HG GLN 9 HG2 GLN 9 -16.826 9.001 -15.527 71 2HG GLN 9 HG3 GLN 9 -15.437 8.117 -16.128 72 1HE2 GLN 9 HE22 GLN 9 -14.566 8.829 -17.990 73 2HE2 GLN 9 HE21 GLN 9 -15.421 9.737 -19.237 74 H SER 10 HN SER 10 -17.197 3.777 -16.366 75 HA SER 10 HA SER 10 -19.808 3.125 -15.670 76 1HB SER 10 HB2 SER 10 -17.612 1.090 -16.070 77 2HB SER 10 HB3 SER 10 -19.332 0.949 -16.468 78 HG SER 10 HG SER 10 -18.140 1.424 -18.338 79 H PHE 11 HN PHE 11 -16.978 3.031 -13.555 80 HA PHE 11 HA PHE 11 -17.822 1.222 -11.560 81 1HB PHE 11 HB2 PHE 11 -15.691 2.365 -11.341 82 2HB PHE 11 HB3 PHE 11 -16.444 3.924 -11.484 83 HD1 PHE 11 HD1 PHE 11 -16.093 0.976 -9.060 84 HD2 PHE 11 HD2 PHE 11 -17.229 5.136 -9.653 85 HE1 PHE 11 HE1 PHE 11 -16.054 1.386 -6.637 86 HE2 PHE 11 HE2 PHE 11 -17.230 5.472 -7.205 87 HZ PHE 11 HZ PHE 11 -16.616 3.598 -5.693 88 H SER 12 HN SER 12 -18.781 4.703 -12.038 89 HA SER 12 HA SER 12 -20.554 4.760 -9.833 90 1HB SER 12 HB2 SER 12 -20.828 6.301 -12.451 91 2HB SER 12 HB3 SER 12 -21.372 6.807 -10.846 92 HG SER 12 HG SER 12 -19.393 7.821 -11.436 93 H ALA 13 HN ALA 13 -21.052 3.995 -13.310 94 HA ALA 13 HA ALA 13 -23.843 3.931 -13.153 95 1HB ALA 13 HB1 ALA 13 -22.538 4.082 -15.258 96 2HB ALA 13 HB2 ALA 13 -22.038 2.382 -15.066 97 3HB ALA 13 HB3 ALA 13 -23.748 2.780 -15.328 98 H GLU 14 HN GLU 14 -21.444 1.340 -12.664 99 HA GLU 14 HA GLU 14 -23.341 -0.747 -12.271 100 1HB GLU 14 HB2 GLU 14 -20.393 -0.458 -11.624 101 2HB GLU 14 HB3 GLU 14 -21.292 -1.909 -11.197 102 1HG GLU 14 HG2 GLU 14 -20.996 -0.794 -14.008 103 2HG GLU 14 HG3 GLU 14 -20.103 -2.159 -13.334 104 H THR 15 HN THR 15 -22.270 1.806 -10.129 105 HA THR 15 HA THR 15 -22.991 0.223 -7.729 106 HB THR 15 HB THR 15 -21.580 1.881 -6.541 107 HG1 THR 15 HG1 THR 15 -20.625 2.683 -9.039 108 1HG2 THR 15 HG21 THR 15 -19.341 1.291 -7.681 109 2HG2 THR 15 HG22 THR 15 -20.322 -0.049 -7.065 110 3HG2 THR 15 HG23 THR 15 -20.274 0.306 -8.805 111 H SER 16 HN SER 16 -24.414 2.485 -9.736 112 HA SER 16 HA SER 16 -25.396 4.395 -7.862 113 1HB SER 16 HB2 SER 16 -26.325 3.674 -10.648 114 2HB SER 16 HB3 SER 16 -26.920 5.047 -9.688 115 HG SER 16 HG SER 16 -24.187 4.627 -10.369 116 H GLU 17 HN GLU 17 -26.353 1.133 -8.207 117 HA GLU 17 HA GLU 17 -28.864 1.693 -6.809 118 1HB GLU 17 HB2 GLU 17 -28.609 0.079 -9.390 119 2HB GLU 17 HB3 GLU 17 -30.009 -0.017 -8.311 120 1HG GLU 17 HG2 GLU 17 -30.399 2.434 -8.641 121 2HG GLU 17 HG3 GLU 17 -29.078 2.463 -9.815 122 H GLY 18 HN GLY 18 -29.534 0.021 -5.452 123 1HA GLY 18 HA2 GLY 18 -29.363 -1.750 -4.084 124 2HA GLY 18 HA3 GLY 18 -28.378 -2.588 -5.301 125 H VAL 19 HN VAL 19 -27.392 -3.315 -3.216 126 HA VAL 19 HA VAL 19 -25.257 -1.453 -2.295 127 HB VAL 19 HB VAL 19 -25.979 -4.149 -1.059 128 1HG1 VAL 19 HG11 VAL 19 -24.175 -1.848 -0.159 129 2HG1 VAL 19 HG12 VAL 19 -24.524 -3.297 0.779 130 3HG1 VAL 19 HG13 VAL 19 -23.632 -3.438 -0.726 131 1HG2 VAL 19 HG21 VAL 19 -27.873 -2.834 -0.613 132 2HG2 VAL 19 HG22 VAL 19 -26.861 -2.552 0.805 133 3HG2 VAL 19 HG23 VAL 19 -26.943 -1.342 -0.469 134 H VAL 20 HN VAL 20 -23.231 -1.727 -2.881 135 HA VAL 20 HA VAL 20 -22.552 -3.954 -4.690 136 HB VAL 20 HB VAL 20 -22.260 -1.004 -5.434 137 1HG1 VAL 20 HG11 VAL 20 -20.480 -2.383 -6.351 138 2HG1 VAL 20 HG12 VAL 20 -21.626 -3.615 -6.875 139 3HG1 VAL 20 HG13 VAL 20 -21.621 -2.015 -7.656 140 1HG2 VAL 20 HG21 VAL 20 -23.935 -1.639 -7.273 141 2HG2 VAL 20 HG22 VAL 20 -24.330 -3.055 -6.306 142 3HG2 VAL 20 HG23 VAL 20 -24.585 -1.431 -5.652 143 H LEU 21 HN LEU 21 -20.734 -4.713 -3.993 144 HA LEU 21 HA LEU 21 -18.849 -3.113 -2.345 145 1HB LEU 21 HB2 LEU 21 -19.325 -5.473 -1.694 146 2HB LEU 21 HB3 LEU 21 -18.818 -6.015 -3.296 147 HG LEU 21 HG LEU 21 -16.516 -5.137 -2.842 148 1HD1 LEU 21 HD11 LEU 21 -15.939 -4.609 -0.444 149 2HD1 LEU 21 HD12 LEU 21 -16.948 -3.381 -1.200 150 3HD1 LEU 21 HD13 LEU 21 -17.670 -4.563 -0.077 151 1HD2 LEU 21 HD21 LEU 21 -17.103 -7.498 -2.403 152 2HD2 LEU 21 HD22 LEU 21 -15.849 -6.882 -1.337 153 3HD2 LEU 21 HD23 LEU 21 -17.512 -7.075 -0.723 154 H ALA 22 HN ALA 22 -17.021 -2.175 -3.315 155 HA ALA 22 HA ALA 22 -16.248 -3.208 -5.975 156 1HB ALA 22 HB1 ALA 22 -16.011 -0.327 -5.043 157 2HB ALA 22 HB2 ALA 22 -15.502 -0.964 -6.626 158 3HB ALA 22 HB3 ALA 22 -17.216 -0.920 -6.214 159 H ASP 23 HN ASP 23 -14.144 -3.674 -6.221 160 HA ASP 23 HA ASP 23 -12.334 -3.443 -3.866 161 1HB ASP 23 HB2 ASP 23 -13.256 -5.655 -3.816 162 2HB ASP 23 HB3 ASP 23 -13.077 -5.836 -5.561 163 H PHE 24 HN PHE 24 -10.139 -3.400 -4.373 164 HA PHE 24 HA PHE 24 -9.484 -2.569 -7.168 165 1HB PHE 24 HB2 PHE 24 -8.886 -1.282 -4.495 166 2HB PHE 24 HB3 PHE 24 -8.081 -0.831 -5.974 167 HD1 PHE 24 HD1 PHE 24 -8.989 0.887 -7.300 168 HD2 PHE 24 HD2 PHE 24 -11.589 -1.108 -4.517 169 HE1 PHE 24 HE1 PHE 24 -10.852 2.418 -7.919 170 HE2 PHE 24 HE2 PHE 24 -13.451 0.341 -5.207 171 HZ PHE 24 HZ PHE 24 -13.088 2.133 -6.894 172 H TRP 25 HN TRP 25 -8.048 -3.965 -7.921 173 HA TRP 25 HA TRP 25 -6.190 -5.430 -6.119 174 1HB TRP 25 HB2 TRP 25 -6.780 -7.456 -7.006 175 2HB TRP 25 HB3 TRP 25 -8.335 -6.666 -6.862 176 HD1 TRP 25 HD1 TRP 25 -9.152 -5.453 -9.294 177 HE1 TRP 25 HE1 TRP 25 -8.886 -6.196 -11.699 178 HE3 TRP 25 HE3 TRP 25 -5.551 -9.024 -8.604 179 HZ2 TRP 25 HZ2 TRP 25 -7.046 -7.920 -13.212 180 HZ3 TRP 25 HZ3 TRP 25 -4.457 -10.089 -10.545 181 HH2 TRP 25 HH2 TRP 25 -5.211 -9.555 -12.856 182 H ALA 26 HN ALA 26 -4.120 -5.970 -7.290 183 HA ALA 26 HA ALA 26 -3.924 -5.726 -10.117 184 1HB ALA 26 HB1 ALA 26 -3.823 -3.378 -10.003 185 2HB ALA 26 HB2 ALA 26 -2.992 -3.433 -8.433 186 3HB ALA 26 HB3 ALA 26 -2.113 -3.794 -9.935 187 HA PRO 27 HA PRO 27 -0.431 -8.242 -9.545 188 1HB PRO 27 HB2 PRO 27 1.179 -6.450 -11.368 189 2HB PRO 27 HB3 PRO 27 0.989 -8.230 -11.421 190 1HG PRO 27 HG2 PRO 27 -0.436 -6.660 -13.107 191 2HG PRO 27 HG3 PRO 27 -1.252 -8.031 -12.276 192 1HD PRO 27 HD2 PRO 27 -1.287 -5.107 -11.566 193 2HD PRO 27 HD3 PRO 27 -2.630 -6.285 -11.632 194 H TRP 28 HN TRP 28 0.029 -4.988 -8.445 195 HA TRP 28 HA TRP 28 2.714 -4.783 -7.655 196 1HB TRP 28 HB2 TRP 28 0.340 -3.891 -6.068 197 2HB TRP 28 HB3 TRP 28 1.994 -3.313 -5.938 198 HD1 TRP 28 HD1 TRP 28 -1.083 -3.051 -8.021 199 HE1 TRP 28 HE1 TRP 28 -1.001 -1.072 -9.651 200 HE3 TRP 28 HE3 TRP 28 3.757 -1.701 -7.240 201 HZ2 TRP 28 HZ2 TRP 28 0.989 0.874 -10.488 202 HZ3 TRP 28 HZ3 TRP 28 4.719 0.256 -8.422 203 HH2 TRP 28 HH2 TRP 28 3.347 1.552 -10.039 204 H CYS 29 HN CYS 29 0.090 -6.563 -5.886 205 HA CYS 29 HA CYS 29 2.236 -8.055 -4.526 206 1HB CYS 29 HB2 CYS 29 0.529 -5.976 -3.164 207 2HB CYS 29 HB3 CYS 29 1.044 -7.390 -2.253 208 H GLY 30 HN GLY 30 1.516 -9.611 -2.993 209 1HA GLY 30 HA2 GLY 30 -0.012 -11.602 -3.994 210 2HA GLY 30 HA3 GLY 30 0.366 -11.403 -2.284 211 HA PRO 31 HA PRO 31 -3.775 -10.521 -1.056 212 1HB PRO 31 HB2 PRO 31 -3.623 -7.519 -1.374 213 2HB PRO 31 HB3 PRO 31 -4.392 -8.477 -0.060 214 1HG PRO 31 HG2 PRO 31 -1.913 -7.429 0.318 215 2HG PRO 31 HG3 PRO 31 -2.222 -9.132 0.796 216 1HD PRO 31 HD2 PRO 31 -0.907 -8.088 -1.715 217 2HD PRO 31 HD3 PRO 31 -0.397 -9.453 -0.671 218 H SER 32 HN SER 32 -3.036 -8.520 -3.995 219 HA SER 32 HA SER 32 -5.696 -8.413 -4.940 220 1HB SER 32 HB2 SER 32 -3.120 -8.800 -6.541 221 2HB SER 32 HB3 SER 32 -4.591 -7.975 -7.080 222 HG SER 32 HG SER 32 -2.659 -6.767 -6.195 223 H LYS 33 HN LYS 33 -3.464 -11.099 -4.864 224 HA LYS 33 HA LYS 33 -5.268 -12.723 -6.573 225 1HB LYS 33 HB2 LYS 33 -2.542 -13.540 -5.527 226 2HB LYS 33 HB3 LYS 33 -3.560 -14.340 -6.723 227 1HG LYS 33 HG2 LYS 33 -2.042 -13.374 -8.098 228 2HG LYS 33 HG3 LYS 33 -3.308 -12.143 -8.124 229 1HD LYS 33 HD2 LYS 33 -2.037 -10.824 -6.442 230 2HD LYS 33 HD3 LYS 33 -0.806 -12.076 -6.354 231 1HE LYS 33 HE2 LYS 33 -1.518 -10.486 -8.863 232 2HE LYS 33 HE3 LYS 33 -0.202 -10.077 -7.757 233 1HZ LYS 33 HZ1 LYS 33 -0.373 -12.586 -9.331 234 2HZ LYS 33 HZ2 LYS 33 0.620 -11.334 -9.638 235 3HZ LYS 33 HZ3 LYS 33 0.830 -12.214 -8.286 236 H MET 34 HN MET 34 -5.296 -11.910 -3.409 237 HA MET 34 HA MET 34 -6.185 -14.640 -2.539 238 1HB MET 34 HB2 MET 34 -5.089 -12.403 -0.801 239 2HB MET 34 HB3 MET 34 -5.707 -13.967 -0.252 240 1HG MET 34 HG2 MET 34 -3.939 -15.086 -1.654 241 2HG MET 34 HG3 MET 34 -3.235 -13.500 -1.954 242 1HE MET 34 HE1 MET 34 -3.563 -12.033 0.951 243 2HE MET 34 HE2 MET 34 -1.984 -12.447 1.644 244 3HE MET 34 HE3 MET 34 -2.098 -11.982 -0.065 245 H ILE 35 HN ILE 35 -6.771 -11.086 -2.256 246 HA ILE 35 HA ILE 35 -9.415 -11.290 -1.297 247 HB ILE 35 HB ILE 35 -7.659 -9.268 -1.633 248 1HG1 ILE 35 HG12 ILE 35 -9.733 -7.698 -1.346 249 2HG1 ILE 35 HG13 ILE 35 -10.656 -9.204 -1.268 250 1HG2 ILE 35 HG21 ILE 35 -9.591 -8.765 -3.906 251 2HG2 ILE 35 HG22 ILE 35 -8.358 -7.664 -3.265 252 3HG2 ILE 35 HG23 ILE 35 -7.854 -9.155 -4.072 253 1HD1 ILE 35 HD11 ILE 35 -9.899 -8.366 0.978 254 2HD1 ILE 35 HD12 ILE 35 -9.225 -9.970 0.615 255 3HD1 ILE 35 HD13 ILE 35 -8.214 -8.515 0.442 256 H ALA 36 HN ALA 36 -7.993 -11.570 -4.559 257 HA ALA 36 HA ALA 36 -10.388 -11.437 -6.034 258 1HB ALA 36 HB1 ALA 36 -8.396 -11.291 -7.295 259 2HB ALA 36 HB2 ALA 36 -7.733 -12.795 -6.648 260 3HB ALA 36 HB3 ALA 36 -9.116 -12.834 -7.763 261 HA PRO 37 HA PRO 37 -11.023 -16.184 -5.675 262 1HB PRO 37 HB2 PRO 37 -9.730 -17.285 -3.366 263 2HB PRO 37 HB3 PRO 37 -9.399 -17.641 -5.094 264 1HG PRO 37 HG2 PRO 37 -7.964 -15.868 -3.197 265 2HG PRO 37 HG3 PRO 37 -7.329 -16.675 -4.655 266 1HD PRO 37 HD2 PRO 37 -7.866 -13.964 -4.552 267 2HD PRO 37 HD3 PRO 37 -7.977 -14.930 -6.039 268 H VAL 38 HN VAL 38 -10.314 -14.368 -2.638 269 HA VAL 38 HA VAL 38 -12.455 -15.369 -1.116 270 HB VAL 38 HB VAL 38 -10.734 -12.917 -1.130 271 1HG1 VAL 38 HG11 VAL 38 -11.786 -12.113 0.997 272 2HG1 VAL 38 HG12 VAL 38 -12.709 -11.815 -0.485 273 3HG1 VAL 38 HG13 VAL 38 -13.196 -13.130 0.590 274 1HG2 VAL 38 HG21 VAL 38 -9.966 -15.099 -0.231 275 2HG2 VAL 38 HG22 VAL 38 -9.992 -13.819 1.001 276 3HG2 VAL 38 HG23 VAL 38 -11.278 -15.050 0.963 277 H LEU 39 HN LEU 39 -12.411 -12.679 -3.517 278 HA LEU 39 HA LEU 39 -15.144 -11.987 -2.940 279 1HB LEU 39 HB2 LEU 39 -13.074 -11.087 -4.854 280 2HB LEU 39 HB3 LEU 39 -14.690 -11.136 -5.561 281 HG LEU 39 HG LEU 39 -15.607 -9.706 -3.851 282 1HD1 LEU 39 HD11 LEU 39 -14.431 -10.304 -1.836 283 2HD1 LEU 39 HD12 LEU 39 -12.875 -9.771 -2.520 284 3HD1 LEU 39 HD13 LEU 39 -14.150 -8.591 -2.142 285 1HD2 LEU 39 HD21 LEU 39 -14.380 -8.703 -5.820 286 2HD2 LEU 39 HD22 LEU 39 -14.481 -7.652 -4.403 287 3HD2 LEU 39 HD23 LEU 39 -12.961 -8.507 -4.769 288 H GLU 40 HN GLU 40 -13.659 -14.218 -5.363 289 HA GLU 40 HA GLU 40 -16.154 -14.701 -6.662 290 1HB GLU 40 HB2 GLU 40 -13.706 -16.477 -6.501 291 2HB GLU 40 HB3 GLU 40 -15.114 -16.694 -7.569 292 1HG GLU 40 HG2 GLU 40 -14.673 -14.533 -8.649 293 2HG GLU 40 HG3 GLU 40 -13.256 -14.286 -7.632 294 H GLU 41 HN GLU 41 -14.578 -16.128 -3.770 295 HA GLU 41 HA GLU 41 -16.550 -18.139 -3.305 296 1HB GLU 41 HB2 GLU 41 -14.460 -16.804 -1.566 297 2HB GLU 41 HB3 GLU 41 -15.545 -18.036 -0.945 298 1HG GLU 41 HG2 GLU 41 -13.657 -18.415 -3.305 299 2HG GLU 41 HG3 GLU 41 -13.321 -18.918 -1.651 300 H LEU 42 HN LEU 42 -16.305 -14.701 -2.494 301 HA LEU 42 HA LEU 42 -18.487 -14.641 -0.618 302 1HB LEU 42 HB2 LEU 42 -16.673 -12.898 -0.780 303 2HB LEU 42 HB3 LEU 42 -17.254 -12.462 -2.377 304 HG LEU 42 HG LEU 42 -19.449 -11.764 -1.387 305 1HD1 LEU 42 HD11 LEU 42 -19.396 -13.088 0.691 306 2HD1 LEU 42 HD12 LEU 42 -17.930 -12.219 1.212 307 3HD1 LEU 42 HD13 LEU 42 -19.480 -11.360 1.051 308 1HD2 LEU 42 HD21 LEU 42 -16.940 -10.435 -0.279 309 2HD2 LEU 42 HD22 LEU 42 -17.640 -10.138 -1.878 310 3HD2 LEU 42 HD23 LEU 42 -18.543 -9.673 -0.426 311 H ASP 43 HN ASP 43 -18.207 -14.028 -4.162 312 HA ASP 43 HA ASP 43 -20.902 -13.124 -4.325 313 1HB ASP 43 HB2 ASP 43 -19.169 -12.484 -6.031 314 2HB ASP 43 HB3 ASP 43 -18.978 -14.172 -6.469 315 H GLN 44 HN GLN 44 -19.387 -16.300 -4.910 316 HA GLN 44 HA GLN 44 -21.834 -17.469 -5.837 317 1HB GLN 44 HB2 GLN 44 -20.718 -19.541 -5.799 318 2HB GLN 44 HB3 GLN 44 -19.549 -18.308 -6.289 319 1HG GLN 44 HG2 GLN 44 -18.733 -18.286 -3.881 320 2HG GLN 44 HG3 GLN 44 -19.754 -19.693 -3.579 321 1HE2 GLN 44 HE22 GLN 44 -17.093 -18.459 -5.642 322 2HE2 GLN 44 HE21 GLN 44 -16.333 -20.024 -5.917 323 H GLU 45 HN GLU 45 -20.886 -16.440 -2.652 324 HA GLU 45 HA GLU 45 -22.504 -18.386 -1.286 325 1HB GLU 45 HB2 GLU 45 -20.460 -18.010 -0.204 326 2HB GLU 45 HB3 GLU 45 -20.400 -16.348 -0.732 327 1HG GLU 45 HG2 GLU 45 -20.603 -15.968 1.388 328 2HG GLU 45 HG3 GLU 45 -22.284 -15.876 0.975 329 H MET 46 HN MET 46 -22.345 -14.864 -1.747 330 HA MET 46 HA MET 46 -25.208 -14.644 -0.937 331 1HB MET 46 HB2 MET 46 -24.506 -12.602 0.309 332 2HB MET 46 HB3 MET 46 -23.989 -14.139 0.997 333 1HG MET 46 HG2 MET 46 -21.726 -13.830 0.098 334 2HG MET 46 HG3 MET 46 -22.193 -12.342 -0.716 335 1HE MET 46 HE1 MET 46 -22.612 -10.212 0.387 336 2HE MET 46 HE2 MET 46 -24.002 -10.778 1.353 337 3HE MET 46 HE3 MET 46 -22.656 -9.851 2.133 338 H GLY 47 HN GLY 47 -23.517 -14.420 -3.588 339 1HA GLY 47 HA2 GLY 47 -23.919 -11.677 -4.378 340 2HA GLY 47 HA3 GLY 47 -23.591 -13.059 -5.456 341 H ASP 48 HN ASP 48 -26.199 -13.785 -3.582 342 HA ASP 48 HA ASP 48 -28.217 -13.220 -5.570 343 1HB ASP 48 HB2 ASP 48 -28.352 -15.262 -4.206 344 2HB ASP 48 HB3 ASP 48 -28.367 -14.298 -2.729 345 H LYS 49 HN LYS 49 -26.875 -11.654 -2.728 346 HA LYS 49 HA LYS 49 -29.086 -9.724 -2.714 347 1HB LYS 49 HB2 LYS 49 -27.027 -9.980 -0.527 348 2HB LYS 49 HB3 LYS 49 -28.675 -9.376 -0.442 349 1HG LYS 49 HG2 LYS 49 -29.047 -11.307 0.622 350 2HG LYS 49 HG3 LYS 49 -29.218 -11.974 -1.015 351 1HD LYS 49 HD2 LYS 49 -27.147 -13.061 -0.926 352 2HD LYS 49 HD3 LYS 49 -26.474 -11.874 0.205 353 1HE LYS 49 HE2 LYS 49 -26.648 -13.925 1.364 354 2HE LYS 49 HE3 LYS 49 -27.759 -12.753 2.051 355 1HZ LYS 49 HZ1 LYS 49 -29.578 -13.864 0.850 356 2HZ LYS 49 HZ2 LYS 49 -28.541 -14.964 0.221 357 3HZ LYS 49 HZ3 LYS 49 -28.809 -14.915 1.823 358 H LEU 50 HN LEU 50 -25.731 -10.056 -3.480 359 HA LEU 50 HA LEU 50 -25.242 -7.150 -3.240 360 1HB LEU 50 HB2 LEU 50 -24.255 -8.436 -1.384 361 2HB LEU 50 HB3 LEU 50 -23.512 -9.548 -2.534 362 HG LEU 50 HG LEU 50 -22.064 -7.714 -3.361 363 1HD1 LEU 50 HD11 LEU 50 -23.272 -6.139 -1.038 364 2HD1 LEU 50 HD12 LEU 50 -21.857 -5.646 -1.996 365 3HD1 LEU 50 HD13 LEU 50 -23.434 -5.763 -2.763 366 1HD2 LEU 50 HD21 LEU 50 -21.306 -9.293 -1.617 367 2HD2 LEU 50 HD22 LEU 50 -20.553 -7.702 -1.469 368 3HD2 LEU 50 HD23 LEU 50 -21.874 -8.162 -0.367 369 H LYS 51 HN LYS 51 -23.935 -6.246 -4.792 370 HA LYS 51 HA LYS 51 -23.145 -7.958 -7.128 371 1HB LYS 51 HB2 LYS 51 -24.641 -5.997 -7.658 372 2HB LYS 51 HB3 LYS 51 -23.423 -4.934 -6.959 373 1HG LYS 51 HG2 LYS 51 -21.760 -5.829 -8.671 374 2HG LYS 51 HG3 LYS 51 -23.091 -6.711 -9.421 375 1HD LYS 51 HD2 LYS 51 -22.874 -3.686 -9.073 376 2HD LYS 51 HD3 LYS 51 -22.508 -4.584 -10.548 377 1HE LYS 51 HE2 LYS 51 -24.868 -5.361 -10.667 378 2HE LYS 51 HE3 LYS 51 -25.244 -4.428 -9.205 379 1HZ LYS 51 HZ1 LYS 51 -24.581 -2.426 -10.396 380 2HZ LYS 51 HZ2 LYS 51 -24.218 -3.285 -11.742 381 3HZ LYS 51 HZ3 LYS 51 -25.785 -3.193 -11.227 382 H ILE 52 HN ILE 52 -20.886 -7.885 -7.693 383 HA ILE 52 HA ILE 52 -19.080 -6.511 -5.778 384 HB ILE 52 HB ILE 52 -19.179 -9.401 -6.708 385 1HG1 ILE 52 HG12 ILE 52 -18.517 -8.381 -3.923 386 2HG1 ILE 52 HG13 ILE 52 -20.190 -8.397 -4.450 387 1HG2 ILE 52 HG21 ILE 52 -16.761 -7.968 -5.528 388 2HG2 ILE 52 HG22 ILE 52 -16.916 -9.727 -5.783 389 3HG2 ILE 52 HG23 ILE 52 -16.884 -8.635 -7.167 390 1HD1 ILE 52 HD11 ILE 52 -18.411 -10.851 -4.343 391 2HD1 ILE 52 HD12 ILE 52 -19.711 -10.408 -3.214 392 3HD1 ILE 52 HD13 ILE 52 -20.114 -10.786 -4.888 393 H VAL 53 HN VAL 53 -17.496 -5.413 -6.829 394 HA VAL 53 HA VAL 53 -17.180 -5.788 -9.759 395 HB VAL 53 HB VAL 53 -17.353 -3.073 -8.382 396 1HG1 VAL 53 HG11 VAL 53 -17.617 -3.937 -11.276 397 2HG1 VAL 53 HG12 VAL 53 -17.872 -2.294 -10.655 398 3HG1 VAL 53 HG13 VAL 53 -16.275 -3.046 -10.512 399 1HG2 VAL 53 HG21 VAL 53 -19.697 -4.492 -9.724 400 2HG2 VAL 53 HG22 VAL 53 -19.566 -4.063 -8.009 401 3HG2 VAL 53 HG23 VAL 53 -19.649 -2.790 -9.221 402 H LYS 54 HN LYS 54 -15.008 -5.498 -10.454 403 HA LYS 54 HA LYS 54 -13.067 -4.701 -8.327 404 1HB LYS 54 HB2 LYS 54 -12.742 -6.684 -10.596 405 2HB LYS 54 HB3 LYS 54 -11.402 -6.048 -9.636 406 1HG LYS 54 HG2 LYS 54 -12.498 -6.914 -7.549 407 2HG LYS 54 HG3 LYS 54 -13.773 -7.611 -8.545 408 1HD LYS 54 HD2 LYS 54 -12.340 -9.432 -8.193 409 2HD LYS 54 HD3 LYS 54 -11.894 -8.865 -9.796 410 1HE LYS 54 HE2 LYS 54 -9.787 -9.105 -8.922 411 2HE LYS 54 HE3 LYS 54 -10.069 -7.436 -8.408 412 1HZ LYS 54 HZ1 LYS 54 -9.223 -8.971 -6.677 413 2HZ LYS 54 HZ2 LYS 54 -10.530 -8.088 -6.274 414 3HZ LYS 54 HZ3 LYS 54 -10.714 -9.687 -6.639 415 H ILE 55 HN ILE 55 -11.246 -3.453 -8.959 416 HA ILE 55 HA ILE 55 -11.273 -2.157 -11.621 417 HB ILE 55 HB ILE 55 -10.881 -1.022 -8.806 418 1HG1 ILE 55 HG12 ILE 55 -13.093 -0.735 -9.928 419 2HG1 ILE 55 HG13 ILE 55 -12.304 0.730 -9.391 420 1HG2 ILE 55 HG21 ILE 55 -9.628 0.055 -11.342 421 2HG2 ILE 55 HG22 ILE 55 -9.853 1.018 -9.856 422 3HG2 ILE 55 HG23 ILE 55 -8.850 -0.437 -9.845 423 1HD1 ILE 55 HD11 ILE 55 -13.287 1.136 -11.552 424 2HD1 ILE 55 HD12 ILE 55 -11.542 1.244 -11.686 425 3HD1 ILE 55 HD13 ILE 55 -12.372 -0.213 -12.278 426 H ASP 56 HN ASP 56 -9.366 -2.695 -12.645 427 HA ASP 56 HA ASP 56 -7.173 -4.013 -11.184 428 1HB ASP 56 HB2 ASP 56 -7.707 -4.840 -13.403 429 2HB ASP 56 HB3 ASP 56 -7.490 -3.233 -14.100 430 H VAL 57 HN VAL 57 -6.020 -2.573 -9.915 431 HA VAL 57 HA VAL 57 -5.765 0.157 -10.760 432 HB VAL 57 HB VAL 57 -4.734 0.646 -8.689 433 1HG1 VAL 57 HG11 VAL 57 -7.269 -0.972 -8.365 434 2HG1 VAL 57 HG12 VAL 57 -6.689 0.338 -7.313 435 3HG1 VAL 57 HG13 VAL 57 -7.149 0.705 -8.980 436 1HG2 VAL 57 HG21 VAL 57 -4.773 -0.988 -6.805 437 2HG2 VAL 57 HG22 VAL 57 -5.118 -2.280 -7.959 438 3HG2 VAL 57 HG23 VAL 57 -3.583 -1.380 -8.052 439 H ASP 58 HN ASP 58 -4.565 -1.162 -12.690 440 HA ASP 58 HA ASP 58 -2.013 0.301 -12.622 441 1HB ASP 58 HB2 ASP 58 -1.245 -1.937 -11.921 442 2HB ASP 58 HB3 ASP 58 -2.113 -2.689 -13.262 443 H GLU 59 HN GLU 59 -4.370 -1.696 -14.549 444 HA GLU 59 HA GLU 59 -3.677 -0.106 -16.954 445 1HB GLU 59 HB2 GLU 59 -3.661 -2.292 -17.594 446 2HB GLU 59 HB3 GLU 59 -4.760 -2.820 -16.325 447 1HG GLU 59 HG2 GLU 59 -6.671 -1.952 -17.474 448 2HG GLU 59 HG3 GLU 59 -5.657 -1.300 -18.777 449 H ASN 60 HN ASN 60 -6.128 -0.545 -14.464 450 HA ASN 60 HA ASN 60 -7.943 1.318 -15.884 451 1HB ASN 60 HB2 ASN 60 -8.329 -1.455 -15.476 452 2HB ASN 60 HB3 ASN 60 -9.291 -0.715 -14.214 453 1HD2 ASN 60 HD22 ASN 60 -9.422 -1.796 -17.332 454 2HD2 ASN 60 HD21 ASN 60 -10.708 -0.793 -17.955 455 H GLN 61 HN GLN 61 -5.985 1.856 -13.900 456 HA GLN 61 HA GLN 61 -7.188 1.903 -11.333 457 1HB GLN 61 HB2 GLN 61 -5.117 2.725 -10.532 458 2HB GLN 61 HB3 GLN 61 -4.747 1.630 -11.862 459 1HG GLN 61 HG2 GLN 61 -4.451 3.598 -13.376 460 2HG GLN 61 HG3 GLN 61 -4.592 4.636 -11.956 461 1HE2 GLN 61 HE22 GLN 61 -3.107 3.705 -9.964 462 2HE2 GLN 61 HE21 GLN 61 -1.466 3.372 -10.428 463 H GLU 62 HN GLU 62 -7.868 3.852 -13.875 464 HA GLU 62 HA GLU 62 -7.515 6.509 -13.063 465 1HB GLU 62 HB2 GLU 62 -9.345 5.023 -14.946 466 2HB GLU 62 HB3 GLU 62 -9.535 6.782 -14.725 467 1HG GLU 62 HG2 GLU 62 -7.142 7.092 -15.337 468 2HG GLU 62 HG3 GLU 62 -6.979 5.354 -15.590 469 H THR 63 HN THR 63 -10.452 4.393 -12.573 470 HA THR 63 HA THR 63 -12.015 6.209 -11.136 471 HB THR 63 HB THR 63 -11.615 3.223 -10.725 472 HG1 THR 63 HG1 THR 63 -13.506 3.273 -12.218 473 1HG2 THR 63 HG21 THR 63 -12.979 4.162 -8.879 474 2HG2 THR 63 HG22 THR 63 -14.086 4.877 -10.077 475 3HG2 THR 63 HG23 THR 63 -13.901 3.108 -9.926 476 H ALA 64 HN ALA 64 -9.237 4.293 -10.085 477 HA ALA 64 HA ALA 64 -9.829 4.469 -7.280 478 1HB ALA 64 HB1 ALA 64 -8.526 2.641 -8.559 479 2HB ALA 64 HB2 ALA 64 -7.165 3.739 -8.610 480 3HB ALA 64 HB3 ALA 64 -7.794 3.192 -7.045 481 H GLY 65 HN GLY 65 -6.995 5.683 -9.091 482 1HA GLY 65 HA2 GLY 65 -6.141 7.797 -7.592 483 2HA GLY 65 HA3 GLY 65 -6.193 7.830 -9.368 484 H LYS 66 HN LYS 66 -9.023 7.984 -9.814 485 HA LYS 66 HA LYS 66 -9.481 10.757 -9.476 486 1HB LYS 66 HB2 LYS 66 -10.478 9.272 -11.233 487 2HB LYS 66 HB3 LYS 66 -11.533 8.565 -9.997 488 1HG LYS 66 HG2 LYS 66 -12.337 11.042 -9.638 489 2HG LYS 66 HG3 LYS 66 -11.530 11.353 -11.180 490 1HD LYS 66 HD2 LYS 66 -13.842 9.472 -10.608 491 2HD LYS 66 HD3 LYS 66 -13.895 10.943 -11.575 492 1HE LYS 66 HE2 LYS 66 -12.287 8.445 -12.270 493 2HE LYS 66 HE3 LYS 66 -13.908 8.775 -12.876 494 1HZ LYS 66 HZ1 LYS 66 -11.536 10.458 -13.430 495 2HZ LYS 66 HZ2 LYS 66 -12.199 9.352 -14.441 496 3HZ LYS 66 HZ3 LYS 66 -13.048 10.699 -14.027 497 H TYR 67 HN TYR 67 -10.797 7.908 -7.622 498 HA TYR 67 HA TYR 67 -12.439 9.580 -5.981 499 1HB TYR 67 HB2 TYR 67 -12.861 7.163 -6.391 500 2HB TYR 67 HB3 TYR 67 -11.427 6.761 -5.458 501 HD1 TYR 67 HD1 TYR 67 -11.441 6.967 -2.972 502 HD2 TYR 67 HD2 TYR 67 -14.882 8.114 -5.315 503 HE1 TYR 67 HE1 TYR 67 -12.780 7.112 -0.911 504 HE2 TYR 67 HE2 TYR 67 -16.229 8.286 -3.243 505 HH TYR 67 HH TYR 67 -14.845 7.656 0.018 506 H GLY 68 HN GLY 68 -9.137 8.341 -5.773 507 1HA GLY 68 HA2 GLY 68 -7.406 9.421 -4.443 508 2HA GLY 68 HA3 GLY 68 -8.630 9.831 -3.219 509 H VAL 69 HN VAL 69 -7.206 7.052 -5.001 510 HA VAL 69 HA VAL 69 -7.233 5.308 -2.650 511 HB VAL 69 HB VAL 69 -8.402 4.609 -5.388 512 1HG1 VAL 69 HG11 VAL 69 -6.937 2.794 -4.777 513 2HG1 VAL 69 HG12 VAL 69 -7.631 2.727 -3.151 514 3HG1 VAL 69 HG13 VAL 69 -8.611 2.279 -4.576 515 1HG2 VAL 69 HG21 VAL 69 -9.697 4.409 -2.664 516 2HG2 VAL 69 HG22 VAL 69 -10.099 5.544 -3.976 517 3HG2 VAL 69 HG23 VAL 69 -10.383 3.821 -4.207 518 H MET 70 HN MET 70 -5.162 4.468 -2.679 519 HA MET 70 HA MET 70 -3.622 4.497 -5.208 520 1HB MET 70 HB2 MET 70 -2.616 5.817 -2.709 521 2HB MET 70 HB3 MET 70 -1.829 5.782 -4.288 522 1HG MET 70 HG2 MET 70 -3.801 7.164 -5.150 523 2HG MET 70 HG3 MET 70 -4.311 7.331 -3.471 524 1HE MET 70 HE1 MET 70 -2.648 8.128 -1.589 525 2HE MET 70 HE2 MET 70 -1.154 7.399 -2.254 526 3HE MET 70 HE3 MET 70 -1.214 9.139 -1.874 527 H SER 71 HN SER 71 -4.739 2.529 -2.991 528 HA SER 71 HA SER 71 -2.208 1.231 -2.258 529 1HB SER 71 HB2 SER 71 -3.626 0.760 -0.100 530 2HB SER 71 HB3 SER 71 -2.886 2.343 -0.342 531 HG SER 71 HG SER 71 -5.621 1.661 -0.774 532 H ILE 72 HN ILE 72 -2.461 -1.095 -1.640 533 HA ILE 72 HA ILE 72 -4.810 -2.324 -2.926 534 HB ILE 72 HB ILE 72 -2.420 -4.022 -2.871 535 1HG1 ILE 72 HG12 ILE 72 -1.256 -1.938 -3.414 536 2HG1 ILE 72 HG13 ILE 72 -1.141 -3.207 -4.594 537 1HG2 ILE 72 HG21 ILE 72 -4.504 -3.417 -4.976 538 2HG2 ILE 72 HG22 ILE 72 -3.127 -4.512 -5.212 539 3HG2 ILE 72 HG23 ILE 72 -4.309 -4.883 -3.968 540 1HD1 ILE 72 HD11 ILE 72 -2.561 -2.089 -6.135 541 2HD1 ILE 72 HD12 ILE 72 -3.064 -0.866 -4.947 542 3HD1 ILE 72 HD13 ILE 72 -1.388 -0.916 -5.509 543 HA PRO 73 HA PRO 73 -6.071 -3.935 -2.745 544 1HB PRO 73 HB2 PRO 73 -7.848 -5.583 -1.596 545 2HB PRO 73 HB3 PRO 73 -6.291 -6.210 -2.224 546 1HG PRO 73 HG2 PRO 73 -7.045 -5.573 0.626 547 2HG PRO 73 HG3 PRO 73 -6.152 -6.988 0.011 548 1HD PRO 73 HD2 PRO 73 -4.958 -4.682 1.086 549 2HD PRO 73 HD3 PRO 73 -4.137 -5.788 -0.038 550 H THR 74 HN THR 74 -7.747 -2.412 -2.872 551 HA THR 74 HA THR 74 -8.639 -1.189 -0.265 552 HB THR 74 HB THR 74 -8.534 0.088 -3.010 553 HG1 THR 74 HG1 THR 74 -6.572 0.191 -2.202 554 1HG2 THR 74 HG21 THR 74 -10.472 1.016 -2.037 555 2HG2 THR 74 HG22 THR 74 -9.773 1.017 -0.406 556 3HG2 THR 74 HG23 THR 74 -9.185 2.157 -1.624 557 H LEU 75 HN LEU 75 -10.760 -1.177 0.238 558 HA LEU 75 HA LEU 75 -12.755 -2.243 -1.736 559 1HB LEU 75 HB2 LEU 75 -12.772 -2.421 1.309 560 2HB LEU 75 HB3 LEU 75 -14.115 -2.849 0.257 561 HG LEU 75 HG LEU 75 -11.442 -4.281 0.437 562 1HD1 LEU 75 HD11 LEU 75 -13.081 -4.604 2.334 563 2HD1 LEU 75 HD12 LEU 75 -14.258 -5.210 1.164 564 3HD1 LEU 75 HD13 LEU 75 -12.736 -6.084 1.418 565 1HD2 LEU 75 HD21 LEU 75 -12.466 -5.982 -1.069 566 2HD2 LEU 75 HD22 LEU 75 -13.849 -4.889 -1.348 567 3HD2 LEU 75 HD23 LEU 75 -12.220 -4.427 -1.857 568 H LEU 76 HN LEU 76 -14.414 -0.947 -2.116 569 HA LEU 76 HA LEU 76 -14.960 1.340 -0.348 570 1HB LEU 76 HB2 LEU 76 -15.530 1.406 -3.323 571 2HB LEU 76 HB3 LEU 76 -15.653 2.708 -2.143 572 HG LEU 76 HG LEU 76 -13.072 1.558 -3.293 573 1HD1 LEU 76 HD11 LEU 76 -14.455 4.245 -3.704 574 2HD1 LEU 76 HD12 LEU 76 -12.910 3.735 -4.415 575 3HD1 LEU 76 HD13 LEU 76 -14.402 2.910 -4.877 576 1HD2 LEU 76 HD21 LEU 76 -12.679 2.342 -1.013 577 2HD2 LEU 76 HD22 LEU 76 -11.939 3.429 -2.186 578 3HD2 LEU 76 HD23 LEU 76 -13.460 3.902 -1.403 579 H VAL 77 HN VAL 77 -16.850 0.703 0.626 580 HA VAL 77 HA VAL 77 -18.625 -1.221 -0.812 581 HB VAL 77 HB VAL 77 -19.118 -0.283 2.034 582 1HG1 VAL 77 HG11 VAL 77 -19.794 -2.829 0.523 583 2HG1 VAL 77 HG12 VAL 77 -20.278 -2.412 2.186 584 3HG1 VAL 77 HG13 VAL 77 -20.904 -1.473 0.828 585 1HG2 VAL 77 HG21 VAL 77 -17.282 -2.570 1.203 586 2HG2 VAL 77 HG22 VAL 77 -16.835 -1.141 2.158 587 3HG2 VAL 77 HG23 VAL 77 -17.958 -2.326 2.827 588 H LEU 78 HN LEU 78 -20.382 -0.399 -1.873 589 HA LEU 78 HA LEU 78 -21.186 2.401 -1.277 590 1HB LEU 78 HB2 LEU 78 -21.178 1.012 -3.999 591 2HB LEU 78 HB3 LEU 78 -21.759 2.626 -3.647 592 HG LEU 78 HG LEU 78 -19.183 2.795 -2.689 593 1HD1 LEU 78 HD11 LEU 78 -19.017 1.137 -5.241 594 2HD1 LEU 78 HD12 LEU 78 -17.665 1.803 -4.306 595 3HD1 LEU 78 HD13 LEU 78 -18.673 0.516 -3.626 596 1HD2 LEU 78 HD21 LEU 78 -20.333 4.440 -4.145 597 2HD2 LEU 78 HD22 LEU 78 -18.691 4.106 -4.701 598 3HD2 LEU 78 HD23 LEU 78 -20.072 3.382 -5.546 599 H LYS 79 HN LYS 79 -23.419 2.884 -1.681 600 HA LYS 79 HA LYS 79 -25.126 0.747 -2.535 601 1HB LYS 79 HB2 LYS 79 -26.738 0.888 -0.688 602 2HB LYS 79 HB3 LYS 79 -25.192 0.170 -0.218 603 1HG LYS 79 HG2 LYS 79 -24.546 2.399 0.762 604 2HG LYS 79 HG3 LYS 79 -26.207 2.945 0.500 605 1HD LYS 79 HD2 LYS 79 -25.374 0.507 2.153 606 2HD LYS 79 HD3 LYS 79 -25.777 2.094 2.825 607 1HE LYS 79 HE2 LYS 79 -28.056 1.947 1.958 608 2HE LYS 79 HE3 LYS 79 -27.695 0.399 1.176 609 1HZ LYS 79 HZ1 LYS 79 -27.302 -0.557 3.373 610 2HZ LYS 79 HZ2 LYS 79 -27.677 0.869 4.099 611 3HZ LYS 79 HZ3 LYS 79 -28.817 0.054 3.270 612 H ASP 80 HN ASP 80 -26.886 1.520 -3.524 613 HA ASP 80 HA ASP 80 -28.010 2.923 -4.811 614 1HB ASP 80 HB2 ASP 80 -29.188 2.969 -2.630 615 2HB ASP 80 HB3 ASP 80 -28.340 4.456 -2.210 616 H GLY 81 HN GLY 81 -25.171 3.518 -4.872 617 1HA GLY 81 HA2 GLY 81 -24.097 4.863 -6.353 618 2HA GLY 81 HA3 GLY 81 -25.342 6.114 -6.211 619 H GLU 82 HN GLU 82 -24.121 5.178 -3.139 620 HA GLU 82 HA GLU 82 -21.881 7.080 -3.272 621 1HB GLU 82 HB2 GLU 82 -22.651 8.252 -1.397 622 2HB GLU 82 HB3 GLU 82 -24.072 8.010 -2.440 623 1HG GLU 82 HG2 GLU 82 -24.794 6.129 -1.002 624 2HG GLU 82 HG3 GLU 82 -23.413 6.425 0.066 625 H VAL 83 HN VAL 83 -20.220 6.779 -1.708 626 HA VAL 83 HA VAL 83 -19.761 4.013 -0.808 627 HB VAL 83 HB VAL 83 -18.173 6.584 -0.356 628 1HG1 VAL 83 HG11 VAL 83 -17.585 4.856 1.315 629 2HG1 VAL 83 HG12 VAL 83 -17.355 3.665 0.017 630 3HG1 VAL 83 HG13 VAL 83 -16.271 5.059 0.166 631 1HG2 VAL 83 HG21 VAL 83 -18.246 6.006 -2.781 632 2HG2 VAL 83 HG22 VAL 83 -16.638 5.762 -2.100 633 3HG2 VAL 83 HG23 VAL 83 -17.670 4.368 -2.394 634 H VAL 84 HN VAL 84 -20.034 3.255 1.139 635 HA VAL 84 HA VAL 84 -20.938 5.076 3.314 636 HB VAL 84 HB VAL 84 -22.401 3.217 4.059 637 1HG1 VAL 84 HG11 VAL 84 -23.122 4.296 1.309 638 2HG1 VAL 84 HG12 VAL 84 -24.232 3.813 2.613 639 3HG1 VAL 84 HG13 VAL 84 -23.207 5.231 2.816 640 1HG2 VAL 84 HG21 VAL 84 -22.035 2.034 1.272 641 2HG2 VAL 84 HG22 VAL 84 -21.358 1.340 2.763 642 3HG2 VAL 84 HG23 VAL 84 -23.106 1.456 2.559 643 H GLU 85 HN GLU 85 -18.752 2.502 2.310 644 HA GLU 85 HA GLU 85 -17.414 2.916 4.847 645 1HB GLU 85 HB2 GLU 85 -18.251 0.153 3.921 646 2HB GLU 85 HB3 GLU 85 -16.827 0.386 4.910 647 1HG GLU 85 HG2 GLU 85 -19.664 1.112 5.634 648 2HG GLU 85 HG3 GLU 85 -18.717 -0.256 6.232 649 H THR 86 HN THR 86 -15.160 2.435 4.699 650 HA THR 86 HA THR 86 -14.083 1.795 2.036 651 HB THR 86 HB THR 86 -12.887 4.077 3.623 652 HG1 THR 86 HG1 THR 86 -15.010 4.765 3.404 653 1HG2 THR 86 HG21 THR 86 -11.775 3.065 1.647 654 2HG2 THR 86 HG22 THR 86 -13.253 3.447 0.719 655 3HG2 THR 86 HG23 THR 86 -12.226 4.764 1.350 656 H SER 87 HN SER 87 -12.222 0.507 2.282 657 HA SER 87 HA SER 87 -10.885 0.332 4.891 658 1HB SER 87 HB2 SER 87 -12.852 -1.220 5.064 659 2HB SER 87 HB3 SER 87 -12.292 -2.054 3.609 660 HG SER 87 HG SER 87 -11.110 -1.932 6.182 661 H VAL 88 HN VAL 88 -8.810 -0.662 4.653 662 HA VAL 88 HA VAL 88 -7.918 -1.319 1.913 663 HB VAL 88 HB VAL 88 -6.628 0.810 3.671 664 1HG1 VAL 88 HG11 VAL 88 -5.042 1.065 1.797 665 2HG1 VAL 88 HG12 VAL 88 -4.942 -0.575 2.451 666 3HG1 VAL 88 HG13 VAL 88 -5.816 -0.281 0.931 667 1HG2 VAL 88 HG21 VAL 88 -7.982 1.076 0.974 668 2HG2 VAL 88 HG22 VAL 88 -8.548 1.769 2.510 669 3HG2 VAL 88 HG23 VAL 88 -7.049 2.348 1.780 670 H GLY 89 HN GLY 89 -7.196 -3.321 2.191 671 1HA GLY 89 HA2 GLY 89 -5.020 -4.285 3.305 672 2HA GLY 89 HA3 GLY 89 -5.979 -4.182 4.786 673 H PHE 90 HN PHE 90 -4.974 -6.645 3.653 674 HA PHE 90 HA PHE 90 -7.008 -8.005 2.192 675 1HB PHE 90 HB2 PHE 90 -4.713 -8.831 2.201 676 2HB PHE 90 HB3 PHE 90 -4.746 -9.029 3.948 677 HD1 PHE 90 HD1 PHE 90 -5.380 -11.104 4.898 678 HD2 PHE 90 HD2 PHE 90 -6.510 -10.214 0.826 679 HE1 PHE 90 HE1 PHE 90 -6.381 -13.362 4.679 680 HE2 PHE 90 HE2 PHE 90 -7.574 -12.451 0.648 681 HZ PHE 90 HZ PHE 90 -7.485 -14.037 2.553 682 H LYS 91 HN LYS 91 -8.667 -9.379 2.874 683 HA LYS 91 HA LYS 91 -9.047 -9.867 5.763 684 1HB LYS 91 HB2 LYS 91 -11.042 -8.573 3.889 685 2HB LYS 91 HB3 LYS 91 -11.622 -9.710 5.064 686 1HG LYS 91 HG2 LYS 91 -11.962 -7.770 6.202 687 2HG LYS 91 HG3 LYS 91 -10.410 -8.277 6.854 688 1HD LYS 91 HD2 LYS 91 -10.375 -5.894 6.446 689 2HD LYS 91 HD3 LYS 91 -9.284 -6.663 5.296 690 1HE LYS 91 HE2 LYS 91 -11.179 -6.596 3.591 691 2HE LYS 91 HE3 LYS 91 -12.113 -5.645 4.757 692 1HZ LYS 91 HZ1 LYS 91 -9.450 -4.878 3.684 693 2HZ LYS 91 HZ2 LYS 91 -10.865 -4.298 3.112 694 3HZ LYS 91 HZ3 LYS 91 -10.430 -3.933 4.641 695 HA PRO 92 HA PRO 92 -9.854 -13.874 3.769 696 1HB PRO 92 HB2 PRO 92 -10.873 -15.284 5.877 697 2HB PRO 92 HB3 PRO 92 -9.138 -14.864 5.752 698 1HG PRO 92 HG2 PRO 92 -11.304 -13.386 7.281 699 2HG PRO 92 HG3 PRO 92 -9.701 -13.925 7.883 700 1HD PRO 92 HD2 PRO 92 -10.078 -11.381 7.009 701 2HD PRO 92 HD3 PRO 92 -8.562 -12.252 6.651 702 H LYS 93 HN LYS 93 -11.810 -15.273 3.459 703 HA LYS 93 HA LYS 93 -13.955 -13.988 2.319 704 1HB LYS 93 HB2 LYS 93 -13.517 -16.202 1.723 705 2HB LYS 93 HB3 LYS 93 -13.416 -16.747 3.386 706 1HG LYS 93 HG2 LYS 93 -15.282 -17.743 2.329 707 2HG LYS 93 HG3 LYS 93 -15.804 -16.703 3.650 708 1HD LYS 93 HD2 LYS 93 -16.622 -15.023 2.051 709 2HD LYS 93 HD3 LYS 93 -15.917 -15.912 0.695 710 1HE LYS 93 HE2 LYS 93 -18.416 -16.210 1.011 711 2HE LYS 93 HE3 LYS 93 -17.486 -17.698 0.889 712 1HZ LYS 93 HZ1 LYS 93 -18.299 -16.555 3.510 713 2HZ LYS 93 HZ2 LYS 93 -19.208 -17.640 2.724 714 3HZ LYS 93 HZ3 LYS 93 -17.707 -18.057 3.215 715 H GLU 94 HN GLU 94 -13.977 -15.305 5.685 716 HA GLU 94 HA GLU 94 -16.674 -14.521 6.041 717 1HB GLU 94 HB2 GLU 94 -14.481 -15.082 8.085 718 2HB GLU 94 HB3 GLU 94 -16.197 -14.862 8.483 719 1HG GLU 94 HG2 GLU 94 -16.785 -16.798 7.033 720 2HG GLU 94 HG3 GLU 94 -15.078 -17.049 6.668 721 H ALA 95 HN ALA 95 -13.609 -12.849 6.933 722 HA ALA 95 HA ALA 95 -14.902 -10.689 8.298 723 1HB ALA 95 HB1 ALA 95 -12.214 -10.817 6.883 724 2HB ALA 95 HB2 ALA 95 -12.728 -9.529 7.991 725 3HB ALA 95 HB3 ALA 95 -12.502 -11.183 8.601 726 H LEU 96 HN LEU 96 -14.011 -11.279 4.912 727 HA LEU 96 HA LEU 96 -14.608 -8.718 3.899 728 1HB LEU 96 HB2 LEU 96 -13.667 -11.081 2.822 729 2HB LEU 96 HB3 LEU 96 -15.301 -11.116 2.223 730 HG LEU 96 HG LEU 96 -14.039 -10.130 0.534 731 1HD1 LEU 96 HD11 LEU 96 -15.122 -7.671 1.988 732 2HD1 LEU 96 HD12 LEU 96 -14.747 -7.832 0.273 733 3HD1 LEU 96 HD13 LEU 96 -16.085 -8.761 0.975 734 1HD2 LEU 96 HD21 LEU 96 -12.010 -9.719 1.907 735 2HD2 LEU 96 HD22 LEU 96 -12.384 -8.383 0.809 736 3HD2 LEU 96 HD23 LEU 96 -12.771 -8.241 2.542 737 H GLN 97 HN GLN 97 -16.635 -11.664 4.089 738 HA GLN 97 HA GLN 97 -18.938 -10.428 2.996 739 1HB GLN 97 HB2 GLN 97 -19.908 -12.424 3.134 740 2HB GLN 97 HB3 GLN 97 -18.247 -12.951 3.257 741 1HG GLN 97 HG2 GLN 97 -18.576 -13.121 5.702 742 2HG GLN 97 HG3 GLN 97 -20.300 -12.740 5.453 743 1HE2 GLN 97 HE22 GLN 97 -21.487 -14.275 3.795 744 2HE2 GLN 97 HE21 GLN 97 -20.971 -15.954 3.801 745 H GLU 98 HN GLU 98 -17.841 -10.839 6.384 746 HA GLU 98 HA GLU 98 -20.156 -9.742 7.570 747 1HB GLU 98 HB2 GLU 98 -18.540 -10.994 8.816 748 2HB GLU 98 HB3 GLU 98 -17.257 -9.824 8.463 749 1HG GLU 98 HG2 GLU 98 -18.329 -8.138 9.805 750 2HG GLU 98 HG3 GLU 98 -19.772 -9.139 10.029 751 H LEU 99 HN LEU 99 -17.210 -8.117 6.341 752 HA LEU 99 HA LEU 99 -17.725 -5.585 7.367 753 1HB LEU 99 HB2 LEU 99 -15.606 -6.482 6.366 754 2HB LEU 99 HB3 LEU 99 -16.281 -6.250 4.765 755 HG LEU 99 HG LEU 99 -14.626 -4.575 5.535 756 1HD1 LEU 99 HD11 LEU 99 -16.287 -4.015 3.761 757 2HD1 LEU 99 HD12 LEU 99 -17.268 -3.196 5.003 758 3HD1 LEU 99 HD13 LEU 99 -15.637 -2.624 4.644 759 1HD2 LEU 99 HD21 LEU 99 -16.762 -3.535 7.433 760 2HD2 LEU 99 HD22 LEU 99 -15.334 -4.482 7.918 761 3HD2 LEU 99 HD23 LEU 99 -15.131 -2.888 7.172 762 H VAL 100 HN VAL 100 -18.762 -6.996 4.267 763 HA VAL 100 HA VAL 100 -20.203 -4.517 3.551 764 HB VAL 100 HB VAL 100 -19.142 -5.644 1.805 765 1HG1 VAL 100 HG11 VAL 100 -19.175 -8.008 2.578 766 2HG1 VAL 100 HG12 VAL 100 -20.912 -8.093 2.243 767 3HG1 VAL 100 HG13 VAL 100 -19.744 -7.842 0.925 768 1HG2 VAL 100 HG21 VAL 100 -20.858 -5.701 0.166 769 2HG2 VAL 100 HG22 VAL 100 -22.109 -6.105 1.364 770 3HG2 VAL 100 HG23 VAL 100 -21.351 -4.505 1.372 771 H ASN 101 HN ASN 101 -21.059 -7.741 4.908 772 HA ASN 101 HA ASN 101 -23.852 -7.632 4.606 773 1HB ASN 101 HB2 ASN 101 -22.777 -9.644 5.314 774 2HB ASN 101 HB3 ASN 101 -22.134 -8.867 6.767 775 1HD2 ASN 101 HD22 ASN 101 -23.476 -8.582 8.580 776 2HD2 ASN 101 HD21 ASN 101 -25.104 -9.210 8.660 777 H LYS 102 HN LYS 102 -21.804 -5.959 6.954 778 HA LYS 102 HA LYS 102 -23.740 -5.103 8.836 779 1HB LYS 102 HB2 LYS 102 -21.201 -3.858 7.744 780 2HB LYS 102 HB3 LYS 102 -22.109 -3.103 9.057 781 1HG LYS 102 HG2 LYS 102 -21.609 -4.787 10.579 782 2HG LYS 102 HG3 LYS 102 -21.217 -5.973 9.321 783 1HD LYS 102 HD2 LYS 102 -19.275 -4.613 8.615 784 2HD LYS 102 HD3 LYS 102 -19.587 -3.443 9.911 785 1HE LYS 102 HE2 LYS 102 -19.123 -6.407 10.291 786 2HE LYS 102 HE3 LYS 102 -17.807 -5.221 10.300 787 1HZ LYS 102 HZ1 LYS 102 -20.055 -5.280 12.244 788 2HZ LYS 102 HZ2 LYS 102 -18.519 -5.721 12.556 789 3HZ LYS 102 HZ3 LYS 102 -18.858 -4.165 12.227 790 H HIS 103 HN HIS 103 -23.244 -3.992 5.516 791 HA HIS 103 HA HIS 103 -25.149 -1.724 5.980 792 1HB HIS 103 HB2 HIS 103 -22.766 -1.825 4.093 793 2HB HIS 103 HB3 HIS 103 -23.841 -0.450 4.364 794 HD1 HIS 103 HD1 HIS 103 -23.657 0.685 6.922 795 HD2 HIS 103 HD2 HIS 103 -20.846 -2.283 5.893 796 HE1 HIS 103 HE1 HIS 103 -21.886 0.709 8.747 797 H LEU 104 HN LEU 104 -24.493 -4.563 4.194 798 HA LEU 104 HA LEU 104 -26.109 -4.163 1.842 799 1HB LEU 104 HB2 LEU 104 -24.446 -5.790 1.752 800 2HB LEU 104 HB3 LEU 104 -24.854 -6.407 3.354 801 HG LEU 104 HG LEU 104 -26.869 -7.430 2.571 802 1HD1 LEU 104 HD11 LEU 104 -27.406 -5.836 0.667 803 2HD1 LEU 104 HD12 LEU 104 -26.025 -6.494 -0.230 804 3HD1 LEU 104 HD13 LEU 104 -27.420 -7.518 0.160 805 1HD2 LEU 104 HD21 LEU 104 -25.825 -9.175 1.200 806 2HD2 LEU 104 HD22 LEU 104 -24.426 -8.109 0.913 807 3HD2 LEU 104 HD23 LEU 104 -24.808 -8.681 2.553 808 1H MET 1 H1 MET 1 10.658 29.132 -9.783 809 2H MET 1 H2 MET 1 10.355 29.513 -11.365 810 3H MET 1 H3 MET 1 9.921 28.047 -10.751 811 HA MET 1 HA MET 1 8.779 30.649 -10.035 812 1HB MET 1 HB2 MET 1 7.558 28.225 -11.438 813 2HB MET 1 HB3 MET 1 6.616 29.533 -10.730 814 1HG MET 1 HG2 MET 1 6.770 29.983 -13.035 815 2HG MET 1 HG3 MET 1 7.761 31.173 -12.201 816 1HE MET 1 HE1 MET 1 8.788 31.907 -14.523 817 2HE MET 1 HE2 MET 1 9.514 30.779 -15.689 818 3HE MET 1 HE3 MET 1 7.772 30.699 -15.346 819 H GLU 2 HN GLU 2 7.601 30.810 -8.187 820 HA GLU 2 HA GLU 2 8.457 29.293 -6.030 821 1HB GLU 2 HB2 GLU 2 6.040 31.131 -6.331 822 2HB GLU 2 HB3 GLU 2 6.592 30.457 -4.806 823 1HG GLU 2 HG2 GLU 2 7.438 32.647 -4.894 824 2HG GLU 2 HG3 GLU 2 8.798 31.551 -5.086 825 H ASN 3 HN ASN 3 7.901 27.438 -5.170 826 HA ASN 3 HA ASN 3 6.896 25.787 -4.305 827 1HB ASN 3 HB2 ASN 3 4.182 26.688 -5.235 828 2HB ASN 3 HB3 ASN 3 4.591 25.393 -4.098 829 1HD2 ASN 3 HD22 ASN 3 5.910 26.117 -2.074 830 2HD2 ASN 3 HD21 ASN 3 5.490 27.668 -1.405 831 H LYS 4 HN LYS 4 7.089 23.972 -4.876 832 HA LYS 4 HA LYS 4 6.173 22.645 -7.311 833 1HB LYS 4 HB2 LYS 4 9.068 22.752 -6.285 834 2HB LYS 4 HB3 LYS 4 8.504 21.651 -7.538 835 1HG LYS 4 HG2 LYS 4 8.150 23.450 -9.091 836 2HG LYS 4 HG3 LYS 4 8.411 24.686 -7.847 837 1HD LYS 4 HD2 LYS 4 10.730 24.091 -7.572 838 2HD LYS 4 HD3 LYS 4 10.571 22.706 -8.663 839 1HE LYS 4 HE2 LYS 4 10.116 25.611 -9.467 840 2HE LYS 4 HE3 LYS 4 11.660 24.769 -9.640 841 1HZ LYS 4 HZ1 LYS 4 9.148 23.983 -11.006 842 2HZ LYS 4 HZ2 LYS 4 10.438 24.693 -11.703 843 3HZ LYS 4 HZ3 LYS 4 10.570 23.182 -11.122 844 H ILE 5 HN ILE 5 5.814 20.302 -6.655 845 HA ILE 5 HA ILE 5 6.288 19.871 -3.744 846 HB ILE 5 HB ILE 5 3.819 19.207 -5.378 847 1HG1 ILE 5 HG12 ILE 5 4.466 21.277 -3.261 848 2HG1 ILE 5 HG13 ILE 5 3.729 21.510 -4.844 849 1HG2 ILE 5 HG21 ILE 5 4.424 18.665 -2.442 850 2HG2 ILE 5 HG22 ILE 5 2.920 18.231 -3.325 851 3HG2 ILE 5 HG23 ILE 5 4.401 17.419 -3.736 852 1HD1 ILE 5 HD11 ILE 5 2.044 21.816 -3.159 853 2HD1 ILE 5 HD12 ILE 5 1.698 20.273 -3.984 854 3HD1 ILE 5 HD13 ILE 5 2.463 20.282 -2.372 855 H ILE 6 HN ILE 6 6.900 17.909 -3.119 856 HA ILE 6 HA ILE 6 7.195 15.717 -5.052 857 HB ILE 6 HB ILE 6 9.280 16.961 -5.285 858 1HG1 ILE 6 HG12 ILE 6 9.656 14.318 -3.828 859 2HG1 ILE 6 HG13 ILE 6 9.328 14.541 -5.547 860 1HG2 ILE 6 HG21 ILE 6 10.872 17.320 -3.488 861 2HG2 ILE 6 HG22 ILE 6 9.346 18.055 -3.053 862 3HG2 ILE 6 HG23 ILE 6 9.805 16.499 -2.330 863 1HD1 ILE 6 HD11 ILE 6 11.862 15.384 -4.070 864 2HD1 ILE 6 HD12 ILE 6 11.693 14.106 -5.266 865 3HD1 ILE 6 HD13 ILE 6 11.498 15.796 -5.765 866 H TYR 7 HN TYR 7 7.055 13.702 -4.007 867 HA TYR 7 HA TYR 7 6.239 13.853 -1.140 868 1HB TYR 7 HB2 TYR 7 4.448 13.781 -3.071 869 2HB TYR 7 HB3 TYR 7 4.882 12.090 -3.181 870 HD1 TYR 7 HD1 TYR 7 3.602 14.772 -0.939 871 HD2 TYR 7 HD2 TYR 7 4.006 10.502 -1.460 872 HE1 TYR 7 HE1 TYR 7 1.841 14.388 0.756 873 HE2 TYR 7 HE2 TYR 7 2.140 10.142 0.081 874 HH TYR 7 HH TYR 7 0.380 12.807 1.695 875 H PHE 8 HN PHE 8 6.952 12.127 0.111 876 HA PHE 8 HA PHE 8 8.626 10.070 -1.272 877 1HB PHE 8 HB2 PHE 8 8.764 11.006 1.597 878 2HB PHE 8 HB3 PHE 8 9.817 9.835 0.828 879 HD1 PHE 8 HD1 PHE 8 9.774 12.041 -1.793 880 HD2 PHE 8 HD2 PHE 8 10.966 11.959 2.355 881 HE1 PHE 8 HE1 PHE 8 11.387 13.833 -2.232 882 HE2 PHE 8 HE2 PHE 8 12.593 13.749 1.875 883 HZ PHE 8 HZ PHE 8 12.785 14.720 -0.383 884 H LEU 9 HN LEU 9 8.378 7.887 -0.649 885 HA LEU 9 HA LEU 9 5.906 7.259 0.880 886 1HB LEU 9 HB2 LEU 9 5.663 7.653 -1.666 887 2HB LEU 9 HB3 LEU 9 6.619 6.196 -1.886 888 HG LEU 9 HG LEU 9 4.866 4.884 -0.712 889 1HD1 LEU 9 HD11 LEU 9 3.864 6.535 0.791 890 2HD1 LEU 9 HD12 LEU 9 3.418 7.584 -0.566 891 3HD1 LEU 9 HD13 LEU 9 2.620 6.007 -0.329 892 1HD2 LEU 9 HD21 LEU 9 3.105 5.257 -2.512 893 2HD2 LEU 9 HD22 LEU 9 4.046 6.645 -3.051 894 3HD2 LEU 9 HD23 LEU 9 4.761 5.024 -3.104 895 H SER 10 HN SER 10 6.537 5.817 2.464 896 HA SER 10 HA SER 10 8.227 3.564 1.793 897 1HB SER 10 HB2 SER 10 9.979 4.144 3.469 898 2HB SER 10 HB3 SER 10 10.004 5.150 2.022 899 HG SER 10 HG SER 10 8.823 6.745 3.288 900 H THR 11 HN THR 11 8.192 1.942 3.400 901 HA THR 11 HA THR 11 5.875 1.512 4.668 902 HB THR 11 HB THR 11 8.627 0.464 5.390 903 HG1 THR 11 HG1 THR 11 8.023 -1.132 3.893 904 1HG2 THR 11 HG21 THR 11 6.987 -0.136 7.155 905 2HG2 THR 11 HG22 THR 11 5.869 -0.747 5.915 906 3HG2 THR 11 HG23 THR 11 7.442 -1.541 6.203 907 H GLY 12 HN GLY 12 4.812 2.420 6.270 908 1HA GLY 12 HA2 GLY 12 4.285 3.217 8.350 909 2HA GLY 12 HA3 GLY 12 5.855 2.618 8.906 910 H ASN 13 HN ASN 13 6.057 4.818 6.303 911 HA ASN 13 HA ASN 13 7.828 6.470 6.623 912 1HB ASN 13 HB2 ASN 13 5.965 6.802 5.071 913 2HB ASN 13 HB3 ASN 13 5.132 7.776 6.281 914 1HD2 ASN 13 HD22 ASN 13 6.567 9.651 7.248 915 2HD2 ASN 13 HD21 ASN 13 7.622 10.445 6.135 916 H SER 14 HN SER 14 8.684 6.409 8.738 917 HA SER 14 HA SER 14 8.045 8.852 10.250 918 1HB SER 14 HB2 SER 14 8.060 7.423 12.388 919 2HB SER 14 HB3 SER 14 6.605 7.382 11.385 920 HG SER 14 HG SER 14 7.087 5.429 10.647 921 H ALA 15 HN ALA 15 10.410 7.284 8.668 922 HA ALA 15 HA ALA 15 12.489 7.946 10.681 923 1HB ALA 15 HB1 ALA 15 13.615 5.785 10.268 924 2HB ALA 15 HB2 ALA 15 12.008 5.569 11.009 925 3HB ALA 15 HB3 ALA 15 12.230 5.255 9.280 926 H ARG 16 HN ARG 16 13.103 6.063 7.753 927 HA ARG 16 HA ARG 16 15.170 7.835 7.080 928 1HB ARG 16 HB2 ARG 16 15.718 6.360 5.408 929 2HB ARG 16 HB3 ARG 16 14.912 5.390 6.607 930 1HG ARG 16 HG2 ARG 16 13.961 6.144 3.857 931 2HG ARG 16 HG3 ARG 16 14.290 4.546 4.522 932 1HD ARG 16 HD2 ARG 16 11.899 6.267 5.304 933 2HD ARG 16 HD3 ARG 16 11.915 5.012 4.084 934 HE ARG 16 HE ARG 16 12.843 3.666 6.282 935 1HH1 ARG 16 HH11 ARG 16 9.827 5.437 5.468 936 2HH1 ARG 16 HH12 ARG 16 8.870 4.338 6.423 937 1HH2 ARG 16 HH21 ARG 16 11.446 2.201 7.266 938 2HH2 ARG 16 HH22 ARG 16 9.764 2.604 7.506 939 H SER 17 HN SER 17 11.851 7.985 6.212 940 HA SER 17 HA SER 17 11.824 9.828 4.068 941 1HB SER 17 HB2 SER 17 9.522 10.165 5.247 942 2HB SER 17 HB3 SER 17 9.923 8.593 4.529 943 HG SER 17 HG SER 17 9.586 9.313 7.192 944 H GLN 18 HN GLN 18 11.736 10.250 7.629 945 HA GLN 18 HA GLN 18 11.358 13.043 7.663 946 1HB GLN 18 HB2 GLN 18 12.912 11.740 9.844 947 2HB GLN 18 HB3 GLN 18 11.690 12.990 9.931 948 1HG GLN 18 HG2 GLN 18 11.288 10.029 9.655 949 2HG GLN 18 HG3 GLN 18 10.801 11.041 10.979 950 1HE2 GLN 18 HE22 GLN 18 8.563 11.714 10.986 951 2HE2 GLN 18 HE21 GLN 18 7.580 11.617 9.547 952 H MET 19 HN MET 19 14.177 10.966 7.880 953 HA MET 19 HA MET 19 16.175 12.934 8.095 954 1HB MET 19 HB2 MET 19 16.573 10.597 8.638 955 2HB MET 19 HB3 MET 19 16.017 10.081 7.057 956 1HG MET 19 HG2 MET 19 18.175 11.569 6.336 957 2HG MET 19 HG3 MET 19 18.699 10.971 7.905 958 1HE MET 19 HE1 MET 19 18.255 7.019 7.158 959 2HE MET 19 HE2 MET 19 18.947 8.128 8.359 960 3HE MET 19 HE3 MET 19 17.195 8.128 8.058 961 H ALA 20 HN ALA 20 14.831 11.224 5.174 962 HA ALA 20 HA ALA 20 16.404 12.582 3.287 963 1HB ALA 20 HB1 ALA 20 15.191 10.541 2.734 964 2HB ALA 20 HB2 ALA 20 13.629 11.365 2.976 965 3HB ALA 20 HB3 ALA 20 14.701 11.848 1.647 966 H GLU 21 HN GLU 21 13.241 13.579 4.742 967 HA GLU 21 HA GLU 21 13.076 15.741 2.850 968 1HB GLU 21 HB2 GLU 21 11.047 16.348 3.818 969 2HB GLU 21 HB3 GLU 21 11.111 14.578 3.777 970 1HG GLU 21 HG2 GLU 21 11.609 14.498 6.135 971 2HG GLU 21 HG3 GLU 21 11.655 16.266 6.224 972 H GLY 22 HN GLY 22 14.534 15.373 6.023 973 1HA GLY 22 HA2 GLY 22 15.064 18.179 6.507 974 2HA GLY 22 HA3 GLY 22 15.952 16.782 7.160 975 H TRP 23 HN TRP 23 16.905 15.477 4.959 976 HA TRP 23 HA TRP 23 19.101 16.935 3.945 977 1HB TRP 23 HB2 TRP 23 17.672 14.391 3.227 978 2HB TRP 23 HB3 TRP 23 18.664 15.105 1.970 979 HD1 TRP 23 HD1 TRP 23 18.882 13.002 4.961 980 HE1 TRP 23 HE1 TRP 23 21.295 12.532 5.601 981 HE3 TRP 23 HE3 TRP 23 21.189 16.322 1.832 982 HZ2 TRP 23 HZ2 TRP 23 23.927 13.458 4.846 983 HZ3 TRP 23 HZ3 TRP 23 23.669 16.441 1.748 984 HH2 TRP 23 HH2 TRP 23 25.050 15.033 3.260 985 H ALA 24 HN ALA 24 15.855 16.406 2.532 986 HA ALA 24 HA ALA 24 16.395 17.447 0.050 987 1HB ALA 24 HB1 ALA 24 14.231 16.303 0.778 988 2HB ALA 24 HB2 ALA 24 13.742 17.822 1.557 989 3HB ALA 24 HB3 ALA 24 13.974 17.774 -0.188 990 H LYS 25 HN LYS 25 15.188 19.231 2.955 991 HA LYS 25 HA LYS 25 14.779 21.582 1.458 992 1HB LYS 25 HB2 LYS 25 14.449 20.721 4.246 993 2HB LYS 25 HB3 LYS 25 14.997 22.393 4.178 994 1HG LYS 25 HG2 LYS 25 12.734 21.391 2.411 995 2HG LYS 25 HG3 LYS 25 12.436 21.938 4.067 996 1HD LYS 25 HD2 LYS 25 13.180 24.139 3.630 997 2HD LYS 25 HD3 LYS 25 13.935 23.709 2.102 998 1HE LYS 25 HE2 LYS 25 10.906 23.633 2.589 999 2HE LYS 25 HE3 LYS 25 11.770 24.969 1.836 1000 1HZ LYS 25 HZ1 LYS 25 10.896 23.585 0.157 1001 2HZ LYS 25 HZ2 LYS 25 12.513 23.409 0.092 1002 3HZ LYS 25 HZ3 LYS 25 11.606 22.224 0.764 1003 H GLN 26 HN GLN 26 17.772 20.425 2.870 1004 HA GLN 26 HA GLN 26 18.963 23.015 2.888 1005 1HB GLN 26 HB2 GLN 26 21.009 22.063 3.318 1006 2HB GLN 26 HB3 GLN 26 19.841 21.128 4.210 1007 1HG GLN 26 HG2 GLN 26 20.352 19.202 3.142 1008 2HG GLN 26 HG3 GLN 26 20.425 19.936 1.549 1009 1HE2 GLN 26 HE22 GLN 26 22.313 18.059 3.270 1010 2HE2 GLN 26 HE21 GLN 26 23.872 18.799 3.028 1011 H TYR 27 HN TYR 27 18.078 21.072 0.183 1012 HA TYR 27 HA TYR 27 19.724 22.837 -1.584 1013 1HB TYR 27 HB2 TYR 27 19.731 19.881 -1.415 1014 2HB TYR 27 HB3 TYR 27 19.407 20.477 -3.023 1015 HD1 TYR 27 HD1 TYR 27 21.852 20.823 -0.203 1016 HD2 TYR 27 HD2 TYR 27 21.149 21.265 -4.432 1017 HE1 TYR 27 HE1 TYR 27 24.260 21.248 -0.545 1018 HE2 TYR 27 HE2 TYR 27 23.560 21.667 -4.797 1019 HH TYR 27 HH TYR 27 25.942 21.708 -2.101 1020 H LEU 28 HN LEU 28 16.802 20.800 -1.332 1021 HA LEU 28 HA LEU 28 15.467 22.116 -3.593 1022 1HB LEU 28 HB2 LEU 28 14.473 20.053 -1.575 1023 2HB LEU 28 HB3 LEU 28 13.539 20.706 -2.912 1024 HG LEU 28 HG LEU 28 16.021 18.958 -3.127 1025 1HD1 LEU 28 HD11 LEU 28 13.906 17.804 -2.478 1026 2HD1 LEU 28 HD12 LEU 28 13.116 18.456 -3.925 1027 3HD1 LEU 28 HD13 LEU 28 14.471 17.318 -4.081 1028 1HD2 LEU 28 HD21 LEU 28 15.975 20.557 -5.036 1029 2HD2 LEU 28 HD22 LEU 28 15.616 18.909 -5.556 1030 3HD2 LEU 28 HD23 LEU 28 14.301 20.082 -5.377 1031 H GLY 29 HN GLY 29 16.006 24.097 -2.564 1032 1HA GLY 29 HA2 GLY 29 15.202 25.029 -0.042 1033 2HA GLY 29 HA3 GLY 29 15.663 26.016 -1.430 1034 H ASP 30 HN ASP 30 14.154 27.627 -0.946 1035 HA ASP 30 HA ASP 30 11.508 27.223 -0.107 1036 1HB ASP 30 HB2 ASP 30 12.829 29.269 0.245 1037 2HB ASP 30 HB3 ASP 30 12.775 29.617 -1.485 1038 H GLU 31 HN GLU 31 12.773 27.082 -3.342 1039 HA GLU 31 HA GLU 31 10.358 27.587 -4.824 1040 1HB GLU 31 HB2 GLU 31 12.818 25.892 -5.388 1041 2HB GLU 31 HB3 GLU 31 11.499 26.064 -6.546 1042 1HG GLU 31 HG2 GLU 31 13.127 28.371 -5.461 1043 2HG GLU 31 HG3 GLU 31 13.435 27.510 -6.979 1044 H TRP 32 HN TRP 32 11.223 24.946 -2.701 1045 HA TRP 32 HA TRP 32 9.236 23.157 -4.024 1046 1HB TRP 32 HB2 TRP 32 11.746 22.433 -2.481 1047 2HB TRP 32 HB3 TRP 32 10.630 21.306 -3.231 1048 HD1 TRP 32 HD1 TRP 32 13.282 23.913 -4.149 1049 HE1 TRP 32 HE1 TRP 32 14.226 23.400 -6.475 1050 HE3 TRP 32 HE3 TRP 32 10.165 20.060 -5.452 1051 HZ2 TRP 32 HZ2 TRP 32 13.722 21.554 -8.605 1052 HZ3 TRP 32 HZ3 TRP 32 10.440 18.923 -7.638 1053 HH2 TRP 32 HH2 TRP 32 12.212 19.652 -9.225 1054 H LYS 33 HN LYS 33 8.139 21.676 -2.687 1055 HA LYS 33 HA LYS 33 8.185 22.058 0.250 1056 1HB LYS 33 HB2 LYS 33 5.812 22.023 -1.659 1057 2HB LYS 33 HB3 LYS 33 5.613 21.455 -0.023 1058 1HG LYS 33 HG2 LYS 33 6.892 24.176 -0.531 1059 2HG LYS 33 HG3 LYS 33 5.138 24.004 -0.608 1060 1HD LYS 33 HD2 LYS 33 6.858 23.271 1.809 1061 2HD LYS 33 HD3 LYS 33 6.031 24.816 1.582 1062 1HE LYS 33 HE2 LYS 33 3.841 23.631 1.463 1063 2HE LYS 33 HE3 LYS 33 4.662 22.093 1.756 1064 1HZ LYS 33 HZ1 LYS 33 3.748 23.007 3.789 1065 2HZ LYS 33 HZ2 LYS 33 5.372 22.961 3.912 1066 3HZ LYS 33 HZ3 LYS 33 4.607 24.381 3.638 1067 H VAL 34 HN VAL 34 7.964 20.071 1.319 1068 HA VAL 34 HA VAL 34 8.158 17.643 -0.384 1069 HB VAL 34 HB VAL 34 9.990 18.358 1.956 1070 1HG1 VAL 34 HG11 VAL 34 11.311 16.427 1.163 1071 2HG1 VAL 34 HG12 VAL 34 9.682 15.938 1.635 1072 3HG1 VAL 34 HG13 VAL 34 10.090 16.094 -0.082 1073 1HG2 VAL 34 HG21 VAL 34 10.624 18.497 -1.019 1074 2HG2 VAL 34 HG22 VAL 34 10.576 19.860 0.116 1075 3HG2 VAL 34 HG23 VAL 34 11.802 18.619 0.300 1076 H TYR 35 HN TYR 35 6.981 15.945 0.486 1077 HA TYR 35 HA TYR 35 6.422 15.965 3.364 1078 1HB TYR 35 HB2 TYR 35 4.451 17.100 2.108 1079 2HB TYR 35 HB3 TYR 35 4.103 15.501 1.467 1080 HD1 TYR 35 HD1 TYR 35 2.972 13.849 2.890 1081 HD2 TYR 35 HD2 TYR 35 4.529 17.495 4.597 1082 HE1 TYR 35 HE1 TYR 35 1.835 13.327 5.014 1083 HE2 TYR 35 HE2 TYR 35 3.396 16.976 6.739 1084 HH TYR 35 HH TYR 35 1.385 14.042 7.190 1085 H SER 36 HN SER 36 5.489 13.772 4.006 1086 HA SER 36 HA SER 36 6.493 11.592 2.276 1087 1HB SER 36 HB2 SER 36 7.428 12.026 5.134 1088 2HB SER 36 HB3 SER 36 8.055 10.894 3.917 1089 HG SER 36 HG SER 36 8.762 13.416 4.487 1090 H ALA 37 HN ALA 37 5.306 9.661 2.658 1091 HA ALA 37 HA ALA 37 3.409 9.581 4.938 1092 1HB ALA 37 HB1 ALA 37 1.532 9.414 3.449 1093 2HB ALA 37 HB2 ALA 37 2.395 10.904 3.057 1094 3HB ALA 37 HB3 ALA 37 2.598 9.466 2.017 1095 H GLY 38 HN GLY 38 2.158 7.413 4.863 1096 1HA GLY 38 HA2 GLY 38 3.109 5.260 3.218 1097 2HA GLY 38 HA3 GLY 38 3.929 5.257 4.776 1098 H ILE 39 HN ILE 39 2.749 3.094 4.593 1099 HA ILE 39 HA ILE 39 0.108 2.594 4.610 1100 HB ILE 39 HB ILE 39 1.466 0.790 4.482 1101 1HG1 ILE 39 HG12 ILE 39 0.459 0.304 7.298 1102 2HG1 ILE 39 HG13 ILE 39 -0.670 0.591 5.990 1103 1HG2 ILE 39 HG21 ILE 39 2.751 1.353 7.173 1104 2HG2 ILE 39 HG22 ILE 39 3.023 -0.083 6.175 1105 3HG2 ILE 39 HG23 ILE 39 3.496 1.497 5.575 1106 1HD1 ILE 39 HD11 ILE 39 0.285 -1.295 4.712 1107 2HD1 ILE 39 HD12 ILE 39 1.325 -1.678 6.111 1108 3HD1 ILE 39 HD13 ILE 39 -0.446 -1.761 6.252 1109 H GLU 40 HN GLU 40 1.851 3.077 7.686 1110 HA GLU 40 HA GLU 40 -0.667 3.865 9.052 1111 1HB GLU 40 HB2 GLU 40 -0.018 2.436 10.958 1112 2HB GLU 40 HB3 GLU 40 -0.422 1.527 9.512 1113 1HG GLU 40 HG2 GLU 40 1.857 0.905 9.104 1114 2HG GLU 40 HG3 GLU 40 2.478 2.115 10.220 1115 H ALA 41 HN ALA 41 1.380 5.406 7.913 1116 HA ALA 41 HA ALA 41 3.556 6.117 9.598 1117 1HB ALA 41 HB1 ALA 41 2.117 7.351 7.220 1118 2HB ALA 41 HB2 ALA 41 3.625 8.010 7.881 1119 3HB ALA 41 HB3 ALA 41 3.579 6.357 7.188 1120 H HIS 42 HN HIS 42 3.944 7.942 10.743 1121 HA HIS 42 HA HIS 42 3.171 10.347 11.083 1122 1HB HIS 42 HB2 HIS 42 0.774 10.003 11.273 1123 2HB HIS 42 HB3 HIS 42 0.984 8.780 12.531 1124 HD1 HIS 42 HD1 HIS 42 1.388 12.589 12.024 1125 HD2 HIS 42 HD2 HIS 42 0.985 9.659 15.020 1126 HE1 HIS 42 HE1 HIS 42 1.015 13.850 14.218 1127 H GLY 43 HN GLY 43 5.290 10.348 12.012 1128 1HA GLY 43 HA2 GLY 43 5.676 9.661 14.742 1129 2HA GLY 43 HA3 GLY 43 6.222 8.331 13.704 1130 H LEU 44 HN LEU 44 8.173 9.374 15.145 1131 HA LEU 44 HA LEU 44 9.929 10.523 13.132 1132 1HB LEU 44 HB2 LEU 44 9.020 12.571 14.125 1133 2HB LEU 44 HB3 LEU 44 9.386 11.991 15.750 1134 HG LEU 44 HG LEU 44 11.814 12.052 15.241 1135 1HD1 LEU 44 HD11 LEU 44 12.527 13.300 13.126 1136 2HD1 LEU 44 HD12 LEU 44 11.959 11.649 12.886 1137 3HD1 LEU 44 HD13 LEU 44 10.891 13.031 12.510 1138 1HD2 LEU 44 HD21 LEU 44 12.075 14.461 15.204 1139 2HD2 LEU 44 HD22 LEU 44 10.445 14.674 14.557 1140 3HD2 LEU 44 HD23 LEU 44 10.676 14.035 16.199 1141 H ASN 45 HN ASN 45 10.997 8.576 13.232 1142 HA ASN 45 HA ASN 45 11.730 7.215 15.626 1143 1HB ASN 45 HB2 ASN 45 11.532 6.223 13.346 1144 2HB ASN 45 HB3 ASN 45 12.993 7.087 12.854 1145 1HD2 ASN 45 HD22 ASN 45 12.668 4.195 12.745 1146 2HD2 ASN 45 HD21 ASN 45 13.827 3.526 13.853 1147 HA PRO 46 HA PRO 46 14.987 10.118 16.713 1148 1HB PRO 46 HB2 PRO 46 16.394 8.631 18.589 1149 2HB PRO 46 HB3 PRO 46 14.886 9.546 18.897 1150 1HG PRO 46 HG2 PRO 46 15.186 6.598 18.263 1151 2HG PRO 46 HG3 PRO 46 14.190 7.361 19.545 1152 1HD PRO 46 HD2 PRO 46 13.086 6.579 17.214 1153 2HD PRO 46 HD3 PRO 46 12.589 8.123 17.963 1154 H ASN 47 HN ASN 47 15.655 6.879 15.348 1155 HA ASN 47 HA ASN 47 18.465 7.317 14.901 1156 1HB ASN 47 HB2 ASN 47 18.375 5.401 13.669 1157 2HB ASN 47 HB3 ASN 47 16.844 5.166 14.497 1158 1HD2 ASN 47 HD22 ASN 47 18.374 5.452 11.419 1159 2HD2 ASN 47 HD21 ASN 47 16.888 5.388 10.482 1160 H ALA 48 HN ALA 48 15.508 8.403 13.181 1161 HA ALA 48 HA ALA 48 16.971 9.316 10.876 1162 1HB ALA 48 HB1 ALA 48 14.187 10.078 11.894 1163 2HB ALA 48 HB2 ALA 48 14.817 10.391 10.271 1164 3HB ALA 48 HB3 ALA 48 14.593 8.710 10.830 1165 H VAL 49 HN VAL 49 15.733 10.736 13.898 1166 HA VAL 49 HA VAL 49 16.476 13.459 13.378 1167 HB VAL 49 HB VAL 49 16.466 12.034 16.079 1168 1HG1 VAL 49 HG11 VAL 49 16.023 14.298 16.988 1169 2HG1 VAL 49 HG12 VAL 49 17.582 14.233 16.161 1170 3HG1 VAL 49 HG13 VAL 49 16.185 14.989 15.360 1171 1HG2 VAL 49 HG21 VAL 49 14.167 12.892 16.329 1172 2HG2 VAL 49 HG22 VAL 49 14.222 13.527 14.671 1173 3HG2 VAL 49 HG23 VAL 49 14.266 11.777 14.967 1174 H LYS 50 HN LYS 50 18.271 10.815 15.023 1175 HA LYS 50 HA LYS 50 20.689 12.248 15.373 1176 1HB LYS 50 HB2 LYS 50 19.899 10.139 16.523 1177 2HB LYS 50 HB3 LYS 50 20.317 9.236 15.055 1178 1HG LYS 50 HG2 LYS 50 22.648 9.894 15.284 1179 2HG LYS 50 HG3 LYS 50 22.258 10.971 16.640 1180 1HD LYS 50 HD2 LYS 50 21.551 9.040 18.011 1181 2HD LYS 50 HD3 LYS 50 21.838 7.953 16.656 1182 1HE LYS 50 HE2 LYS 50 23.698 7.741 18.134 1183 2HE LYS 50 HE3 LYS 50 24.263 8.567 16.682 1184 1HZ LYS 50 HZ1 LYS 50 23.597 9.891 19.254 1185 2HZ LYS 50 HZ2 LYS 50 25.100 9.598 18.707 1186 3HZ LYS 50 HZ3 LYS 50 24.153 10.662 17.920 1187 H ALA 51 HN ALA 51 19.623 10.155 12.669 1188 HA ALA 51 HA ALA 51 21.883 10.188 11.088 1189 1HB ALA 51 HB1 ALA 51 19.885 8.878 10.599 1190 2HB ALA 51 HB2 ALA 51 18.977 10.352 10.210 1191 3HB ALA 51 HB3 ALA 51 20.342 9.857 9.207 1192 H MET 52 HN MET 52 19.467 12.882 11.505 1193 HA MET 52 HA MET 52 20.792 14.447 9.427 1194 1HB MET 52 HB2 MET 52 18.573 15.181 11.400 1195 2HB MET 52 HB3 MET 52 19.134 16.164 10.046 1196 1HG MET 52 HG2 MET 52 17.648 13.551 9.949 1197 2HG MET 52 HG3 MET 52 17.201 15.091 9.241 1198 1HE MET 52 HE1 MET 52 20.088 15.868 7.761 1199 2HE MET 52 HE2 MET 52 19.493 15.400 6.167 1200 3HE MET 52 HE3 MET 52 18.372 16.161 7.319 1201 H LYS 53 HN LYS 53 20.826 14.307 13.001 1202 HA LYS 53 HA LYS 53 22.405 16.688 13.240 1203 1HB LYS 53 HB2 LYS 53 22.478 14.256 15.083 1204 2HB LYS 53 HB3 LYS 53 23.021 15.891 15.471 1205 1HG LYS 53 HG2 LYS 53 20.172 15.013 15.010 1206 2HG LYS 53 HG3 LYS 53 20.922 15.355 16.557 1207 1HD LYS 53 HD2 LYS 53 21.071 17.730 16.065 1208 2HD LYS 53 HD3 LYS 53 20.662 17.451 14.365 1209 1HE LYS 53 HE2 LYS 53 18.656 18.202 15.272 1210 2HE LYS 53 HE3 LYS 53 18.493 16.449 15.089 1211 1HZ LYS 53 HZ1 LYS 53 17.604 17.195 17.198 1212 2HZ LYS 53 HZ2 LYS 53 18.918 16.267 17.504 1213 3HZ LYS 53 HZ3 LYS 53 19.015 17.896 17.627 1214 H GLU 54 HN GLU 54 23.289 13.423 12.153 1215 HA GLU 54 HA GLU 54 26.080 13.593 12.509 1216 1HB GLU 54 HB2 GLU 54 24.604 12.396 10.125 1217 2HB GLU 54 HB3 GLU 54 26.303 12.171 10.503 1218 1HG GLU 54 HG2 GLU 54 25.563 11.153 12.733 1219 2HG GLU 54 HG3 GLU 54 23.935 11.094 12.052 1220 H VAL 55 HN VAL 55 24.006 15.208 10.134 1221 HA VAL 55 HA VAL 55 26.387 16.544 8.943 1222 HB VAL 55 HB VAL 55 24.996 16.777 6.908 1223 1HG1 VAL 55 HG11 VAL 55 26.642 14.914 7.284 1224 2HG1 VAL 55 HG12 VAL 55 25.291 13.869 7.772 1225 3HG1 VAL 55 HG13 VAL 55 25.368 14.547 6.129 1226 1HG2 VAL 55 HG21 VAL 55 23.045 14.820 8.221 1227 2HG2 VAL 55 HG22 VAL 55 22.726 16.551 7.978 1228 3HG2 VAL 55 HG23 VAL 55 22.964 15.495 6.584 1229 H GLY 56 HN GLY 56 24.501 17.201 11.351 1230 1HA GLY 56 HA2 GLY 56 23.881 19.127 12.373 1231 2HA GLY 56 HA3 GLY 56 24.848 19.990 11.167 1232 H ILE 57 HN ILE 57 21.827 17.986 10.743 1233 HA ILE 57 HA ILE 57 20.373 20.499 10.012 1234 HB ILE 57 HB ILE 57 20.053 17.788 8.703 1235 1HG1 ILE 57 HG12 ILE 57 20.985 20.455 7.554 1236 2HG1 ILE 57 HG13 ILE 57 22.006 19.051 7.854 1237 1HG2 ILE 57 HG21 ILE 57 18.281 18.859 7.326 1238 2HG2 ILE 57 HG22 ILE 57 17.847 18.914 9.017 1239 3HG2 ILE 57 HG23 ILE 57 18.480 20.371 8.215 1240 1HD1 ILE 57 HD11 ILE 57 20.689 17.749 6.170 1241 2HD1 ILE 57 HD12 ILE 57 19.811 19.247 5.757 1242 3HD1 ILE 57 HD13 ILE 57 21.557 19.147 5.519 1243 H ASP 58 HN ASP 58 18.230 20.494 10.962 1244 HA ASP 58 HA ASP 58 17.912 18.493 13.160 1245 1HB ASP 58 HB2 ASP 58 18.562 20.607 14.121 1246 2HB ASP 58 HB3 ASP 58 17.346 21.471 13.163 1247 H ILE 59 HN ILE 59 16.015 17.570 13.369 1248 HA ILE 59 HA ILE 59 13.645 18.509 11.888 1249 HB ILE 59 HB ILE 59 13.121 16.289 11.103 1250 1HG1 ILE 59 HG12 ILE 59 15.932 15.380 11.948 1251 2HG1 ILE 59 HG13 ILE 59 14.461 14.998 12.842 1252 1HG2 ILE 59 HG21 ILE 59 14.477 17.894 9.668 1253 2HG2 ILE 59 HG22 ILE 59 15.938 17.003 10.127 1254 3HG2 ILE 59 HG23 ILE 59 14.649 16.192 9.210 1255 1HD1 ILE 59 HD11 ILE 59 13.537 13.915 10.788 1256 2HD1 ILE 59 HD12 ILE 59 15.135 14.084 10.031 1257 3HD1 ILE 59 HD13 ILE 59 14.939 13.104 11.496 1258 H SER 60 HN SER 60 14.732 18.241 14.832 1259 HA SER 60 HA SER 60 13.490 16.054 16.022 1260 1HB SER 60 HB2 SER 60 14.091 18.728 17.340 1261 2HB SER 60 HB3 SER 60 13.972 17.146 18.132 1262 HG SER 60 HG SER 60 15.925 18.112 16.300 1263 H ASN 61 HN ASN 61 11.831 18.703 14.710 1264 HA ASN 61 HA ASN 61 9.495 18.470 16.476 1265 1HB ASN 61 HB2 ASN 61 10.373 20.724 15.975 1266 2HB ASN 61 HB3 ASN 61 10.171 20.427 14.249 1267 1HD2 ASN 61 HD22 ASN 61 8.268 21.218 13.376 1268 2HD2 ASN 61 HD21 ASN 61 6.815 21.539 14.283 1269 H GLN 62 HN GLN 62 10.627 17.167 13.426 1270 HA GLN 62 HA GLN 62 8.384 17.346 11.844 1271 1HB GLN 62 HB2 GLN 62 10.705 15.437 11.906 1272 2HB GLN 62 HB3 GLN 62 9.359 15.198 10.789 1273 1HG GLN 62 HG2 GLN 62 9.589 17.610 10.051 1274 2HG GLN 62 HG3 GLN 62 11.065 17.698 11.017 1275 1HE2 GLN 62 HE22 GLN 62 12.035 18.250 8.951 1276 2HE2 GLN 62 HE21 GLN 62 12.514 16.959 7.845 1277 H THR 63 HN THR 63 7.036 15.685 11.041 1278 HA THR 63 HA THR 63 6.571 13.212 12.299 1279 HB THR 63 HB THR 63 5.400 14.644 13.965 1280 HG1 THR 63 HG1 THR 63 3.814 13.227 14.118 1281 1HG2 THR 63 HG21 THR 63 4.556 16.432 12.442 1282 2HG2 THR 63 HG22 THR 63 3.421 15.265 11.727 1283 3HG2 THR 63 HG23 THR 63 3.283 15.712 13.441 1284 H SER 64 HN SER 64 4.138 12.581 11.208 1285 HA SER 64 HA SER 64 4.087 13.358 8.375 1286 1HB SER 64 HB2 SER 64 4.729 10.499 9.230 1287 2HB SER 64 HB3 SER 64 4.415 11.042 7.572 1288 HG SER 64 HG SER 64 6.217 12.472 7.822 1289 H ASP 65 HN ASP 65 2.560 11.080 7.585 1290 HA ASP 65 HA ASP 65 0.207 10.736 9.180 1291 1HB ASP 65 HB2 ASP 65 -0.124 13.080 8.255 1292 2HB ASP 65 HB3 ASP 65 0.047 12.395 6.627 1293 H ILE 66 HN ILE 66 -1.373 9.379 7.711 1294 HA ILE 66 HA ILE 66 0.095 7.413 6.241 1295 HB ILE 66 HB ILE 66 -2.248 6.622 5.675 1296 1HG1 ILE 66 HG12 ILE 66 -3.123 8.759 7.648 1297 2HG1 ILE 66 HG13 ILE 66 -3.330 8.882 5.896 1298 1HG2 ILE 66 HG21 ILE 66 -1.579 6.999 8.627 1299 2HG2 ILE 66 HG22 ILE 66 -2.579 5.706 7.918 1300 3HG2 ILE 66 HG23 ILE 66 -0.859 5.791 7.541 1301 1HD1 ILE 66 HD11 ILE 66 -4.718 6.797 5.968 1302 2HD1 ILE 66 HD12 ILE 66 -4.578 6.819 7.747 1303 3HD1 ILE 66 HD13 ILE 66 -5.392 8.149 6.908 1304 H ILE 67 HN ILE 67 -0.607 6.761 3.952 1305 HA ILE 67 HA ILE 67 0.061 8.649 2.091 1306 HB ILE 67 HB ILE 67 -0.443 7.206 0.431 1307 1HG1 ILE 67 HG12 ILE 67 -2.708 5.890 1.971 1308 2HG1 ILE 67 HG13 ILE 67 -2.877 7.072 0.667 1309 1HG2 ILE 67 HG21 ILE 67 0.280 5.020 1.063 1310 2HG2 ILE 67 HG22 ILE 67 1.083 6.188 2.108 1311 3HG2 ILE 67 HG23 ILE 67 -0.289 5.226 2.726 1312 1HD1 ILE 67 HD11 ILE 67 -1.587 5.434 -0.827 1313 2HD1 ILE 67 HD12 ILE 67 -1.963 4.217 0.409 1314 3HD1 ILE 67 HD13 ILE 67 -3.275 5.090 -0.436 1315 H ASP 68 HN ASP 68 -0.866 10.401 1.185 1316 HA ASP 68 HA ASP 68 -3.820 10.709 1.380 1317 1HB ASP 68 HB2 ASP 68 -2.786 11.842 3.287 1318 2HB ASP 68 HB3 ASP 68 -1.846 12.853 2.181 1319 H SER 69 HN SER 69 -4.196 10.336 -0.634 1320 HA SER 69 HA SER 69 -3.095 11.029 -2.967 1321 1HB SER 69 HB2 SER 69 -6.040 11.350 -2.370 1322 2HB SER 69 HB3 SER 69 -5.294 10.694 -3.844 1323 HG SER 69 HG SER 69 -6.230 9.255 -1.982 1324 H ASP 70 HN ASP 70 -4.650 13.382 -0.785 1325 HA ASP 70 HA ASP 70 -5.260 15.361 -2.766 1326 1HB ASP 70 HB2 ASP 70 -6.219 15.254 -0.445 1327 2HB ASP 70 HB3 ASP 70 -4.628 15.732 0.179 1328 H ILE 71 HN ILE 71 -2.264 14.333 -1.415 1329 HA ILE 71 HA ILE 71 -0.917 16.741 -2.547 1330 HB ILE 71 HB ILE 71 0.072 15.108 -0.250 1331 1HG1 ILE 71 HG12 ILE 71 -0.596 17.652 0.824 1332 2HG1 ILE 71 HG13 ILE 71 -1.998 17.225 -0.148 1333 1HG2 ILE 71 HG21 ILE 71 1.561 16.974 0.210 1334 2HG2 ILE 71 HG22 ILE 71 1.811 16.378 -1.441 1335 3HG2 ILE 71 HG23 ILE 71 0.899 17.881 -1.174 1336 1HD1 ILE 71 HD11 ILE 71 -0.667 15.499 1.961 1337 2HD1 ILE 71 HD12 ILE 71 -2.203 16.384 2.145 1338 3HD1 ILE 71 HD13 ILE 71 -2.096 15.023 0.997 1339 H LEU 72 HN LEU 72 -0.742 13.135 -1.940 1340 HA LEU 72 HA LEU 72 1.686 12.799 -3.363 1341 1HB LEU 72 HB2 LEU 72 0.551 11.075 -1.942 1342 2HB LEU 72 HB3 LEU 72 -0.595 10.787 -3.238 1343 HG LEU 72 HG LEU 72 2.410 10.582 -3.700 1344 1HD1 LEU 72 HD11 LEU 72 2.506 8.315 -3.156 1345 2HD1 LEU 72 HD12 LEU 72 1.653 9.031 -1.791 1346 3HD1 LEU 72 HD13 LEU 72 0.757 8.139 -3.034 1347 1HD2 LEU 72 HD21 LEU 72 -0.016 9.422 -5.136 1348 2HD2 LEU 72 HD22 LEU 72 1.246 10.465 -5.799 1349 3HD2 LEU 72 HD23 LEU 72 1.620 8.802 -5.392 1350 H ASN 73 HN ASN 73 -1.716 12.443 -4.595 1351 HA ASN 73 HA ASN 73 -0.908 12.059 -7.284 1352 1HB ASN 73 HB2 ASN 73 -3.065 11.715 -7.672 1353 2HB ASN 73 HB3 ASN 73 -3.359 11.913 -5.961 1354 1HD2 ASN 73 HD22 ASN 73 -3.900 14.253 -5.255 1355 2HD2 ASN 73 HD21 ASN 73 -4.781 15.251 -6.401 1356 H ASN 74 HN ASN 74 -1.066 14.871 -5.317 1357 HA ASN 74 HA ASN 74 -1.374 16.854 -7.390 1358 1HB ASN 74 HB2 ASN 74 -1.979 16.671 -4.723 1359 2HB ASN 74 HB3 ASN 74 -0.509 17.629 -4.637 1360 1HD2 ASN 74 HD22 ASN 74 -3.397 18.217 -4.065 1361 2HD2 ASN 74 HD21 ASN 74 -3.782 19.636 -5.031 1362 H ALA 75 HN ALA 75 1.303 15.312 -5.704 1363 HA ALA 75 HA ALA 75 3.285 17.260 -5.992 1364 1HB ALA 75 HB1 ALA 75 3.403 15.262 -4.532 1365 2HB ALA 75 HB2 ALA 75 3.560 14.221 -5.961 1366 3HB ALA 75 HB3 ALA 75 4.831 15.393 -5.572 1367 H ASP 76 HN ASP 76 5.317 16.864 -7.302 1368 HA ASP 76 HA ASP 76 4.662 16.441 -10.179 1369 1HB ASP 76 HB2 ASP 76 5.828 18.522 -9.499 1370 2HB ASP 76 HB3 ASP 76 7.162 17.552 -8.860 1371 H LEU 77 HN LEU 77 6.366 14.920 -7.484 1372 HA LEU 77 HA LEU 77 6.991 12.618 -9.122 1373 1HB LEU 77 HB2 LEU 77 9.025 13.787 -9.510 1374 2HB LEU 77 HB3 LEU 77 9.074 14.415 -7.870 1375 HG LEU 77 HG LEU 77 9.622 12.178 -6.993 1376 1HD1 LEU 77 HD11 LEU 77 10.329 11.102 -9.684 1377 2HD1 LEU 77 HD12 LEU 77 9.972 10.265 -8.182 1378 3HD1 LEU 77 HD13 LEU 77 8.647 10.933 -9.153 1379 1HD2 LEU 77 HD21 LEU 77 11.946 12.148 -7.834 1380 2HD2 LEU 77 HD22 LEU 77 11.457 13.180 -9.200 1381 3HD2 LEU 77 HD23 LEU 77 11.380 13.803 -7.550 1382 H VAL 78 HN VAL 78 6.926 10.783 -7.954 1383 HA VAL 78 HA VAL 78 6.630 10.829 -4.986 1384 HB VAL 78 HB VAL 78 5.580 8.830 -7.001 1385 1HG1 VAL 78 HG11 VAL 78 5.130 9.172 -3.993 1386 2HG1 VAL 78 HG12 VAL 78 4.280 8.016 -5.038 1387 3HG1 VAL 78 HG13 VAL 78 6.019 7.845 -4.775 1388 1HG2 VAL 78 HG21 VAL 78 4.068 10.990 -5.467 1389 2HG2 VAL 78 HG22 VAL 78 4.377 10.978 -7.210 1390 3HG2 VAL 78 HG23 VAL 78 3.375 9.723 -6.522 1391 H VAL 79 HN VAL 79 8.500 10.469 -4.130 1392 HA VAL 79 HA VAL 79 10.542 8.781 -5.432 1393 HB VAL 79 HB VAL 79 10.582 10.372 -2.835 1394 1HG1 VAL 79 HG11 VAL 79 12.983 10.214 -2.890 1395 2HG1 VAL 79 HG12 VAL 79 12.319 8.575 -2.968 1396 3HG1 VAL 79 HG13 VAL 79 12.939 9.359 -4.438 1397 1HG2 VAL 79 HG21 VAL 79 11.901 12.064 -4.052 1398 2HG2 VAL 79 HG22 VAL 79 11.618 11.191 -5.574 1399 3HG2 VAL 79 HG23 VAL 79 10.265 11.938 -4.689 1400 H THR 80 HN THR 80 9.825 6.605 -5.171 1401 HA THR 80 HA THR 80 8.820 5.745 -2.567 1402 HB THR 80 HB THR 80 10.008 4.108 -4.853 1403 HG1 THR 80 HG1 THR 80 7.879 5.500 -4.799 1404 1HG2 THR 80 HG21 THR 80 10.025 2.831 -2.742 1405 2HG2 THR 80 HG22 THR 80 8.337 3.299 -2.430 1406 3HG2 THR 80 HG23 THR 80 8.745 2.234 -3.808 1407 H LEU 81 HN LEU 81 10.091 5.324 -0.790 1408 HA LEU 81 HA LEU 81 13.043 5.706 -1.106 1409 1HB LEU 81 HB2 LEU 81 11.554 7.672 -0.341 1410 2HB LEU 81 HB3 LEU 81 11.261 6.743 1.117 1411 HG LEU 81 HG LEU 81 13.907 6.668 1.304 1412 1HD1 LEU 81 HD11 LEU 81 14.995 8.656 0.301 1413 2HD1 LEU 81 HD12 LEU 81 14.398 7.559 -0.950 1414 3HD1 LEU 81 HD13 LEU 81 13.504 9.046 -0.569 1415 1HD2 LEU 81 HD21 LEU 81 12.336 7.886 2.798 1416 2HD2 LEU 81 HD22 LEU 81 13.869 8.726 2.559 1417 3HD2 LEU 81 HD23 LEU 81 12.409 9.287 1.702 1418 H SER 82 HN SER 82 12.311 3.118 -1.120 1419 HA SER 82 HA SER 82 13.591 2.051 1.164 1420 1HB SER 82 HB2 SER 82 10.591 1.527 0.837 1421 2HB SER 82 HB3 SER 82 11.661 0.466 1.771 1422 HG SER 82 HG SER 82 11.834 3.164 2.337 1423 H GLY 83 HN GLY 83 13.409 -0.528 0.855 1424 1HA GLY 83 HA2 GLY 83 13.167 -1.282 -2.020 1425 2HA GLY 83 HA3 GLY 83 14.476 -1.899 -0.985 1426 H ASP 84 HN ASP 84 10.994 -1.229 -0.457 1427 HA ASP 84 HA ASP 84 10.402 -3.945 0.463 1428 1HB ASP 84 HB2 ASP 84 11.368 -2.905 2.457 1429 2HB ASP 84 HB3 ASP 84 10.381 -1.461 2.223 1430 H ALA 85 HN ALA 85 8.020 -4.046 0.941 1431 HA ALA 85 HA ALA 85 6.424 -2.102 -0.664 1432 1HB ALA 85 HB1 ALA 85 6.296 -5.137 -0.902 1433 2HB ALA 85 HB2 ALA 85 5.339 -3.950 -1.814 1434 3HB ALA 85 HB3 ALA 85 7.086 -4.050 -2.071 1435 H ALA 86 HN ALA 86 6.769 -3.486 2.372 1436 HA ALA 86 HA ALA 86 4.183 -4.256 3.142 1437 1HB ALA 86 HB1 ALA 86 4.908 -3.420 5.432 1438 2HB ALA 86 HB2 ALA 86 6.075 -4.513 4.644 1439 3HB ALA 86 HB3 ALA 86 6.358 -2.767 4.660 1440 H ASP 87 HN ASP 87 5.266 -1.116 2.204 1441 HA ASP 87 HA ASP 87 3.613 0.577 3.626 1442 1HB ASP 87 HB2 ASP 87 5.724 0.978 2.209 1443 2HB ASP 87 HB3 ASP 87 4.634 1.119 0.832 1444 H LYS 88 HN LYS 88 1.985 -1.622 2.239 1445 HA LYS 88 HA LYS 88 -0.091 -1.934 1.412 1446 1HB LYS 88 HB2 LYS 88 -0.395 1.064 0.907 1447 2HB LYS 88 HB3 LYS 88 -1.626 -0.155 0.682 1448 1HG LYS 88 HG2 LYS 88 -1.770 -0.690 2.978 1449 2HG LYS 88 HG3 LYS 88 -0.361 0.306 3.366 1450 1HD LYS 88 HD2 LYS 88 -1.482 2.340 3.009 1451 2HD LYS 88 HD3 LYS 88 -2.819 1.579 2.147 1452 1HE LYS 88 HE2 LYS 88 -3.774 0.650 4.073 1453 2HE LYS 88 HE3 LYS 88 -2.276 0.692 4.982 1454 1HZ LYS 88 HZ1 LYS 88 -3.757 3.161 4.268 1455 2HZ LYS 88 HZ2 LYS 88 -3.965 2.355 5.670 1456 3HZ LYS 88 HZ3 LYS 88 -2.518 3.009 5.357 1457 H CYS 89 HN CYS 89 2.484 -1.829 -0.159 1458 HA CYS 89 HA CYS 89 3.346 -1.503 -2.239 1459 1HB CYS 89 HB2 CYS 89 1.020 -3.240 -3.116 1460 2HB CYS 89 HB3 CYS 89 2.657 -3.258 -3.732 1461 HA PRO 90 HA PRO 90 -0.121 1.596 -3.055 1462 1HB PRO 90 HB2 PRO 90 2.245 3.433 -3.435 1463 2HB PRO 90 HB3 PRO 90 0.638 3.823 -2.744 1464 1HG PRO 90 HG2 PRO 90 2.701 3.367 -1.074 1465 2HG PRO 90 HG3 PRO 90 1.120 2.586 -0.750 1466 1HD PRO 90 HD2 PRO 90 3.552 1.403 -2.148 1467 2HD PRO 90 HD3 PRO 90 2.595 0.710 -0.823 1468 H MET 91 HN MET 91 -1.088 1.903 -5.042 1469 HA MET 91 HA MET 91 0.552 1.274 -7.381 1470 1HB MET 91 HB2 MET 91 -1.600 1.310 -8.611 1471 2HB MET 91 HB3 MET 91 -1.450 0.136 -7.327 1472 1HG MET 91 HG2 MET 91 -3.543 0.971 -7.020 1473 2HG MET 91 HG3 MET 91 -2.659 1.846 -5.815 1474 1HE MET 91 HE1 MET 91 -5.541 3.964 -7.157 1475 2HE MET 91 HE2 MET 91 -5.408 2.193 -7.354 1476 3HE MET 91 HE3 MET 91 -4.793 2.886 -5.858 1477 H THR 92 HN THR 92 0.049 4.227 -5.826 1478 HA THR 92 HA THR 92 0.354 6.363 -6.460 1479 HB THR 92 HB THR 92 2.402 6.643 -7.924 1480 HG1 THR 92 HG1 THR 92 2.022 4.574 -8.969 1481 1HG2 THR 92 HG21 THR 92 2.671 4.740 -5.553 1482 2HG2 THR 92 HG22 THR 92 3.914 5.845 -6.189 1483 3HG2 THR 92 HG23 THR 92 2.462 6.493 -5.421 1484 HA PRO 93 HA PRO 93 -2.504 6.251 -9.974 1485 1HB PRO 93 HB2 PRO 93 -3.763 8.676 -9.611 1486 2HB PRO 93 HB3 PRO 93 -4.089 7.230 -8.593 1487 1HG PRO 93 HG2 PRO 93 -2.178 9.496 -7.963 1488 2HG PRO 93 HG3 PRO 93 -3.490 8.818 -6.940 1489 1HD PRO 93 HD2 PRO 93 -0.942 7.990 -6.667 1490 2HD PRO 93 HD3 PRO 93 -2.269 6.783 -6.599 1491 HA PRO 94 HA PRO 94 0.405 7.987 -12.733 1492 1HB PRO 94 HB2 PRO 94 -0.943 7.966 -15.169 1493 2HB PRO 94 HB3 PRO 94 -0.340 6.524 -14.309 1494 1HG PRO 94 HG2 PRO 94 -3.129 7.725 -14.190 1495 2HG PRO 94 HG3 PRO 94 -2.670 6.018 -14.519 1496 1HD PRO 94 HD2 PRO 94 -3.380 6.737 -12.038 1497 2HD PRO 94 HD3 PRO 94 -1.939 5.696 -12.280 1498 H HIS 95 HN HIS 95 -1.694 10.058 -11.519 1499 HA HIS 95 HA HIS 95 -1.650 12.282 -13.386 1500 1HB HIS 95 HB2 HIS 95 -2.014 12.256 -10.365 1501 2HB HIS 95 HB3 HIS 95 -2.432 13.566 -11.461 1502 HD1 HIS 95 HD1 HIS 95 -4.709 12.672 -9.698 1503 HD2 HIS 95 HD2 HIS 95 -3.835 10.900 -13.417 1504 HE1 HIS 95 HE1 HIS 95 -6.835 11.473 -10.445 1505 H VAL 96 HN VAL 96 0.820 10.736 -11.558 1506 HA VAL 96 HA VAL 96 2.558 13.122 -11.634 1507 HB VAL 96 HB VAL 96 1.431 13.138 -9.474 1508 1HG1 VAL 96 HG11 VAL 96 1.761 11.378 -7.793 1509 2HG1 VAL 96 HG12 VAL 96 0.800 10.809 -9.154 1510 3HG1 VAL 96 HG13 VAL 96 2.507 10.329 -9.012 1511 1HG2 VAL 96 HG21 VAL 96 3.800 13.823 -9.637 1512 2HG2 VAL 96 HG22 VAL 96 3.329 13.255 -8.023 1513 3HG2 VAL 96 HG23 VAL 96 4.295 12.218 -9.080 1514 H LYS 97 HN LYS 97 4.842 12.587 -11.501 1515 HA LYS 97 HA LYS 97 5.576 10.083 -12.801 1516 1HB LYS 97 HB2 LYS 97 6.543 12.400 -13.218 1517 2HB LYS 97 HB3 LYS 97 7.332 12.291 -11.646 1518 1HG LYS 97 HG2 LYS 97 7.791 9.949 -13.425 1519 2HG LYS 97 HG3 LYS 97 8.361 11.469 -14.103 1520 1HD LYS 97 HD2 LYS 97 9.063 10.468 -11.355 1521 2HD LYS 97 HD3 LYS 97 10.032 10.099 -12.774 1522 1HE LYS 97 HE2 LYS 97 9.534 12.893 -11.625 1523 2HE LYS 97 HE3 LYS 97 11.036 11.967 -11.512 1524 1HZ LYS 97 HZ1 LYS 97 11.242 13.556 -13.226 1525 2HZ LYS 97 HZ2 LYS 97 11.203 12.086 -13.944 1526 3HZ LYS 97 HZ3 LYS 97 9.886 13.062 -14.004 1527 H ARG 98 HN ARG 98 7.049 8.499 -11.821 1528 HA ARG 98 HA ARG 98 7.468 8.696 -8.906 1529 1HB ARG 98 HB2 ARG 98 5.328 7.394 -9.242 1530 2HB ARG 98 HB3 ARG 98 6.224 6.266 -10.263 1531 1HG ARG 98 HG2 ARG 98 7.747 5.864 -8.163 1532 2HG ARG 98 HG3 ARG 98 6.488 6.727 -7.264 1533 1HD ARG 98 HD2 ARG 98 4.849 5.087 -8.153 1534 2HD ARG 98 HD3 ARG 98 6.146 4.210 -8.970 1535 HE ARG 98 HE ARG 98 7.064 4.284 -6.422 1536 1HH1 ARG 98 HH21 ARG 98 3.828 3.361 -7.555 1537 2HH1 ARG 98 HH22 ARG 98 3.590 2.177 -6.331 1538 1HH2 ARG 98 HH11 ARG 98 6.687 2.960 -4.733 1539 2HH2 ARG 98 HH12 ARG 98 5.309 1.888 -4.674 1540 H GLU 99 HN GLU 99 9.369 7.643 -8.275 1541 HA GLU 99 HA GLU 99 10.532 5.612 -9.911 1542 1HB GLU 99 HB2 GLU 99 11.433 7.597 -11.102 1543 2HB GLU 99 HB3 GLU 99 12.065 8.234 -9.592 1544 1HG GLU 99 HG2 GLU 99 13.811 7.174 -10.980 1545 2HG GLU 99 HG3 GLU 99 13.648 6.359 -9.436 1546 H HIS 100 HN HIS 100 12.156 4.497 -8.649 1547 HA HIS 100 HA HIS 100 11.805 4.927 -5.743 1548 1HB HIS 100 HB2 HIS 100 12.398 2.690 -5.398 1549 2HB HIS 100 HB3 HIS 100 11.228 2.686 -6.705 1550 HD1 HIS 100 HD1 HIS 100 13.038 2.894 -9.293 1551 HD2 HIS 100 HD2 HIS 100 14.068 0.801 -5.769 1552 HE1 HIS 100 HE1 HIS 100 14.731 1.134 -9.967 1553 H TRP 101 HN TRP 101 13.440 5.425 -4.453 1554 HA TRP 101 HA TRP 101 16.224 5.557 -5.467 1555 1HB TRP 101 HB2 TRP 101 14.667 7.848 -4.210 1556 2HB TRP 101 HB3 TRP 101 16.395 7.853 -4.533 1557 HD1 TRP 101 HD1 TRP 101 13.062 8.282 -6.315 1558 HE1 TRP 101 HE1 TRP 101 13.451 9.120 -8.677 1559 HE3 TRP 101 HE3 TRP 101 18.095 7.446 -6.626 1560 HZ2 TRP 101 HZ2 TRP 101 15.634 9.191 -10.583 1561 HZ3 TRP 101 HZ3 TRP 101 19.296 7.840 -8.763 1562 HH2 TRP 101 HH2 TRP 101 18.082 8.705 -10.744 1563 H GLY 102 HN GLY 102 15.089 3.582 -3.902 1564 1HA GLY 102 HA2 GLY 102 16.762 3.751 -1.536 1565 2HA GLY 102 HA3 GLY 102 15.038 3.463 -1.219 1566 H PHE 103 HN PHE 103 16.782 1.555 -0.535 1567 HA PHE 103 HA PHE 103 16.200 -0.750 -2.245 1568 1HB PHE 103 HB2 PHE 103 18.241 0.306 -3.264 1569 2HB PHE 103 HB3 PHE 103 19.072 0.139 -1.727 1570 HD1 PHE 103 HD1 PHE 103 20.318 -1.849 -1.292 1571 HD2 PHE 103 HD2 PHE 103 17.321 -1.852 -4.399 1572 HE1 PHE 103 HE1 PHE 103 21.054 -4.109 -2.004 1573 HE2 PHE 103 HE2 PHE 103 18.061 -4.115 -5.104 1574 HZ PHE 103 HZ PHE 103 19.927 -5.247 -3.909 1575 H ASP 104 HN ASP 104 17.037 0.701 0.762 1576 HA ASP 104 HA ASP 104 16.652 -1.735 2.284 1577 1HB ASP 104 HB2 ASP 104 19.113 -1.717 1.861 1578 2HB ASP 104 HB3 ASP 104 19.200 -0.062 2.469 1579 H ASP 105 HN ASP 105 16.581 -0.932 4.703 1580 HA ASP 105 HA ASP 105 15.542 1.845 4.885 1581 1HB ASP 105 HB2 ASP 105 13.613 0.630 4.245 1582 2HB ASP 105 HB3 ASP 105 13.967 -0.682 5.366 1583 HA PRO 106 HA PRO 106 18.029 0.995 8.520 1584 1HB PRO 106 HB2 PRO 106 18.238 3.496 9.574 1585 2HB PRO 106 HB3 PRO 106 19.048 3.010 8.050 1586 1HG PRO 106 HG2 PRO 106 16.400 4.462 8.338 1587 2HG PRO 106 HG3 PRO 106 17.798 4.890 7.292 1588 1HD PRO 106 HD2 PRO 106 15.664 3.439 6.347 1589 2HD PRO 106 HD3 PRO 106 17.332 3.135 5.790 1590 H ALA 107 HN ALA 107 14.710 2.236 8.635 1591 HA ALA 107 HA ALA 107 14.343 1.991 11.443 1592 1HB ALA 107 HB1 ALA 107 12.342 1.485 9.202 1593 2HB ALA 107 HB2 ALA 107 11.967 1.891 10.886 1594 3HB ALA 107 HB3 ALA 107 12.753 3.090 9.843 1595 H ARG 108 HN ARG 108 15.471 -0.316 9.407 1596 HA ARG 108 HA ARG 108 14.078 -2.625 10.740 1597 1HB ARG 108 HB2 ARG 108 15.332 -2.785 8.013 1598 2HB ARG 108 HB3 ARG 108 14.129 -3.848 8.724 1599 1HG ARG 108 HG2 ARG 108 13.691 -0.993 7.767 1600 2HG ARG 108 HG3 ARG 108 13.252 -2.422 6.861 1601 1HD ARG 108 HD2 ARG 108 12.069 -2.186 9.615 1602 2HD ARG 108 HD3 ARG 108 11.530 -0.995 8.442 1603 HE ARG 108 HE ARG 108 10.896 -3.820 8.476 1604 1HH1 ARG 108 HH11 ARG 108 11.111 -0.893 6.374 1605 2HH1 ARG 108 HH12 ARG 108 9.998 -1.597 5.202 1606 1HH2 ARG 108 HH21 ARG 108 9.379 -4.578 6.844 1607 2HH2 ARG 108 HH22 ARG 108 9.055 -3.545 5.466 1608 H ALA 109 HN ALA 109 16.810 -1.010 10.973 1609 HA ALA 109 HA ALA 109 18.991 -2.612 10.492 1610 1HB ALA 109 HB1 ALA 109 19.024 -0.307 11.471 1611 2HB ALA 109 HB2 ALA 109 18.467 -0.994 13.016 1612 3HB ALA 109 HB3 ALA 109 20.044 -1.474 12.346 1613 H GLN 110 HN GLN 110 20.202 -4.037 11.727 1614 HA GLN 110 HA GLN 110 18.707 -6.234 12.478 1615 1HB GLN 110 HB2 GLN 110 21.085 -6.275 11.675 1616 2HB GLN 110 HB3 GLN 110 21.630 -5.688 13.251 1617 1HG GLN 110 HG2 GLN 110 19.907 -8.120 13.374 1618 2HG GLN 110 HG3 GLN 110 21.405 -8.344 12.477 1619 1HE2 GLN 110 HE22 GLN 110 20.054 -7.485 15.678 1620 2HE2 GLN 110 HE21 GLN 110 21.512 -7.867 16.574 1621 H GLY 111 HN GLY 111 20.065 -3.687 14.521 1622 1HA GLY 111 HA2 GLY 111 18.602 -3.090 16.311 1623 2HA GLY 111 HA3 GLY 111 18.506 -4.814 16.770 1624 H THR 112 HN THR 112 21.586 -4.672 16.206 1625 HA THR 112 HA THR 112 22.313 -4.138 19.019 1626 HB THR 112 HB THR 112 23.432 -6.016 18.069 1627 HG1 THR 112 HG1 THR 112 24.788 -5.068 19.398 1628 1HG2 THR 112 HG21 THR 112 25.045 -5.878 16.220 1629 2HG2 THR 112 HG22 THR 112 23.378 -5.620 15.695 1630 3HG2 THR 112 HG23 THR 112 24.474 -4.234 15.884 1631 H GLU 113 HN GLU 113 23.719 -2.412 19.560 1632 HA GLU 113 HA GLU 113 23.014 0.105 18.711 1633 1HB GLU 113 HB2 GLU 113 25.693 -0.873 19.806 1634 2HB GLU 113 HB3 GLU 113 25.144 0.817 19.824 1635 1HG GLU 113 HG2 GLU 113 23.157 0.109 21.194 1636 2HG GLU 113 HG3 GLU 113 23.828 -1.521 21.269 1637 H GLU 114 HN GLU 114 25.633 -1.961 17.451 1638 HA GLU 114 HA GLU 114 26.826 0.158 15.900 1639 1HB GLU 114 HB2 GLU 114 28.064 -1.845 14.854 1640 2HB GLU 114 HB3 GLU 114 28.387 -1.455 16.559 1641 1HG GLU 114 HG2 GLU 114 26.809 -3.278 17.209 1642 2HG GLU 114 HG3 GLU 114 26.614 -3.650 15.474 1643 H GLU 115 HN GLU 115 24.396 -2.483 15.318 1644 HA GLU 115 HA GLU 115 24.672 -2.042 12.430 1645 1HB GLU 115 HB2 GLU 115 22.883 -3.783 14.128 1646 2HB GLU 115 HB3 GLU 115 22.702 -3.652 12.374 1647 1HG GLU 115 HG2 GLU 115 25.395 -4.354 13.625 1648 2HG GLU 115 HG3 GLU 115 24.171 -5.583 13.306 1649 H LYS 116 HN LYS 116 22.585 -0.946 15.097 1650 HA LYS 116 HA LYS 116 20.657 0.282 13.346 1651 1HB LYS 116 HB2 LYS 116 21.367 1.135 16.187 1652 2HB LYS 116 HB3 LYS 116 19.941 1.619 15.263 1653 1HG LYS 116 HG2 LYS 116 19.364 -0.923 15.163 1654 2HG LYS 116 HG3 LYS 116 20.600 -1.112 16.393 1655 1HD LYS 116 HD2 LYS 116 18.769 -0.922 17.742 1656 2HD LYS 116 HD3 LYS 116 19.265 0.775 17.675 1657 1HE LYS 116 HE2 LYS 116 17.630 1.101 15.768 1658 2HE LYS 116 HE3 LYS 116 17.159 -0.601 15.940 1659 1HZ LYS 116 HZ1 LYS 116 16.817 1.481 18.028 1660 2HZ LYS 116 HZ2 LYS 116 15.627 0.868 17.101 1661 3HZ LYS 116 HZ3 LYS 116 16.379 -0.087 18.183 1662 H TRP 117 HN TRP 117 23.625 1.523 14.901 1663 HA TRP 117 HA TRP 117 23.284 4.071 13.651 1664 1HB TRP 117 HB2 TRP 117 24.775 3.578 15.628 1665 2HB TRP 117 HB3 TRP 117 25.929 2.859 14.504 1666 HD1 TRP 117 HD1 TRP 117 24.548 5.715 12.714 1667 HE1 TRP 117 HE1 TRP 117 26.007 7.800 12.931 1668 HE3 TRP 117 HE3 TRP 117 27.443 4.275 16.708 1669 HZ2 TRP 117 HZ2 TRP 117 27.941 8.825 14.760 1670 HZ3 TRP 117 HZ3 TRP 117 29.076 5.868 17.692 1671 HH2 TRP 117 HH2 TRP 117 29.339 8.152 16.736 1672 H ALA 118 HN ALA 118 25.139 1.165 12.715 1673 HA ALA 118 HA ALA 118 26.303 2.238 10.422 1674 1HB ALA 118 HB1 ALA 118 26.577 -0.216 9.792 1675 2HB ALA 118 HB2 ALA 118 26.982 0.081 11.503 1676 3HB ALA 118 HB3 ALA 118 25.423 -0.623 11.089 1677 H PHE 119 HN PHE 119 23.103 0.635 10.705 1678 HA PHE 119 HA PHE 119 22.579 0.683 7.885 1679 1HB PHE 119 HB2 PHE 119 20.876 0.434 10.364 1680 2HB PHE 119 HB3 PHE 119 20.110 0.831 8.853 1681 HD1 PHE 119 HD1 PHE 119 18.996 -0.939 7.880 1682 HD2 PHE 119 HD2 PHE 119 22.807 -1.687 9.774 1683 HE1 PHE 119 HE1 PHE 119 18.811 -3.334 7.321 1684 HE2 PHE 119 HE2 PHE 119 22.600 -4.086 9.224 1685 HZ PHE 119 HZ PHE 119 20.601 -4.925 8.004 1686 H PHE 120 HN PHE 120 21.792 3.003 10.588 1687 HA PHE 120 HA PHE 120 20.435 4.695 8.722 1688 1HB PHE 120 HB2 PHE 120 19.934 6.142 10.359 1689 2HB PHE 120 HB3 PHE 120 20.015 4.587 11.180 1690 HD1 PHE 120 HD1 PHE 120 20.718 4.678 13.340 1691 HD2 PHE 120 HD2 PHE 120 22.209 7.619 10.549 1692 HE1 PHE 120 HE1 PHE 120 21.877 5.841 15.185 1693 HE2 PHE 120 HE2 PHE 120 23.355 8.772 12.412 1694 HZ PHE 120 HZ PHE 120 23.253 7.856 14.703 1695 H GLN 121 HN GLN 121 23.832 4.775 9.899 1696 HA GLN 121 HA GLN 121 24.487 7.221 8.697 1697 1HB GLN 121 HB2 GLN 121 25.808 6.052 10.373 1698 2HB GLN 121 HB3 GLN 121 26.182 4.745 9.239 1699 1HG GLN 121 HG2 GLN 121 27.482 6.209 7.837 1700 2HG GLN 121 HG3 GLN 121 26.883 7.647 8.679 1701 1HE2 GLN 121 HE22 GLN 121 27.344 7.768 11.104 1702 2HE2 GLN 121 HE21 GLN 121 28.921 7.197 11.633 1703 H ARG 122 HN ARG 122 24.721 3.851 7.366 1704 HA ARG 122 HA ARG 122 25.881 4.685 4.920 1705 1HB ARG 122 HB2 ARG 122 25.911 2.349 5.848 1706 2HB ARG 122 HB3 ARG 122 24.197 2.210 5.462 1707 1HG ARG 122 HG2 ARG 122 25.298 1.148 3.695 1708 2HG ARG 122 HG3 ARG 122 24.834 2.705 3.016 1709 1HD ARG 122 HD2 ARG 122 27.586 2.185 4.192 1710 2HD ARG 122 HD3 ARG 122 27.191 1.767 2.524 1711 HE ARG 122 HE ARG 122 26.461 4.340 2.499 1712 1HH1 ARG 122 HH11 ARG 122 29.409 2.810 3.755 1713 2HH1 ARG 122 HH12 ARG 122 30.450 4.112 3.321 1714 1HH2 ARG 122 HH21 ARG 122 27.895 6.086 1.834 1715 2HH2 ARG 122 HH22 ARG 122 29.566 5.993 2.250 1716 H VAL 123 HN VAL 123 22.426 3.963 5.763 1717 HA VAL 123 HA VAL 123 21.558 4.537 3.091 1718 HB VAL 123 HB VAL 123 19.935 4.453 5.667 1719 1HG1 VAL 123 HG11 VAL 123 18.037 3.960 4.009 1720 2HG1 VAL 123 HG12 VAL 123 18.661 5.609 3.966 1721 3HG1 VAL 123 HG13 VAL 123 19.136 4.444 2.716 1722 1HG2 VAL 123 HG21 VAL 123 20.351 2.309 3.522 1723 2HG2 VAL 123 HG22 VAL 123 21.093 2.274 5.127 1724 3HG2 VAL 123 HG23 VAL 123 19.341 2.166 4.980 1725 H ARG 124 HN ARG 124 21.948 6.637 6.006 1726 HA ARG 124 HA ARG 124 20.647 8.909 4.954 1727 1HB ARG 124 HB2 ARG 124 21.226 8.654 7.262 1728 2HB ARG 124 HB3 ARG 124 22.954 8.591 6.922 1729 1HG ARG 124 HG2 ARG 124 21.235 11.024 6.369 1730 2HG ARG 124 HG3 ARG 124 21.922 10.700 7.947 1731 1HD ARG 124 HD2 ARG 124 23.586 11.145 5.458 1732 2HD ARG 124 HD3 ARG 124 23.291 12.307 6.758 1733 HE ARG 124 HE ARG 124 24.297 10.344 8.231 1734 1HH1 ARG 124 HH11 ARG 124 25.583 11.600 5.133 1735 2HH1 ARG 124 HH12 ARG 124 27.209 11.202 5.538 1736 1HH2 ARG 124 HH21 ARG 124 26.293 9.847 8.708 1737 2HH2 ARG 124 HH22 ARG 124 27.670 10.176 7.663 1738 H ASP 125 HN ASP 125 24.072 7.914 4.598 1739 HA ASP 125 HA ASP 125 24.922 10.137 3.066 1740 1HB ASP 125 HB2 ASP 125 26.548 8.629 3.914 1741 2HB ASP 125 HB3 ASP 125 25.771 7.234 3.173 1742 H GLU 126 HN GLU 126 23.408 7.041 1.968 1743 HA GLU 126 HA GLU 126 23.493 7.732 -0.808 1744 1HB GLU 126 HB2 GLU 126 23.238 5.434 0.078 1745 2HB GLU 126 HB3 GLU 126 21.616 5.828 0.663 1746 1HG GLU 126 HG2 GLU 126 20.860 6.259 -1.647 1747 2HG GLU 126 HG3 GLU 126 22.497 5.995 -2.253 1748 H ILE 127 HN ILE 127 20.899 8.059 1.646 1749 HA ILE 127 HA ILE 127 18.865 9.100 0.022 1750 HB ILE 127 HB ILE 127 19.509 9.008 2.945 1751 1HG1 ILE 127 HG12 ILE 127 17.041 8.416 1.262 1752 2HG1 ILE 127 HG13 ILE 127 18.277 7.242 1.720 1753 1HG2 ILE 127 HG21 ILE 127 18.893 11.330 2.888 1754 2HG2 ILE 127 HG22 ILE 127 17.437 10.955 1.929 1755 3HG2 ILE 127 HG23 ILE 127 17.614 10.402 3.623 1756 1HD1 ILE 127 HD11 ILE 127 16.281 8.614 3.565 1757 2HD1 ILE 127 HD12 ILE 127 16.341 6.911 3.108 1758 3HD1 ILE 127 HD13 ILE 127 17.612 7.592 4.141 1759 H GLY 128 HN GLY 128 21.408 10.909 1.849 1760 1HA GLY 128 HA2 GLY 128 20.488 13.475 1.051 1761 2HA GLY 128 HA3 GLY 128 22.143 13.057 1.586 1762 H ASN 129 HN ASN 129 22.949 11.278 -0.474 1763 HA ASN 129 HA ASN 129 23.661 13.127 -2.494 1764 1HB ASN 129 HB2 ASN 129 25.049 11.157 -2.094 1765 2HB ASN 129 HB3 ASN 129 23.716 10.080 -2.537 1766 1HD2 ASN 129 HD22 ASN 129 23.597 9.466 -4.727 1767 2HD2 ASN 129 HD21 ASN 129 24.207 10.445 -6.053 1768 H ARG 130 HN ARG 130 21.105 10.606 -2.496 1769 HA ARG 130 HA ARG 130 20.349 11.212 -5.235 1770 1HB ARG 130 HB2 ARG 130 18.735 9.854 -3.027 1771 2HB ARG 130 HB3 ARG 130 18.263 9.954 -4.723 1772 1HG ARG 130 HG2 ARG 130 20.625 8.422 -3.575 1773 2HG ARG 130 HG3 ARG 130 19.178 7.781 -4.352 1774 1HD ARG 130 HD2 ARG 130 19.924 8.975 -6.485 1775 2HD ARG 130 HD3 ARG 130 21.439 9.355 -5.656 1776 HE ARG 130 HE ARG 130 20.977 6.571 -5.429 1777 1HH1 ARG 130 HH11 ARG 130 21.854 8.999 -7.900 1778 2HH1 ARG 130 HH12 ARG 130 22.657 7.846 -8.914 1779 1HH2 ARG 130 HH21 ARG 130 22.063 5.064 -6.791 1780 2HH2 ARG 130 HH22 ARG 130 22.786 5.578 -8.265 1781 H LEU 131 HN LEU 131 19.202 12.492 -2.071 1782 HA LEU 131 HA LEU 131 17.145 14.036 -3.269 1783 1HB LEU 131 HB2 LEU 131 18.384 13.842 -0.606 1784 2HB LEU 131 HB3 LEU 131 18.169 15.519 -1.032 1785 HG LEU 131 HG LEU 131 16.246 14.788 0.160 1786 1HD1 LEU 131 HD11 LEU 131 14.508 15.520 -1.326 1787 2HD1 LEU 131 HD12 LEU 131 15.980 16.341 -1.863 1788 3HD1 LEU 131 HD13 LEU 131 15.349 14.941 -2.738 1789 1HD2 LEU 131 HD21 LEU 131 15.837 12.621 -1.948 1790 2HD2 LEU 131 HD22 LEU 131 16.391 12.368 -0.283 1791 3HD2 LEU 131 HD23 LEU 131 14.760 12.987 -0.586 1792 H LYS 132 HN LYS 132 20.578 14.836 -2.578 1793 HA LYS 132 HA LYS 132 20.465 17.501 -3.556 1794 1HB LYS 132 HB2 LYS 132 22.231 16.462 -2.123 1795 2HB LYS 132 HB3 LYS 132 22.776 15.503 -3.508 1796 1HG LYS 132 HG2 LYS 132 23.331 17.587 -4.733 1797 2HG LYS 132 HG3 LYS 132 22.765 18.554 -3.360 1798 1HD LYS 132 HD2 LYS 132 25.000 16.491 -3.212 1799 2HD LYS 132 HD3 LYS 132 25.264 18.225 -3.495 1800 1HE LYS 132 HE2 LYS 132 24.158 18.728 -1.315 1801 2HE LYS 132 HE3 LYS 132 23.980 16.995 -1.016 1802 1HZ LYS 132 HZ1 LYS 132 26.398 16.798 -1.056 1803 2HZ LYS 132 HZ2 LYS 132 26.574 18.395 -1.347 1804 3HZ LYS 132 HZ3 LYS 132 25.953 17.888 0.069 1805 H GLU 133 HN GLU 133 21.017 14.339 -5.248 1806 HA GLU 133 HA GLU 133 21.611 15.530 -7.734 1807 1HB GLU 133 HB2 GLU 133 20.396 12.850 -6.979 1808 2HB GLU 133 HB3 GLU 133 20.439 13.350 -8.688 1809 1HG GLU 133 HG2 GLU 133 22.741 13.484 -8.772 1810 2HG GLU 133 HG3 GLU 133 22.936 13.499 -7.010 1811 H PHE 134 HN PHE 134 18.297 15.009 -6.293 1812 HA PHE 134 HA PHE 134 17.061 15.548 -8.806 1813 1HB PHE 134 HB2 PHE 134 15.997 16.440 -6.106 1814 2HB PHE 134 HB3 PHE 134 15.056 16.184 -7.569 1815 HD1 PHE 134 HD1 PHE 134 14.707 15.091 -4.790 1816 HD2 PHE 134 HD2 PHE 134 16.538 13.463 -8.296 1817 HE1 PHE 134 HE1 PHE 134 14.138 12.777 -3.983 1818 HE2 PHE 134 HE2 PHE 134 16.029 11.147 -7.501 1819 HZ PHE 134 HZ PHE 134 14.825 10.806 -5.353 1820 H ALA 135 HN ALA 135 18.075 17.705 -6.248 1821 HA ALA 135 HA ALA 135 17.332 20.159 -7.407 1822 1HB ALA 135 HB1 ALA 135 19.818 19.611 -5.732 1823 2HB ALA 135 HB2 ALA 135 19.012 21.179 -5.950 1824 3HB ALA 135 HB3 ALA 135 18.188 19.876 -5.073 1825 H GLU 136 HN GLU 136 20.098 18.082 -8.179 1826 HA GLU 136 HA GLU 136 21.453 20.080 -9.776 1827 1HB GLU 136 HB2 GLU 136 21.976 17.143 -9.241 1828 2HB GLU 136 HB3 GLU 136 23.016 18.135 -10.246 1829 1HG GLU 136 HG2 GLU 136 22.418 18.860 -7.350 1830 2HG GLU 136 HG3 GLU 136 23.698 17.749 -7.808 1831 H THR 137 HN THR 137 19.694 17.089 -10.296 1832 HA THR 137 HA THR 137 20.140 17.002 -13.162 1833 HB THR 137 HB THR 137 19.008 14.774 -12.916 1834 HG1 THR 137 HG1 THR 137 18.843 15.343 -10.183 1835 1HG2 THR 137 HG21 THR 137 21.162 15.323 -10.827 1836 2HG2 THR 137 HG22 THR 137 20.652 13.727 -11.412 1837 3HG2 THR 137 HG23 THR 137 21.406 14.887 -12.522 1838 H GLY 138 HN GLY 138 17.645 18.222 -11.058 1839 1HA GLY 138 HA2 GLY 138 15.610 19.148 -11.428 1840 2HA GLY 138 HA3 GLY 138 15.966 19.248 -13.180 1841 H LYS 139 HN LYS 139 15.716 16.669 -10.751 1842 HA LYS 139 HA LYS 139 14.837 14.687 -12.461 1843 1HB LYS 139 HB2 LYS 139 15.783 14.428 -10.161 1844 2HB LYS 139 HB3 LYS 139 14.186 14.836 -9.513 1845 1HG LYS 139 HG2 LYS 139 14.406 12.443 -9.579 1846 2HG LYS 139 HG3 LYS 139 13.214 12.960 -10.771 1847 1HD LYS 139 HD2 LYS 139 14.600 11.141 -11.637 1848 2HD LYS 139 HD3 LYS 139 14.799 12.592 -12.603 1849 1HE LYS 139 HE2 LYS 139 16.914 13.121 -11.314 1850 2HE LYS 139 HE3 LYS 139 16.739 11.574 -10.475 1851 1HZ LYS 139 HZ1 LYS 139 18.234 11.396 -12.358 1852 2HZ LYS 139 HZ2 LYS 139 16.918 10.484 -12.668 1853 3HZ LYS 139 HZ3 LYS 139 17.106 11.931 -13.401 Start of MODEL 8 1 1H MET 1 H1 MET 1 -24.958 -12.924 -9.065 2 2H MET 1 H2 MET 1 -24.795 -13.336 -10.657 3 3H MET 1 H3 MET 1 -24.117 -11.962 -10.083 4 HA MET 1 HA MET 1 -22.669 -13.251 -8.626 5 1HB MET 1 HB2 MET 1 -23.879 -15.598 -10.150 6 2HB MET 1 HB3 MET 1 -22.351 -15.666 -9.271 7 1HG MET 1 HG2 MET 1 -23.547 -14.962 -7.199 8 2HG MET 1 HG3 MET 1 -25.079 -15.115 -8.063 9 1HE MET 1 HE1 MET 1 -24.856 -18.146 -5.485 10 2HE MET 1 HE2 MET 1 -24.052 -16.576 -5.274 11 3HE MET 1 HE3 MET 1 -25.716 -16.648 -5.903 12 H ALA 2 HN ALA 2 -21.111 -12.003 -9.570 13 HA ALA 2 HA ALA 2 -19.473 -13.192 -11.488 14 1HB ALA 2 HB1 ALA 2 -20.910 -10.676 -12.508 15 2HB ALA 2 HB2 ALA 2 -19.489 -11.420 -13.265 16 3HB ALA 2 HB3 ALA 2 -21.024 -12.297 -13.233 17 H ILE 3 HN ILE 3 -17.425 -12.162 -11.484 18 HA ILE 3 HA ILE 3 -17.065 -9.865 -9.666 19 HB ILE 3 HB ILE 3 -15.234 -12.074 -10.651 20 1HG1 ILE 3 HG12 ILE 3 -14.411 -12.031 -8.350 21 2HG1 ILE 3 HG13 ILE 3 -15.468 -10.683 -7.969 22 1HG2 ILE 3 HG21 ILE 3 -14.308 -9.295 -9.753 23 2HG2 ILE 3 HG22 ILE 3 -13.257 -10.728 -9.868 24 3HG2 ILE 3 HG23 ILE 3 -13.974 -10.053 -11.322 25 1HD1 ILE 3 HD11 ILE 3 -16.359 -12.692 -7.109 26 2HD1 ILE 3 HD12 ILE 3 -17.441 -12.164 -8.393 27 3HD1 ILE 3 HD13 ILE 3 -16.301 -13.514 -8.687 28 H VAL 4 HN VAL 4 -17.791 -8.176 -10.775 29 HA VAL 4 HA VAL 4 -17.457 -7.863 -13.652 30 HB VAL 4 HB VAL 4 -18.498 -5.986 -11.505 31 1HG1 VAL 4 HG11 VAL 4 -18.983 -5.916 -14.511 32 2HG1 VAL 4 HG12 VAL 4 -19.842 -4.927 -13.313 33 3HG1 VAL 4 HG13 VAL 4 -18.125 -4.691 -13.539 34 1HG2 VAL 4 HG21 VAL 4 -20.787 -6.712 -12.197 35 2HG2 VAL 4 HG22 VAL 4 -20.057 -7.945 -13.249 36 3HG2 VAL 4 HG23 VAL 4 -19.872 -8.029 -11.484 37 H LYS 5 HN LYS 5 -16.496 -5.753 -14.417 38 HA LYS 5 HA LYS 5 -14.113 -4.998 -12.879 39 1HB LYS 5 HB2 LYS 5 -12.818 -4.685 -14.883 40 2HB LYS 5 HB3 LYS 5 -13.221 -6.370 -14.625 41 1HG LYS 5 HG2 LYS 5 -14.727 -4.603 -16.610 42 2HG LYS 5 HG3 LYS 5 -13.249 -5.462 -17.008 43 1HD LYS 5 HD2 LYS 5 -14.298 -7.631 -16.478 44 2HD LYS 5 HD3 LYS 5 -15.830 -6.813 -16.107 45 1HE LYS 5 HE2 LYS 5 -15.957 -5.915 -18.379 46 2HE LYS 5 HE3 LYS 5 -14.395 -6.642 -18.783 47 1HZ LYS 5 HZ1 LYS 5 -16.848 -8.153 -18.078 48 2HZ LYS 5 HZ2 LYS 5 -16.224 -7.994 -19.572 49 3HZ LYS 5 HZ3 LYS 5 -15.400 -8.826 -18.443 50 H ALA 6 HN ALA 6 -14.105 -2.960 -12.418 51 HA ALA 6 HA ALA 6 -16.050 -1.079 -13.619 52 1HB ALA 6 HB1 ALA 6 -14.267 -1.103 -11.182 53 2HB ALA 6 HB2 ALA 6 -14.867 0.418 -11.846 54 3HB ALA 6 HB3 ALA 6 -16.011 -0.782 -11.304 55 H THR 7 HN THR 7 -14.948 1.153 -14.050 56 HA THR 7 HA THR 7 -12.194 1.412 -14.431 57 HB THR 7 HB THR 7 -12.499 0.142 -16.484 58 HG1 THR 7 HG1 THR 7 -11.558 1.591 -17.842 59 1HG2 THR 7 HG21 THR 7 -13.826 1.072 -18.384 60 2HG2 THR 7 HG22 THR 7 -14.802 0.466 -17.046 61 3HG2 THR 7 HG23 THR 7 -14.578 2.222 -17.255 62 H ASP 8 HN ASP 8 -12.138 3.696 -15.829 63 HA ASP 8 HA ASP 8 -12.465 5.626 -14.039 64 1HB ASP 8 HB2 ASP 8 -11.291 5.970 -16.102 65 2HB ASP 8 HB3 ASP 8 -12.783 5.882 -17.035 66 H GLN 9 HN GLN 9 -15.184 4.811 -16.232 67 HA GLN 9 HA GLN 9 -16.942 6.529 -14.576 68 1HB GLN 9 HB2 GLN 9 -16.831 6.186 -17.583 69 2HB GLN 9 HB3 GLN 9 -18.225 6.901 -16.757 70 1HG GLN 9 HG2 GLN 9 -16.968 8.763 -15.952 71 2HG GLN 9 HG3 GLN 9 -15.430 7.992 -16.283 72 1HE2 GLN 9 HE22 GLN 9 -14.358 8.853 -17.966 73 2HE2 GLN 9 HE21 GLN 9 -15.102 9.529 -19.414 74 H SER 10 HN SER 10 -16.616 3.490 -16.446 75 HA SER 10 HA SER 10 -19.196 2.533 -15.976 76 1HB SER 10 HB2 SER 10 -16.713 0.811 -16.025 77 2HB SER 10 HB3 SER 10 -18.355 0.386 -16.536 78 HG SER 10 HG SER 10 -17.102 0.900 -18.351 79 H PHE 11 HN PHE 11 -16.540 2.879 -13.636 80 HA PHE 11 HA PHE 11 -17.440 1.118 -11.601 81 1HB PHE 11 HB2 PHE 11 -15.352 2.379 -11.346 82 2HB PHE 11 HB3 PHE 11 -16.188 3.886 -11.534 83 HD1 PHE 11 HD1 PHE 11 -17.098 5.061 -9.739 84 HD2 PHE 11 HD2 PHE 11 -15.803 0.956 -9.080 85 HE1 PHE 11 HE1 PHE 11 -17.252 5.390 -7.295 86 HE2 PHE 11 HE2 PHE 11 -15.914 1.363 -6.661 87 HZ PHE 11 HZ PHE 11 -16.635 3.543 -5.750 88 H SER 12 HN SER 12 -18.382 4.577 -12.246 89 HA SER 12 HA SER 12 -20.360 4.663 -10.249 90 1HB SER 12 HB2 SER 12 -20.451 6.134 -12.917 91 2HB SER 12 HB3 SER 12 -21.060 6.694 -11.353 92 HG SER 12 HG SER 12 -19.054 7.675 -11.869 93 H ALA 13 HN ALA 13 -20.549 3.836 -13.745 94 HA ALA 13 HA ALA 13 -23.332 3.721 -13.832 95 1HB ALA 13 HB1 ALA 13 -21.380 2.095 -15.519 96 2HB ALA 13 HB2 ALA 13 -23.044 2.530 -15.953 97 3HB ALA 13 HB3 ALA 13 -21.809 3.802 -15.805 98 H GLU 14 HN GLU 14 -20.987 1.154 -13.029 99 HA GLU 14 HA GLU 14 -22.938 -0.912 -12.757 100 1HB GLU 14 HB2 GLU 14 -20.041 -0.659 -11.905 101 2HB GLU 14 HB3 GLU 14 -20.996 -2.090 -11.541 102 1HG GLU 14 HG2 GLU 14 -20.482 -1.002 -14.332 103 2HG GLU 14 HG3 GLU 14 -19.649 -2.365 -13.585 104 H THR 15 HN THR 15 -21.906 1.647 -10.576 105 HA THR 15 HA THR 15 -22.795 0.115 -8.204 106 HB THR 15 HB THR 15 -21.504 1.821 -6.958 107 HG1 THR 15 HG1 THR 15 -20.425 2.604 -9.412 108 1HG2 THR 15 HG21 THR 15 -20.031 0.230 -9.101 109 2HG2 THR 15 HG22 THR 15 -19.183 1.263 -7.950 110 3HG2 THR 15 HG23 THR 15 -20.173 -0.085 -7.358 111 H SER 16 HN SER 16 -24.091 2.419 -10.302 112 HA SER 16 HA SER 16 -25.246 4.234 -8.426 113 1HB SER 16 HB2 SER 16 -25.937 3.643 -11.317 114 2HB SER 16 HB3 SER 16 -26.611 4.975 -10.354 115 HG SER 16 HG SER 16 -23.847 4.554 -10.902 116 H GLU 17 HN GLU 17 -26.108 0.986 -8.967 117 HA GLU 17 HA GLU 17 -28.719 1.425 -7.735 118 1HB GLU 17 HB2 GLU 17 -28.253 -0.065 -10.361 119 2HB GLU 17 HB3 GLU 17 -29.710 -0.261 -9.377 120 1HG GLU 17 HG2 GLU 17 -30.174 2.188 -9.625 121 2HG GLU 17 HG3 GLU 17 -28.788 2.314 -10.717 122 H GLY 18 HN GLY 18 -29.414 -0.355 -6.504 123 1HA GLY 18 HA2 GLY 18 -29.259 -2.219 -5.244 124 2HA GLY 18 HA3 GLY 18 -28.114 -2.910 -6.409 125 H VAL 19 HN VAL 19 -27.346 -3.669 -4.185 126 HA VAL 19 HA VAL 19 -25.375 -1.748 -3.046 127 HB VAL 19 HB VAL 19 -26.141 -4.476 -1.917 128 1HG1 VAL 19 HG11 VAL 19 -24.505 -2.141 -0.807 129 2HG1 VAL 19 HG12 VAL 19 -24.890 -3.629 0.059 130 3HG1 VAL 19 HG13 VAL 19 -23.847 -3.694 -1.353 131 1HG2 VAL 19 HG21 VAL 19 -27.219 -2.870 -0.133 132 2HG2 VAL 19 HG22 VAL 19 -27.207 -1.686 -1.430 133 3HG2 VAL 19 HG23 VAL 19 -28.093 -3.198 -1.635 134 H VAL 20 HN VAL 20 -23.289 -1.940 -3.470 135 HA VAL 20 HA VAL 20 -22.410 -4.113 -5.261 136 HB VAL 20 HB VAL 20 -22.135 -1.148 -5.928 137 1HG1 VAL 20 HG11 VAL 20 -21.420 -3.719 -7.402 138 2HG1 VAL 20 HG12 VAL 20 -21.367 -2.096 -8.128 139 3HG1 VAL 20 HG13 VAL 20 -20.295 -2.507 -6.778 140 1HG2 VAL 20 HG21 VAL 20 -24.118 -3.217 -6.959 141 2HG2 VAL 20 HG22 VAL 20 -24.447 -1.615 -6.277 142 3HG2 VAL 20 HG23 VAL 20 -23.705 -1.767 -7.861 143 H LEU 21 HN LEU 21 -20.661 -4.854 -4.489 144 HA LEU 21 HA LEU 21 -18.884 -3.416 -2.609 145 1HB LEU 21 HB2 LEU 21 -19.657 -5.791 -2.313 146 2HB LEU 21 HB3 LEU 21 -18.888 -6.224 -3.819 147 HG LEU 21 HG LEU 21 -17.686 -6.991 -1.868 148 1HD1 LEU 21 HD11 LEU 21 -15.490 -6.466 -2.478 149 2HD1 LEU 21 HD12 LEU 21 -16.420 -6.343 -3.974 150 3HD1 LEU 21 HD13 LEU 21 -15.910 -4.876 -3.103 151 1HD2 LEU 21 HD21 LEU 21 -18.358 -5.105 -0.341 152 2HD2 LEU 21 HD22 LEU 21 -16.651 -5.546 -0.262 153 3HD2 LEU 21 HD23 LEU 21 -17.140 -4.085 -1.145 154 H ALA 22 HN ALA 22 -17.077 -2.277 -3.459 155 HA ALA 22 HA ALA 22 -16.021 -3.206 -6.060 156 1HB ALA 22 HB1 ALA 22 -17.026 -0.873 -6.185 157 2HB ALA 22 HB2 ALA 22 -15.778 -0.370 -5.009 158 3HB ALA 22 HB3 ALA 22 -15.318 -0.966 -6.616 159 H ASP 23 HN ASP 23 -13.913 -3.661 -6.151 160 HA ASP 23 HA ASP 23 -12.272 -3.421 -3.668 161 1HB ASP 23 HB2 ASP 23 -13.173 -5.650 -3.723 162 2HB ASP 23 HB3 ASP 23 -12.849 -5.795 -5.448 163 H PHE 24 HN PHE 24 -10.058 -3.248 -4.023 164 HA PHE 24 HA PHE 24 -9.226 -2.458 -6.783 165 1HB PHE 24 HB2 PHE 24 -8.774 -1.091 -4.114 166 2HB PHE 24 HB3 PHE 24 -7.934 -0.670 -5.591 167 HD1 PHE 24 HD1 PHE 24 -8.806 0.998 -6.966 168 HD2 PHE 24 HD2 PHE 24 -11.488 -1.008 -4.269 169 HE1 PHE 24 HE1 PHE 24 -10.675 2.500 -7.670 170 HE2 PHE 24 HE2 PHE 24 -13.342 0.418 -5.032 171 HZ PHE 24 HZ PHE 24 -12.938 2.198 -6.725 172 H TRP 25 HN TRP 25 -7.672 -3.738 -7.427 173 HA TRP 25 HA TRP 25 -5.895 -5.112 -5.491 174 1HB TRP 25 HB2 TRP 25 -6.371 -7.185 -6.340 175 2HB TRP 25 HB3 TRP 25 -7.962 -6.457 -6.362 176 HD1 TRP 25 HD1 TRP 25 -8.651 -5.385 -8.858 177 HE1 TRP 25 HE1 TRP 25 -8.064 -6.046 -11.217 178 HE3 TRP 25 HE3 TRP 25 -4.823 -8.597 -7.786 179 HZ2 TRP 25 HZ2 TRP 25 -5.875 -7.584 -12.534 180 HZ3 TRP 25 HZ3 TRP 25 -3.456 -9.578 -9.597 181 HH2 TRP 25 HH2 TRP 25 -3.976 -9.065 -11.973 182 H ALA 26 HN ALA 26 -3.812 -5.686 -6.551 183 HA ALA 26 HA ALA 26 -3.355 -5.481 -9.348 184 1HB ALA 26 HB1 ALA 26 -3.295 -3.169 -9.304 185 2HB ALA 26 HB2 ALA 26 -2.657 -3.144 -7.625 186 3HB ALA 26 HB3 ALA 26 -1.597 -3.516 -9.007 187 HA PRO 27 HA PRO 27 0.393 -7.672 -8.235 188 1HB PRO 27 HB2 PRO 27 1.862 -5.666 -9.947 189 2HB PRO 27 HB3 PRO 27 2.012 -7.450 -9.929 190 1HG PRO 27 HG2 PRO 27 0.547 -6.211 -11.857 191 2HG PRO 27 HG3 PRO 27 -0.097 -7.703 -11.082 192 1HD PRO 27 HD2 PRO 27 -0.799 -4.840 -10.545 193 2HD PRO 27 HD3 PRO 27 -1.858 -6.276 -10.661 194 H TRP 28 HN TRP 28 0.168 -4.252 -7.391 195 HA TRP 28 HA TRP 28 2.661 -3.856 -6.118 196 1HB TRP 28 HB2 TRP 28 0.041 -2.683 -5.240 197 2HB TRP 28 HB3 TRP 28 1.655 -2.017 -5.039 198 HD1 TRP 28 HD1 TRP 28 -1.252 -1.755 -7.107 199 HE1 TRP 28 HE1 TRP 28 -0.881 -0.536 -9.345 200 HE3 TRP 28 HE3 TRP 28 3.840 -1.740 -7.093 201 HZ2 TRP 28 HZ2 TRP 28 1.397 0.201 -10.978 202 HZ3 TRP 28 HZ3 TRP 28 5.099 -0.764 -8.993 203 HH2 TRP 28 HH2 TRP 28 3.892 0.203 -10.942 204 H CYS 29 HN CYS 29 0.047 -5.983 -5.069 205 HA CYS 29 HA CYS 29 1.463 -6.254 -2.475 206 1HB CYS 29 HB2 CYS 29 -0.833 -4.674 -2.828 207 2HB CYS 29 HB3 CYS 29 -1.463 -6.175 -2.180 208 H GLY 30 HN GLY 30 1.094 -8.128 -1.331 209 1HA GLY 30 HA2 GLY 30 0.407 -10.543 -2.685 210 2HA GLY 30 HA3 GLY 30 0.624 -10.319 -0.942 211 HA PRO 31 HA PRO 31 -3.781 -10.176 -0.096 212 1HB PRO 31 HB2 PRO 31 -3.827 -7.156 -0.162 213 2HB PRO 31 HB3 PRO 31 -4.721 -8.272 0.931 214 1HG PRO 31 HG2 PRO 31 -2.387 -7.126 1.758 215 2HG PRO 31 HG3 PRO 31 -2.650 -8.877 2.050 216 1HD PRO 31 HD2 PRO 31 -1.012 -7.550 -0.104 217 2HD PRO 31 HD3 PRO 31 -0.643 -9.019 0.841 218 H SER 32 HN SER 32 -2.893 -7.996 -2.847 219 HA SER 32 HA SER 32 -5.440 -7.953 -4.064 220 1HB SER 32 HB2 SER 32 -2.716 -8.222 -5.409 221 2HB SER 32 HB3 SER 32 -4.156 -7.454 -6.075 222 HG SER 32 HG SER 32 -2.406 -6.129 -5.091 223 H LYS 33 HN LYS 33 -3.268 -10.610 -3.643 224 HA LYS 33 HA LYS 33 -4.850 -12.260 -5.558 225 1HB LYS 33 HB2 LYS 33 -2.184 -13.020 -4.342 226 2HB LYS 33 HB3 LYS 33 -3.102 -13.828 -5.611 227 1HG LYS 33 HG2 LYS 33 -1.502 -12.815 -6.865 228 2HG LYS 33 HG3 LYS 33 -2.799 -11.620 -6.979 229 1HD LYS 33 HD2 LYS 33 -1.700 -10.286 -5.195 230 2HD LYS 33 HD3 LYS 33 -0.438 -11.496 -5.024 231 1HE LYS 33 HE2 LYS 33 -1.013 -9.890 -7.560 232 2HE LYS 33 HE3 LYS 33 0.192 -9.453 -6.345 233 1HZ LYS 33 HZ1 LYS 33 0.245 -11.941 -7.962 234 2HZ LYS 33 HZ2 LYS 33 1.210 -10.650 -8.176 235 3HZ LYS 33 HZ3 LYS 33 1.346 -11.540 -6.821 236 H MET 34 HN MET 34 -5.258 -11.423 -2.494 237 HA MET 34 HA MET 34 -6.097 -14.167 -1.638 238 1HB MET 34 HB2 MET 34 -5.186 -11.917 0.187 239 2HB MET 34 HB3 MET 34 -5.780 -13.511 0.668 240 1HG MET 34 HG2 MET 34 -3.877 -14.532 -0.647 241 2HG MET 34 HG3 MET 34 -3.210 -12.911 -0.840 242 1HE MET 34 HE1 MET 34 -2.193 -11.462 1.146 243 2HE MET 34 HE2 MET 34 -3.742 -11.529 2.030 244 3HE MET 34 HE3 MET 34 -2.227 -11.952 2.852 245 H ILE 35 HN ILE 35 -6.770 -10.614 -1.432 246 HA ILE 35 HA ILE 35 -9.478 -10.893 -0.670 247 HB ILE 35 HB ILE 35 -7.778 -8.830 -0.830 248 1HG1 ILE 35 HG12 ILE 35 -9.886 -7.276 -0.786 249 2HG1 ILE 35 HG13 ILE 35 -10.807 -8.777 -0.873 250 1HG2 ILE 35 HG21 ILE 35 -7.626 -8.748 -3.255 251 2HG2 ILE 35 HG22 ILE 35 -9.371 -8.409 -3.365 252 3HG2 ILE 35 HG23 ILE 35 -8.282 -7.258 -2.564 253 1HD1 ILE 35 HD11 ILE 35 -8.603 -8.172 1.169 254 2HD1 ILE 35 HD12 ILE 35 -10.345 -7.981 1.475 255 3HD1 ILE 35 HD13 ILE 35 -9.672 -9.598 1.175 256 H ALA 36 HN ALA 36 -7.794 -11.104 -3.796 257 HA ALA 36 HA ALA 36 -10.027 -11.021 -5.479 258 1HB ALA 36 HB1 ALA 36 -7.889 -10.765 -6.453 259 2HB ALA 36 HB2 ALA 36 -7.284 -12.304 -5.844 260 3HB ALA 36 HB3 ALA 36 -8.528 -12.283 -7.111 261 HA PRO 37 HA PRO 37 -10.525 -15.811 -5.231 262 1HB PRO 37 HB2 PRO 37 -9.448 -16.888 -2.800 263 2HB PRO 37 HB3 PRO 37 -8.920 -17.222 -4.484 264 1HG PRO 37 HG2 PRO 37 -7.764 -15.423 -2.432 265 2HG PRO 37 HG3 PRO 37 -6.945 -16.197 -3.812 266 1HD PRO 37 HD2 PRO 37 -7.585 -13.500 -3.763 267 2HD PRO 37 HD3 PRO 37 -7.498 -14.456 -5.257 268 H VAL 38 HN VAL 38 -10.200 -13.995 -2.125 269 HA VAL 38 HA VAL 38 -12.482 -15.044 -0.840 270 HB VAL 38 HB VAL 38 -10.867 -12.529 -0.663 271 1HG1 VAL 38 HG11 VAL 38 -12.233 -11.831 1.322 272 2HG1 VAL 38 HG12 VAL 38 -13.000 -11.608 -0.264 273 3HG1 VAL 38 HG13 VAL 38 -13.500 -12.960 0.743 274 1HG2 VAL 38 HG21 VAL 38 -10.312 -13.430 1.522 275 2HG2 VAL 38 HG22 VAL 38 -11.526 -14.719 1.340 276 3HG2 VAL 38 HG23 VAL 38 -10.092 -14.698 0.293 277 H LEU 39 HN LEU 39 -12.228 -12.391 -3.270 278 HA LEU 39 HA LEU 39 -15.007 -11.747 -3.092 279 1HB LEU 39 HB2 LEU 39 -12.737 -10.971 -4.825 280 2HB LEU 39 HB3 LEU 39 -14.239 -11.157 -5.737 281 HG LEU 39 HG LEU 39 -15.415 -9.636 -4.230 282 1HD1 LEU 39 HD11 LEU 39 -14.163 -8.279 -2.577 283 2HD1 LEU 39 HD12 LEU 39 -14.291 -9.982 -2.130 284 3HD1 LEU 39 HD13 LEU 39 -12.760 -9.349 -2.783 285 1HD2 LEU 39 HD21 LEU 39 -14.370 -7.582 -4.940 286 2HD2 LEU 39 HD22 LEU 39 -12.793 -8.389 -5.155 287 3HD2 LEU 39 HD23 LEU 39 -14.153 -8.772 -6.230 288 H GLU 40 HN GLU 40 -13.241 -14.043 -5.251 289 HA GLU 40 HA GLU 40 -15.577 -14.635 -6.773 290 1HB GLU 40 HB2 GLU 40 -13.078 -16.298 -6.358 291 2HB GLU 40 HB3 GLU 40 -14.367 -16.590 -7.553 292 1HG GLU 40 HG2 GLU 40 -13.927 -14.423 -8.613 293 2HG GLU 40 HG3 GLU 40 -12.632 -14.093 -7.465 294 H GLU 41 HN GLU 41 -14.235 -15.997 -3.726 295 HA GLU 41 HA GLU 41 -16.087 -18.154 -3.481 296 1HB GLU 41 HB2 GLU 41 -14.315 -16.646 -1.533 297 2HB GLU 41 HB3 GLU 41 -15.364 -17.957 -1.014 298 1HG GLU 41 HG2 GLU 41 -13.209 -18.226 -3.152 299 2HG GLU 41 HG3 GLU 41 -12.996 -18.644 -1.455 300 H LEU 42 HN LEU 42 -16.054 -14.772 -2.381 301 HA LEU 42 HA LEU 42 -18.453 -14.856 -0.833 302 1HB LEU 42 HB2 LEU 42 -16.684 -13.047 -0.725 303 2HB LEU 42 HB3 LEU 42 -17.015 -12.611 -2.386 304 HG LEU 42 HG LEU 42 -19.334 -11.902 -1.724 305 1HD1 LEU 42 HD11 LEU 42 -18.183 -12.425 1.039 306 2HD1 LEU 42 HD12 LEU 42 -19.689 -11.540 0.711 307 3HD1 LEU 42 HD13 LEU 42 -19.573 -13.265 0.311 308 1HD2 LEU 42 HD21 LEU 42 -18.607 -9.817 -0.670 309 2HD2 LEU 42 HD22 LEU 42 -17.075 -10.559 -0.164 310 3HD2 LEU 42 HD23 LEU 42 -17.408 -10.288 -1.886 311 H ASP 43 HN ASP 43 -17.826 -14.046 -4.271 312 HA ASP 43 HA ASP 43 -20.512 -13.224 -4.694 313 1HB ASP 43 HB2 ASP 43 -18.674 -12.442 -6.184 314 2HB ASP 43 HB3 ASP 43 -18.279 -14.106 -6.594 315 H GLN 44 HN GLN 44 -18.821 -16.311 -5.316 316 HA GLN 44 HA GLN 44 -21.150 -17.463 -6.508 317 1HB GLN 44 HB2 GLN 44 -19.958 -19.460 -6.645 318 2HB GLN 44 HB3 GLN 44 -18.783 -18.152 -6.840 319 1HG GLN 44 HG2 GLN 44 -18.198 -18.458 -4.389 320 2HG GLN 44 HG3 GLN 44 -19.215 -19.900 -4.375 321 1HE2 GLN 44 HE22 GLN 44 -16.413 -18.378 -6.003 322 2HE2 GLN 44 HE21 GLN 44 -15.580 -19.881 -6.392 323 H GLU 45 HN GLU 45 -20.670 -16.562 -3.221 324 HA GLU 45 HA GLU 45 -22.389 -18.657 -2.239 325 1HB GLU 45 HB2 GLU 45 -20.539 -18.594 -0.915 326 2HB GLU 45 HB3 GLU 45 -20.305 -16.845 -1.115 327 1HG GLU 45 HG2 GLU 45 -22.003 -16.270 0.317 328 2HG GLU 45 HG3 GLU 45 -22.648 -17.927 0.419 329 H MET 46 HN MET 46 -22.119 -15.110 -2.331 330 HA MET 46 HA MET 46 -25.053 -14.940 -1.825 331 1HB MET 46 HB2 MET 46 -24.531 -12.958 -0.437 332 2HB MET 46 HB3 MET 46 -24.052 -14.517 0.234 333 1HG MET 46 HG2 MET 46 -21.725 -14.125 -0.368 334 2HG MET 46 HG3 MET 46 -22.120 -12.626 -1.199 335 1HE MET 46 HE1 MET 46 -22.785 -10.547 -0.136 336 2HE MET 46 HE2 MET 46 -24.217 -11.141 0.739 337 3HE MET 46 HE3 MET 46 -22.947 -10.182 1.602 338 H GLY 47 HN GLY 47 -23.082 -14.536 -4.294 339 1HA GLY 47 HA2 GLY 47 -23.625 -11.787 -4.997 340 2HA GLY 47 HA3 GLY 47 -22.982 -13.042 -6.082 341 H ASP 48 HN ASP 48 -25.817 -13.907 -4.463 342 HA ASP 48 HA ASP 48 -27.599 -13.482 -6.720 343 1HB ASP 48 HB2 ASP 48 -27.768 -15.609 -5.509 344 2HB ASP 48 HB3 ASP 48 -27.976 -14.750 -3.982 345 H LYS 49 HN LYS 49 -26.709 -12.054 -3.628 346 HA LYS 49 HA LYS 49 -29.006 -10.242 -3.755 347 1HB LYS 49 HB2 LYS 49 -27.046 -10.418 -1.466 348 2HB LYS 49 HB3 LYS 49 -28.707 -9.847 -1.462 349 1HG LYS 49 HG2 LYS 49 -29.120 -11.794 -0.449 350 2HG LYS 49 HG3 LYS 49 -29.155 -12.454 -2.100 351 1HD LYS 49 HD2 LYS 49 -27.056 -13.471 -1.874 352 2HD LYS 49 HD3 LYS 49 -26.522 -12.298 -0.658 353 1HE LYS 49 HE2 LYS 49 -26.730 -14.398 0.412 354 2HE LYS 49 HE3 LYS 49 -27.919 -13.267 1.045 355 1HZ LYS 49 HZ1 LYS 49 -28.895 -15.448 0.668 356 2HZ LYS 49 HZ2 LYS 49 -29.613 -14.378 -0.322 357 3HZ LYS 49 HZ3 LYS 49 -28.507 -15.432 -0.911 358 H LEU 50 HN LEU 50 -25.557 -10.397 -4.136 359 HA LEU 50 HA LEU 50 -25.228 -7.471 -3.933 360 1HB LEU 50 HB2 LEU 50 -24.303 -8.755 -2.051 361 2HB LEU 50 HB3 LEU 50 -23.472 -9.835 -3.169 362 HG LEU 50 HG LEU 50 -22.000 -7.986 -3.880 363 1HD1 LEU 50 HD11 LEU 50 -23.400 -6.416 -1.659 364 2HD1 LEU 50 HD12 LEU 50 -21.958 -5.886 -2.559 365 3HD1 LEU 50 HD13 LEU 50 -23.490 -6.069 -3.391 366 1HD2 LEU 50 HD21 LEU 50 -22.050 -8.431 -0.879 367 2HD2 LEU 50 HD22 LEU 50 -21.358 -9.546 -2.076 368 3HD2 LEU 50 HD23 LEU 50 -20.647 -7.944 -1.861 369 H LYS 51 HN LYS 51 -23.771 -6.508 -5.372 370 HA LYS 51 HA LYS 51 -22.828 -8.168 -7.688 371 1HB LYS 51 HB2 LYS 51 -24.352 -6.269 -8.292 372 2HB LYS 51 HB3 LYS 51 -23.231 -5.158 -7.496 373 1HG LYS 51 HG2 LYS 51 -21.428 -5.955 -9.121 374 2HG LYS 51 HG3 LYS 51 -22.681 -6.864 -9.966 375 1HD LYS 51 HD2 LYS 51 -22.571 -3.842 -9.553 376 2HD LYS 51 HD3 LYS 51 -22.140 -4.705 -11.029 377 1HE LYS 51 HE2 LYS 51 -24.481 -5.527 -11.231 378 2HE LYS 51 HE3 LYS 51 -24.919 -4.627 -9.767 379 1HZ LYS 51 HZ1 LYS 51 -23.847 -3.425 -12.253 380 2HZ LYS 51 HZ2 LYS 51 -25.430 -3.376 -11.783 381 3HZ LYS 51 HZ3 LYS 51 -24.272 -2.590 -10.907 382 H ILE 52 HN ILE 52 -20.560 -8.023 -8.126 383 HA ILE 52 HA ILE 52 -18.893 -6.612 -6.112 384 HB ILE 52 HB ILE 52 -18.965 -9.523 -6.923 385 1HG1 ILE 52 HG12 ILE 52 -18.053 -8.397 -4.254 386 2HG1 ILE 52 HG13 ILE 52 -19.774 -8.332 -4.654 387 1HG2 ILE 52 HG21 ILE 52 -16.466 -8.085 -5.968 388 2HG2 ILE 52 HG22 ILE 52 -16.668 -9.854 -6.115 389 3HG2 ILE 52 HG23 ILE 52 -16.684 -8.840 -7.557 390 1HD1 ILE 52 HD11 ILE 52 -18.097 -10.855 -4.496 391 2HD1 ILE 52 HD12 ILE 52 -19.358 -10.306 -3.373 392 3HD1 ILE 52 HD13 ILE 52 -19.807 -10.774 -5.013 393 H VAL 53 HN VAL 53 -17.239 -5.520 -7.025 394 HA VAL 53 HA VAL 53 -16.738 -5.816 -9.930 395 HB VAL 53 HB VAL 53 -17.057 -3.134 -8.520 396 1HG1 VAL 53 HG11 VAL 53 -15.849 -3.050 -10.581 397 2HG1 VAL 53 HG12 VAL 53 -17.127 -3.949 -11.440 398 3HG1 VAL 53 HG13 VAL 53 -17.447 -2.322 -10.808 399 1HG2 VAL 53 HG21 VAL 53 -19.268 -4.176 -8.306 400 2HG2 VAL 53 HG22 VAL 53 -19.298 -2.872 -9.490 401 3HG2 VAL 53 HG23 VAL 53 -19.287 -4.561 -10.037 402 H LYS 54 HN LYS 54 -14.530 -5.395 -10.484 403 HA LYS 54 HA LYS 54 -12.775 -4.578 -8.210 404 1HB LYS 54 HB2 LYS 54 -12.261 -6.637 -10.376 405 2HB LYS 54 HB3 LYS 54 -10.989 -5.939 -9.363 406 1HG LYS 54 HG2 LYS 54 -12.217 -6.701 -7.318 407 2HG LYS 54 HG3 LYS 54 -13.422 -7.471 -8.350 408 1HD LYS 54 HD2 LYS 54 -11.957 -9.197 -7.651 409 2HD LYS 54 HD3 LYS 54 -11.570 -8.858 -9.344 410 1HE LYS 54 HE2 LYS 54 -9.756 -7.204 -8.146 411 2HE LYS 54 HE3 LYS 54 -9.967 -8.314 -6.823 412 1HZ LYS 54 HZ1 LYS 54 -9.119 -9.025 -9.583 413 2HZ LYS 54 HZ2 LYS 54 -8.188 -9.064 -8.248 414 3HZ LYS 54 HZ3 LYS 54 -9.415 -10.141 -8.426 415 H ILE 55 HN ILE 55 -10.851 -3.390 -8.749 416 HA ILE 55 HA ILE 55 -10.789 -2.043 -11.379 417 HB ILE 55 HB ILE 55 -10.563 -0.930 -8.544 418 1HG1 ILE 55 HG12 ILE 55 -12.697 -0.584 -9.711 419 2HG1 ILE 55 HG13 ILE 55 -11.875 0.895 -9.246 420 1HG2 ILE 55 HG21 ILE 55 -8.466 -0.321 -9.424 421 2HG2 ILE 55 HG22 ILE 55 -9.137 0.174 -10.983 422 3HG2 ILE 55 HG23 ILE 55 -9.478 1.125 -9.521 423 1HD1 ILE 55 HD11 ILE 55 -11.087 1.261 -11.552 424 2HD1 ILE 55 HD12 ILE 55 -11.907 -0.229 -12.071 425 3HD1 ILE 55 HD13 ILE 55 -12.833 1.162 -11.459 426 H ASP 56 HN ASP 56 -8.811 -2.332 -12.274 427 HA ASP 56 HA ASP 56 -6.644 -3.737 -10.782 428 1HB ASP 56 HB2 ASP 56 -7.253 -4.725 -12.949 429 2HB ASP 56 HB3 ASP 56 -7.063 -3.166 -13.750 430 H VAL 57 HN VAL 57 -5.593 -2.146 -9.641 431 HA VAL 57 HA VAL 57 -5.613 0.528 -10.559 432 HB VAL 57 HB VAL 57 -4.359 1.118 -8.565 433 1HG1 VAL 57 HG11 VAL 57 -6.811 0.951 -8.530 434 2HG1 VAL 57 HG12 VAL 57 -6.695 -0.751 -8.001 435 3HG1 VAL 57 HG13 VAL 57 -6.103 0.560 -6.965 436 1HG2 VAL 57 HG21 VAL 57 -4.511 -1.814 -7.837 437 2HG2 VAL 57 HG22 VAL 57 -3.045 -1.037 -8.506 438 3HG2 VAL 57 HG23 VAL 57 -3.669 -0.532 -6.974 439 H ASP 58 HN ASP 58 -4.319 -1.010 -12.514 440 HA ASP 58 HA ASP 58 -2.066 0.866 -12.869 441 1HB ASP 58 HB2 ASP 58 -0.927 -1.204 -12.117 442 2HB ASP 58 HB3 ASP 58 -1.822 -2.149 -13.317 443 H GLU 59 HN GLU 59 -4.314 -1.635 -14.254 444 HA GLU 59 HA GLU 59 -4.005 -0.566 -16.936 445 1HB GLU 59 HB2 GLU 59 -4.430 -2.777 -17.100 446 2HB GLU 59 HB3 GLU 59 -5.310 -2.856 -15.576 447 1HG GLU 59 HG2 GLU 59 -7.286 -1.985 -16.512 448 2HG GLU 59 HG3 GLU 59 -6.501 -1.655 -18.065 449 H ASN 60 HN ASN 60 -6.397 -0.294 -14.312 450 HA ASN 60 HA ASN 60 -7.688 1.905 -15.772 451 1HB ASN 60 HB2 ASN 60 -9.937 1.059 -15.444 452 2HB ASN 60 HB3 ASN 60 -8.976 0.083 -16.531 453 1HD2 ASN 60 HD22 ASN 60 -10.175 -1.817 -16.333 454 2HD2 ASN 60 HD21 ASN 60 -10.340 -2.696 -14.838 455 H GLN 61 HN GLN 61 -5.970 2.162 -13.745 456 HA GLN 61 HA GLN 61 -7.164 2.169 -11.177 457 1HB GLN 61 HB2 GLN 61 -5.080 2.807 -10.396 458 2HB GLN 61 HB3 GLN 61 -4.719 1.959 -11.912 459 1HG GLN 61 HG2 GLN 61 -4.424 4.110 -13.064 460 2HG GLN 61 HG3 GLN 61 -4.629 4.929 -11.510 461 1HE2 GLN 61 HE22 GLN 61 -3.139 3.910 -9.626 462 2HE2 GLN 61 HE21 GLN 61 -1.498 3.607 -10.086 463 H GLU 62 HN GLU 62 -7.625 4.290 -13.738 464 HA GLU 62 HA GLU 62 -7.483 6.886 -12.816 465 1HB GLU 62 HB2 GLU 62 -9.318 5.364 -14.684 466 2HB GLU 62 HB3 GLU 62 -9.564 7.093 -14.406 467 1HG GLU 62 HG2 GLU 62 -8.287 6.882 -16.395 468 2HG GLU 62 HG3 GLU 62 -7.238 7.545 -15.146 469 H THR 63 HN THR 63 -10.260 4.578 -12.351 470 HA THR 63 HA THR 63 -11.980 6.235 -10.924 471 HB THR 63 HB THR 63 -11.305 3.308 -10.439 472 HG1 THR 63 HG1 THR 63 -13.300 4.179 -12.208 473 1HG2 THR 63 HG21 THR 63 -13.961 4.730 -10.031 474 2HG2 THR 63 HG22 THR 63 -13.627 2.988 -9.817 475 3HG2 THR 63 HG23 THR 63 -12.877 4.161 -8.744 476 H ALA 64 HN ALA 64 -9.141 4.429 -9.828 477 HA ALA 64 HA ALA 64 -9.764 4.611 -7.024 478 1HB ALA 64 HB1 ALA 64 -7.757 3.314 -6.781 479 2HB ALA 64 HB2 ALA 64 -8.454 2.783 -8.319 480 3HB ALA 64 HB3 ALA 64 -7.097 3.878 -8.342 481 H GLY 65 HN GLY 65 -7.072 5.921 -8.998 482 1HA GLY 65 HA2 GLY 65 -6.096 7.922 -7.341 483 2HA GLY 65 HA3 GLY 65 -6.176 8.030 -9.119 484 H LYS 66 HN LYS 66 -8.905 8.268 -9.618 485 HA LYS 66 HA LYS 66 -9.355 11.002 -9.050 486 1HB LYS 66 HB2 LYS 66 -10.268 9.873 -11.000 487 2HB LYS 66 HB3 LYS 66 -11.250 8.807 -9.973 488 1HG LYS 66 HG2 LYS 66 -12.641 10.665 -9.255 489 2HG LYS 66 HG3 LYS 66 -11.546 11.838 -10.007 490 1HD LYS 66 HD2 LYS 66 -13.541 11.532 -11.362 491 2HD LYS 66 HD3 LYS 66 -12.095 10.979 -12.230 492 1HE LYS 66 HE2 LYS 66 -12.698 8.605 -11.461 493 2HE LYS 66 HE3 LYS 66 -14.233 9.271 -10.879 494 1HZ LYS 66 HZ1 LYS 66 -13.234 9.187 -13.670 495 2HZ LYS 66 HZ2 LYS 66 -14.487 8.378 -13.074 496 3HZ LYS 66 HZ3 LYS 66 -14.605 10.015 -13.223 497 H TYR 67 HN TYR 67 -10.688 8.018 -7.455 498 HA TYR 67 HA TYR 67 -12.454 9.529 -5.811 499 1HB TYR 67 HB2 TYR 67 -12.763 7.128 -6.305 500 2HB TYR 67 HB3 TYR 67 -11.295 6.740 -5.419 501 HD1 TYR 67 HD1 TYR 67 -14.809 7.902 -5.141 502 HD2 TYR 67 HD2 TYR 67 -11.277 6.764 -2.933 503 HE1 TYR 67 HE1 TYR 67 -16.133 7.838 -3.050 504 HE2 TYR 67 HE2 TYR 67 -12.593 6.671 -0.852 505 HH TYR 67 HH TYR 67 -14.674 7.018 0.135 506 H GLY 68 HN GLY 68 -9.089 8.466 -5.548 507 1HA GLY 68 HA2 GLY 68 -7.422 9.512 -4.190 508 2HA GLY 68 HA3 GLY 68 -8.670 10.029 -3.039 509 H VAL 69 HN VAL 69 -7.299 7.034 -4.556 510 HA VAL 69 HA VAL 69 -8.015 5.513 -2.055 511 HB VAL 69 HB VAL 69 -7.927 4.674 -4.967 512 1HG1 VAL 69 HG11 VAL 69 -7.465 2.869 -2.604 513 2HG1 VAL 69 HG12 VAL 69 -8.038 2.299 -4.195 514 3HG1 VAL 69 HG13 VAL 69 -6.453 3.056 -4.038 515 1HG2 VAL 69 HG21 VAL 69 -9.917 4.212 -2.750 516 2HG2 VAL 69 HG22 VAL 69 -10.060 5.310 -4.140 517 3HG2 VAL 69 HG23 VAL 69 -10.025 3.570 -4.408 518 H MET 70 HN MET 70 -5.662 5.462 -4.659 519 HA MET 70 HA MET 70 -3.529 5.263 -4.877 520 1HB MET 70 HB2 MET 70 -2.086 6.833 -3.844 521 2HB MET 70 HB3 MET 70 -3.612 7.614 -4.234 522 1HG MET 70 HG2 MET 70 -4.260 7.823 -2.014 523 2HG MET 70 HG3 MET 70 -3.284 6.464 -1.497 524 1HE MET 70 HE1 MET 70 -0.194 7.459 -2.753 525 2HE MET 70 HE2 MET 70 0.240 7.690 -1.044 526 3HE MET 70 HE3 MET 70 -0.810 6.345 -1.525 527 H SER 71 HN SER 71 -4.855 3.513 -2.614 528 HA SER 71 HA SER 71 -2.357 2.203 -1.770 529 1HB SER 71 HB2 SER 71 -3.461 1.908 0.458 530 2HB SER 71 HB3 SER 71 -2.905 3.520 -0.002 531 HG SER 71 HG SER 71 -5.052 4.106 -0.470 532 H ILE 72 HN ILE 72 -2.755 -0.044 -0.848 533 HA ILE 72 HA ILE 72 -5.078 -1.367 -2.066 534 HB ILE 72 HB ILE 72 -2.150 -1.913 -2.617 535 1HG1 ILE 72 HG12 ILE 72 -3.219 -0.205 -4.081 536 2HG1 ILE 72 HG13 ILE 72 -2.632 -1.597 -4.945 537 1HG2 ILE 72 HG21 ILE 72 -2.703 -3.796 -4.050 538 2HG2 ILE 72 HG22 ILE 72 -3.165 -4.168 -2.382 539 3HG2 ILE 72 HG23 ILE 72 -4.390 -3.736 -3.589 540 1HD1 ILE 72 HD11 ILE 72 -5.522 -1.707 -4.094 541 2HD1 ILE 72 HD12 ILE 72 -5.088 -0.587 -5.360 542 3HD1 ILE 72 HD13 ILE 72 -4.705 -2.322 -5.554 543 HA PRO 73 HA PRO 73 -5.881 -3.443 -2.108 544 1HB PRO 73 HB2 PRO 73 -7.457 -5.228 -0.859 545 2HB PRO 73 HB3 PRO 73 -5.812 -5.696 -1.400 546 1HG PRO 73 HG2 PRO 73 -6.695 -4.839 1.370 547 2HG PRO 73 HG3 PRO 73 -5.716 -6.248 0.941 548 1HD PRO 73 HD2 PRO 73 -4.617 -3.846 1.763 549 2HD PRO 73 HD3 PRO 73 -3.783 -4.914 0.601 550 H THR 74 HN THR 74 -7.716 -2.166 -2.404 551 HA THR 74 HA THR 74 -8.843 -0.909 0.089 552 HB THR 74 HB THR 74 -8.482 0.378 -2.625 553 HG1 THR 74 HG1 THR 74 -6.657 0.818 -1.719 554 1HG2 THR 74 HG21 THR 74 -9.836 1.368 -0.077 555 2HG2 THR 74 HG22 THR 74 -9.280 2.437 -1.364 556 3HG2 THR 74 HG23 THR 74 -10.549 1.258 -1.708 557 H LEU 75 HN LEU 75 -10.982 -0.710 0.327 558 HA LEU 75 HA LEU 75 -12.775 -2.167 -1.586 559 1HB LEU 75 HB2 LEU 75 -11.899 -3.263 0.733 560 2HB LEU 75 HB3 LEU 75 -13.098 -2.184 1.417 561 HG LEU 75 HG LEU 75 -14.740 -3.274 -0.334 562 1HD1 LEU 75 HD11 LEU 75 -14.100 -5.643 -0.866 563 2HD1 LEU 75 HD12 LEU 75 -13.064 -4.465 -1.673 564 3HD1 LEU 75 HD13 LEU 75 -12.462 -5.349 -0.259 565 1HD2 LEU 75 HD21 LEU 75 -15.114 -5.169 1.317 566 2HD2 LEU 75 HD22 LEU 75 -13.613 -4.671 2.124 567 3HD2 LEU 75 HD23 LEU 75 -14.990 -3.559 2.037 568 H LEU 76 HN LEU 76 -14.382 -0.877 -2.217 569 HA LEU 76 HA LEU 76 -15.263 1.356 -0.499 570 1HB LEU 76 HB2 LEU 76 -15.431 1.331 -3.534 571 2HB LEU 76 HB3 LEU 76 -15.909 2.618 -2.442 572 HG LEU 76 HG LEU 76 -13.053 1.768 -3.132 573 1HD1 LEU 76 HD11 LEU 76 -14.596 4.336 -3.688 574 2HD1 LEU 76 HD12 LEU 76 -12.927 3.968 -4.173 575 3HD1 LEU 76 HD13 LEU 76 -14.271 3.050 -4.867 576 1HD2 LEU 76 HD21 LEU 76 -12.284 3.654 -1.792 577 2HD2 LEU 76 HD22 LEU 76 -13.948 4.030 -1.309 578 3HD2 LEU 76 HD23 LEU 76 -13.168 2.523 -0.759 579 H VAL 77 HN VAL 77 -17.187 0.635 0.328 580 HA VAL 77 HA VAL 77 -18.761 -1.353 -1.249 581 HB VAL 77 HB VAL 77 -19.325 -0.529 1.610 582 1HG1 VAL 77 HG11 VAL 77 -20.424 -2.702 1.710 583 2HG1 VAL 77 HG12 VAL 77 -21.072 -1.756 0.368 584 3HG1 VAL 77 HG13 VAL 77 -19.915 -3.066 0.044 585 1HG2 VAL 77 HG21 VAL 77 -17.415 -2.740 0.752 586 2HG2 VAL 77 HG22 VAL 77 -17.023 -1.320 1.742 587 3HG2 VAL 77 HG23 VAL 77 -18.102 -2.559 2.379 588 H LEU 78 HN LEU 78 -20.591 -0.597 -2.282 589 HA LEU 78 HA LEU 78 -21.504 2.164 -1.641 590 1HB LEU 78 HB2 LEU 78 -21.281 0.880 -4.403 591 2HB LEU 78 HB3 LEU 78 -21.932 2.463 -4.031 592 HG LEU 78 HG LEU 78 -19.428 2.683 -2.904 593 1HD1 LEU 78 HD11 LEU 78 -17.770 1.765 -4.406 594 2HD1 LEU 78 HD12 LEU 78 -18.802 0.431 -3.872 595 3HD1 LEU 78 HD13 LEU 78 -19.020 1.115 -5.485 596 1HD2 LEU 78 HD21 LEU 78 -18.835 4.042 -4.864 597 2HD2 LEU 78 HD22 LEU 78 -20.160 3.318 -5.794 598 3HD2 LEU 78 HD23 LEU 78 -20.510 4.336 -4.380 599 H LYS 79 HN LYS 79 -23.733 2.593 -2.207 600 HA LYS 79 HA LYS 79 -25.336 0.386 -3.135 601 1HB LYS 79 HB2 LYS 79 -27.036 0.502 -1.436 602 2HB LYS 79 HB3 LYS 79 -25.500 -0.018 -0.728 603 1HG LYS 79 HG2 LYS 79 -25.206 2.385 0.086 604 2HG LYS 79 HG3 LYS 79 -26.865 2.692 -0.436 605 1HD LYS 79 HD2 LYS 79 -25.996 0.602 1.612 606 2HD LYS 79 HD3 LYS 79 -26.749 2.169 1.972 607 1HE LYS 79 HE2 LYS 79 -28.793 1.506 0.848 608 2HE LYS 79 HE3 LYS 79 -28.053 -0.013 0.310 609 1HZ LYS 79 HZ1 LYS 79 -29.476 -0.293 2.260 610 2HZ LYS 79 HZ2 LYS 79 -27.946 -0.768 2.557 611 3HZ LYS 79 HZ3 LYS 79 -28.509 0.668 3.151 612 H ASP 80 HN ASP 80 -26.972 1.131 -4.358 613 HA ASP 80 HA ASP 80 -28.045 2.525 -5.714 614 1HB ASP 80 HB2 ASP 80 -29.400 2.379 -3.638 615 2HB ASP 80 HB3 ASP 80 -28.708 3.906 -3.092 616 H GLY 81 HN GLY 81 -25.261 3.335 -5.473 617 1HA GLY 81 HA2 GLY 81 -24.126 4.844 -6.742 618 2HA GLY 81 HA3 GLY 81 -25.494 5.971 -6.730 619 H GLU 82 HN GLU 82 -24.505 4.887 -3.583 620 HA GLU 82 HA GLU 82 -22.523 7.042 -3.305 621 1HB GLU 82 HB2 GLU 82 -23.509 7.840 -1.352 622 2HB GLU 82 HB3 GLU 82 -24.871 7.540 -2.448 623 1HG GLU 82 HG2 GLU 82 -25.342 5.412 -1.261 624 2HG GLU 82 HG3 GLU 82 -24.018 5.723 -0.143 625 H VAL 83 HN VAL 83 -20.865 6.658 -1.747 626 HA VAL 83 HA VAL 83 -20.223 3.850 -1.123 627 HB VAL 83 HB VAL 83 -18.875 6.458 -0.294 628 1HG1 VAL 83 HG11 VAL 83 -17.868 3.575 -0.215 629 2HG1 VAL 83 HG12 VAL 83 -16.914 5.014 0.187 630 3HG1 VAL 83 HG13 VAL 83 -18.285 4.566 1.198 631 1HG2 VAL 83 HG21 VAL 83 -18.122 4.524 -2.535 632 2HG2 VAL 83 HG22 VAL 83 -18.772 6.165 -2.767 633 3HG2 VAL 83 HG23 VAL 83 -17.191 5.930 -2.019 634 H VAL 84 HN VAL 84 -20.663 2.881 0.733 635 HA VAL 84 HA VAL 84 -22.016 4.422 2.890 636 HB VAL 84 HB VAL 84 -23.603 3.235 1.503 637 1HG1 VAL 84 HG11 VAL 84 -22.304 1.375 0.635 638 2HG1 VAL 84 HG12 VAL 84 -22.166 0.660 2.261 639 3HG1 VAL 84 HG13 VAL 84 -23.739 0.769 1.445 640 1HG2 VAL 84 HG21 VAL 84 -24.827 2.054 3.241 641 2HG2 VAL 84 HG22 VAL 84 -23.368 1.965 4.246 642 3HG2 VAL 84 HG23 VAL 84 -24.104 3.542 3.862 643 H GLU 85 HN GLU 85 -19.515 2.120 2.001 644 HA GLU 85 HA GLU 85 -18.428 2.470 4.635 645 1HB GLU 85 HB2 GLU 85 -19.467 -0.183 3.759 646 2HB GLU 85 HB3 GLU 85 -17.773 -0.224 4.247 647 1HG GLU 85 HG2 GLU 85 -20.063 0.891 5.863 648 2HG GLU 85 HG3 GLU 85 -19.328 -0.710 6.075 649 H THR 86 HN THR 86 -16.150 1.929 4.699 650 HA THR 86 HA THR 86 -14.782 1.771 2.092 651 HB THR 86 HB THR 86 -13.948 4.074 3.813 652 HG1 THR 86 HG1 THR 86 -16.121 4.523 3.833 653 1HG2 THR 86 HG21 THR 86 -13.538 5.084 1.616 654 2HG2 THR 86 HG22 THR 86 -12.876 3.435 1.659 655 3HG2 THR 86 HG23 THR 86 -14.432 3.748 0.843 656 H SER 87 HN SER 87 -12.816 0.683 2.410 657 HA SER 87 HA SER 87 -11.397 1.050 4.914 658 1HB SER 87 HB2 SER 87 -11.265 -1.352 5.468 659 2HB SER 87 HB3 SER 87 -12.904 -0.726 5.627 660 HG SER 87 HG SER 87 -13.410 -1.622 3.617 661 H VAL 88 HN VAL 88 -9.270 -0.019 4.842 662 HA VAL 88 HA VAL 88 -8.368 -0.945 2.226 663 HB VAL 88 HB VAL 88 -7.868 1.308 1.906 664 1HG1 VAL 88 HG11 VAL 88 -8.130 2.289 4.104 665 2HG1 VAL 88 HG12 VAL 88 -6.659 1.489 4.688 666 3HG1 VAL 88 HG13 VAL 88 -6.567 2.745 3.431 667 1HG2 VAL 88 HG21 VAL 88 -6.039 -0.220 1.318 668 2HG2 VAL 88 HG22 VAL 88 -5.430 1.367 1.787 669 3HG2 VAL 88 HG23 VAL 88 -5.307 0.009 2.922 670 H GLY 89 HN GLY 89 -7.602 -2.847 2.653 671 1HA GLY 89 HA2 GLY 89 -5.518 -3.755 3.963 672 2HA GLY 89 HA3 GLY 89 -6.566 -3.540 5.370 673 H PHE 90 HN PHE 90 -5.501 -6.056 4.425 674 HA PHE 90 HA PHE 90 -7.417 -7.508 2.907 675 1HB PHE 90 HB2 PHE 90 -5.095 -8.269 3.142 676 2HB PHE 90 HB3 PHE 90 -5.288 -8.430 4.879 677 HD1 PHE 90 HD1 PHE 90 -6.791 -9.706 1.650 678 HD2 PHE 90 HD2 PHE 90 -5.914 -10.514 5.801 679 HE1 PHE 90 HE1 PHE 90 -7.764 -11.978 1.428 680 HE2 PHE 90 HE2 PHE 90 -6.829 -12.803 5.545 681 HZ PHE 90 HZ PHE 90 -7.758 -13.538 3.357 682 H LYS 91 HN LYS 91 -9.098 -8.865 3.536 683 HA LYS 91 HA LYS 91 -9.657 -9.260 6.407 684 1HB LYS 91 HB2 LYS 91 -11.504 -7.977 4.396 685 2HB LYS 91 HB3 LYS 91 -12.195 -9.200 5.429 686 1HG LYS 91 HG2 LYS 91 -12.678 -7.316 6.639 687 2HG LYS 91 HG3 LYS 91 -11.197 -7.861 7.419 688 1HD LYS 91 HD2 LYS 91 -10.991 -5.505 7.160 689 2HD LYS 91 HD3 LYS 91 -9.948 -6.202 5.924 690 1HE LYS 91 HE2 LYS 91 -12.013 -5.942 4.329 691 2HE LYS 91 HE3 LYS 91 -12.678 -4.907 5.594 692 1HZ LYS 91 HZ1 LYS 91 -10.146 -4.486 4.099 693 2HZ LYS 91 HZ2 LYS 91 -11.513 -3.537 4.070 694 3HZ LYS 91 HZ3 LYS 91 -10.586 -3.597 5.406 695 HA PRO 92 HA PRO 92 -10.116 -13.362 4.544 696 1HB PRO 92 HB2 PRO 92 -11.318 -14.724 6.587 697 2HB PRO 92 HB3 PRO 92 -9.596 -14.234 6.642 698 1HG PRO 92 HG2 PRO 92 -11.984 -12.791 7.837 699 2HG PRO 92 HG3 PRO 92 -10.445 -13.230 8.647 700 1HD PRO 92 HD2 PRO 92 -10.806 -10.745 7.613 701 2HD PRO 92 HD3 PRO 92 -9.230 -11.567 7.471 702 H LYS 93 HN LYS 93 -11.979 -14.879 4.106 703 HA LYS 93 HA LYS 93 -13.924 -13.631 2.638 704 1HB LYS 93 HB2 LYS 93 -13.132 -16.221 3.038 705 2HB LYS 93 HB3 LYS 93 -14.669 -16.280 3.864 706 1HG LYS 93 HG2 LYS 93 -14.096 -15.637 0.952 707 2HG LYS 93 HG3 LYS 93 -14.874 -17.068 1.594 708 1HD LYS 93 HD2 LYS 93 -16.000 -14.277 1.332 709 2HD LYS 93 HD3 LYS 93 -16.523 -15.745 0.513 710 1HE LYS 93 HE2 LYS 93 -16.890 -15.026 3.461 711 2HE LYS 93 HE3 LYS 93 -18.129 -15.001 2.225 712 1HZ LYS 93 HZ1 LYS 93 -18.153 -17.340 2.147 713 2HZ LYS 93 HZ2 LYS 93 -16.784 -17.503 3.072 714 3HZ LYS 93 HZ3 LYS 93 -18.186 -16.910 3.702 715 H GLU 94 HN GLU 94 -14.367 -14.887 5.969 716 HA GLU 94 HA GLU 94 -17.117 -14.243 6.004 717 1HB GLU 94 HB2 GLU 94 -15.132 -14.680 8.282 718 2HB GLU 94 HB3 GLU 94 -16.891 -14.552 8.494 719 1HG GLU 94 HG2 GLU 94 -17.216 -16.521 7.007 720 2HG GLU 94 HG3 GLU 94 -15.469 -16.678 6.823 721 H ALA 95 HN ALA 95 -14.247 -12.441 7.241 722 HA ALA 95 HA ALA 95 -15.732 -10.342 8.473 723 1HB ALA 95 HB1 ALA 95 -13.320 -10.722 8.919 724 2HB ALA 95 HB2 ALA 95 -12.956 -10.299 7.224 725 3HB ALA 95 HB3 ALA 95 -13.609 -9.072 8.322 726 H LEU 96 HN LEU 96 -14.553 -10.873 5.160 727 HA LEU 96 HA LEU 96 -15.272 -8.261 4.264 728 1HB LEU 96 HB2 LEU 96 -13.745 -10.185 3.139 729 2HB LEU 96 HB3 LEU 96 -15.274 -10.616 2.380 730 HG LEU 96 HG LEU 96 -15.474 -8.081 1.749 731 1HD1 LEU 96 HD11 LEU 96 -12.516 -8.228 2.487 732 2HD1 LEU 96 HD12 LEU 96 -13.265 -6.897 1.604 733 3HD1 LEU 96 HD13 LEU 96 -13.723 -7.200 3.291 734 1HD2 LEU 96 HD21 LEU 96 -13.102 -9.529 0.531 735 2HD2 LEU 96 HD22 LEU 96 -14.805 -9.884 0.137 736 3HD2 LEU 96 HD23 LEU 96 -14.121 -8.284 -0.211 737 H GLN 97 HN GLN 97 -16.993 -11.404 4.102 738 HA GLN 97 HA GLN 97 -19.257 -10.339 2.730 739 1HB GLN 97 HB2 GLN 97 -20.120 -12.358 2.806 740 2HB GLN 97 HB3 GLN 97 -18.454 -12.816 3.124 741 1HG GLN 97 HG2 GLN 97 -19.008 -13.033 5.488 742 2HG GLN 97 HG3 GLN 97 -20.706 -12.627 5.126 743 1HE2 GLN 97 HE22 GLN 97 -21.633 -14.071 3.127 744 2HE2 GLN 97 HE21 GLN 97 -21.255 -15.779 3.270 745 H GLU 98 HN GLU 98 -18.398 -10.569 6.202 746 HA GLU 98 HA GLU 98 -20.908 -9.662 7.155 747 1HB GLU 98 HB2 GLU 98 -19.294 -10.718 8.604 748 2HB GLU 98 HB3 GLU 98 -18.131 -9.404 8.358 749 1HG GLU 98 HG2 GLU 98 -19.628 -7.819 9.477 750 2HG GLU 98 HG3 GLU 98 -20.886 -9.051 9.609 751 H LEU 99 HN LEU 99 -17.954 -7.845 6.248 752 HA LEU 99 HA LEU 99 -18.803 -5.312 7.053 753 1HB LEU 99 HB2 LEU 99 -16.507 -5.858 6.493 754 2HB LEU 99 HB3 LEU 99 -16.941 -6.134 4.804 755 HG LEU 99 HG LEU 99 -17.434 -3.772 4.468 756 1HD1 LEU 99 HD11 LEU 99 -16.771 -3.416 7.428 757 2HD1 LEU 99 HD12 LEU 99 -16.915 -2.090 6.250 758 3HD1 LEU 99 HD13 LEU 99 -18.326 -3.071 6.632 759 1HD2 LEU 99 HD21 LEU 99 -15.101 -4.619 4.273 760 2HD2 LEU 99 HD22 LEU 99 -15.167 -2.907 4.725 761 3HD2 LEU 99 HD23 LEU 99 -14.799 -4.137 5.955 762 H VAL 100 HN VAL 100 -19.416 -6.988 3.984 763 HA VAL 100 HA VAL 100 -20.858 -4.646 2.949 764 HB VAL 100 HB VAL 100 -19.583 -5.871 1.439 765 1HG1 VAL 100 HG11 VAL 100 -20.095 -8.106 0.614 766 2HG1 VAL 100 HG12 VAL 100 -19.769 -8.182 2.339 767 3HG1 VAL 100 HG13 VAL 100 -21.441 -8.270 1.763 768 1HG2 VAL 100 HG21 VAL 100 -22.501 -6.279 0.709 769 2HG2 VAL 100 HG22 VAL 100 -21.685 -4.707 0.704 770 3HG2 VAL 100 HG23 VAL 100 -21.124 -5.986 -0.376 771 H ASN 101 HN ASN 101 -21.738 -7.876 4.317 772 HA ASN 101 HA ASN 101 -24.507 -7.856 3.898 773 1HB ASN 101 HB2 ASN 101 -23.389 -9.807 4.714 774 2HB ASN 101 HB3 ASN 101 -22.875 -8.971 6.184 775 1HD2 ASN 101 HD21 ASN 101 -24.351 -8.700 7.900 776 2HD2 ASN 101 HD22 ASN 101 -25.955 -9.389 7.884 777 H LYS 102 HN LYS 102 -22.621 -6.099 6.319 778 HA LYS 102 HA LYS 102 -24.665 -5.251 8.079 779 1HB LYS 102 HB2 LYS 102 -22.016 -4.122 7.159 780 2HB LYS 102 HB3 LYS 102 -23.037 -3.182 8.249 781 1HG LYS 102 HG2 LYS 102 -22.830 -4.638 10.015 782 2HG LYS 102 HG3 LYS 102 -22.450 -6.036 9.004 783 1HD LYS 102 HD2 LYS 102 -20.529 -5.170 10.400 784 2HD LYS 102 HD3 LYS 102 -20.228 -5.372 8.686 785 1HE LYS 102 HE2 LYS 102 -19.202 -3.329 9.268 786 2HE LYS 102 HE3 LYS 102 -20.645 -2.937 8.328 787 1HZ LYS 102 HZ1 LYS 102 -21.773 -2.407 10.431 788 2HZ LYS 102 HZ2 LYS 102 -20.429 -2.778 11.286 789 3HZ LYS 102 HZ3 LYS 102 -20.425 -1.509 10.267 790 H HIS 103 HN HIS 103 -24.067 -4.185 4.775 791 HA HIS 103 HA HIS 103 -26.086 -1.999 5.119 792 1HB HIS 103 HB2 HIS 103 -23.613 -1.951 3.352 793 2HB HIS 103 HB3 HIS 103 -24.763 -0.636 3.605 794 HD1 HIS 103 HD1 HIS 103 -24.784 0.354 6.269 795 HD2 HIS 103 HD2 HIS 103 -21.678 -2.249 5.117 796 HE1 HIS 103 HE1 HIS 103 -23.041 0.458 8.119 797 H LEU 104 HN LEU 104 -25.162 -4.794 3.386 798 HA LEU 104 HA LEU 104 -26.623 -4.510 0.926 799 1HB LEU 104 HB2 LEU 104 -24.856 -6.051 1.049 800 2HB LEU 104 HB3 LEU 104 -25.442 -6.686 2.588 801 HG LEU 104 HG LEU 104 -27.293 -7.797 1.561 802 1HD1 LEU 104 HD11 LEU 104 -27.529 -7.901 -0.901 803 2HD1 LEU 104 HD12 LEU 104 -27.670 -6.226 -0.386 804 3HD1 LEU 104 HD13 LEU 104 -26.153 -6.800 -1.110 805 1HD2 LEU 104 HD21 LEU 104 -25.189 -8.964 1.797 806 2HD2 LEU 104 HD22 LEU 104 -25.996 -9.484 0.319 807 3HD2 LEU 104 HD23 LEU 104 -24.623 -8.354 0.228 808 1H MET 1 H1 MET 1 9.721 27.858 -10.098 809 2H MET 1 H2 MET 1 9.386 29.458 -10.083 810 3H MET 1 H3 MET 1 9.203 28.605 -11.473 811 HA MET 1 HA MET 1 7.057 29.047 -10.502 812 1HB MET 1 HB2 MET 1 7.900 26.129 -10.232 813 2HB MET 1 HB3 MET 1 6.235 26.705 -10.180 814 1HG MET 1 HG2 MET 1 6.475 27.615 -12.481 815 2HG MET 1 HG3 MET 1 8.113 26.950 -12.559 816 1HE MET 1 HE1 MET 1 5.880 26.403 -14.748 817 2HE MET 1 HE2 MET 1 7.526 25.732 -14.821 818 3HE MET 1 HE3 MET 1 6.121 24.665 -15.035 819 H GLU 2 HN GLU 2 5.839 29.370 -8.651 820 HA GLU 2 HA GLU 2 7.198 29.200 -6.081 821 1HB GLU 2 HB2 GLU 2 5.775 31.094 -6.762 822 2HB GLU 2 HB3 GLU 2 4.362 30.030 -6.783 823 1HG GLU 2 HG2 GLU 2 4.689 29.590 -4.347 824 2HG GLU 2 HG3 GLU 2 6.121 30.619 -4.358 825 H ASN 3 HN ASN 3 7.576 26.974 -5.985 826 HA ASN 3 HA ASN 3 7.396 25.072 -4.997 827 1HB ASN 3 HB2 ASN 3 4.471 25.443 -4.354 828 2HB ASN 3 HB3 ASN 3 5.592 24.282 -3.672 829 1HD2 ASN 3 HD22 ASN 3 7.615 25.388 -2.456 830 2HD2 ASN 3 HD21 ASN 3 7.280 26.906 -1.665 831 H LYS 4 HN LYS 4 7.476 23.367 -5.768 832 HA LYS 4 HA LYS 4 5.525 22.166 -7.630 833 1HB LYS 4 HB2 LYS 4 8.572 21.954 -7.698 834 2HB LYS 4 HB3 LYS 4 7.464 21.050 -8.749 835 1HG LYS 4 HG2 LYS 4 6.593 23.167 -9.690 836 2HG LYS 4 HG3 LYS 4 7.655 24.108 -8.643 837 1HD LYS 4 HD2 LYS 4 8.511 22.249 -10.853 838 2HD LYS 4 HD3 LYS 4 8.544 24.030 -10.821 839 1HE LYS 4 HE2 LYS 4 10.064 23.705 -8.705 840 2HE LYS 4 HE3 LYS 4 10.314 22.076 -9.344 841 1HZ LYS 4 HZ1 LYS 4 12.018 23.458 -10.190 842 2HZ LYS 4 HZ2 LYS 4 11.012 23.245 -11.464 843 3HZ LYS 4 HZ3 LYS 4 10.982 24.661 -10.597 844 H ILE 5 HN ILE 5 4.802 20.220 -6.755 845 HA ILE 5 HA ILE 5 5.849 19.792 -4.031 846 HB ILE 5 HB ILE 5 3.224 19.008 -5.312 847 1HG1 ILE 5 HG12 ILE 5 4.187 21.277 -3.568 848 2HG1 ILE 5 HG13 ILE 5 3.209 21.329 -5.024 849 1HG2 ILE 5 HG21 ILE 5 3.920 17.352 -3.582 850 2HG2 ILE 5 HG22 ILE 5 4.157 18.705 -2.434 851 3HG2 ILE 5 HG23 ILE 5 2.534 18.287 -3.063 852 1HD1 ILE 5 HD11 ILE 5 2.319 20.468 -2.251 853 2HD1 ILE 5 HD12 ILE 5 1.890 21.954 -3.115 854 3HD1 ILE 5 HD13 ILE 5 1.296 20.378 -3.707 855 H ILE 6 HN ILE 6 6.532 17.891 -3.226 856 HA ILE 6 HA ILE 6 6.834 15.527 -4.949 857 HB ILE 6 HB ILE 6 8.711 16.756 -5.603 858 1HG1 ILE 6 HG12 ILE 6 9.001 14.288 -4.928 859 2HG1 ILE 6 HG13 ILE 6 10.365 15.254 -5.405 860 1HG2 ILE 6 HG21 ILE 6 10.477 17.675 -4.068 861 2HG2 ILE 6 HG22 ILE 6 8.936 18.511 -4.014 862 3HG2 ILE 6 HG23 ILE 6 9.365 17.381 -2.717 863 1HD1 ILE 6 HD11 ILE 6 9.672 14.528 -2.523 864 2HD1 ILE 6 HD12 ILE 6 10.987 13.884 -3.512 865 3HD1 ILE 6 HD13 ILE 6 11.029 15.563 -3.011 866 H TYR 7 HN TYR 7 7.230 13.598 -3.672 867 HA TYR 7 HA TYR 7 6.619 13.938 -0.771 868 1HB TYR 7 HB2 TYR 7 4.840 13.145 -2.907 869 2HB TYR 7 HB3 TYR 7 5.177 11.723 -1.960 870 HD1 TYR 7 HD1 TYR 7 3.503 14.950 -2.049 871 HD2 TYR 7 HD2 TYR 7 4.642 11.670 0.507 872 HE1 TYR 7 HE1 TYR 7 1.795 15.620 -0.418 873 HE2 TYR 7 HE2 TYR 7 2.942 12.361 2.157 874 HH TYR 7 HH TYR 7 1.230 13.869 2.668 875 H PHE 8 HN PHE 8 7.036 12.096 0.529 876 HA PHE 8 HA PHE 8 8.645 9.894 -0.692 877 1HB PHE 8 HB2 PHE 8 8.632 10.854 2.185 878 2HB PHE 8 HB3 PHE 8 9.611 9.549 1.532 879 HD1 PHE 8 HD1 PHE 8 11.315 10.191 -0.373 880 HD2 PHE 8 HD2 PHE 8 9.591 13.007 2.387 881 HE1 PHE 8 HE1 PHE 8 13.002 11.861 -1.020 882 HE2 PHE 8 HE2 PHE 8 11.358 14.616 1.837 883 HZ PHE 8 HZ PHE 8 13.069 14.080 0.150 884 H LEU 9 HN LEU 9 7.878 7.761 -0.225 885 HA LEU 9 HA LEU 9 5.638 7.535 1.716 886 1HB LEU 9 HB2 LEU 9 5.792 6.424 -1.100 887 2HB LEU 9 HB3 LEU 9 4.859 5.611 0.145 888 HG LEU 9 HG LEU 9 4.414 8.472 -0.787 889 1HD1 LEU 9 HD11 LEU 9 3.721 6.479 -2.315 890 2HD1 LEU 9 HD12 LEU 9 2.470 6.178 -1.090 891 3HD1 LEU 9 HD13 LEU 9 2.511 7.722 -1.942 892 1HD2 LEU 9 HD21 LEU 9 3.683 8.405 1.505 893 2HD2 LEU 9 HD22 LEU 9 2.228 8.241 0.528 894 3HD2 LEU 9 HD23 LEU 9 2.936 6.803 1.303 895 H SER 10 HN SER 10 6.008 6.129 3.235 896 HA SER 10 HA SER 10 8.144 4.119 3.128 897 1HB SER 10 HB2 SER 10 8.152 6.626 4.877 898 2HB SER 10 HB3 SER 10 9.219 5.248 5.118 899 HG SER 10 HG SER 10 9.585 7.341 3.611 900 H THR 11 HN THR 11 7.540 2.476 4.559 901 HA THR 11 HA THR 11 5.102 2.272 5.732 902 HB THR 11 HB THR 11 7.634 0.953 6.737 903 HG1 THR 11 HG1 THR 11 7.304 -0.511 5.061 904 1HG2 THR 11 HG21 THR 11 6.208 -0.896 7.337 905 2HG2 THR 11 HG22 THR 11 5.531 0.545 8.074 906 3HG2 THR 11 HG23 THR 11 4.782 -0.108 6.603 907 H GLY 12 HN GLY 12 4.140 3.342 7.307 908 1HA GLY 12 HA2 GLY 12 3.702 4.338 9.332 909 2HA GLY 12 HA3 GLY 12 5.170 3.574 9.958 910 H ASN 13 HN ASN 13 5.974 5.439 7.275 911 HA ASN 13 HA ASN 13 7.582 7.029 7.153 912 1HB ASN 13 HB2 ASN 13 5.200 7.952 6.783 913 2HB ASN 13 HB3 ASN 13 5.456 8.828 8.296 914 1HD2 ASN 13 HD22 ASN 13 7.244 10.464 8.312 915 2HD2 ASN 13 HD21 ASN 13 7.482 11.290 6.777 916 H SER 14 HN SER 14 8.148 5.673 9.537 917 HA SER 14 HA SER 14 8.252 7.475 11.773 918 1HB SER 14 HB2 SER 14 9.490 5.428 12.740 919 2HB SER 14 HB3 SER 14 7.815 5.200 12.208 920 HG SER 14 HG SER 14 9.177 3.534 11.438 921 H ALA 15 HN ALA 15 10.649 6.128 9.515 922 HA ALA 15 HA ALA 15 12.718 7.950 10.665 923 1HB ALA 15 HB1 ALA 15 13.005 5.615 11.423 924 2HB ALA 15 HB2 ALA 15 13.000 5.040 9.749 925 3HB ALA 15 HB3 ALA 15 14.316 6.080 10.320 926 H ARG 16 HN ARG 16 12.111 5.867 7.807 927 HA ARG 16 HA ARG 16 14.175 6.668 6.207 928 1HB ARG 16 HB2 ARG 16 11.356 6.081 5.234 929 2HB ARG 16 HB3 ARG 16 12.818 5.932 4.262 930 1HG ARG 16 HG2 ARG 16 13.562 4.036 5.605 931 2HG ARG 16 HG3 ARG 16 12.239 4.279 6.754 932 1HD ARG 16 HD2 ARG 16 10.743 3.944 4.546 933 2HD ARG 16 HD3 ARG 16 12.175 3.073 4.005 934 HE ARG 16 HE ARG 16 11.755 2.120 6.553 935 1HH1 ARG 16 HH11 ARG 16 9.720 2.170 3.621 936 2HH1 ARG 16 HH12 ARG 16 8.751 0.807 4.140 937 1HH2 ARG 16 HH21 ARG 16 10.712 0.091 6.960 938 2HH2 ARG 16 HH22 ARG 16 9.446 -0.472 5.891 939 H SER 17 HN SER 17 10.872 8.105 5.861 940 HA SER 17 HA SER 17 11.791 10.115 4.091 941 1HB SER 17 HB2 SER 17 9.314 10.288 5.779 942 2HB SER 17 HB3 SER 17 9.609 10.942 4.159 943 HG SER 17 HG SER 17 8.313 8.938 4.450 944 H GLN 18 HN GLN 18 11.534 10.099 7.627 945 HA GLN 18 HA GLN 18 11.480 12.877 8.130 946 1HB GLN 18 HB2 GLN 18 13.075 10.801 9.657 947 2HB GLN 18 HB3 GLN 18 12.594 12.361 10.244 948 1HG GLN 18 HG2 GLN 18 10.698 10.058 9.590 949 2HG GLN 18 HG3 GLN 18 11.262 10.540 11.185 950 1HE2 GLN 18 HE22 GLN 18 8.411 10.418 10.463 951 2HE2 GLN 18 HE21 GLN 18 7.827 12.047 10.687 952 H MET 19 HN MET 19 14.191 10.605 7.567 953 HA MET 19 HA MET 19 16.114 12.691 7.808 954 1HB MET 19 HB2 MET 19 17.650 11.066 7.784 955 2HB MET 19 HB3 MET 19 16.292 10.021 8.058 956 1HG MET 19 HG2 MET 19 16.333 9.218 5.812 957 2HG MET 19 HG3 MET 19 17.308 10.581 5.256 958 1HE MET 19 HE1 MET 19 18.999 7.046 7.639 959 2HE MET 19 HE2 MET 19 17.807 8.151 8.379 960 3HE MET 19 HE3 MET 19 17.343 7.143 6.977 961 H ALA 20 HN ALA 20 14.516 11.103 4.979 962 HA ALA 20 HA ALA 20 16.043 12.405 2.987 963 1HB ALA 20 HB1 ALA 20 13.210 11.419 2.739 964 2HB ALA 20 HB2 ALA 20 14.361 11.810 1.433 965 3HB ALA 20 HB3 ALA 20 14.710 10.463 2.511 966 H GLU 21 HN GLU 21 13.034 13.488 4.621 967 HA GLU 21 HA GLU 21 12.836 15.774 2.923 968 1HB GLU 21 HB2 GLU 21 11.003 16.460 4.172 969 2HB GLU 21 HB3 GLU 21 10.946 14.695 4.147 970 1HG GLU 21 HG2 GLU 21 11.832 14.629 6.443 971 2HG GLU 21 HG3 GLU 21 11.875 16.397 6.471 972 H GLY 22 HN GLY 22 14.572 15.197 5.985 973 1HA GLY 22 HA2 GLY 22 15.458 17.906 6.364 974 2HA GLY 22 HA3 GLY 22 16.272 16.427 6.915 975 H TRP 23 HN TRP 23 16.976 15.090 4.680 976 HA TRP 23 HA TRP 23 19.223 16.379 3.573 977 1HB TRP 23 HB2 TRP 23 17.560 13.959 2.847 978 2HB TRP 23 HB3 TRP 23 18.758 14.535 1.706 979 HD1 TRP 23 HD1 TRP 23 18.454 12.318 4.601 980 HE1 TRP 23 HE1 TRP 23 20.718 11.560 5.462 981 HE3 TRP 23 HE3 TRP 23 21.392 15.514 1.949 982 HZ2 TRP 23 HZ2 TRP 23 23.510 12.296 5.089 983 HZ3 TRP 23 HZ3 TRP 23 23.870 15.443 2.168 984 HH2 TRP 23 HH2 TRP 23 24.934 13.827 3.719 985 H ALA 24 HN ALA 24 15.876 16.266 2.405 986 HA ALA 24 HA ALA 24 16.455 17.235 -0.192 987 1HB ALA 24 HB1 ALA 24 13.911 17.636 -0.203 988 2HB ALA 24 HB2 ALA 24 14.401 15.989 0.260 989 3HB ALA 24 HB3 ALA 24 13.890 17.172 1.485 990 H LYS 25 HN LYS 25 15.047 18.922 2.737 991 HA LYS 25 HA LYS 25 14.538 21.259 1.238 992 1HB LYS 25 HB2 LYS 25 14.629 20.724 4.219 993 2HB LYS 25 HB3 LYS 25 14.368 22.359 3.589 994 1HG LYS 25 HG2 LYS 25 12.471 21.537 2.201 995 2HG LYS 25 HG3 LYS 25 12.664 19.928 2.935 996 1HD LYS 25 HD2 LYS 25 12.234 20.882 5.171 997 2HD LYS 25 HD3 LYS 25 12.075 22.501 4.461 998 1HE LYS 25 HE2 LYS 25 10.104 21.743 3.135 999 2HE LYS 25 HE3 LYS 25 10.282 20.113 3.793 1000 1HZ LYS 25 HZ1 LYS 25 9.664 22.528 5.396 1001 2HZ LYS 25 HZ2 LYS 25 8.603 21.361 4.987 1002 3HZ LYS 25 HZ3 LYS 25 9.830 21.020 6.000 1003 H GLN 26 HN GLN 26 17.518 20.330 2.875 1004 HA GLN 26 HA GLN 26 18.681 22.920 2.826 1005 1HB GLN 26 HB2 GLN 26 20.869 21.719 2.869 1006 2HB GLN 26 HB3 GLN 26 19.756 21.198 4.135 1007 1HG GLN 26 HG2 GLN 26 19.409 19.113 3.211 1008 2HG GLN 26 HG3 GLN 26 19.606 19.681 1.563 1009 1HE2 GLN 26 HE22 GLN 26 20.703 17.665 1.339 1010 2HE2 GLN 26 HE21 GLN 26 22.439 17.608 1.661 1011 H TYR 27 HN TYR 27 17.878 20.877 0.138 1012 HA TYR 27 HA TYR 27 19.545 22.559 -1.665 1013 1HB TYR 27 HB2 TYR 27 19.394 19.604 -1.345 1014 2HB TYR 27 HB3 TYR 27 19.195 20.133 -2.992 1015 HD1 TYR 27 HD1 TYR 27 20.996 21.052 -4.296 1016 HD2 TYR 27 HD2 TYR 27 21.542 20.175 -0.112 1017 HE1 TYR 27 HE1 TYR 27 23.440 21.304 -4.571 1018 HE2 TYR 27 HE2 TYR 27 23.990 20.439 -0.365 1019 HH TYR 27 HH TYR 27 25.524 21.233 -3.520 1020 H LEU 28 HN LEU 28 16.372 21.617 -0.874 1021 HA LEU 28 HA LEU 28 15.314 22.271 -3.575 1022 1HB LEU 28 HB2 LEU 28 14.370 20.258 -1.502 1023 2HB LEU 28 HB3 LEU 28 13.382 20.775 -2.855 1024 HG LEU 28 HG LEU 28 16.155 19.637 -3.336 1025 1HD1 LEU 28 HD11 LEU 28 13.578 18.056 -3.018 1026 2HD1 LEU 28 HD12 LEU 28 15.136 17.441 -3.659 1027 3HD1 LEU 28 HD13 LEU 28 15.052 17.997 -2.004 1028 1HD2 LEU 28 HD21 LEU 28 15.062 20.721 -5.264 1029 2HD2 LEU 28 HD22 LEU 28 15.156 18.971 -5.508 1030 3HD2 LEU 28 HD23 LEU 28 13.618 19.705 -5.030 1031 H GLY 29 HN GLY 29 15.397 24.414 -2.890 1032 1HA GLY 29 HA2 GLY 29 14.190 25.546 -0.555 1033 2HA GLY 29 HA3 GLY 29 14.702 26.392 -2.022 1034 H ASP 30 HN ASP 30 12.730 27.709 -1.576 1035 HA ASP 30 HA ASP 30 10.123 26.642 -1.538 1036 1HB ASP 30 HB2 ASP 30 10.826 28.869 -0.675 1037 2HB ASP 30 HB3 ASP 30 10.983 29.440 -2.340 1038 H GLU 31 HN GLU 31 12.179 26.850 -4.199 1039 HA GLU 31 HA GLU 31 10.312 27.079 -6.416 1040 1HB GLU 31 HB2 GLU 31 12.767 27.333 -6.564 1041 2HB GLU 31 HB3 GLU 31 12.960 25.657 -6.059 1042 1HG GLU 31 HG2 GLU 31 13.214 25.708 -8.418 1043 2HG GLU 31 HG3 GLU 31 11.678 24.936 -8.032 1044 H TRP 32 HN TRP 32 10.900 24.692 -3.966 1045 HA TRP 32 HA TRP 32 9.166 22.686 -5.291 1046 1HB TRP 32 HB2 TRP 32 11.520 22.127 -3.478 1047 2HB TRP 32 HB3 TRP 32 10.581 20.965 -4.407 1048 HD1 TRP 32 HD1 TRP 32 13.344 23.550 -4.739 1049 HE1 TRP 32 HE1 TRP 32 14.582 23.271 -6.961 1050 HE3 TRP 32 HE3 TRP 32 10.275 20.086 -6.931 1051 HZ2 TRP 32 HZ2 TRP 32 14.299 21.736 -9.366 1052 HZ3 TRP 32 HZ3 TRP 32 10.785 19.234 -9.207 1053 HH2 TRP 32 HH2 TRP 32 12.790 20.042 -10.436 1054 H LYS 33 HN LYS 33 8.398 21.099 -3.456 1055 HA LYS 33 HA LYS 33 8.456 22.177 -0.773 1056 1HB LYS 33 HB2 LYS 33 6.428 23.266 -2.010 1057 2HB LYS 33 HB3 LYS 33 5.742 21.641 -2.069 1058 1HG LYS 33 HG2 LYS 33 4.750 22.761 -0.297 1059 2HG LYS 33 HG3 LYS 33 5.899 21.617 0.469 1060 1HD LYS 33 HD2 LYS 33 7.474 23.488 0.863 1061 2HD LYS 33 HD3 LYS 33 6.346 24.606 0.059 1062 1HE LYS 33 HE2 LYS 33 4.588 23.982 1.727 1063 2HE LYS 33 HE3 LYS 33 5.755 22.950 2.555 1064 1HZ LYS 33 HZ1 LYS 33 5.993 25.893 2.240 1065 2HZ LYS 33 HZ2 LYS 33 5.589 25.116 3.611 1066 3HZ LYS 33 HZ3 LYS 33 7.090 24.946 3.001 1067 H VAL 34 HN VAL 34 8.600 20.368 0.556 1068 HA VAL 34 HA VAL 34 8.012 17.774 -0.721 1069 HB VAL 34 HB VAL 34 10.322 18.488 -0.729 1070 1HG1 VAL 34 HG11 VAL 34 11.697 18.538 1.279 1071 2HG1 VAL 34 HG12 VAL 34 10.483 19.823 1.289 1072 3HG1 VAL 34 HG13 VAL 34 10.255 18.368 2.300 1073 1HG2 VAL 34 HG21 VAL 34 11.276 16.394 0.089 1074 2HG2 VAL 34 HG22 VAL 34 9.832 16.106 1.095 1075 3HG2 VAL 34 HG23 VAL 34 9.707 16.084 -0.671 1076 H TYR 35 HN TYR 35 7.183 16.139 0.458 1077 HA TYR 35 HA TYR 35 6.234 16.615 3.233 1078 1HB TYR 35 HB2 TYR 35 4.589 15.829 0.813 1079 2HB TYR 35 HB3 TYR 35 4.009 15.752 2.471 1080 HD1 TYR 35 HD1 TYR 35 3.408 17.786 3.717 1081 HD2 TYR 35 HD2 TYR 35 4.801 17.962 -0.360 1082 HE1 TYR 35 HE1 TYR 35 2.532 20.093 3.530 1083 HE2 TYR 35 HE2 TYR 35 3.918 20.274 -0.562 1084 HH TYR 35 HH TYR 35 2.243 21.944 2.143 1085 H SER 36 HN SER 36 5.250 14.434 4.041 1086 HA SER 36 HA SER 36 6.257 12.052 2.671 1087 1HB SER 36 HB2 SER 36 7.555 11.342 4.561 1088 2HB SER 36 HB3 SER 36 8.179 12.880 3.985 1089 HG SER 36 HG SER 36 7.990 13.557 5.933 1090 H ALA 37 HN ALA 37 5.196 10.106 3.456 1091 HA ALA 37 HA ALA 37 3.338 10.254 5.645 1092 1HB ALA 37 HB1 ALA 37 2.228 10.065 2.802 1093 2HB ALA 37 HB2 ALA 37 1.319 9.796 4.302 1094 3HB ALA 37 HB3 ALA 37 1.944 11.398 3.960 1095 H GLY 38 HN GLY 38 1.953 8.133 5.656 1096 1HA GLY 38 HA2 GLY 38 2.829 5.924 4.085 1097 2HA GLY 38 HA3 GLY 38 3.604 5.880 5.672 1098 H ILE 39 HN ILE 39 2.230 3.816 5.297 1099 HA ILE 39 HA ILE 39 -0.407 3.457 5.331 1100 HB ILE 39 HB ILE 39 0.863 1.611 5.202 1101 1HG1 ILE 39 HG12 ILE 39 -0.233 1.173 7.999 1102 2HG1 ILE 39 HG13 ILE 39 -1.285 1.465 6.628 1103 1HG2 ILE 39 HG21 ILE 39 2.911 2.263 6.356 1104 2HG2 ILE 39 HG22 ILE 39 2.118 2.074 7.929 1105 3HG2 ILE 39 HG23 ILE 39 2.377 0.670 6.887 1106 1HD1 ILE 39 HD11 ILE 39 0.592 -0.870 6.975 1107 2HD1 ILE 39 HD12 ILE 39 -1.188 -0.858 6.859 1108 3HD1 ILE 39 HD13 ILE 39 -0.211 -0.458 5.437 1109 H GLU 40 HN GLU 40 1.278 3.811 8.453 1110 HA GLU 40 HA GLU 40 -1.223 4.737 9.768 1111 1HB GLU 40 HB2 GLU 40 -0.674 3.270 11.680 1112 2HB GLU 40 HB3 GLU 40 -1.101 2.386 10.226 1113 1HG GLU 40 HG2 GLU 40 1.158 1.661 9.847 1114 2HG GLU 40 HG3 GLU 40 1.813 2.827 10.988 1115 H ALA 41 HN ALA 41 0.908 6.190 8.660 1116 HA ALA 41 HA ALA 41 3.107 6.654 10.362 1117 1HB ALA 41 HB1 ALA 41 1.850 8.038 7.975 1118 2HB ALA 41 HB2 ALA 41 3.342 8.632 8.706 1119 3HB ALA 41 HB3 ALA 41 3.281 6.993 7.992 1120 H HIS 42 HN HIS 42 3.588 8.049 11.813 1121 HA HIS 42 HA HIS 42 3.101 10.680 12.070 1122 1HB HIS 42 HB2 HIS 42 1.342 8.989 13.997 1123 2HB HIS 42 HB3 HIS 42 1.886 10.603 14.394 1124 HD1 HIS 42 HD1 HIS 42 0.897 12.470 12.239 1125 HD2 HIS 42 HD2 HIS 42 -1.144 9.002 13.479 1126 HE1 HIS 42 HE1 HIS 42 -1.575 12.888 11.787 1127 H GLY 43 HN GLY 43 5.227 10.850 12.836 1128 1HA GLY 43 HA2 GLY 43 6.044 9.821 15.377 1129 2HA GLY 43 HA3 GLY 43 6.501 8.713 14.066 1130 H LEU 44 HN LEU 44 8.523 9.570 15.353 1131 HA LEU 44 HA LEU 44 10.126 10.773 13.342 1132 1HB LEU 44 HB2 LEU 44 9.418 12.909 14.317 1133 2HB LEU 44 HB3 LEU 44 9.766 12.328 15.946 1134 HG LEU 44 HG LEU 44 12.192 12.175 15.373 1135 1HD1 LEU 44 HD11 LEU 44 11.270 13.251 12.682 1136 2HD1 LEU 44 HD12 LEU 44 12.943 13.355 13.244 1137 3HD1 LEU 44 HD13 LEU 44 12.209 11.771 13.005 1138 1HD2 LEU 44 HD21 LEU 44 12.646 14.537 15.374 1139 2HD2 LEU 44 HD22 LEU 44 11.038 14.903 14.742 1140 3HD2 LEU 44 HD23 LEU 44 11.223 14.228 16.376 1141 H ASN 45 HN ASN 45 11.151 8.743 13.486 1142 HA ASN 45 HA ASN 45 11.843 7.477 15.956 1143 1HB ASN 45 HB2 ASN 45 11.610 6.372 13.720 1144 2HB ASN 45 HB3 ASN 45 13.116 7.143 13.209 1145 1HD2 ASN 45 HD22 ASN 45 12.601 4.242 13.338 1146 2HD2 ASN 45 HD21 ASN 45 13.718 3.604 14.509 1147 HA PRO 46 HA PRO 46 15.215 10.332 16.861 1148 1HB PRO 46 HB2 PRO 46 16.543 8.904 18.838 1149 2HB PRO 46 HB3 PRO 46 15.085 9.911 19.086 1150 1HG PRO 46 HG2 PRO 46 15.235 6.919 18.643 1151 2HG PRO 46 HG3 PRO 46 14.283 7.813 19.874 1152 1HD PRO 46 HD2 PRO 46 13.133 6.937 17.602 1153 2HD PRO 46 HD3 PRO 46 12.718 8.551 18.245 1154 H ASN 47 HN ASN 47 15.664 6.983 15.753 1155 HA ASN 47 HA ASN 47 18.473 7.130 15.249 1156 1HB ASN 47 HB2 ASN 47 18.150 5.110 14.387 1157 2HB ASN 47 HB3 ASN 47 16.533 5.175 15.023 1158 1HD2 ASN 47 HD22 ASN 47 18.468 4.949 12.209 1159 2HD2 ASN 47 HD21 ASN 47 17.185 5.122 11.016 1160 H ALA 48 HN ALA 48 15.600 8.321 13.438 1161 HA ALA 48 HA ALA 48 17.144 8.964 11.086 1162 1HB ALA 48 HB1 ALA 48 14.356 9.909 11.956 1163 2HB ALA 48 HB2 ALA 48 15.075 10.092 10.346 1164 3HB ALA 48 HB3 ALA 48 14.756 8.470 10.988 1165 H VAL 49 HN VAL 49 16.010 10.635 14.003 1166 HA VAL 49 HA VAL 49 16.913 13.274 13.350 1167 HB VAL 49 HB VAL 49 16.879 12.007 16.125 1168 1HG1 VAL 49 HG11 VAL 49 16.752 14.924 15.234 1169 2HG1 VAL 49 HG12 VAL 49 16.593 14.341 16.903 1170 3HG1 VAL 49 HG13 VAL 49 18.123 14.135 16.043 1171 1HG2 VAL 49 HG21 VAL 49 14.692 13.564 14.696 1172 2HG2 VAL 49 HG22 VAL 49 14.635 11.828 15.053 1173 3HG2 VAL 49 HG23 VAL 49 14.640 12.996 16.376 1174 H LYS 50 HN LYS 50 18.624 10.552 15.024 1175 HA LYS 50 HA LYS 50 21.154 11.812 15.142 1176 1HB LYS 50 HB2 LYS 50 20.647 9.801 16.395 1177 2HB LYS 50 HB3 LYS 50 20.403 8.865 14.915 1178 1HG LYS 50 HG2 LYS 50 22.750 9.050 14.316 1179 2HG LYS 50 HG3 LYS 50 23.051 10.173 15.658 1180 1HD LYS 50 HD2 LYS 50 22.557 8.423 17.291 1181 2HD LYS 50 HD3 LYS 50 22.117 7.285 15.995 1182 1HE LYS 50 HE2 LYS 50 24.380 7.327 15.102 1183 2HE LYS 50 HE3 LYS 50 24.851 8.611 16.226 1184 1HZ LYS 50 HZ1 LYS 50 24.107 5.854 17.020 1185 2HZ LYS 50 HZ2 LYS 50 25.620 6.475 17.005 1186 3HZ LYS 50 HZ3 LYS 50 24.517 7.052 18.056 1187 H ALA 51 HN ALA 51 19.730 9.778 12.541 1188 HA ALA 51 HA ALA 51 21.892 9.727 10.812 1189 1HB ALA 51 HB1 ALA 51 18.958 9.888 10.027 1190 2HB ALA 51 HB2 ALA 51 20.285 9.225 9.063 1191 3HB ALA 51 HB3 ALA 51 19.793 8.415 10.567 1192 H MET 52 HN MET 52 19.767 12.524 11.494 1193 HA MET 52 HA MET 52 20.919 13.998 9.199 1194 1HB MET 52 HB2 MET 52 18.596 14.649 11.060 1195 2HB MET 52 HB3 MET 52 19.150 15.636 9.703 1196 1HG MET 52 HG2 MET 52 17.866 12.916 9.586 1197 2HG MET 52 HG3 MET 52 17.296 14.431 8.901 1198 1HE MET 52 HE1 MET 52 18.475 15.661 6.996 1199 2HE MET 52 HE2 MET 52 20.168 15.457 7.542 1200 3HE MET 52 HE3 MET 52 19.703 14.986 5.896 1201 H LYS 53 HN LYS 53 20.820 14.075 12.785 1202 HA LYS 53 HA LYS 53 22.362 16.474 13.052 1203 1HB LYS 53 HB2 LYS 53 22.292 13.956 14.784 1204 2HB LYS 53 HB3 LYS 53 23.046 15.476 15.268 1205 1HG LYS 53 HG2 LYS 53 20.098 15.298 14.600 1206 2HG LYS 53 HG3 LYS 53 20.747 14.951 16.204 1207 1HD LYS 53 HD2 LYS 53 21.657 17.242 16.368 1208 2HD LYS 53 HD3 LYS 53 21.140 17.572 14.704 1209 1HE LYS 53 HE2 LYS 53 19.434 18.509 16.029 1210 2HE LYS 53 HE3 LYS 53 18.793 16.993 15.388 1211 1HZ LYS 53 HZ1 LYS 53 19.740 17.472 18.150 1212 2HZ LYS 53 HZ2 LYS 53 18.202 17.179 17.665 1213 3HZ LYS 53 HZ3 LYS 53 19.321 15.992 17.591 1214 H GLU 54 HN GLU 54 23.229 13.172 12.150 1215 HA GLU 54 HA GLU 54 26.012 13.161 12.295 1216 1HB GLU 54 HB2 GLU 54 23.912 11.986 10.498 1217 2HB GLU 54 HB3 GLU 54 25.560 11.888 9.929 1218 1HG GLU 54 HG2 GLU 54 24.971 10.970 12.746 1219 2HG GLU 54 HG3 GLU 54 24.483 9.962 11.382 1220 H VAL 55 HN VAL 55 23.947 14.886 9.981 1221 HA VAL 55 HA VAL 55 26.354 16.045 8.680 1222 HB VAL 55 HB VAL 55 24.954 16.184 6.649 1223 1HG1 VAL 55 HG11 VAL 55 25.182 13.340 7.732 1224 2HG1 VAL 55 HG12 VAL 55 25.192 13.854 6.038 1225 3HG1 VAL 55 HG13 VAL 55 26.536 14.298 7.090 1226 1HG2 VAL 55 HG21 VAL 55 22.952 14.366 8.068 1227 2HG2 VAL 55 HG22 VAL 55 22.684 16.096 7.746 1228 3HG2 VAL 55 HG23 VAL 55 22.883 14.966 6.403 1229 H GLY 56 HN GLY 56 24.621 16.883 11.091 1230 1HA GLY 56 HA2 GLY 56 24.124 18.872 12.044 1231 2HA GLY 56 HA3 GLY 56 24.988 19.649 10.710 1232 H ILE 57 HN ILE 57 21.951 17.646 10.491 1233 HA ILE 57 HA ILE 57 20.467 20.163 9.792 1234 HB ILE 57 HB ILE 57 20.089 17.397 8.612 1235 1HG1 ILE 57 HG12 ILE 57 21.035 20.036 7.409 1236 2HG1 ILE 57 HG13 ILE 57 21.979 18.560 7.601 1237 1HG2 ILE 57 HG21 ILE 57 17.924 18.587 9.056 1238 2HG2 ILE 57 HG22 ILE 57 18.511 19.962 8.100 1239 3HG2 ILE 57 HG23 ILE 57 18.232 18.383 7.339 1240 1HD1 ILE 57 HD11 ILE 57 19.685 19.017 5.655 1241 2HD1 ILE 57 HD12 ILE 57 21.393 18.719 5.314 1242 3HD1 ILE 57 HD13 ILE 57 20.408 17.415 5.979 1243 H ASP 58 HN ASP 58 19.419 20.613 11.677 1244 HA ASP 58 HA ASP 58 18.637 18.497 13.540 1245 1HB ASP 58 HB2 ASP 58 19.213 20.650 14.480 1246 2HB ASP 58 HB3 ASP 58 18.024 21.472 13.454 1247 H ILE 59 HN ILE 59 16.729 17.476 13.591 1248 HA ILE 59 HA ILE 59 14.357 18.596 12.243 1249 HB ILE 59 HB ILE 59 13.718 16.455 11.326 1250 1HG1 ILE 59 HG12 ILE 59 16.489 15.321 11.965 1251 2HG1 ILE 59 HG13 ILE 59 15.075 15.013 12.963 1252 1HG2 ILE 59 HG21 ILE 59 16.533 17.102 10.334 1253 2HG2 ILE 59 HG22 ILE 59 15.202 16.386 9.396 1254 3HG2 ILE 59 HG23 ILE 59 15.084 18.061 9.951 1255 1HD1 ILE 59 HD11 ILE 59 15.358 14.207 10.049 1256 2HD1 ILE 59 HD12 ILE 59 15.361 13.149 11.469 1257 3HD1 ILE 59 HD13 ILE 59 13.889 14.031 11.030 1258 H SER 60 HN SER 60 15.459 18.200 15.104 1259 HA SER 60 HA SER 60 14.026 16.094 16.280 1260 1HB SER 60 HB2 SER 60 14.728 18.728 17.635 1261 2HB SER 60 HB3 SER 60 14.569 17.132 18.388 1262 HG SER 60 HG SER 60 16.563 18.116 16.610 1263 H ASN 61 HN ASN 61 12.847 18.985 14.948 1264 HA ASN 61 HA ASN 61 10.420 19.303 16.480 1265 1HB ASN 61 HB2 ASN 61 10.091 21.201 15.081 1266 2HB ASN 61 HB3 ASN 61 11.832 21.152 15.369 1267 1HD2 ASN 61 HD22 ASN 61 9.564 21.611 12.924 1268 2HD2 ASN 61 HD21 ASN 61 10.559 21.154 11.568 1269 H GLN 62 HN GLN 62 11.338 17.231 13.791 1270 HA GLN 62 HA GLN 62 9.064 17.675 12.175 1271 1HB GLN 62 HB2 GLN 62 11.253 15.621 12.163 1272 2HB GLN 62 HB3 GLN 62 9.820 15.449 11.136 1273 1HG GLN 62 HG2 GLN 62 10.144 17.670 10.172 1274 2HG GLN 62 HG3 GLN 62 11.582 17.913 11.174 1275 1HE2 GLN 62 HE22 GLN 62 11.191 14.637 9.849 1276 2HE2 GLN 62 HE21 GLN 62 12.465 14.850 8.641 1277 H THR 63 HN THR 63 7.453 16.234 11.606 1278 HA THR 63 HA THR 63 6.518 14.125 13.468 1279 HB THR 63 HB THR 63 4.251 15.131 13.236 1280 HG1 THR 63 HG1 THR 63 4.005 17.094 12.218 1281 1HG2 THR 63 HG21 THR 63 6.227 17.263 14.136 1282 2HG2 THR 63 HG22 THR 63 4.538 17.072 14.667 1283 3HG2 THR 63 HG23 THR 63 5.753 15.865 15.133 1284 H SER 64 HN SER 64 4.222 13.387 12.044 1285 HA SER 64 HA SER 64 4.525 13.487 9.236 1286 1HB SER 64 HB2 SER 64 4.664 11.000 8.839 1287 2HB SER 64 HB3 SER 64 6.145 11.805 9.341 1288 HG SER 64 HG SER 64 5.873 9.869 10.489 1289 H ASP 65 HN ASP 65 2.785 11.424 8.525 1290 HA ASP 65 HA ASP 65 0.311 11.481 9.949 1291 1HB ASP 65 HB2 ASP 65 0.388 13.875 9.258 1292 2HB ASP 65 HB3 ASP 65 0.679 13.379 7.589 1293 H ILE 66 HN ILE 66 -1.390 10.383 8.525 1294 HA ILE 66 HA ILE 66 -0.157 8.261 7.081 1295 HB ILE 66 HB ILE 66 -2.547 7.564 6.691 1296 1HG1 ILE 66 HG12 ILE 66 -3.206 9.971 8.444 1297 2HG1 ILE 66 HG13 ILE 66 -3.517 9.878 6.707 1298 1HG2 ILE 66 HG21 ILE 66 -1.746 8.147 9.565 1299 2HG2 ILE 66 HG22 ILE 66 -2.875 6.887 9.003 1300 3HG2 ILE 66 HG23 ILE 66 -1.178 6.802 8.545 1301 1HD1 ILE 66 HD11 ILE 66 -5.002 7.899 7.139 1302 2HD1 ILE 66 HD12 ILE 66 -4.764 8.171 8.887 1303 3HD1 ILE 66 HD13 ILE 66 -5.551 9.410 7.899 1304 H ILE 67 HN ILE 67 -0.955 7.547 4.872 1305 HA ILE 67 HA ILE 67 -0.306 9.354 2.904 1306 HB ILE 67 HB ILE 67 -0.739 7.772 1.353 1307 1HG1 ILE 67 HG12 ILE 67 -3.200 6.805 2.848 1308 2HG1 ILE 67 HG13 ILE 67 -3.167 7.845 1.416 1309 1HG2 ILE 67 HG21 ILE 67 0.617 6.756 3.150 1310 2HG2 ILE 67 HG22 ILE 67 -0.853 5.936 3.755 1311 3HG2 ILE 67 HG23 ILE 67 -0.223 5.591 2.136 1312 1HD1 ILE 67 HD11 ILE 67 -2.520 4.914 1.564 1313 2HD1 ILE 67 HD12 ILE 67 -3.702 5.777 0.537 1314 3HD1 ILE 67 HD13 ILE 67 -1.973 5.900 0.204 1315 H ASP 68 HN ASP 68 -1.336 10.933 1.778 1316 HA ASP 68 HA ASP 68 -4.251 11.323 2.133 1317 1HB ASP 68 HB2 ASP 68 -3.177 12.564 3.971 1318 2HB ASP 68 HB3 ASP 68 -2.258 13.507 2.794 1319 H SER 69 HN SER 69 -4.650 10.886 0.108 1320 HA SER 69 HA SER 69 -3.526 11.496 -2.240 1321 1HB SER 69 HB2 SER 69 -6.467 11.814 -1.605 1322 2HB SER 69 HB3 SER 69 -5.753 11.226 -3.124 1323 HG SER 69 HG SER 69 -6.623 9.667 -1.403 1324 H ASP 70 HN ASP 70 -5.102 13.920 -0.132 1325 HA ASP 70 HA ASP 70 -5.735 15.812 -2.189 1326 1HB ASP 70 HB2 ASP 70 -6.699 15.771 0.139 1327 2HB ASP 70 HB3 ASP 70 -5.125 16.343 0.732 1328 H ILE 71 HN ILE 71 -2.718 14.961 -0.742 1329 HA ILE 71 HA ILE 71 -1.457 17.308 -2.079 1330 HB ILE 71 HB ILE 71 -0.234 16.016 0.302 1331 1HG1 ILE 71 HG12 ILE 71 -1.228 18.391 1.389 1332 2HG1 ILE 71 HG13 ILE 71 -2.602 17.843 0.437 1333 1HG2 ILE 71 HG21 ILE 71 1.122 17.588 -1.110 1334 2HG2 ILE 71 HG22 ILE 71 0.003 18.884 -0.648 1335 3HG2 ILE 71 HG23 ILE 71 0.956 18.035 0.601 1336 1HD1 ILE 71 HD11 ILE 71 -2.639 16.927 2.720 1337 2HD1 ILE 71 HD12 ILE 71 -2.403 15.606 1.541 1338 3HD1 ILE 71 HD13 ILE 71 -1.009 16.250 2.461 1339 H LEU 72 HN LEU 72 -1.268 13.799 -1.178 1340 HA LEU 72 HA LEU 72 1.186 13.344 -2.541 1341 1HB LEU 72 HB2 LEU 72 0.207 11.819 -0.867 1342 2HB LEU 72 HB3 LEU 72 -1.094 11.402 -1.970 1343 HG LEU 72 HG LEU 72 0.705 9.725 -1.756 1344 1HD1 LEU 72 HD11 LEU 72 0.717 10.640 -4.650 1345 2HD1 LEU 72 HD12 LEU 72 0.876 9.017 -4.006 1346 3HD1 LEU 72 HD13 LEU 72 -0.683 9.850 -3.882 1347 1HD2 LEU 72 HD21 LEU 72 2.872 9.971 -2.794 1348 2HD2 LEU 72 HD22 LEU 72 2.524 11.663 -3.195 1349 3HD2 LEU 72 HD23 LEU 72 2.624 11.137 -1.494 1350 H ASN 73 HN ASN 73 -2.241 12.805 -3.682 1351 HA ASN 73 HA ASN 73 -1.387 12.111 -6.316 1352 1HB ASN 73 HB2 ASN 73 -3.507 11.607 -6.649 1353 2HB ASN 73 HB3 ASN 73 -3.858 12.066 -5.001 1354 1HD2 ASN 73 HD22 ASN 73 -4.555 14.414 -4.663 1355 2HD2 ASN 73 HD21 ASN 73 -5.426 15.204 -5.967 1356 H ASN 74 HN ASN 74 -1.755 15.098 -4.623 1357 HA ASN 74 HA ASN 74 -1.978 16.887 -6.854 1358 1HB ASN 74 HB2 ASN 74 -2.395 17.000 -4.131 1359 2HB ASN 74 HB3 ASN 74 -0.897 17.910 -4.270 1360 1HD2 ASN 74 HD22 ASN 74 -3.816 18.573 -3.638 1361 2HD2 ASN 74 HD21 ASN 74 -4.182 19.929 -4.696 1362 H ALA 75 HN ALA 75 0.698 15.327 -5.176 1363 HA ALA 75 HA ALA 75 2.792 17.058 -5.761 1364 1HB ALA 75 HB1 ALA 75 2.855 15.074 -4.220 1365 2HB ALA 75 HB2 ALA 75 2.952 14.016 -5.640 1366 3HB ALA 75 HB3 ALA 75 4.246 15.178 -5.313 1367 H ASP 76 HN ASP 76 4.577 16.698 -7.210 1368 HA ASP 76 HA ASP 76 3.779 15.934 -9.978 1369 1HB ASP 76 HB2 ASP 76 4.972 18.080 -9.616 1370 2HB ASP 76 HB3 ASP 76 6.337 17.194 -8.923 1371 H LEU 77 HN LEU 77 5.778 14.820 -7.242 1372 HA LEU 77 HA LEU 77 6.510 12.427 -8.747 1373 1HB LEU 77 HB2 LEU 77 8.262 14.086 -9.143 1374 2HB LEU 77 HB3 LEU 77 8.491 14.328 -7.425 1375 HG LEU 77 HG LEU 77 10.170 12.919 -8.807 1376 1HD1 LEU 77 HD11 LEU 77 9.149 11.882 -6.158 1377 2HD1 LEU 77 HD12 LEU 77 10.659 11.396 -6.949 1378 3HD1 LEU 77 HD13 LEU 77 10.431 13.075 -6.451 1379 1HD2 LEU 77 HD21 LEU 77 8.402 10.558 -8.205 1380 2HD2 LEU 77 HD22 LEU 77 8.331 11.428 -9.745 1381 3HD2 LEU 77 HD23 LEU 77 9.848 10.664 -9.197 1382 H VAL 78 HN VAL 78 6.446 10.626 -7.539 1383 HA VAL 78 HA VAL 78 6.395 10.762 -4.552 1384 HB VAL 78 HB VAL 78 5.330 8.521 -6.261 1385 1HG1 VAL 78 HG11 VAL 78 4.279 7.848 -4.115 1386 2HG1 VAL 78 HG12 VAL 78 6.036 7.870 -3.983 1387 3HG1 VAL 78 HG13 VAL 78 5.085 9.199 -3.290 1388 1HG2 VAL 78 HG21 VAL 78 3.832 10.211 -6.752 1389 2HG2 VAL 78 HG22 VAL 78 3.063 9.403 -5.399 1390 3HG2 VAL 78 HG23 VAL 78 3.905 10.955 -5.136 1391 H VAL 79 HN VAL 79 8.268 10.361 -3.689 1392 HA VAL 79 HA VAL 79 10.230 8.606 -5.003 1393 HB VAL 79 HB VAL 79 10.344 10.070 -2.328 1394 1HG1 VAL 79 HG11 VAL 79 12.817 9.697 -2.593 1395 2HG1 VAL 79 HG12 VAL 79 11.919 8.186 -2.433 1396 3HG1 VAL 79 HG13 VAL 79 12.474 8.715 -4.035 1397 1HG2 VAL 79 HG21 VAL 79 10.202 11.739 -4.085 1398 2HG2 VAL 79 HG22 VAL 79 11.822 11.687 -3.397 1399 3HG2 VAL 79 HG23 VAL 79 11.517 10.921 -4.971 1400 H THR 80 HN THR 80 9.727 6.435 -4.720 1401 HA THR 80 HA THR 80 8.623 5.562 -2.105 1402 HB THR 80 HB THR 80 9.727 3.980 -4.465 1403 HG1 THR 80 HG1 THR 80 7.635 5.346 -4.325 1404 1HG2 THR 80 HG21 THR 80 8.265 3.144 -1.918 1405 2HG2 THR 80 HG22 THR 80 8.521 2.080 -3.339 1406 3HG2 THR 80 HG23 THR 80 9.908 2.661 -2.406 1407 H LEU 81 HN LEU 81 9.959 5.400 -0.372 1408 HA LEU 81 HA LEU 81 12.892 5.738 -0.876 1409 1HB LEU 81 HB2 LEU 81 11.388 7.608 0.042 1410 2HB LEU 81 HB3 LEU 81 11.169 6.585 1.452 1411 HG LEU 81 HG LEU 81 13.752 6.663 1.732 1412 1HD1 LEU 81 HD11 LEU 81 13.424 8.889 -0.331 1413 2HD1 LEU 81 HD12 LEU 81 14.851 8.632 0.678 1414 3HD1 LEU 81 HD13 LEU 81 14.397 7.414 -0.521 1415 1HD2 LEU 81 HD21 LEU 81 13.581 8.698 2.915 1416 2HD2 LEU 81 HD22 LEU 81 12.261 9.299 1.874 1417 3HD2 LEU 81 HD23 LEU 81 11.991 7.951 2.989 1418 H SER 82 HN SER 82 11.930 3.092 -0.915 1419 HA SER 82 HA SER 82 12.875 1.953 1.574 1420 1HB SER 82 HB2 SER 82 10.041 1.362 0.583 1421 2HB SER 82 HB3 SER 82 10.785 0.847 2.098 1422 HG SER 82 HG SER 82 9.937 3.459 1.340 1423 H GLY 83 HN GLY 83 12.814 -0.453 1.462 1424 1HA GLY 83 HA2 GLY 83 12.576 -1.672 -1.250 1425 2HA GLY 83 HA3 GLY 83 13.874 -2.122 -0.111 1426 H ASP 84 HN ASP 84 10.397 -1.320 0.215 1427 HA ASP 84 HA ASP 84 9.706 -3.777 1.650 1428 1HB ASP 84 HB2 ASP 84 10.741 -2.351 3.380 1429 2HB ASP 84 HB3 ASP 84 9.761 -0.984 2.859 1430 H ALA 85 HN ALA 85 7.324 -3.723 2.035 1431 HA ALA 85 HA ALA 85 5.789 -1.924 0.229 1432 1HB ALA 85 HB1 ALA 85 6.312 -3.995 -1.027 1433 2HB ALA 85 HB2 ALA 85 5.576 -4.965 0.272 1434 3HB ALA 85 HB3 ALA 85 4.578 -3.853 -0.689 1435 H ALA 86 HN ALA 86 6.174 -3.003 3.362 1436 HA ALA 86 HA ALA 86 3.547 -3.546 4.249 1437 1HB ALA 86 HB1 ALA 86 4.464 -2.656 6.464 1438 2HB ALA 86 HB2 ALA 86 5.438 -3.938 5.705 1439 3HB ALA 86 HB3 ALA 86 5.962 -2.262 5.597 1440 H ASP 87 HN ASP 87 4.835 -0.578 3.029 1441 HA ASP 87 HA ASP 87 3.354 1.314 4.483 1442 1HB ASP 87 HB2 ASP 87 5.471 1.667 3.177 1443 2HB ASP 87 HB3 ASP 87 4.499 1.668 1.708 1444 H LYS 88 HN LYS 88 1.351 -0.606 3.605 1445 HA LYS 88 HA LYS 88 -0.709 -0.748 2.608 1446 1HB LYS 88 HB2 LYS 88 -0.393 2.113 3.157 1447 2HB LYS 88 HB3 LYS 88 -1.365 1.900 1.730 1448 1HG LYS 88 HG2 LYS 88 -2.941 0.475 2.965 1449 2HG LYS 88 HG3 LYS 88 -1.894 0.531 4.382 1450 1HD LYS 88 HD2 LYS 88 -2.170 3.166 4.141 1451 2HD LYS 88 HD3 LYS 88 -3.608 2.737 3.212 1452 1HE LYS 88 HE2 LYS 88 -4.557 1.548 5.098 1453 2HE LYS 88 HE3 LYS 88 -3.026 1.579 5.974 1454 1HZ LYS 88 HZ1 LYS 88 -3.249 3.894 6.361 1455 2HZ LYS 88 HZ2 LYS 88 -4.564 4.037 5.368 1456 3HZ LYS 88 HZ3 LYS 88 -4.667 3.216 6.773 1457 H CYS 89 HN CYS 89 1.813 -0.919 1.024 1458 HA CYS 89 HA CYS 89 2.639 -0.800 -1.128 1459 1HB CYS 89 HB2 CYS 89 1.261 -2.519 -2.521 1460 2HB CYS 89 HB3 CYS 89 2.075 -2.996 -1.038 1461 HA PRO 90 HA PRO 90 -0.381 2.490 -2.330 1462 1HB PRO 90 HB2 PRO 90 2.112 4.043 -2.979 1463 2HB PRO 90 HB3 PRO 90 0.610 4.586 -2.170 1464 1HG PRO 90 HG2 PRO 90 2.851 4.048 -0.700 1465 2HG PRO 90 HG3 PRO 90 1.235 3.534 -0.123 1466 1HD PRO 90 HD2 PRO 90 3.310 1.924 -1.685 1467 2HD PRO 90 HD3 PRO 90 2.507 1.460 -0.177 1468 H MET 91 HN MET 91 -1.280 2.609 -4.361 1469 HA MET 91 HA MET 91 0.335 1.407 -6.526 1470 1HB MET 91 HB2 MET 91 -1.817 1.176 -7.681 1471 2HB MET 91 HB3 MET 91 -1.709 0.394 -6.095 1472 1HG MET 91 HG2 MET 91 -3.825 1.360 -6.220 1473 2HG MET 91 HG3 MET 91 -2.922 2.322 -5.103 1474 1HE MET 91 HE1 MET 91 -5.532 2.788 -6.844 1475 2HE MET 91 HE2 MET 91 -4.865 3.634 -5.447 1476 3HE MET 91 HE3 MET 91 -5.456 4.589 -6.898 1477 H THR 92 HN THR 92 0.116 4.446 -5.488 1478 HA THR 92 HA THR 92 0.353 6.520 -6.299 1479 HB THR 92 HB THR 92 2.285 6.642 -7.969 1480 HG1 THR 92 HG1 THR 92 1.909 4.468 -8.718 1481 1HG2 THR 92 HG21 THR 92 2.635 5.136 -5.335 1482 2HG2 THR 92 HG22 THR 92 3.876 6.079 -6.190 1483 3HG2 THR 92 HG23 THR 92 2.475 6.893 -5.504 1484 HA PRO 93 HA PRO 93 -2.651 6.377 -9.657 1485 1HB PRO 93 HB2 PRO 93 -3.932 8.749 -9.198 1486 2HB PRO 93 HB3 PRO 93 -4.162 7.293 -8.167 1487 1HG PRO 93 HG2 PRO 93 -2.311 9.619 -7.609 1488 2HG PRO 93 HG3 PRO 93 -3.551 8.872 -6.536 1489 1HD PRO 93 HD2 PRO 93 -0.942 8.148 -6.422 1490 2HD PRO 93 HD3 PRO 93 -2.238 6.923 -6.233 1491 HA PRO 94 HA PRO 94 -0.072 8.082 -12.670 1492 1HB PRO 94 HB2 PRO 94 -1.719 8.545 -14.855 1493 2HB PRO 94 HB3 PRO 94 -1.265 6.927 -14.243 1494 1HG PRO 94 HG2 PRO 94 -3.763 8.530 -13.575 1495 2HG PRO 94 HG3 PRO 94 -3.656 6.825 -14.139 1496 1HD PRO 94 HD2 PRO 94 -3.880 7.318 -11.517 1497 2HD PRO 94 HD3 PRO 94 -2.667 6.126 -12.097 1498 H HIS 95 HN HIS 95 -2.192 10.243 -11.239 1499 HA HIS 95 HA HIS 95 -1.725 12.638 -12.716 1500 1HB HIS 95 HB2 HIS 95 -2.157 12.359 -9.722 1501 2HB HIS 95 HB3 HIS 95 -2.564 13.735 -10.743 1502 HD1 HIS 95 HD1 HIS 95 -4.402 12.532 -12.940 1503 HD2 HIS 95 HD2 HIS 95 -4.318 11.178 -8.956 1504 HE1 HIS 95 HE1 HIS 95 -6.576 11.265 -12.563 1505 H VAL 96 HN VAL 96 0.506 10.633 -11.029 1506 HA VAL 96 HA VAL 96 2.420 12.867 -10.599 1507 HB VAL 96 HB VAL 96 2.189 10.501 -8.710 1508 1HG1 VAL 96 HG11 VAL 96 4.134 11.927 -8.473 1509 2HG1 VAL 96 HG12 VAL 96 3.128 13.375 -8.479 1510 3HG1 VAL 96 HG13 VAL 96 3.057 12.270 -7.111 1511 1HG2 VAL 96 HG21 VAL 96 0.798 11.802 -7.152 1512 2HG2 VAL 96 HG22 VAL 96 0.521 13.023 -8.414 1513 3HG2 VAL 96 HG23 VAL 96 -0.094 11.357 -8.598 1514 H LYS 97 HN LYS 97 4.644 12.298 -10.942 1515 HA LYS 97 HA LYS 97 5.184 9.807 -12.432 1516 1HB LYS 97 HB2 LYS 97 6.160 12.061 -13.003 1517 2HB LYS 97 HB3 LYS 97 7.071 12.037 -11.507 1518 1HG LYS 97 HG2 LYS 97 7.350 9.726 -13.437 1519 2HG LYS 97 HG3 LYS 97 8.047 11.264 -13.904 1520 1HD LYS 97 HD2 LYS 97 8.723 9.937 -11.273 1521 2HD LYS 97 HD3 LYS 97 9.570 9.544 -12.744 1522 1HE LYS 97 HE2 LYS 97 9.399 12.461 -11.868 1523 2HE LYS 97 HE3 LYS 97 10.602 11.411 -11.127 1524 1HZ LYS 97 HZ1 LYS 97 11.342 12.635 -13.116 1525 2HZ LYS 97 HZ2 LYS 97 11.635 10.992 -13.091 1526 3HZ LYS 97 HZ3 LYS 97 10.439 11.636 -14.047 1527 H ARG 98 HN ARG 98 6.779 8.218 -11.497 1528 HA ARG 98 HA ARG 98 7.256 8.505 -8.591 1529 1HB ARG 98 HB2 ARG 98 5.160 7.151 -8.834 1530 2HB ARG 98 HB3 ARG 98 6.063 6.002 -9.831 1531 1HG ARG 98 HG2 ARG 98 7.640 5.752 -7.716 1532 2HG ARG 98 HG3 ARG 98 6.338 6.595 -6.852 1533 1HD ARG 98 HD2 ARG 98 4.779 4.821 -7.863 1534 2HD ARG 98 HD3 ARG 98 6.197 3.981 -8.469 1535 HE ARG 98 HE ARG 98 6.878 4.101 -5.919 1536 1HH1 ARG 98 HH11 ARG 98 3.595 3.367 -7.101 1537 2HH1 ARG 98 HH12 ARG 98 3.231 2.333 -5.763 1538 1HH2 ARG 98 HH21 ARG 98 6.320 2.964 -4.144 1539 2HH2 ARG 98 HH22 ARG 98 4.847 2.031 -4.059 1540 H GLU 99 HN GLU 99 9.138 7.606 -7.942 1541 HA GLU 99 HA GLU 99 10.593 5.675 -9.571 1542 1HB GLU 99 HB2 GLU 99 11.723 8.401 -8.767 1543 2HB GLU 99 HB3 GLU 99 12.722 7.002 -9.197 1544 1HG GLU 99 HG2 GLU 99 11.729 6.973 -11.462 1545 2HG GLU 99 HG3 GLU 99 10.719 8.361 -11.031 1546 H HIS 100 HN HIS 100 12.180 4.604 -8.082 1547 HA HIS 100 HA HIS 100 11.711 5.299 -5.250 1548 1HB HIS 100 HB2 HIS 100 12.049 3.132 -4.558 1549 2HB HIS 100 HB3 HIS 100 11.063 2.937 -5.998 1550 HD1 HIS 100 HD1 HIS 100 14.280 1.830 -4.470 1551 HD2 HIS 100 HD2 HIS 100 12.490 2.031 -8.281 1552 HE1 HIS 100 HE1 HIS 100 15.622 0.267 -5.983 1553 H TRP 101 HN TRP 101 13.305 6.087 -4.094 1554 HA TRP 101 HA TRP 101 16.061 6.124 -5.263 1555 1HB TRP 101 HB2 TRP 101 14.758 8.331 -3.652 1556 2HB TRP 101 HB3 TRP 101 16.367 8.336 -4.311 1557 HD1 TRP 101 HD1 TRP 101 15.067 7.190 -7.280 1558 HE1 TRP 101 HE1 TRP 101 14.024 8.922 -8.825 1559 HE3 TRP 101 HE3 TRP 101 14.650 11.055 -3.949 1560 HZ2 TRP 101 HZ2 TRP 101 13.035 11.637 -8.617 1561 HZ3 TRP 101 HZ3 TRP 101 13.675 13.219 -4.681 1562 HH2 TRP 101 HH2 TRP 101 12.857 13.512 -6.999 1563 H GLY 102 HN GLY 102 14.376 4.561 -3.063 1564 1HA GLY 102 HA2 GLY 102 16.711 4.206 -1.315 1565 2HA GLY 102 HA3 GLY 102 15.111 4.393 -0.559 1566 H PHE 103 HN PHE 103 16.558 1.997 -0.384 1567 HA PHE 103 HA PHE 103 14.743 0.067 -1.567 1568 1HB PHE 103 HB2 PHE 103 16.515 0.600 -3.358 1569 2HB PHE 103 HB3 PHE 103 17.689 -0.147 -2.289 1570 HD1 PHE 103 HD1 PHE 103 18.171 -2.415 -2.800 1571 HD2 PHE 103 HD2 PHE 103 14.238 -0.866 -3.686 1572 HE1 PHE 103 HE1 PHE 103 17.529 -4.598 -3.790 1573 HE2 PHE 103 HE2 PHE 103 13.603 -3.052 -4.671 1574 HZ PHE 103 HZ PHE 103 15.244 -4.922 -4.724 1575 H ASP 104 HN ASP 104 15.577 1.070 1.096 1576 HA ASP 104 HA ASP 104 16.387 -1.334 2.503 1577 1HB ASP 104 HB2 ASP 104 18.541 -0.288 1.633 1578 2HB ASP 104 HB3 ASP 104 18.134 1.170 2.530 1579 H ASP 105 HN ASP 105 16.503 -0.557 4.955 1580 HA ASP 105 HA ASP 105 14.832 1.797 5.539 1581 1HB ASP 105 HB2 ASP 105 13.115 0.190 5.202 1582 2HB ASP 105 HB3 ASP 105 13.962 -1.037 6.123 1583 HA PRO 106 HA PRO 106 18.236 1.408 8.419 1584 1HB PRO 106 HB2 PRO 106 18.015 3.771 9.767 1585 2HB PRO 106 HB3 PRO 106 18.591 3.658 8.080 1586 1HG PRO 106 HG2 PRO 106 15.807 4.338 9.076 1587 2HG PRO 106 HG3 PRO 106 16.762 5.170 7.812 1588 1HD PRO 106 HD2 PRO 106 14.847 3.292 7.257 1589 2HD PRO 106 HD3 PRO 106 16.290 3.469 6.226 1590 H ALA 107 HN ALA 107 14.885 2.009 9.531 1591 HA ALA 107 HA ALA 107 15.285 1.453 12.276 1592 1HB ALA 107 HB1 ALA 107 12.811 1.112 10.522 1593 2HB ALA 107 HB2 ALA 107 12.832 1.218 12.294 1594 3HB ALA 107 HB3 ALA 107 13.310 2.621 11.318 1595 H ARG 108 HN ARG 108 15.887 -0.609 9.748 1596 HA ARG 108 HA ARG 108 14.883 -3.078 11.117 1597 1HB ARG 108 HB2 ARG 108 16.233 -2.900 8.411 1598 2HB ARG 108 HB3 ARG 108 15.369 -4.273 9.094 1599 1HG ARG 108 HG2 ARG 108 14.163 -1.647 8.242 1600 2HG ARG 108 HG3 ARG 108 14.094 -3.143 7.312 1601 1HD ARG 108 HD2 ARG 108 12.798 -2.599 9.996 1602 2HD ARG 108 HD3 ARG 108 11.945 -2.757 8.440 1603 HE ARG 108 HE ARG 108 13.311 -5.142 8.724 1604 1HH1 ARG 108 HH11 ARG 108 10.839 -3.418 10.595 1605 2HH1 ARG 108 HH12 ARG 108 10.144 -4.844 11.269 1606 1HH2 ARG 108 HH21 ARG 108 12.397 -7.052 9.633 1607 2HH2 ARG 108 HH22 ARG 108 11.050 -6.957 10.700 1608 H ALA 109 HN ALA 109 17.522 -1.137 11.400 1609 HA ALA 109 HA ALA 109 19.788 -2.571 11.028 1610 1HB ALA 109 HB1 ALA 109 19.710 -0.274 11.962 1611 2HB ALA 109 HB2 ALA 109 19.106 -0.925 13.506 1612 3HB ALA 109 HB3 ALA 109 20.733 -1.354 12.936 1613 H GLN 110 HN GLN 110 20.964 -4.112 12.069 1614 HA GLN 110 HA GLN 110 19.594 -6.289 13.111 1615 1HB GLN 110 HB2 GLN 110 21.799 -6.532 12.097 1616 2HB GLN 110 HB3 GLN 110 22.532 -5.551 13.370 1617 1HG GLN 110 HG2 GLN 110 23.059 -7.905 13.664 1618 2HG GLN 110 HG3 GLN 110 22.187 -7.251 15.036 1619 1HE2 GLN 110 HE22 GLN 110 19.905 -7.882 15.353 1620 2HE2 GLN 110 HE21 GLN 110 19.354 -9.408 14.679 1621 H GLY 111 HN GLY 111 21.394 -3.763 14.885 1622 1HA GLY 111 HA2 GLY 111 19.956 -3.027 16.775 1623 2HA GLY 111 HA3 GLY 111 20.059 -4.735 17.344 1624 H THR 112 HN THR 112 22.982 -4.479 16.304 1625 HA THR 112 HA THR 112 24.146 -3.835 18.908 1626 HB THR 112 HB THR 112 26.275 -4.339 17.873 1627 HG1 THR 112 HG1 THR 112 26.318 -4.857 15.639 1628 1HG2 THR 112 HG21 THR 112 24.289 -6.289 16.663 1629 2HG2 THR 112 HG22 THR 112 25.956 -6.606 17.198 1630 3HG2 THR 112 HG23 THR 112 24.692 -6.251 18.407 1631 H GLU 113 HN GLU 113 25.811 -2.088 19.050 1632 HA GLU 113 HA GLU 113 24.615 0.310 18.256 1633 1HB GLU 113 HB2 GLU 113 27.468 -0.381 19.142 1634 2HB GLU 113 HB3 GLU 113 26.877 1.293 19.090 1635 1HG GLU 113 HG2 GLU 113 25.575 -0.910 20.740 1636 2HG GLU 113 HG3 GLU 113 26.821 0.166 21.370 1637 H GLU 114 HN GLU 114 27.248 -1.583 16.884 1638 HA GLU 114 HA GLU 114 28.120 0.323 14.938 1639 1HB GLU 114 HB2 GLU 114 29.170 -1.801 13.933 1640 2HB GLU 114 HB3 GLU 114 29.762 -1.249 15.517 1641 1HG GLU 114 HG2 GLU 114 28.252 -2.968 16.582 1642 2HG GLU 114 HG3 GLU 114 27.853 -3.513 14.926 1643 H GLU 115 HN GLU 115 25.670 -2.433 15.005 1644 HA GLU 115 HA GLU 115 25.460 -2.203 12.123 1645 1HB GLU 115 HB2 GLU 115 23.866 -3.727 14.167 1646 2HB GLU 115 HB3 GLU 115 23.495 -3.725 12.440 1647 1HG GLU 115 HG2 GLU 115 26.326 -4.371 13.363 1648 2HG GLU 115 HG3 GLU 115 25.064 -5.604 13.415 1649 H LYS 116 HN LYS 116 23.765 -0.855 14.942 1650 HA LYS 116 HA LYS 116 21.684 0.486 13.528 1651 1HB LYS 116 HB2 LYS 116 23.214 1.093 16.107 1652 2HB LYS 116 HB3 LYS 116 22.046 2.225 15.446 1653 1HG LYS 116 HG2 LYS 116 20.363 0.293 15.424 1654 2HG LYS 116 HG3 LYS 116 21.534 -0.593 16.433 1655 1HD LYS 116 HD2 LYS 116 21.283 0.859 18.248 1656 2HD LYS 116 HD3 LYS 116 20.658 2.190 17.253 1657 1HE LYS 116 HE2 LYS 116 18.576 1.018 16.830 1658 2HE LYS 116 HE3 LYS 116 19.154 -0.417 17.698 1659 1HZ LYS 116 HZ1 LYS 116 19.204 0.910 19.730 1660 2HZ LYS 116 HZ2 LYS 116 18.674 2.238 18.934 1661 3HZ LYS 116 HZ3 LYS 116 17.710 0.934 19.085 1662 H TRP 117 HN TRP 117 24.874 1.796 14.518 1663 HA TRP 117 HA TRP 117 24.441 4.163 13.037 1664 1HB TRP 117 HB2 TRP 117 26.241 3.584 14.848 1665 2HB TRP 117 HB3 TRP 117 27.237 3.090 13.483 1666 HD1 TRP 117 HD1 TRP 117 26.204 5.600 11.590 1667 HE1 TRP 117 HE1 TRP 117 27.021 7.949 12.051 1668 HE3 TRP 117 HE3 TRP 117 27.798 4.910 16.411 1669 HZ2 TRP 117 HZ2 TRP 117 28.252 9.350 14.219 1670 HZ3 TRP 117 HZ3 TRP 117 28.781 6.812 17.670 1671 HH2 TRP 117 HH2 TRP 117 29.016 9.045 16.594 1672 H ALA 118 HN ALA 118 25.959 1.066 12.058 1673 HA ALA 118 HA ALA 118 26.805 1.896 9.514 1674 1HB ALA 118 HB1 ALA 118 27.513 -0.234 10.628 1675 2HB ALA 118 HB2 ALA 118 25.863 -0.838 10.535 1676 3HB ALA 118 HB3 ALA 118 26.796 -0.593 9.036 1677 H PHE 119 HN PHE 119 23.594 0.562 10.466 1678 HA PHE 119 HA PHE 119 22.581 0.554 7.778 1679 1HB PHE 119 HB2 PHE 119 21.392 0.401 10.533 1680 2HB PHE 119 HB3 PHE 119 20.341 0.916 9.238 1681 HD1 PHE 119 HD1 PHE 119 22.988 -1.786 9.565 1682 HD2 PHE 119 HD2 PHE 119 18.953 -0.750 8.420 1683 HE1 PHE 119 HE1 PHE 119 22.575 -4.127 8.873 1684 HE2 PHE 119 HE2 PHE 119 18.559 -3.085 7.718 1685 HZ PHE 119 HZ PHE 119 20.361 -4.784 7.945 1686 H PHE 120 HN PHE 120 22.444 2.968 10.452 1687 HA PHE 120 HA PHE 120 20.785 4.769 9.000 1688 1HB PHE 120 HB2 PHE 120 22.772 5.592 11.130 1689 2HB PHE 120 HB3 PHE 120 21.267 6.384 10.692 1690 HD1 PHE 120 HD1 PHE 120 21.986 5.938 13.458 1691 HD2 PHE 120 HD2 PHE 120 19.930 3.248 10.774 1692 HE1 PHE 120 HE1 PHE 120 20.994 4.742 15.389 1693 HE2 PHE 120 HE2 PHE 120 18.953 2.073 12.697 1694 HZ PHE 120 HZ PHE 120 19.489 2.795 15.011 1695 H GLN 121 HN GLN 121 24.355 4.507 9.274 1696 HA GLN 121 HA GLN 121 24.982 6.876 7.872 1697 1HB GLN 121 HB2 GLN 121 26.496 5.692 9.353 1698 2HB GLN 121 HB3 GLN 121 26.587 4.320 8.234 1699 1HG GLN 121 HG2 GLN 121 27.650 5.664 6.542 1700 2HG GLN 121 HG3 GLN 121 27.310 7.166 7.430 1701 1HE2 GLN 121 HE22 GLN 121 28.203 7.159 9.836 1702 2HE2 GLN 121 HE21 GLN 121 29.852 6.612 9.988 1703 H ARG 122 HN ARG 122 24.664 3.440 6.802 1704 HA ARG 122 HA ARG 122 25.409 3.898 4.134 1705 1HB ARG 122 HB2 ARG 122 25.259 1.656 5.134 1706 2HB ARG 122 HB3 ARG 122 23.523 1.844 5.404 1707 1HG ARG 122 HG2 ARG 122 23.150 1.868 2.928 1708 2HG ARG 122 HG3 ARG 122 24.894 1.672 2.688 1709 1HD ARG 122 HD2 ARG 122 23.798 -0.470 2.453 1710 2HD ARG 122 HD3 ARG 122 24.800 -0.497 3.903 1711 HE ARG 122 HE ARG 122 21.799 -0.156 3.841 1712 1HH1 ARG 122 HH21 ARG 122 24.640 -1.409 5.610 1713 2HH1 ARG 122 HH22 ARG 122 23.675 -2.196 6.802 1714 1HH2 ARG 122 HH11 ARG 122 20.614 -1.102 5.321 1715 2HH2 ARG 122 HH12 ARG 122 21.270 -1.986 6.687 1716 H VAL 123 HN VAL 123 22.137 3.850 5.663 1717 HA VAL 123 HA VAL 123 20.730 4.444 3.269 1718 HB VAL 123 HB VAL 123 20.008 4.771 6.207 1719 1HG1 VAL 123 HG11 VAL 123 18.607 6.310 4.906 1720 2HG1 VAL 123 HG12 VAL 123 18.193 5.014 3.763 1721 3HG1 VAL 123 HG13 VAL 123 17.651 4.944 5.454 1722 1HG2 VAL 123 HG21 VAL 123 19.171 2.720 4.094 1723 2HG2 VAL 123 HG22 VAL 123 20.349 2.416 5.375 1724 3HG2 VAL 123 HG23 VAL 123 18.663 2.729 5.793 1725 H ARG 124 HN ARG 124 21.947 6.720 5.884 1726 HA ARG 124 HA ARG 124 20.712 8.924 4.648 1727 1HB ARG 124 HB2 ARG 124 21.946 10.361 6.046 1728 2HB ARG 124 HB3 ARG 124 21.583 8.919 6.984 1729 1HG ARG 124 HG2 ARG 124 23.884 8.139 6.664 1730 2HG ARG 124 HG3 ARG 124 24.272 9.558 5.690 1731 1HD ARG 124 HD2 ARG 124 23.864 11.031 7.615 1732 2HD ARG 124 HD3 ARG 124 23.354 9.648 8.583 1733 HE ARG 124 HE ARG 124 25.514 9.293 9.143 1734 1HH1 ARG 124 HH11 ARG 124 25.695 10.915 5.963 1735 2HH1 ARG 124 HH12 ARG 124 27.406 11.094 6.041 1736 1HH2 ARG 124 HH21 ARG 124 27.651 9.623 9.270 1737 2HH2 ARG 124 HH22 ARG 124 28.582 10.289 7.950 1738 H ASP 125 HN ASP 125 23.934 7.535 4.063 1739 HA ASP 125 HA ASP 125 24.885 9.625 2.388 1740 1HB ASP 125 HB2 ASP 125 26.367 7.909 3.298 1741 2HB ASP 125 HB3 ASP 125 25.520 6.646 2.400 1742 H GLU 126 HN GLU 126 23.047 6.633 1.625 1743 HA GLU 126 HA GLU 126 23.002 7.017 -1.208 1744 1HB GLU 126 HB2 GLU 126 22.545 4.870 0.026 1745 2HB GLU 126 HB3 GLU 126 21.027 5.549 0.601 1746 1HG GLU 126 HG2 GLU 126 20.500 4.159 -1.251 1747 2HG GLU 126 HG3 GLU 126 20.296 5.817 -1.806 1748 H ILE 127 HN ILE 127 20.524 7.715 1.330 1749 HA ILE 127 HA ILE 127 18.591 8.852 -0.362 1750 HB ILE 127 HB ILE 127 19.220 9.077 2.600 1751 1HG1 ILE 127 HG12 ILE 127 17.013 7.801 0.923 1752 2HG1 ILE 127 HG13 ILE 127 18.281 6.971 1.808 1753 1HG2 ILE 127 HG21 ILE 127 18.255 11.271 2.035 1754 2HG2 ILE 127 HG22 ILE 127 16.864 10.457 1.273 1755 3HG2 ILE 127 HG23 ILE 127 17.182 10.315 3.022 1756 1HD1 ILE 127 HD11 ILE 127 15.892 8.444 3.002 1757 2HD1 ILE 127 HD12 ILE 127 16.199 6.705 2.999 1758 3HD1 ILE 127 HD13 ILE 127 17.224 7.791 3.964 1759 H GLY 128 HN GLY 128 21.189 10.557 1.507 1760 1HA GLY 128 HA2 GLY 128 20.457 13.153 0.713 1761 2HA GLY 128 HA3 GLY 128 22.089 12.619 1.210 1762 H ASN 129 HN ASN 129 22.723 10.822 -0.918 1763 HA ASN 129 HA ASN 129 23.518 12.672 -2.910 1764 1HB ASN 129 HB2 ASN 129 24.778 10.600 -2.600 1765 2HB ASN 129 HB3 ASN 129 23.362 9.628 -3.025 1766 1HD2 ASN 129 HD22 ASN 129 22.957 9.228 -5.252 1767 2HD2 ASN 129 HD21 ASN 129 23.651 10.180 -6.551 1768 H ARG 130 HN ARG 130 20.803 10.324 -2.890 1769 HA ARG 130 HA ARG 130 20.069 10.963 -5.620 1770 1HB ARG 130 HB2 ARG 130 18.270 9.843 -3.428 1771 2HB ARG 130 HB3 ARG 130 17.948 9.828 -5.165 1772 1HG ARG 130 HG2 ARG 130 20.177 8.335 -3.741 1773 2HG ARG 130 HG3 ARG 130 18.697 7.624 -4.344 1774 1HD ARG 130 HD2 ARG 130 19.356 7.888 -6.614 1775 2HD ARG 130 HD3 ARG 130 20.673 9.005 -6.197 1776 HE ARG 130 HE ARG 130 21.244 6.705 -4.761 1777 1HH1 ARG 130 HH11 ARG 130 20.931 7.408 -8.244 1778 2HH1 ARG 130 HH12 ARG 130 22.065 6.189 -8.695 1779 1HH2 ARG 130 HH21 ARG 130 22.643 5.233 -5.289 1780 2HH2 ARG 130 HH22 ARG 130 23.101 4.859 -6.943 1781 H LEU 131 HN LEU 131 18.954 12.284 -2.451 1782 HA LEU 131 HA LEU 131 17.027 13.974 -3.734 1783 1HB LEU 131 HB2 LEU 131 18.259 13.887 -0.968 1784 2HB LEU 131 HB3 LEU 131 17.423 15.344 -1.464 1785 HG LEU 131 HG LEU 131 15.916 13.910 -0.204 1786 1HD1 LEU 131 HD11 LEU 131 14.021 13.897 -1.762 1787 2HD1 LEU 131 HD12 LEU 131 14.997 15.345 -2.034 1788 3HD1 LEU 131 HD13 LEU 131 15.084 13.962 -3.141 1789 1HD2 LEU 131 HD21 LEU 131 16.261 11.818 -2.391 1790 2HD2 LEU 131 HD22 LEU 131 16.879 11.723 -0.731 1791 3HD2 LEU 131 HD23 LEU 131 15.151 11.742 -1.011 1792 H LYS 132 HN LYS 132 20.497 14.498 -2.939 1793 HA LYS 132 HA LYS 132 20.504 17.228 -3.766 1794 1HB LYS 132 HB2 LYS 132 22.275 16.127 -2.451 1795 2HB LYS 132 HB3 LYS 132 22.695 15.108 -3.839 1796 1HG LYS 132 HG2 LYS 132 23.312 17.122 -5.143 1797 2HG LYS 132 HG3 LYS 132 22.875 18.158 -3.773 1798 1HD LYS 132 HD2 LYS 132 24.980 15.958 -3.667 1799 2HD LYS 132 HD3 LYS 132 25.342 17.657 -4.038 1800 1HE LYS 132 HE2 LYS 132 24.343 18.308 -1.825 1801 2HE LYS 132 HE3 LYS 132 24.130 16.596 -1.444 1802 1HZ LYS 132 HZ1 LYS 132 26.547 16.335 -1.611 1803 2HZ LYS 132 HZ2 LYS 132 26.733 17.925 -1.948 1804 3HZ LYS 132 HZ3 LYS 132 26.173 17.458 -0.492 1805 H GLU 133 HN GLU 133 21.127 14.145 -5.653 1806 HA GLU 133 HA GLU 133 21.493 15.605 -8.064 1807 1HB GLU 133 HB2 GLU 133 20.711 12.705 -7.514 1808 2HB GLU 133 HB3 GLU 133 20.608 13.365 -9.166 1809 1HG GLU 133 HG2 GLU 133 22.902 14.038 -9.143 1810 2HG GLU 133 HG3 GLU 133 23.120 13.476 -7.474 1811 H PHE 134 HN PHE 134 18.404 14.464 -6.558 1812 HA PHE 134 HA PHE 134 16.903 15.062 -8.873 1813 1HB PHE 134 HB2 PHE 134 15.772 13.870 -7.230 1814 2HB PHE 134 HB3 PHE 134 16.355 14.891 -5.929 1815 HD1 PHE 134 HD1 PHE 134 14.521 15.587 -4.746 1816 HD2 PHE 134 HD2 PHE 134 14.394 15.856 -9.040 1817 HE1 PHE 134 HE1 PHE 134 12.387 16.802 -4.610 1818 HE2 PHE 134 HE2 PHE 134 12.240 17.051 -8.904 1819 HZ PHE 134 HZ PHE 134 11.226 17.548 -6.687 1820 H ALA 135 HN ALA 135 18.002 17.224 -6.262 1821 HA ALA 135 HA ALA 135 16.726 19.574 -7.198 1822 1HB ALA 135 HB1 ALA 135 17.765 19.281 -4.941 1823 2HB ALA 135 HB2 ALA 135 19.370 19.312 -5.703 1824 3HB ALA 135 HB3 ALA 135 18.316 20.747 -5.767 1825 H GLU 136 HN GLU 136 19.664 17.944 -8.267 1826 HA GLU 136 HA GLU 136 20.688 20.237 -9.716 1827 1HB GLU 136 HB2 GLU 136 21.634 17.371 -9.376 1828 2HB GLU 136 HB3 GLU 136 22.517 18.560 -10.314 1829 1HG GLU 136 HG2 GLU 136 21.859 19.041 -7.383 1830 2HG GLU 136 HG3 GLU 136 23.244 18.089 -7.888 1831 H THR 137 HN THR 137 19.211 17.117 -10.374 1832 HA THR 137 HA THR 137 19.594 17.338 -13.280 1833 HB THR 137 HB THR 137 19.096 14.967 -13.299 1834 HG1 THR 137 HG1 THR 137 18.814 15.123 -10.508 1835 1HG2 THR 137 HG21 THR 137 21.414 15.639 -12.841 1836 2HG2 THR 137 HG22 THR 137 21.096 15.586 -11.097 1837 3HG2 THR 137 HG23 THR 137 20.989 14.105 -12.063 1838 H GLY 138 HN GLY 138 17.066 17.883 -10.979 1839 1HA GLY 138 HA2 GLY 138 14.926 18.559 -11.252 1840 2HA GLY 138 HA3 GLY 138 15.307 18.923 -12.954 1841 H LYS 139 HN LYS 139 15.271 15.913 -11.045 1842 HA LYS 139 HA LYS 139 14.119 14.226 -12.938 1843 1HB LYS 139 HB2 LYS 139 14.836 13.989 -10.214 1844 2HB LYS 139 HB3 LYS 139 13.094 13.660 -10.242 1845 1HG LYS 139 HG2 LYS 139 13.849 11.583 -10.638 1846 2HG LYS 139 HG3 LYS 139 13.700 12.125 -12.297 1847 1HD LYS 139 HD2 LYS 139 16.302 12.256 -10.684 1848 2HD LYS 139 HD3 LYS 139 15.846 10.869 -11.683 1849 1HE LYS 139 HE2 LYS 139 15.860 12.225 -13.701 1850 2HE LYS 139 HE3 LYS 139 16.158 13.700 -12.763 1851 1HZ LYS 139 HZ1 LYS 139 18.166 12.713 -13.786 1852 2HZ LYS 139 HZ2 LYS 139 18.278 12.939 -12.168 1853 3HZ LYS 139 HZ3 LYS 139 18.045 11.426 -12.792 Start of MODEL 9 1 1H MET 1 H1 MET 1 -23.886 -10.876 -7.504 2 2H MET 1 H2 MET 1 -25.210 -11.832 -7.518 3 3H MET 1 H3 MET 1 -23.699 -12.475 -7.743 4 HA MET 1 HA MET 1 -25.264 -12.132 -9.734 5 1HB MET 1 HB2 MET 1 -25.700 -9.761 -9.257 6 2HB MET 1 HB3 MET 1 -23.984 -9.385 -9.404 7 1HG MET 1 HG2 MET 1 -24.055 -10.132 -11.793 8 2HG MET 1 HG3 MET 1 -25.788 -10.435 -11.619 9 1HE MET 1 HE1 MET 1 -26.161 -8.944 -13.792 10 2HE MET 1 HE2 MET 1 -25.567 -7.277 -13.961 11 3HE MET 1 HE3 MET 1 -24.413 -8.628 -13.892 12 H ALA 2 HN ALA 2 -22.084 -10.364 -9.680 13 HA ALA 2 HA ALA 2 -20.536 -12.687 -10.346 14 1HB ALA 2 HB1 ALA 2 -19.843 -11.859 -12.596 15 2HB ALA 2 HB2 ALA 2 -21.569 -12.243 -12.598 16 3HB ALA 2 HB3 ALA 2 -21.037 -10.549 -12.493 17 H ILE 3 HN ILE 3 -18.272 -11.906 -10.803 18 HA ILE 3 HA ILE 3 -17.629 -9.469 -9.291 19 HB ILE 3 HB ILE 3 -15.974 -11.885 -10.162 20 1HG1 ILE 3 HG12 ILE 3 -15.284 -11.818 -7.726 21 2HG1 ILE 3 HG13 ILE 3 -16.493 -10.569 -7.455 22 1HG2 ILE 3 HG21 ILE 3 -14.656 -9.815 -10.620 23 2HG2 ILE 3 HG22 ILE 3 -15.011 -9.255 -8.967 24 3HG2 ILE 3 HG23 ILE 3 -14.003 -10.699 -9.244 25 1HD1 ILE 3 HD11 ILE 3 -17.189 -12.681 -6.666 26 2HD1 ILE 3 HD12 ILE 3 -18.275 -12.198 -7.966 27 3HD1 ILE 3 HD13 ILE 3 -17.024 -13.448 -8.261 28 H VAL 4 HN VAL 4 -18.271 -7.909 -10.645 29 HA VAL 4 HA VAL 4 -17.820 -7.899 -13.530 30 HB VAL 4 HB VAL 4 -18.900 -5.810 -11.605 31 1HG1 VAL 4 HG11 VAL 4 -18.379 -4.708 -13.721 32 2HG1 VAL 4 HG12 VAL 4 -19.215 -5.997 -14.629 33 3HG1 VAL 4 HG13 VAL 4 -20.111 -4.883 -13.574 34 1HG2 VAL 4 HG21 VAL 4 -20.343 -7.761 -11.444 35 2HG2 VAL 4 HG22 VAL 4 -21.169 -6.568 -12.433 36 3HG2 VAL 4 HG23 VAL 4 -20.370 -7.943 -13.214 37 H LYS 5 HN LYS 5 -16.719 -5.764 -14.367 38 HA LYS 5 HA LYS 5 -14.557 -4.892 -12.604 39 1HB LYS 5 HB2 LYS 5 -13.582 -6.586 -14.123 40 2HB LYS 5 HB3 LYS 5 -14.117 -5.632 -15.519 41 1HG LYS 5 HG2 LYS 5 -12.651 -3.775 -14.854 42 2HG LYS 5 HG3 LYS 5 -12.252 -4.585 -13.334 43 1HD LYS 5 HD2 LYS 5 -10.415 -4.784 -14.911 44 2HD LYS 5 HD3 LYS 5 -11.094 -6.380 -14.553 45 1HE LYS 5 HE2 LYS 5 -12.328 -6.377 -16.680 46 2HE LYS 5 HE3 LYS 5 -11.805 -4.721 -17.017 47 1HZ LYS 5 HZ1 LYS 5 -9.523 -5.506 -17.148 48 2HZ LYS 5 HZ2 LYS 5 -9.985 -7.051 -16.814 49 3HZ LYS 5 HZ3 LYS 5 -10.460 -6.336 -18.202 50 H ALA 6 HN ALA 6 -14.337 -2.765 -12.574 51 HA ALA 6 HA ALA 6 -16.283 -1.078 -14.008 52 1HB ALA 6 HB1 ALA 6 -15.291 0.598 -12.308 53 2HB ALA 6 HB2 ALA 6 -16.333 -0.675 -11.715 54 3HB ALA 6 HB3 ALA 6 -14.578 -0.821 -11.532 55 H THR 7 HN THR 7 -15.249 1.240 -14.376 56 HA THR 7 HA THR 7 -12.474 1.470 -14.904 57 HB THR 7 HB THR 7 -13.063 0.409 -17.021 58 HG1 THR 7 HG1 THR 7 -11.516 1.774 -17.351 59 1HG2 THR 7 HG21 THR 7 -15.084 2.644 -17.396 60 2HG2 THR 7 HG22 THR 7 -14.480 1.599 -18.699 61 3HG2 THR 7 HG23 THR 7 -15.372 0.883 -17.359 62 H ASP 8 HN ASP 8 -12.435 3.861 -16.088 63 HA ASP 8 HA ASP 8 -12.464 5.629 -14.093 64 1HB ASP 8 HB2 ASP 8 -11.396 6.051 -16.184 65 2HB ASP 8 HB3 ASP 8 -12.938 6.117 -17.035 66 H GLN 9 HN GLN 9 -15.408 5.087 -16.033 67 HA GLN 9 HA GLN 9 -16.890 6.834 -14.160 68 1HB GLN 9 HB2 GLN 9 -17.048 6.745 -17.188 69 2HB GLN 9 HB3 GLN 9 -18.320 7.464 -16.187 70 1HG GLN 9 HG2 GLN 9 -16.886 9.178 -15.354 71 2HG GLN 9 HG3 GLN 9 -15.433 8.352 -15.883 72 1HE2 GLN 9 HE22 GLN 9 -14.463 9.251 -17.607 73 2HE2 GLN 9 HE21 GLN 9 -15.284 10.098 -18.917 74 H SER 10 HN SER 10 -16.925 3.964 -16.312 75 HA SER 10 HA SER 10 -19.506 3.118 -15.697 76 1HB SER 10 HB2 SER 10 -17.148 1.275 -16.118 77 2HB SER 10 HB3 SER 10 -18.851 0.982 -16.503 78 HG SER 10 HG SER 10 -17.739 1.593 -18.379 79 H PHE 11 HN PHE 11 -16.683 3.138 -13.525 80 HA PHE 11 HA PHE 11 -17.494 1.242 -11.601 81 1HB PHE 11 HB2 PHE 11 -15.449 2.423 -11.201 82 2HB PHE 11 HB3 PHE 11 -16.210 3.974 -11.424 83 HD1 PHE 11 HD1 PHE 11 -16.891 5.250 -9.623 84 HD2 PHE 11 HD2 PHE 11 -16.272 0.997 -8.987 85 HE1 PHE 11 HE1 PHE 11 -17.070 5.580 -7.179 86 HE2 PHE 11 HE2 PHE 11 -16.444 1.379 -6.562 87 HZ PHE 11 HZ PHE 11 -16.820 3.640 -5.641 88 H SER 12 HN SER 12 -18.609 4.696 -11.901 89 HA SER 12 HA SER 12 -20.470 4.427 -9.783 90 1HB SER 12 HB2 SER 12 -20.729 6.233 -12.238 91 2HB SER 12 HB3 SER 12 -21.344 6.548 -10.608 92 HG SER 12 HG SER 12 -19.403 7.706 -11.027 93 H ALA 13 HN ALA 13 -20.799 4.027 -13.346 94 HA ALA 13 HA ALA 13 -23.584 3.824 -13.310 95 1HB ALA 13 HB1 ALA 13 -21.669 2.512 -15.286 96 2HB ALA 13 HB2 ALA 13 -23.370 2.924 -15.578 97 3HB ALA 13 HB3 ALA 13 -22.178 4.222 -15.328 98 H GLU 14 HN GLU 14 -21.112 1.315 -12.854 99 HA GLU 14 HA GLU 14 -22.961 -0.860 -12.815 100 1HB GLU 14 HB2 GLU 14 -20.039 -0.623 -12.041 101 2HB GLU 14 HB3 GLU 14 -20.916 -2.146 -11.975 102 1HG GLU 14 HG2 GLU 14 -20.594 -0.469 -14.492 103 2HG GLU 14 HG3 GLU 14 -19.577 -1.842 -14.053 104 H THR 15 HN THR 15 -22.117 1.494 -10.397 105 HA THR 15 HA THR 15 -22.841 -0.361 -8.185 106 HB THR 15 HB THR 15 -21.409 1.105 -6.810 107 HG1 THR 15 HG1 THR 15 -20.436 2.258 -9.158 108 1HG2 THR 15 HG21 THR 15 -19.164 0.698 -7.953 109 2HG2 THR 15 HG22 THR 15 -20.146 -0.743 -7.626 110 3HG2 THR 15 HG23 THR 15 -20.043 -0.075 -9.269 111 H SER 16 HN SER 16 -24.158 2.261 -9.876 112 HA SER 16 HA SER 16 -25.045 3.823 -7.634 113 1HB SER 16 HB2 SER 16 -25.810 3.855 -10.576 114 2HB SER 16 HB3 SER 16 -26.379 5.039 -9.385 115 HG SER 16 HG SER 16 -23.690 4.492 -10.106 116 H GLU 17 HN GLU 17 -26.152 0.810 -8.483 117 HA GLU 17 HA GLU 17 -28.742 1.323 -7.229 118 1HB GLU 17 HB2 GLU 17 -28.392 -0.149 -9.879 119 2HB GLU 17 HB3 GLU 17 -29.846 -0.234 -8.877 120 1HG GLU 17 HG2 GLU 17 -30.123 2.244 -9.113 121 2HG GLU 17 HG3 GLU 17 -28.741 2.270 -10.215 122 H GLY 18 HN GLY 18 -29.445 -0.444 -5.970 123 1HA GLY 18 HA2 GLY 18 -29.368 -2.480 -4.912 124 2HA GLY 18 HA3 GLY 18 -28.138 -3.038 -6.053 125 H VAL 19 HN VAL 19 -27.393 -3.957 -3.950 126 HA VAL 19 HA VAL 19 -25.511 -2.089 -2.593 127 HB VAL 19 HB VAL 19 -26.419 -4.794 -1.509 128 1HG1 VAL 19 HG11 VAL 19 -25.324 -3.905 0.547 129 2HG1 VAL 19 HG12 VAL 19 -24.188 -4.151 -0.783 130 3HG1 VAL 19 HG13 VAL 19 -24.739 -2.514 -0.390 131 1HG2 VAL 19 HG21 VAL 19 -28.357 -3.459 -1.413 132 2HG2 VAL 19 HG22 VAL 19 -27.626 -3.327 0.182 133 3HG2 VAL 19 HG23 VAL 19 -27.461 -2.000 -0.991 134 H VAL 20 HN VAL 20 -23.592 -2.061 -3.319 135 HA VAL 20 HA VAL 20 -22.623 -4.354 -4.922 136 HB VAL 20 HB VAL 20 -22.416 -1.449 -5.823 137 1HG1 VAL 20 HG11 VAL 20 -21.746 -2.533 -7.961 138 2HG1 VAL 20 HG12 VAL 20 -20.638 -2.904 -6.626 139 3HG1 VAL 20 HG13 VAL 20 -21.812 -4.115 -7.163 140 1HG2 VAL 20 HG21 VAL 20 -24.073 -2.133 -7.621 141 2HG2 VAL 20 HG22 VAL 20 -24.457 -3.556 -6.638 142 3HG2 VAL 20 HG23 VAL 20 -24.750 -1.928 -6.006 143 H LEU 21 HN LEU 21 -20.753 -4.935 -4.175 144 HA LEU 21 HA LEU 21 -19.107 -3.112 -2.507 145 1HB LEU 21 HB2 LEU 21 -19.673 -5.406 -1.776 146 2HB LEU 21 HB3 LEU 21 -18.848 -6.080 -3.176 147 HG LEU 21 HG LEU 21 -17.242 -4.188 -1.488 148 1HD1 LEU 21 HD11 LEU 21 -16.826 -5.992 0.228 149 2HD1 LEU 21 HD12 LEU 21 -18.447 -5.317 0.274 150 3HD1 LEU 21 HD13 LEU 21 -18.164 -6.915 -0.465 151 1HD2 LEU 21 HD21 LEU 21 -15.484 -5.889 -1.857 152 2HD2 LEU 21 HD22 LEU 21 -16.678 -6.968 -2.600 153 3HD2 LEU 21 HD23 LEU 21 -16.233 -5.441 -3.395 154 H ALA 22 HN ALA 22 -17.152 -2.209 -3.319 155 HA ALA 22 HA ALA 22 -16.287 -3.231 -5.938 156 1HB ALA 22 HB1 ALA 22 -15.545 -1.022 -6.610 157 2HB ALA 22 HB2 ALA 22 -17.239 -0.912 -6.140 158 3HB ALA 22 HB3 ALA 22 -15.963 -0.357 -5.020 159 H ASP 23 HN ASP 23 -14.059 -3.467 -6.216 160 HA ASP 23 HA ASP 23 -12.369 -3.340 -3.758 161 1HB ASP 23 HB2 ASP 23 -13.330 -5.558 -3.768 162 2HB ASP 23 HB3 ASP 23 -12.938 -5.771 -5.478 163 H PHE 24 HN PHE 24 -10.178 -3.104 -4.247 164 HA PHE 24 HA PHE 24 -9.516 -2.368 -7.056 165 1HB PHE 24 HB2 PHE 24 -8.865 -1.034 -4.413 166 2HB PHE 24 HB3 PHE 24 -8.122 -0.610 -5.924 167 HD1 PHE 24 HD1 PHE 24 -11.660 -0.985 -4.530 168 HD2 PHE 24 HD2 PHE 24 -8.939 1.259 -6.995 169 HE1 PHE 24 HE1 PHE 24 -13.491 0.543 -5.134 170 HE2 PHE 24 HE2 PHE 24 -10.794 2.831 -7.567 171 HZ PHE 24 HZ PHE 24 -13.064 2.471 -6.646 172 H TRP 25 HN TRP 25 -8.012 -3.726 -7.785 173 HA TRP 25 HA TRP 25 -6.112 -5.067 -5.931 174 1HB TRP 25 HB2 TRP 25 -6.634 -7.159 -6.768 175 2HB TRP 25 HB3 TRP 25 -8.218 -6.434 -6.612 176 HD1 TRP 25 HD1 TRP 25 -9.030 -5.209 -9.107 177 HE1 TRP 25 HE1 TRP 25 -8.762 -6.035 -11.491 178 HE3 TRP 25 HE3 TRP 25 -5.486 -8.815 -8.295 179 HZ2 TRP 25 HZ2 TRP 25 -6.954 -7.839 -12.939 180 HZ3 TRP 25 HZ3 TRP 25 -4.444 -9.998 -10.195 181 HH2 TRP 25 HH2 TRP 25 -5.172 -9.515 -12.524 182 H ALA 26 HN ALA 26 -4.075 -5.680 -7.087 183 HA ALA 26 HA ALA 26 -3.873 -5.503 -9.919 184 1HB ALA 26 HB1 ALA 26 -2.707 -3.242 -8.284 185 2HB ALA 26 HB2 ALA 26 -2.050 -3.641 -9.881 186 3HB ALA 26 HB3 ALA 26 -3.719 -3.115 -9.744 187 HA PRO 27 HA PRO 27 -0.454 -8.147 -9.176 188 1HB PRO 27 HB2 PRO 27 1.227 -6.416 -10.993 189 2HB PRO 27 HB3 PRO 27 1.032 -8.196 -11.002 190 1HG PRO 27 HG2 PRO 27 -0.316 -6.655 -12.787 191 2HG PRO 27 HG3 PRO 27 -1.166 -8.015 -11.969 192 1HD PRO 27 HD2 PRO 27 -1.253 -5.078 -11.341 193 2HD PRO 27 HD3 PRO 27 -2.583 -6.274 -11.396 194 H TRP 28 HN TRP 28 0.020 -4.774 -8.307 195 HA TRP 28 HA TRP 28 2.692 -4.803 -7.429 196 1HB TRP 28 HB2 TRP 28 0.498 -3.235 -6.119 197 2HB TRP 28 HB3 TRP 28 2.195 -2.818 -6.282 198 HD1 TRP 28 HD1 TRP 28 -1.032 -2.162 -7.690 199 HE1 TRP 28 HE1 TRP 28 -0.978 -0.899 -9.927 200 HE3 TRP 28 HE3 TRP 28 3.895 -2.845 -8.766 201 HZ2 TRP 28 HZ2 TRP 28 1.013 -0.368 -11.984 202 HZ3 TRP 28 HZ3 TRP 28 4.857 -1.968 -10.879 203 HH2 TRP 28 HH2 TRP 28 3.425 -0.731 -12.494 204 H CYS 29 HN CYS 29 -0.075 -6.388 -5.894 205 HA CYS 29 HA CYS 29 1.599 -6.789 -3.475 206 1HB CYS 29 HB2 CYS 29 -0.472 -4.923 -3.662 207 2HB CYS 29 HB3 CYS 29 -1.271 -6.296 -2.944 208 H GLY 30 HN GLY 30 0.991 -8.517 -2.125 209 1HA GLY 30 HA2 GLY 30 0.169 -10.914 -3.416 210 2HA GLY 30 HA3 GLY 30 0.414 -10.669 -1.682 211 HA PRO 31 HA PRO 31 -3.928 -10.407 -0.730 212 1HB PRO 31 HB2 PRO 31 -4.030 -7.401 -0.936 213 2HB PRO 31 HB3 PRO 31 -4.827 -8.465 0.271 214 1HG PRO 31 HG2 PRO 31 -2.489 -7.235 0.903 215 2HG PRO 31 HG3 PRO 31 -2.692 -8.974 1.297 216 1HD PRO 31 HD2 PRO 31 -1.221 -7.724 -1.022 217 2HD PRO 31 HD3 PRO 31 -0.740 -9.114 -0.005 218 H SER 32 HN SER 32 -3.123 -8.351 -3.588 219 HA SER 32 HA SER 32 -5.677 -8.303 -4.749 220 1HB SER 32 HB2 SER 32 -3.031 -8.708 -6.207 221 2HB SER 32 HB3 SER 32 -4.441 -7.803 -6.768 222 HG SER 32 HG SER 32 -2.600 -6.607 -5.920 223 H LYS 33 HN LYS 33 -3.592 -11.037 -4.277 224 HA LYS 33 HA LYS 33 -5.279 -12.644 -6.133 225 1HB LYS 33 HB2 LYS 33 -2.603 -13.523 -5.053 226 2HB LYS 33 HB3 LYS 33 -3.603 -14.225 -6.327 227 1HG LYS 33 HG2 LYS 33 -1.969 -13.229 -7.570 228 2HG LYS 33 HG3 LYS 33 -3.222 -11.985 -7.610 229 1HD LYS 33 HD2 LYS 33 -2.035 -10.759 -5.802 230 2HD LYS 33 HD3 LYS 33 -0.821 -12.023 -5.701 231 1HE LYS 33 HE2 LYS 33 -1.380 -10.314 -8.172 232 2HE LYS 33 HE3 LYS 33 -0.146 -9.949 -6.962 233 1HZ LYS 33 HZ1 LYS 33 -0.187 -12.383 -8.659 234 2HZ LYS 33 HZ2 LYS 33 0.816 -11.112 -8.835 235 3HZ LYS 33 HZ3 LYS 33 0.937 -12.054 -7.516 236 H MET 34 HN MET 34 -5.506 -11.787 -3.061 237 HA MET 34 HA MET 34 -6.334 -14.507 -2.118 238 1HB MET 34 HB2 MET 34 -5.272 -12.236 -0.398 239 2HB MET 34 HB3 MET 34 -5.847 -13.813 0.155 240 1HG MET 34 HG2 MET 34 -4.040 -14.879 -1.253 241 2HG MET 34 HG3 MET 34 -3.380 -13.269 -1.536 242 1HE MET 34 HE1 MET 34 -3.732 -11.817 1.347 243 2HE MET 34 HE2 MET 34 -2.158 -12.213 2.062 244 3HE MET 34 HE3 MET 34 -2.253 -11.756 0.350 245 H ILE 35 HN ILE 35 -6.927 -10.936 -1.922 246 HA ILE 35 HA ILE 35 -9.581 -11.177 -0.967 247 HB ILE 35 HB ILE 35 -7.894 -9.119 -1.234 248 1HG1 ILE 35 HG12 ILE 35 -10.010 -7.579 -1.086 249 2HG1 ILE 35 HG13 ILE 35 -10.919 -9.094 -1.113 250 1HG2 ILE 35 HG21 ILE 35 -8.508 -7.539 -2.944 251 2HG2 ILE 35 HG22 ILE 35 -7.882 -9.020 -3.673 252 3HG2 ILE 35 HG23 ILE 35 -9.635 -8.691 -3.679 253 1HD1 ILE 35 HD11 ILE 35 -9.635 -9.877 0.872 254 2HD1 ILE 35 HD12 ILE 35 -8.642 -8.401 0.808 255 3HD1 ILE 35 HD13 ILE 35 -10.373 -8.294 1.196 256 H ALA 36 HN ALA 36 -8.127 -11.288 -4.230 257 HA ALA 36 HA ALA 36 -10.435 -11.186 -5.756 258 1HB ALA 36 HB1 ALA 36 -8.365 -11.021 -6.872 259 2HB ALA 36 HB2 ALA 36 -7.770 -12.574 -6.273 260 3HB ALA 36 HB3 ALA 36 -9.088 -12.524 -7.464 261 HA PRO 37 HA PRO 37 -11.120 -15.945 -5.510 262 1HB PRO 37 HB2 PRO 37 -9.914 -17.112 -3.184 263 2HB PRO 37 HB3 PRO 37 -9.508 -17.417 -4.908 264 1HG PRO 37 HG2 PRO 37 -8.166 -15.682 -2.900 265 2HG PRO 37 HG3 PRO 37 -7.458 -16.466 -4.340 266 1HD PRO 37 HD2 PRO 37 -7.994 -13.768 -4.218 267 2HD PRO 37 HD3 PRO 37 -8.053 -14.708 -5.726 268 H VAL 38 HN VAL 38 -10.533 -14.184 -2.415 269 HA VAL 38 HA VAL 38 -12.694 -15.283 -0.991 270 HB VAL 38 HB VAL 38 -10.969 -12.843 -0.829 271 1HG1 VAL 38 HG11 VAL 38 -13.560 -13.033 0.692 272 2HG1 VAL 38 HG12 VAL 38 -12.147 -12.105 1.275 273 3HG1 VAL 38 HG13 VAL 38 -12.921 -11.691 -0.263 274 1HG2 VAL 38 HG21 VAL 38 -10.359 -13.819 1.296 275 2HG2 VAL 38 HG22 VAL 38 -11.673 -15.015 1.168 276 3HG2 VAL 38 HG23 VAL 38 -10.306 -15.067 0.032 277 H LEU 39 HN LEU 39 -12.646 -12.545 -3.320 278 HA LEU 39 HA LEU 39 -15.390 -11.837 -2.836 279 1HB LEU 39 HB2 LEU 39 -13.625 -11.444 -5.284 280 2HB LEU 39 HB3 LEU 39 -15.258 -10.820 -5.158 281 HG LEU 39 HG LEU 39 -13.003 -10.152 -3.185 282 1HD1 LEU 39 HD11 LEU 39 -12.458 -9.359 -5.442 283 2HD1 LEU 39 HD12 LEU 39 -13.994 -8.456 -5.499 284 3HD1 LEU 39 HD13 LEU 39 -12.743 -8.045 -4.305 285 1HD2 LEU 39 HD21 LEU 39 -15.671 -8.777 -3.549 286 2HD2 LEU 39 HD22 LEU 39 -15.194 -9.783 -2.166 287 3HD2 LEU 39 HD23 LEU 39 -14.361 -8.261 -2.476 288 H GLU 40 HN GLU 40 -13.839 -14.078 -5.216 289 HA GLU 40 HA GLU 40 -16.302 -14.632 -6.530 290 1HB GLU 40 HB2 GLU 40 -13.793 -16.330 -6.369 291 2HB GLU 40 HB3 GLU 40 -15.175 -16.576 -7.464 292 1HG GLU 40 HG2 GLU 40 -14.784 -14.368 -8.490 293 2HG GLU 40 HG3 GLU 40 -13.384 -14.115 -7.451 294 H GLU 41 HN GLU 41 -14.724 -16.110 -3.665 295 HA GLU 41 HA GLU 41 -16.687 -18.158 -3.342 296 1HB GLU 41 HB2 GLU 41 -14.736 -16.859 -1.425 297 2HB GLU 41 HB3 GLU 41 -15.796 -18.193 -0.967 298 1HG GLU 41 HG2 GLU 41 -13.763 -18.287 -3.233 299 2HG GLU 41 HG3 GLU 41 -13.498 -18.928 -1.615 300 H LEU 42 HN LEU 42 -16.469 -14.772 -2.250 301 HA LEU 42 HA LEU 42 -18.711 -14.782 -0.495 302 1HB LEU 42 HB2 LEU 42 -16.975 -13.019 -0.544 303 2HB LEU 42 HB3 LEU 42 -17.455 -12.572 -2.173 304 HG LEU 42 HG LEU 42 -19.701 -11.879 -1.327 305 1HD1 LEU 42 HD11 LEU 42 -19.932 -11.478 1.085 306 2HD1 LEU 42 HD12 LEU 42 -19.740 -13.206 0.790 307 3HD1 LEU 42 HD13 LEU 42 -18.358 -12.256 1.381 308 1HD2 LEU 42 HD21 LEU 42 -17.931 -10.225 -1.701 309 2HD2 LEU 42 HD22 LEU 42 -18.822 -9.802 -0.230 310 3HD2 LEU 42 HD23 LEU 42 -17.226 -10.581 -0.116 311 H ASP 43 HN ASP 43 -18.445 -14.052 -4.025 312 HA ASP 43 HA ASP 43 -21.223 -13.430 -4.255 313 1HB ASP 43 HB2 ASP 43 -19.614 -12.634 -5.916 314 2HB ASP 43 HB3 ASP 43 -19.140 -14.295 -6.293 315 H GLN 44 HN GLN 44 -19.382 -16.453 -4.635 316 HA GLN 44 HA GLN 44 -21.550 -18.054 -5.577 317 1HB GLN 44 HB2 GLN 44 -18.996 -18.573 -4.046 318 2HB GLN 44 HB3 GLN 44 -20.139 -19.897 -4.348 319 1HG GLN 44 HG2 GLN 44 -19.966 -19.595 -6.740 320 2HG GLN 44 HG3 GLN 44 -19.000 -18.128 -6.528 321 1HE2 GLN 44 HE22 GLN 44 -16.879 -18.314 -5.605 322 2HE2 GLN 44 HE21 GLN 44 -16.019 -19.838 -5.394 323 H GLU 45 HN GLU 45 -20.797 -16.742 -2.393 324 HA GLU 45 HA GLU 45 -22.486 -18.621 -1.023 325 1HB GLU 45 HB2 GLU 45 -20.508 -18.203 0.142 326 2HB GLU 45 HB3 GLU 45 -20.424 -16.551 -0.427 327 1HG GLU 45 HG2 GLU 45 -20.661 -16.337 1.797 328 2HG GLU 45 HG3 GLU 45 -22.191 -15.871 1.092 329 H MET 46 HN MET 46 -22.508 -15.149 -1.708 330 HA MET 46 HA MET 46 -25.402 -15.042 -1.006 331 1HB MET 46 HB2 MET 46 -24.860 -12.935 0.219 332 2HB MET 46 HB3 MET 46 -24.278 -14.420 0.970 333 1HG MET 46 HG2 MET 46 -22.007 -13.993 0.095 334 2HG MET 46 HG3 MET 46 -22.557 -12.539 -0.721 335 1HE MET 46 HE1 MET 46 -23.103 -10.477 0.320 336 2HE MET 46 HE2 MET 46 -24.484 -11.075 1.272 337 3HE MET 46 HE3 MET 46 -23.202 -10.073 2.055 338 H GLY 47 HN GLY 47 -23.649 -14.859 -3.571 339 1HA GLY 47 HA2 GLY 47 -24.071 -12.250 -4.641 340 2HA GLY 47 HA3 GLY 47 -23.904 -13.773 -5.566 341 H ASP 48 HN ASP 48 -26.393 -14.421 -3.692 342 HA ASP 48 HA ASP 48 -28.461 -13.888 -5.622 343 1HB ASP 48 HB2 ASP 48 -28.596 -15.819 -4.107 344 2HB ASP 48 HB3 ASP 48 -28.615 -14.739 -2.711 345 H LYS 49 HN LYS 49 -27.034 -12.123 -2.971 346 HA LYS 49 HA LYS 49 -29.130 -10.085 -3.147 347 1HB LYS 49 HB2 LYS 49 -27.337 -10.331 -0.762 348 2HB LYS 49 HB3 LYS 49 -28.988 -9.735 -0.879 349 1HG LYS 49 HG2 LYS 49 -29.404 -11.638 0.250 350 2HG LYS 49 HG3 LYS 49 -29.501 -12.325 -1.386 351 1HD LYS 49 HD2 LYS 49 -27.455 -13.446 -1.174 352 2HD LYS 49 HD3 LYS 49 -26.827 -12.249 -0.038 353 1HE LYS 49 HE2 LYS 49 -27.089 -14.287 1.133 354 2HE LYS 49 HE3 LYS 49 -28.201 -13.067 1.753 355 1HZ LYS 49 HZ1 LYS 49 -29.991 -14.159 0.486 356 2HZ LYS 49 HZ2 LYS 49 -28.955 -15.306 -0.058 357 3HZ LYS 49 HZ3 LYS 49 -29.304 -15.202 1.526 358 H LEU 50 HN LEU 50 -25.839 -10.669 -3.841 359 HA LEU 50 HA LEU 50 -25.054 -7.851 -3.406 360 1HB LEU 50 HB2 LEU 50 -24.092 -9.405 -1.759 361 2HB LEU 50 HB3 LEU 50 -23.527 -10.455 -3.059 362 HG LEU 50 HG LEU 50 -21.949 -8.682 -3.814 363 1HD1 LEU 50 HD11 LEU 50 -21.503 -6.779 -2.264 364 2HD1 LEU 50 HD12 LEU 50 -23.101 -6.658 -2.990 365 3HD1 LEU 50 HD13 LEU 50 -22.948 -7.234 -1.323 366 1HD2 LEU 50 HD21 LEU 50 -21.634 -9.421 -0.895 367 2HD2 LEU 50 HD22 LEU 50 -21.257 -10.467 -2.282 368 3HD2 LEU 50 HD23 LEU 50 -20.354 -8.961 -2.037 369 H LYS 51 HN LYS 51 -23.633 -6.906 -4.861 370 HA LYS 51 HA LYS 51 -22.798 -8.479 -7.266 371 1HB LYS 51 HB2 LYS 51 -24.625 -6.860 -7.812 372 2HB LYS 51 HB3 LYS 51 -23.646 -5.562 -7.118 373 1HG LYS 51 HG2 LYS 51 -21.912 -5.941 -8.881 374 2HG LYS 51 HG3 LYS 51 -22.934 -7.215 -9.582 375 1HD LYS 51 HD2 LYS 51 -24.756 -5.537 -9.898 376 2HD LYS 51 HD3 LYS 51 -23.709 -4.287 -9.190 377 1HE LYS 51 HE2 LYS 51 -22.034 -4.727 -11.021 378 2HE LYS 51 HE3 LYS 51 -23.185 -5.851 -11.759 379 1HZ LYS 51 HZ1 LYS 51 -23.312 -3.620 -12.708 380 2HZ LYS 51 HZ2 LYS 51 -24.741 -4.001 -11.988 381 3HZ LYS 51 HZ3 LYS 51 -23.680 -2.975 -11.245 382 H ILE 52 HN ILE 52 -20.601 -7.901 -7.996 383 HA ILE 52 HA ILE 52 -19.037 -6.354 -6.012 384 HB ILE 52 HB ILE 52 -18.385 -9.095 -7.140 385 1HG1 ILE 52 HG12 ILE 52 -18.964 -8.226 -4.269 386 2HG1 ILE 52 HG13 ILE 52 -20.040 -9.174 -5.298 387 1HG2 ILE 52 HG21 ILE 52 -16.754 -7.269 -5.311 388 2HG2 ILE 52 HG22 ILE 52 -16.326 -8.933 -5.760 389 3HG2 ILE 52 HG23 ILE 52 -16.356 -7.697 -6.992 390 1HD1 ILE 52 HD11 ILE 52 -18.220 -10.936 -5.439 391 2HD1 ILE 52 HD12 ILE 52 -17.428 -10.088 -4.099 392 3HD1 ILE 52 HD13 ILE 52 -19.053 -10.749 -3.885 393 H VAL 53 HN VAL 53 -17.409 -5.078 -7.037 394 HA VAL 53 HA VAL 53 -17.030 -5.473 -9.956 395 HB VAL 53 HB VAL 53 -17.431 -2.707 -8.762 396 1HG1 VAL 53 HG11 VAL 53 -17.540 -3.798 -11.593 397 2HG1 VAL 53 HG12 VAL 53 -17.864 -2.124 -11.101 398 3HG1 VAL 53 HG13 VAL 53 -16.248 -2.819 -10.856 399 1HG2 VAL 53 HG21 VAL 53 -19.616 -4.361 -10.105 400 2HG2 VAL 53 HG22 VAL 53 -19.577 -3.879 -8.407 401 3HG2 VAL 53 HG23 VAL 53 -19.709 -2.645 -9.654 402 H LYS 54 HN LYS 54 -14.878 -5.627 -10.403 403 HA LYS 54 HA LYS 54 -12.893 -4.807 -8.404 404 1HB LYS 54 HB2 LYS 54 -12.560 -6.026 -11.184 405 2HB LYS 54 HB3 LYS 54 -11.284 -5.850 -9.988 406 1HG LYS 54 HG2 LYS 54 -13.761 -7.565 -9.660 407 2HG LYS 54 HG3 LYS 54 -12.217 -8.166 -10.217 408 1HD LYS 54 HD2 LYS 54 -12.720 -6.915 -7.483 409 2HD LYS 54 HD3 LYS 54 -12.707 -8.638 -7.809 410 1HE LYS 54 HE2 LYS 54 -10.322 -6.743 -8.045 411 2HE LYS 54 HE3 LYS 54 -10.598 -7.912 -6.782 412 1HZ LYS 54 HZ1 LYS 54 -9.080 -8.809 -8.389 413 2HZ LYS 54 HZ2 LYS 54 -10.457 -9.687 -8.481 414 3HZ LYS 54 HZ3 LYS 54 -10.105 -8.576 -9.632 415 H ILE 55 HN ILE 55 -11.220 -3.306 -8.839 416 HA ILE 55 HA ILE 55 -11.242 -1.784 -11.386 417 HB ILE 55 HB ILE 55 -11.015 -0.785 -8.509 418 1HG1 ILE 55 HG12 ILE 55 -13.166 -0.494 -9.746 419 2HG1 ILE 55 HG13 ILE 55 -12.422 0.981 -9.151 420 1HG2 ILE 55 HG21 ILE 55 -9.601 0.366 -10.927 421 2HG2 ILE 55 HG22 ILE 55 -9.981 1.319 -9.471 422 3HG2 ILE 55 HG23 ILE 55 -8.954 -0.117 -9.355 423 1HD1 ILE 55 HD11 ILE 55 -13.299 1.378 -11.367 424 2HD1 ILE 55 HD12 ILE 55 -11.546 1.500 -11.419 425 3HD1 ILE 55 HD13 ILE 55 -12.339 0.044 -12.048 426 H ASP 56 HN ASP 56 -9.444 -2.446 -12.432 427 HA ASP 56 HA ASP 56 -7.221 -3.776 -11.027 428 1HB ASP 56 HB2 ASP 56 -7.930 -4.567 -13.250 429 2HB ASP 56 HB3 ASP 56 -7.574 -2.987 -13.946 430 H VAL 57 HN VAL 57 -6.010 -2.323 -9.811 431 HA VAL 57 HA VAL 57 -5.811 0.400 -10.660 432 HB VAL 57 HB VAL 57 -4.642 0.882 -8.660 433 1HG1 VAL 57 HG11 VAL 57 -7.138 -0.774 -8.202 434 2HG1 VAL 57 HG12 VAL 57 -6.510 0.512 -7.148 435 3HG1 VAL 57 HG13 VAL 57 -7.074 0.919 -8.776 436 1HG2 VAL 57 HG21 VAL 57 -4.929 -2.053 -7.949 437 2HG2 VAL 57 HG22 VAL 57 -3.417 -1.124 -8.137 438 3HG2 VAL 57 HG23 VAL 57 -4.540 -0.772 -6.809 439 H ASP 58 HN ASP 58 -4.781 -0.905 -12.651 440 HA ASP 58 HA ASP 58 -2.345 0.663 -12.915 441 1HB ASP 58 HB2 ASP 58 -1.259 -1.427 -12.309 442 2HB ASP 58 HB3 ASP 58 -2.328 -2.360 -13.356 443 H GLU 59 HN GLU 59 -4.615 -1.760 -14.435 444 HA GLU 59 HA GLU 59 -4.392 -0.510 -17.062 445 1HB GLU 59 HB2 GLU 59 -4.754 -2.721 -17.359 446 2HB GLU 59 HB3 GLU 59 -5.575 -2.932 -15.819 447 1HG GLU 59 HG2 GLU 59 -7.596 -1.976 -16.661 448 2HG GLU 59 HG3 GLU 59 -6.863 -1.718 -18.260 449 H ASN 60 HN ASN 60 -6.590 -0.368 -14.299 450 HA ASN 60 HA ASN 60 -8.271 1.663 -15.655 451 1HB ASN 60 HB2 ASN 60 -9.063 -1.019 -14.503 452 2HB ASN 60 HB3 ASN 60 -10.180 0.311 -14.278 453 1HD2 ASN 60 HD22 ASN 60 -9.954 -2.231 -16.243 454 2HD2 ASN 60 HD21 ASN 60 -10.580 -1.511 -17.703 455 H GLN 61 HN GLN 61 -6.129 2.054 -13.849 456 HA GLN 61 HA GLN 61 -7.147 2.197 -11.208 457 1HB GLN 61 HB2 GLN 61 -5.022 2.891 -10.528 458 2HB GLN 61 HB3 GLN 61 -4.754 1.860 -11.930 459 1HG GLN 61 HG2 GLN 61 -4.449 3.881 -13.350 460 2HG GLN 61 HG3 GLN 61 -4.521 4.860 -11.881 461 1HE2 GLN 61 HE22 GLN 61 -2.966 3.837 -9.976 462 2HE2 GLN 61 HE21 GLN 61 -1.362 3.482 -10.535 463 H GLU 62 HN GLU 62 -7.778 4.196 -13.789 464 HA GLU 62 HA GLU 62 -7.441 6.840 -12.936 465 1HB GLU 62 HB2 GLU 62 -9.319 5.387 -14.810 466 2HB GLU 62 HB3 GLU 62 -9.483 7.141 -14.560 467 1HG GLU 62 HG2 GLU 62 -7.099 7.440 -15.217 468 2HG GLU 62 HG3 GLU 62 -6.963 5.706 -15.506 469 H THR 63 HN THR 63 -10.340 4.684 -12.439 470 HA THR 63 HA THR 63 -11.927 6.463 -10.978 471 HB THR 63 HB THR 63 -11.471 3.486 -10.557 472 HG1 THR 63 HG1 THR 63 -13.301 3.417 -12.060 473 1HG2 THR 63 HG21 THR 63 -13.964 5.115 -9.924 474 2HG2 THR 63 HG22 THR 63 -13.761 3.353 -9.744 475 3HG2 THR 63 HG23 THR 63 -12.845 4.435 -8.720 476 H ALA 64 HN ALA 64 -9.149 4.515 -9.961 477 HA ALA 64 HA ALA 64 -9.702 4.711 -7.159 478 1HB ALA 64 HB1 ALA 64 -8.441 2.864 -8.388 479 2HB ALA 64 HB2 ALA 64 -7.070 3.949 -8.526 480 3HB ALA 64 HB3 ALA 64 -7.645 3.467 -6.922 481 H GLY 65 HN GLY 65 -6.872 5.897 -9.000 482 1HA GLY 65 HA2 GLY 65 -5.896 7.884 -7.403 483 2HA GLY 65 HA3 GLY 65 -5.941 7.996 -9.178 484 H LYS 66 HN LYS 66 -8.699 8.335 -9.681 485 HA LYS 66 HA LYS 66 -9.024 11.100 -9.121 486 1HB LYS 66 HB2 LYS 66 -9.939 9.990 -11.097 487 2HB LYS 66 HB3 LYS 66 -11.013 9.011 -10.077 488 1HG LYS 66 HG2 LYS 66 -12.267 11.006 -9.405 489 2HG LYS 66 HG3 LYS 66 -11.091 12.056 -10.216 490 1HD LYS 66 HD2 LYS 66 -13.089 11.842 -11.575 491 2HD LYS 66 HD3 LYS 66 -11.709 11.090 -12.395 492 1HE LYS 66 HE2 LYS 66 -12.528 8.850 -11.457 493 2HE LYS 66 HE3 LYS 66 -13.987 9.695 -10.916 494 1HZ LYS 66 HZ1 LYS 66 -14.341 10.288 -13.292 495 2HZ LYS 66 HZ2 LYS 66 -13.021 9.359 -13.698 496 3HZ LYS 66 HZ3 LYS 66 -14.311 8.653 -13.050 497 H TYR 67 HN TYR 67 -10.560 8.168 -7.579 498 HA TYR 67 HA TYR 67 -12.296 9.792 -6.008 499 1HB TYR 67 HB2 TYR 67 -12.674 7.375 -6.608 500 2HB TYR 67 HB3 TYR 67 -11.424 6.928 -5.454 501 HD1 TYR 67 HD1 TYR 67 -14.760 8.562 -5.853 502 HD2 TYR 67 HD2 TYR 67 -11.958 6.834 -3.062 503 HE1 TYR 67 HE1 TYR 67 -16.469 8.682 -4.071 504 HE2 TYR 67 HE2 TYR 67 -13.661 6.940 -1.276 505 HH TYR 67 HH TYR 67 -16.941 8.315 -1.818 506 H GLY 68 HN GLY 68 -8.996 8.658 -5.655 507 1HA GLY 68 HA2 GLY 68 -7.404 9.726 -4.189 508 2HA GLY 68 HA3 GLY 68 -8.695 10.016 -3.002 509 H VAL 69 HN VAL 69 -7.053 7.353 -4.834 510 HA VAL 69 HA VAL 69 -7.109 5.545 -2.547 511 HB VAL 69 HB VAL 69 -8.423 4.914 -5.244 512 1HG1 VAL 69 HG11 VAL 69 -7.529 3.030 -3.077 513 2HG1 VAL 69 HG12 VAL 69 -8.615 2.587 -4.427 514 3HG1 VAL 69 HG13 VAL 69 -6.949 3.085 -4.743 515 1HG2 VAL 69 HG21 VAL 69 -9.570 4.733 -2.454 516 2HG2 VAL 69 HG22 VAL 69 -10.014 5.886 -3.731 517 3HG2 VAL 69 HG23 VAL 69 -10.351 4.169 -3.958 518 H MET 70 HN MET 70 -5.082 4.678 -2.608 519 HA MET 70 HA MET 70 -3.548 4.661 -5.136 520 1HB MET 70 HB2 MET 70 -2.496 5.969 -2.647 521 2HB MET 70 HB3 MET 70 -1.745 5.939 -4.245 522 1HG MET 70 HG2 MET 70 -3.688 7.367 -5.058 523 2HG MET 70 HG3 MET 70 -4.206 7.501 -3.378 524 1HE MET 70 HE1 MET 70 -1.170 9.295 -1.691 525 2HE MET 70 HE2 MET 70 -2.612 8.280 -1.461 526 3HE MET 70 HE3 MET 70 -1.092 7.559 -2.071 527 H SER 71 HN SER 71 -4.733 2.709 -2.997 528 HA SER 71 HA SER 71 -2.255 1.375 -2.160 529 1HB SER 71 HB2 SER 71 -3.849 1.030 -0.045 530 2HB SER 71 HB3 SER 71 -2.920 2.518 -0.262 531 HG SER 71 HG SER 71 -5.686 2.113 -0.807 532 H ILE 72 HN ILE 72 -2.580 -0.888 -1.389 533 HA ILE 72 HA ILE 72 -4.808 -2.164 -2.836 534 HB ILE 72 HB ILE 72 -2.288 -3.704 -2.545 535 1HG1 ILE 72 HG12 ILE 72 -1.344 -1.571 -3.256 536 2HG1 ILE 72 HG13 ILE 72 -1.105 -2.886 -4.377 537 1HG2 ILE 72 HG21 ILE 72 -4.382 -3.455 -4.730 538 2HG2 ILE 72 HG22 ILE 72 -2.923 -4.455 -4.845 539 3HG2 ILE 72 HG23 ILE 72 -4.121 -4.812 -3.602 540 1HD1 ILE 72 HD11 ILE 72 -2.636 -2.017 -5.950 541 2HD1 ILE 72 HD12 ILE 72 -3.289 -0.823 -4.808 542 3HD1 ILE 72 HD13 ILE 72 -1.626 -0.670 -5.376 543 HA PRO 73 HA PRO 73 -6.149 -3.705 -2.653 544 1HB PRO 73 HB2 PRO 73 -8.040 -5.258 -1.538 545 2HB PRO 73 HB3 PRO 73 -6.496 -5.954 -2.122 546 1HG PRO 73 HG2 PRO 73 -7.311 -5.305 0.706 547 2HG PRO 73 HG3 PRO 73 -6.418 -6.726 0.107 548 1HD PRO 73 HD2 PRO 73 -5.250 -4.412 1.226 549 2HD PRO 73 HD3 PRO 73 -4.386 -5.560 0.181 550 H THR 74 HN THR 74 -7.525 -1.928 -2.842 551 HA THR 74 HA THR 74 -8.597 -0.741 -0.296 552 HB THR 74 HB THR 74 -8.501 0.513 -3.052 553 HG1 THR 74 HG1 THR 74 -6.520 0.556 -2.191 554 1HG2 THR 74 HG21 THR 74 -10.438 1.412 -2.022 555 2HG2 THR 74 HG22 THR 74 -9.709 1.386 -0.407 556 3HG2 THR 74 HG23 THR 74 -9.161 2.563 -1.603 557 H LEU 75 HN LEU 75 -10.846 -0.609 -0.004 558 HA LEU 75 HA LEU 75 -12.583 -2.036 -1.962 559 1HB LEU 75 HB2 LEU 75 -11.440 -3.518 -0.190 560 2HB LEU 75 HB3 LEU 75 -12.427 -2.688 1.009 561 HG LEU 75 HG LEU 75 -13.528 -4.173 -1.431 562 1HD1 LEU 75 HD11 LEU 75 -12.284 -5.732 0.027 563 2HD1 LEU 75 HD12 LEU 75 -13.276 -5.197 1.430 564 3HD1 LEU 75 HD13 LEU 75 -14.020 -6.032 0.063 565 1HD2 LEU 75 HD21 LEU 75 -15.223 -2.724 -0.676 566 2HD2 LEU 75 HD22 LEU 75 -15.574 -4.231 0.162 567 3HD2 LEU 75 HD23 LEU 75 -14.785 -2.930 1.046 568 H LEU 76 HN LEU 76 -14.338 -0.865 -2.300 569 HA LEU 76 HA LEU 76 -15.160 1.183 -0.343 570 1HB LEU 76 HB2 LEU 76 -15.500 1.491 -3.348 571 2HB LEU 76 HB3 LEU 76 -15.819 2.664 -2.083 572 HG LEU 76 HG LEU 76 -13.105 1.781 -3.135 573 1HD1 LEU 76 HD11 LEU 76 -12.955 4.085 -3.930 574 2HD1 LEU 76 HD12 LEU 76 -14.383 3.286 -4.599 575 3HD1 LEU 76 HD13 LEU 76 -14.564 4.445 -3.268 576 1HD2 LEU 76 HD21 LEU 76 -13.694 3.852 -0.983 577 2HD2 LEU 76 HD22 LEU 76 -12.951 2.261 -0.687 578 3HD2 LEU 76 HD23 LEU 76 -12.103 3.466 -1.665 579 H VAL 77 HN VAL 77 -17.059 0.315 0.452 580 HA VAL 77 HA VAL 77 -18.696 -1.414 -1.340 581 HB VAL 77 HB VAL 77 -19.436 -0.858 1.528 582 1HG1 VAL 77 HG11 VAL 77 -20.297 -3.208 1.272 583 2HG1 VAL 77 HG12 VAL 77 -21.005 -2.055 0.123 584 3HG1 VAL 77 HG13 VAL 77 -19.753 -3.211 -0.400 585 1HG2 VAL 77 HG21 VAL 77 -17.432 -2.989 0.709 586 2HG2 VAL 77 HG22 VAL 77 -17.079 -1.582 1.748 587 3HG2 VAL 77 HG23 VAL 77 -18.204 -2.824 2.298 588 H LEU 78 HN LEU 78 -20.760 -0.756 -2.057 589 HA LEU 78 HA LEU 78 -21.544 2.016 -1.372 590 1HB LEU 78 HB2 LEU 78 -21.674 0.717 -4.132 591 2HB LEU 78 HB3 LEU 78 -22.179 2.334 -3.702 592 HG LEU 78 HG LEU 78 -19.575 2.445 -2.874 593 1HD1 LEU 78 HD11 LEU 78 -19.104 0.140 -3.780 594 2HD1 LEU 78 HD12 LEU 78 -19.513 0.723 -5.392 595 3HD1 LEU 78 HD13 LEU 78 -18.120 1.401 -4.526 596 1HD2 LEU 78 HD21 LEU 78 -19.107 3.683 -4.938 597 2HD2 LEU 78 HD22 LEU 78 -20.553 2.997 -5.702 598 3HD2 LEU 78 HD23 LEU 78 -20.709 4.089 -4.318 599 H LYS 79 HN LYS 79 -23.765 2.555 -1.744 600 HA LYS 79 HA LYS 79 -25.664 0.338 -2.225 601 1HB LYS 79 HB2 LYS 79 -25.858 2.316 0.101 602 2HB LYS 79 HB3 LYS 79 -27.213 1.384 -0.528 603 1HG LYS 79 HG2 LYS 79 -26.048 -0.720 0.031 604 2HG LYS 79 HG3 LYS 79 -24.696 0.184 0.670 605 1HD LYS 79 HD2 LYS 79 -26.116 -0.572 2.497 606 2HD LYS 79 HD3 LYS 79 -26.213 1.183 2.411 607 1HE LYS 79 HE2 LYS 79 -28.380 1.097 1.382 608 2HE LYS 79 HE3 LYS 79 -28.243 -0.641 1.069 609 1HZ LYS 79 HZ1 LYS 79 -29.648 -0.216 2.977 610 2HZ LYS 79 HZ2 LYS 79 -28.313 -1.031 3.459 611 3HZ LYS 79 HZ3 LYS 79 -28.462 0.580 3.760 612 H ASP 80 HN ASP 80 -26.921 0.968 -3.771 613 HA ASP 80 HA ASP 80 -27.905 2.194 -5.378 614 1HB ASP 80 HB2 ASP 80 -29.425 1.698 -3.467 615 2HB ASP 80 HB3 ASP 80 -29.166 3.334 -2.867 616 H GLY 81 HN GLY 81 -25.417 3.543 -5.043 617 1HA GLY 81 HA2 GLY 81 -25.450 5.744 -6.537 618 2HA GLY 81 HA3 GLY 81 -26.091 6.430 -5.021 619 H GLU 82 HN GLU 82 -24.475 4.906 -3.135 620 HA GLU 82 HA GLU 82 -21.975 6.392 -3.628 621 1HB GLU 82 HB2 GLU 82 -22.501 7.902 -1.869 622 2HB GLU 82 HB3 GLU 82 -23.986 7.744 -2.878 623 1HG GLU 82 HG2 GLU 82 -24.920 6.157 -1.210 624 2HG GLU 82 HG3 GLU 82 -23.508 6.401 -0.180 625 H VAL 83 HN VAL 83 -20.357 6.209 -1.965 626 HA VAL 83 HA VAL 83 -20.000 3.544 -0.937 627 HB VAL 83 HB VAL 83 -18.472 6.115 -0.358 628 1HG1 VAL 83 HG11 VAL 83 -17.608 3.211 0.032 629 2HG1 VAL 83 HG12 VAL 83 -16.588 4.637 0.284 630 3HG1 VAL 83 HG13 VAL 83 -17.971 4.360 1.335 631 1HG2 VAL 83 HG21 VAL 83 -16.827 5.262 -2.022 632 2HG2 VAL 83 HG22 VAL 83 -17.902 3.913 -2.400 633 3HG2 VAL 83 HG23 VAL 83 -18.390 5.580 -2.775 634 H VAL 84 HN VAL 84 -20.441 2.721 0.905 635 HA VAL 84 HA VAL 84 -21.564 4.378 3.115 636 HB VAL 84 HB VAL 84 -22.934 2.414 3.665 637 1HG1 VAL 84 HG11 VAL 84 -23.822 4.302 2.296 638 2HG1 VAL 84 HG12 VAL 84 -23.469 3.367 0.828 639 3HG1 VAL 84 HG13 VAL 84 -24.646 2.766 2.013 640 1HG2 VAL 84 HG21 VAL 84 -22.232 1.217 0.951 641 2HG2 VAL 84 HG22 VAL 84 -21.536 0.644 2.476 642 3HG2 VAL 84 HG23 VAL 84 -23.265 0.556 2.234 643 H GLU 85 HN GLU 85 -19.205 1.898 2.169 644 HA GLU 85 HA GLU 85 -18.075 2.083 4.836 645 1HB GLU 85 HB2 GLU 85 -19.117 -0.499 3.639 646 2HB GLU 85 HB3 GLU 85 -17.642 -0.552 4.579 647 1HG GLU 85 HG2 GLU 85 -20.285 0.511 5.644 648 2HG GLU 85 HG3 GLU 85 -19.719 -1.139 5.797 649 H THR 86 HN THR 86 -15.820 1.481 4.825 650 HA THR 86 HA THR 86 -14.559 1.283 2.159 651 HB THR 86 HB THR 86 -13.541 3.373 4.070 652 HG1 THR 86 HG1 THR 86 -15.675 4.001 3.968 653 1HG2 THR 86 HG21 THR 86 -13.853 3.191 1.094 654 2HG2 THR 86 HG22 THR 86 -12.932 4.457 1.952 655 3HG2 THR 86 HG23 THR 86 -12.359 2.774 1.982 656 H SER 87 HN SER 87 -12.480 0.308 2.313 657 HA SER 87 HA SER 87 -11.140 0.027 4.892 658 1HB SER 87 HB2 SER 87 -12.181 -2.373 3.322 659 2HB SER 87 HB3 SER 87 -10.926 -2.466 4.574 660 HG SER 87 HG SER 87 -13.202 -1.108 5.316 661 H VAL 88 HN VAL 88 -8.928 -0.610 4.583 662 HA VAL 88 HA VAL 88 -7.935 -0.675 1.799 663 HB VAL 88 HB VAL 88 -6.877 1.277 3.885 664 1HG1 VAL 88 HG11 VAL 88 -5.596 2.139 1.962 665 2HG1 VAL 88 HG12 VAL 88 -5.304 0.395 2.123 666 3HG1 VAL 88 HG13 VAL 88 -6.413 0.974 0.886 667 1HG2 VAL 88 HG21 VAL 88 -7.778 3.090 2.458 668 2HG2 VAL 88 HG22 VAL 88 -8.673 1.883 1.516 669 3HG2 VAL 88 HG23 VAL 88 -9.051 2.149 3.233 670 H GLY 89 HN GLY 89 -7.800 -2.937 2.477 671 1HA GLY 89 HA2 GLY 89 -5.349 -3.876 3.357 672 2HA GLY 89 HA3 GLY 89 -6.282 -3.704 4.846 673 H PHE 90 HN PHE 90 -5.348 -6.216 3.895 674 HA PHE 90 HA PHE 90 -7.326 -7.640 2.422 675 1HB PHE 90 HB2 PHE 90 -5.023 -8.439 2.579 676 2HB PHE 90 HB3 PHE 90 -5.146 -8.571 4.328 677 HD1 PHE 90 HD1 PHE 90 -5.806 -10.613 5.326 678 HD2 PHE 90 HD2 PHE 90 -6.728 -9.906 1.166 679 HE1 PHE 90 HE1 PHE 90 -6.740 -12.901 5.141 680 HE2 PHE 90 HE2 PHE 90 -7.714 -12.179 1.013 681 HZ PHE 90 HZ PHE 90 -7.699 -13.687 2.982 682 H LYS 91 HN LYS 91 -8.945 -9.101 3.140 683 HA LYS 91 HA LYS 91 -9.486 -9.359 6.012 684 1HB LYS 91 HB2 LYS 91 -11.380 -8.109 4.013 685 2HB LYS 91 HB3 LYS 91 -12.043 -9.344 5.030 686 1HG LYS 91 HG2 LYS 91 -12.550 -7.500 6.256 687 2HG LYS 91 HG3 LYS 91 -11.105 -8.090 7.054 688 1HD LYS 91 HD2 LYS 91 -10.994 -5.736 6.979 689 2HD LYS 91 HD3 LYS 91 -9.787 -6.281 5.836 690 1HE LYS 91 HE2 LYS 91 -12.609 -5.565 4.961 691 2HE LYS 91 HE3 LYS 91 -11.419 -4.307 5.273 692 1HZ LYS 91 HZ1 LYS 91 -9.979 -5.313 3.573 693 2HZ LYS 91 HZ2 LYS 91 -11.106 -6.452 3.245 694 3HZ LYS 91 HZ3 LYS 91 -11.416 -4.880 2.937 695 HA PRO 92 HA PRO 92 -10.099 -13.521 4.296 696 1HB PRO 92 HB2 PRO 92 -11.219 -14.786 6.450 697 2HB PRO 92 HB3 PRO 92 -9.484 -14.348 6.376 698 1HG PRO 92 HG2 PRO 92 -11.742 -12.801 7.685 699 2HG PRO 92 HG3 PRO 92 -10.158 -13.256 8.396 700 1HD PRO 92 HD2 PRO 92 -10.557 -10.796 7.312 701 2HD PRO 92 HD3 PRO 92 -9.004 -11.647 7.097 702 H LYS 93 HN LYS 93 -12.028 -15.024 4.016 703 HA LYS 93 HA LYS 93 -14.003 -13.689 2.619 704 1HB LYS 93 HB2 LYS 93 -13.182 -16.271 2.834 705 2HB LYS 93 HB3 LYS 93 -14.666 -16.407 3.749 706 1HG LYS 93 HG2 LYS 93 -14.332 -15.448 0.874 707 2HG LYS 93 HG3 LYS 93 -14.897 -17.028 1.372 708 1HD LYS 93 HD2 LYS 93 -16.348 -14.376 1.650 709 2HD LYS 93 HD3 LYS 93 -16.745 -15.711 0.587 710 1HE LYS 93 HE2 LYS 93 -16.936 -15.760 3.637 711 2HE LYS 93 HE3 LYS 93 -18.280 -15.537 2.528 712 1HZ LYS 93 HZ1 LYS 93 -16.635 -18.002 2.722 713 2HZ LYS 93 HZ2 LYS 93 -18.156 -17.814 3.263 714 3HZ LYS 93 HZ3 LYS 93 -17.860 -17.780 1.659 715 H GLU 94 HN GLU 94 -14.292 -14.973 5.957 716 HA GLU 94 HA GLU 94 -17.034 -14.304 6.212 717 1HB GLU 94 HB2 GLU 94 -14.864 -14.651 8.325 718 2HB GLU 94 HB3 GLU 94 -16.596 -14.494 8.671 719 1HG GLU 94 HG2 GLU 94 -17.053 -16.529 7.310 720 2HG GLU 94 HG3 GLU 94 -15.326 -16.715 7.004 721 H ALA 95 HN ALA 95 -14.049 -12.453 7.005 722 HA ALA 95 HA ALA 95 -15.447 -10.292 8.254 723 1HB ALA 95 HB1 ALA 95 -13.325 -9.079 8.007 724 2HB ALA 95 HB2 ALA 95 -13.047 -10.715 8.634 725 3HB ALA 95 HB3 ALA 95 -12.722 -10.350 6.921 726 H LEU 96 HN LEU 96 -14.542 -11.032 4.899 727 HA LEU 96 HA LEU 96 -15.252 -8.517 3.773 728 1HB LEU 96 HB2 LEU 96 -14.178 -10.897 2.817 729 2HB LEU 96 HB3 LEU 96 -15.795 -10.992 2.173 730 HG LEU 96 HG LEU 96 -14.517 -10.000 0.485 731 1HD1 LEU 96 HD11 LEU 96 -15.638 -7.497 1.773 732 2HD1 LEU 96 HD12 LEU 96 -15.427 -7.886 0.050 733 3HD1 LEU 96 HD13 LEU 96 -16.657 -8.720 1.002 734 1HD2 LEU 96 HD21 LEU 96 -12.534 -9.497 1.899 735 2HD2 LEU 96 HD22 LEU 96 -12.930 -8.181 0.784 736 3HD2 LEU 96 HD23 LEU 96 -13.354 -8.044 2.510 737 H GLN 97 HN GLN 97 -17.099 -11.572 4.123 738 HA GLN 97 HA GLN 97 -19.479 -10.494 3.008 739 1HB GLN 97 HB2 GLN 97 -20.380 -12.493 3.255 740 2HB GLN 97 HB3 GLN 97 -18.705 -12.986 3.391 741 1HG GLN 97 HG2 GLN 97 -18.941 -13.137 5.779 742 2HG GLN 97 HG3 GLN 97 -20.644 -12.620 5.669 743 1HE2 GLN 97 HE22 GLN 97 -22.005 -14.017 3.989 744 2HE2 GLN 97 HE21 GLN 97 -21.738 -15.745 4.046 745 H GLU 98 HN GLU 98 -18.274 -10.610 6.382 746 HA GLU 98 HA GLU 98 -20.568 -9.441 7.539 747 1HB GLU 98 HB2 GLU 98 -18.828 -10.491 8.854 748 2HB GLU 98 HB3 GLU 98 -17.640 -9.283 8.338 749 1HG GLU 98 HG2 GLU 98 -18.867 -7.513 9.497 750 2HG GLU 98 HG3 GLU 98 -20.164 -8.638 9.914 751 H LEU 99 HN LEU 99 -17.676 -7.890 6.074 752 HA LEU 99 HA LEU 99 -18.181 -5.259 6.802 753 1HB LEU 99 HB2 LEU 99 -16.077 -6.041 5.867 754 2HB LEU 99 HB3 LEU 99 -16.857 -6.330 4.308 755 HG LEU 99 HG LEU 99 -17.261 -3.921 4.016 756 1HD1 LEU 99 HD11 LEU 99 -17.466 -3.135 6.320 757 2HD1 LEU 99 HD12 LEU 99 -15.788 -3.618 6.671 758 3HD1 LEU 99 HD13 LEU 99 -16.127 -2.290 5.540 759 1HD2 LEU 99 HD21 LEU 99 -14.380 -4.550 4.698 760 2HD2 LEU 99 HD22 LEU 99 -15.201 -4.966 3.171 761 3HD2 LEU 99 HD23 LEU 99 -14.957 -3.268 3.615 762 H VAL 100 HN VAL 100 -19.627 -7.145 4.220 763 HA VAL 100 HA VAL 100 -21.092 -4.710 3.304 764 HB VAL 100 HB VAL 100 -19.990 -5.829 1.631 765 1HG1 VAL 100 HG11 VAL 100 -19.947 -8.176 2.393 766 2HG1 VAL 100 HG12 VAL 100 -21.690 -8.312 2.097 767 3HG1 VAL 100 HG13 VAL 100 -20.564 -8.043 0.750 768 1HG2 VAL 100 HG21 VAL 100 -22.937 -6.334 1.160 769 2HG2 VAL 100 HG22 VAL 100 -22.206 -4.720 1.212 770 3HG2 VAL 100 HG23 VAL 100 -21.677 -5.868 -0.013 771 H ASN 101 HN ASN 101 -21.769 -7.995 4.633 772 HA ASN 101 HA ASN 101 -24.572 -7.942 4.476 773 1HB ASN 101 HB2 ASN 101 -23.315 -9.955 5.000 774 2HB ASN 101 HB3 ASN 101 -22.800 -9.266 6.547 775 1HD2 ASN 101 HD22 ASN 101 -24.284 -9.258 8.308 776 2HD2 ASN 101 HD21 ASN 101 -25.865 -9.986 8.205 777 H LYS 102 HN LYS 102 -22.437 -6.284 6.764 778 HA LYS 102 HA LYS 102 -24.335 -5.817 8.813 779 1HB LYS 102 HB2 LYS 102 -22.833 -4.188 9.654 780 2HB LYS 102 HB3 LYS 102 -21.863 -5.460 8.920 781 1HG LYS 102 HG2 LYS 102 -22.086 -3.750 6.786 782 2HG LYS 102 HG3 LYS 102 -22.230 -2.590 8.113 783 1HD LYS 102 HD2 LYS 102 -20.014 -4.572 7.601 784 2HD LYS 102 HD3 LYS 102 -19.902 -2.838 7.332 785 1HE LYS 102 HE2 LYS 102 -20.287 -4.202 10.015 786 2HE LYS 102 HE3 LYS 102 -18.726 -3.743 9.325 787 1HZ LYS 102 HZ1 LYS 102 -19.531 -1.411 9.287 788 2HZ LYS 102 HZ2 LYS 102 -20.897 -1.860 10.077 789 3HZ LYS 102 HZ3 LYS 102 -19.450 -2.013 10.812 790 H HIS 103 HN HIS 103 -24.157 -4.322 5.634 791 HA HIS 103 HA HIS 103 -26.350 -2.455 6.420 792 1HB HIS 103 HB2 HIS 103 -25.315 -0.766 5.073 793 2HB HIS 103 HB3 HIS 103 -24.133 -1.389 6.226 794 HD1 HIS 103 HD1 HIS 103 -25.011 -2.152 2.495 795 HD2 HIS 103 HD2 HIS 103 -21.789 -1.928 5.190 796 HE1 HIS 103 HE1 HIS 103 -22.903 -2.447 1.127 797 H LEU 104 HN LEU 104 -25.349 -4.928 4.236 798 HA LEU 104 HA LEU 104 -27.085 -4.450 1.968 799 1HB LEU 104 HB2 LEU 104 -25.312 -5.969 1.674 800 2HB LEU 104 HB3 LEU 104 -25.593 -6.714 3.241 801 HG LEU 104 HG LEU 104 -27.574 -7.844 2.481 802 1HD1 LEU 104 HD11 LEU 104 -26.943 -6.689 -0.285 803 2HD1 LEU 104 HD12 LEU 104 -28.238 -7.831 0.109 804 3HD1 LEU 104 HD13 LEU 104 -28.315 -6.181 0.719 805 1HD2 LEU 104 HD21 LEU 104 -25.342 -8.861 2.275 806 2HD2 LEU 104 HD22 LEU 104 -26.471 -9.451 1.062 807 3HD2 LEU 104 HD23 LEU 104 -25.223 -8.266 0.601 808 1H MET 1 H1 MET 1 8.198 26.829 -11.168 809 2H MET 1 H2 MET 1 8.735 28.372 -11.206 810 3H MET 1 H3 MET 1 7.582 27.888 -12.267 811 HA MET 1 HA MET 1 6.631 29.220 -10.505 812 1HB MET 1 HB2 MET 1 5.438 27.153 -11.591 813 2HB MET 1 HB3 MET 1 5.704 26.357 -10.043 814 1HG MET 1 HG2 MET 1 4.234 28.997 -10.481 815 2HG MET 1 HG3 MET 1 3.466 27.423 -10.344 816 1HE MET 1 HE1 MET 1 1.778 28.356 -8.574 817 2HE MET 1 HE2 MET 1 2.267 29.222 -7.100 818 3HE MET 1 HE3 MET 1 2.547 29.957 -8.695 819 H GLU 2 HN GLU 2 6.734 29.779 -8.284 820 HA GLU 2 HA GLU 2 9.035 28.670 -6.930 821 1HB GLU 2 HB2 GLU 2 7.109 30.915 -6.182 822 2HB GLU 2 HB3 GLU 2 8.624 30.558 -5.337 823 1HG GLU 2 HG2 GLU 2 9.896 30.972 -7.432 824 2HG GLU 2 HG3 GLU 2 8.398 31.429 -8.246 825 H ASN 3 HN ASN 3 6.723 26.890 -7.068 826 HA ASN 3 HA ASN 3 6.940 25.693 -4.602 827 1HB ASN 3 HB2 ASN 3 4.267 27.042 -5.034 828 2HB ASN 3 HB3 ASN 3 4.300 25.307 -4.637 829 1HD2 ASN 3 HD22 ASN 3 6.648 27.622 -3.220 830 2HD2 ASN 3 HD21 ASN 3 6.065 27.369 -1.589 831 H LYS 4 HN LYS 4 6.969 23.873 -5.023 832 HA LYS 4 HA LYS 4 5.787 22.383 -7.237 833 1HB LYS 4 HB2 LYS 4 8.796 22.687 -6.732 834 2HB LYS 4 HB3 LYS 4 8.086 21.489 -7.830 835 1HG LYS 4 HG2 LYS 4 7.143 23.264 -9.234 836 2HG LYS 4 HG3 LYS 4 7.753 24.510 -8.142 837 1HD LYS 4 HD2 LYS 4 9.521 22.620 -9.677 838 2HD LYS 4 HD3 LYS 4 9.070 24.281 -10.152 839 1HE LYS 4 HE2 LYS 4 10.075 25.155 -8.066 840 2HE LYS 4 HE3 LYS 4 10.594 23.523 -7.633 841 1HZ LYS 4 HZ1 LYS 4 11.924 23.504 -9.696 842 2HZ LYS 4 HZ2 LYS 4 11.502 25.052 -10.007 843 3HZ LYS 4 HZ3 LYS 4 12.398 24.702 -8.681 844 H ILE 5 HN ILE 5 5.674 20.105 -6.586 845 HA ILE 5 HA ILE 5 6.281 19.745 -3.691 846 HB ILE 5 HB ILE 5 3.819 18.994 -5.296 847 1HG1 ILE 5 HG12 ILE 5 4.525 21.200 -3.377 848 2HG1 ILE 5 HG13 ILE 5 3.620 21.261 -4.877 849 1HG2 ILE 5 HG21 ILE 5 4.402 18.437 -2.362 850 2HG2 ILE 5 HG22 ILE 5 2.888 18.062 -3.236 851 3HG2 ILE 5 HG23 ILE 5 4.359 17.224 -3.674 852 1HD1 ILE 5 HD11 ILE 5 2.173 21.731 -3.021 853 2HD1 ILE 5 HD12 ILE 5 1.708 20.151 -3.714 854 3HD1 ILE 5 HD13 ILE 5 2.655 20.230 -2.197 855 H ILE 6 HN ILE 6 6.992 17.820 -3.024 856 HA ILE 6 HA ILE 6 7.312 15.606 -4.938 857 HB ILE 6 HB ILE 6 9.336 16.817 -5.311 858 1HG1 ILE 6 HG12 ILE 6 9.867 14.396 -3.538 859 2HG1 ILE 6 HG13 ILE 6 9.470 14.375 -5.260 860 1HG2 ILE 6 HG21 ILE 6 9.889 16.786 -2.327 861 2HG2 ILE 6 HG22 ILE 6 10.952 17.450 -3.588 862 3HG2 ILE 6 HG23 ILE 6 9.410 18.211 -3.269 863 1HD1 ILE 6 HD11 ILE 6 12.005 15.565 -4.044 864 2HD1 ILE 6 HD12 ILE 6 11.858 14.048 -4.941 865 3HD1 ILE 6 HD13 ILE 6 11.550 15.584 -5.765 866 H TYR 7 HN TYR 7 7.298 13.627 -3.938 867 HA TYR 7 HA TYR 7 6.414 13.676 -1.085 868 1HB TYR 7 HB2 TYR 7 4.780 13.392 -3.172 869 2HB TYR 7 HB3 TYR 7 5.420 11.767 -3.219 870 HD1 TYR 7 HD1 TYR 7 4.686 10.118 -1.526 871 HD2 TYR 7 HD2 TYR 7 3.530 14.265 -1.245 872 HE1 TYR 7 HE1 TYR 7 2.852 9.505 0.009 873 HE2 TYR 7 HE2 TYR 7 1.775 13.659 0.392 874 HH TYR 7 HH TYR 7 0.698 11.968 1.493 875 H PHE 8 HN PHE 8 7.266 12.042 0.198 876 HA PHE 8 HA PHE 8 9.071 10.045 -1.076 877 1HB PHE 8 HB2 PHE 8 9.450 11.632 1.485 878 2HB PHE 8 HB3 PHE 8 10.381 10.201 1.052 879 HD1 PHE 8 HD1 PHE 8 12.104 10.248 -0.645 880 HD2 PHE 8 HD2 PHE 8 9.684 13.735 0.055 881 HE1 PHE 8 HE1 PHE 8 13.692 11.600 -1.964 882 HE2 PHE 8 HE2 PHE 8 11.234 15.056 -1.402 883 HZ PHE 8 HZ PHE 8 13.203 13.981 -2.421 884 H LEU 9 HN LEU 9 8.590 7.950 -0.512 885 HA LEU 9 HA LEU 9 6.389 7.538 1.462 886 1HB LEU 9 HB2 LEU 9 5.546 7.947 -0.820 887 2HB LEU 9 HB3 LEU 9 6.614 6.706 -1.467 888 HG LEU 9 HG LEU 9 5.355 4.954 -0.317 889 1HD1 LEU 9 HD11 LEU 9 3.592 7.232 0.714 890 2HD1 LEU 9 HD12 LEU 9 3.229 5.492 0.847 891 3HD1 LEU 9 HD13 LEU 9 4.623 6.163 1.688 892 1HD2 LEU 9 HD21 LEU 9 3.207 5.259 -1.584 893 2HD2 LEU 9 HD22 LEU 9 3.631 6.951 -1.862 894 3HD2 LEU 9 HD23 LEU 9 4.634 5.657 -2.557 895 H SER 10 HN SER 10 7.085 6.005 2.912 896 HA SER 10 HA SER 10 8.684 3.713 1.936 897 1HB SER 10 HB2 SER 10 9.946 4.141 4.264 898 2HB SER 10 HB3 SER 10 10.513 4.802 2.744 899 HG SER 10 HG SER 10 9.976 6.141 4.896 900 H THR 11 HN THR 11 8.562 1.857 3.198 901 HA THR 11 HA THR 11 6.155 1.075 4.231 902 HB THR 11 HB THR 11 8.935 0.035 4.919 903 HG1 THR 11 HG1 THR 11 8.720 -0.364 2.821 904 1HG2 THR 11 HG21 THR 11 7.713 -2.122 5.332 905 2HG2 THR 11 HG22 THR 11 7.366 -0.881 6.533 906 3HG2 THR 11 HG23 THR 11 6.179 -1.209 5.255 907 H GLY 12 HN GLY 12 5.027 2.133 5.599 908 1HA GLY 12 HA2 GLY 12 4.217 2.917 7.598 909 2HA GLY 12 HA3 GLY 12 5.307 1.749 8.381 910 H ASN 13 HN ASN 13 6.197 4.432 6.288 911 HA ASN 13 HA ASN 13 8.415 5.199 7.336 912 1HB ASN 13 HB2 ASN 13 7.526 6.395 5.430 913 2HB ASN 13 HB3 ASN 13 6.406 7.289 6.467 914 1HD2 ASN 13 HD22 ASN 13 7.190 9.244 7.415 915 2HD2 ASN 13 HD21 ASN 13 8.863 9.649 7.502 916 H SER 14 HN SER 14 9.304 5.653 9.120 917 HA SER 14 HA SER 14 8.352 7.937 10.717 918 1HB SER 14 HB2 SER 14 9.134 6.692 12.763 919 2HB SER 14 HB3 SER 14 7.707 5.980 11.990 920 HG SER 14 HG SER 14 9.180 4.354 12.472 921 H ALA 15 HN ALA 15 10.661 6.726 8.660 922 HA ALA 15 HA ALA 15 12.887 8.103 9.989 923 1HB ALA 15 HB1 ALA 15 13.090 5.788 10.704 924 2HB ALA 15 HB2 ALA 15 13.012 5.218 9.026 925 3HB ALA 15 HB3 ALA 15 14.395 6.195 9.573 926 H ARG 16 HN ARG 16 12.864 6.008 7.004 927 HA ARG 16 HA ARG 16 14.744 7.650 5.804 928 1HB ARG 16 HB2 ARG 16 12.701 5.811 4.470 929 2HB ARG 16 HB3 ARG 16 13.873 6.754 3.558 930 1HG ARG 16 HG2 ARG 16 15.675 5.730 5.096 931 2HG ARG 16 HG3 ARG 16 14.431 4.562 5.519 932 1HD ARG 16 HD2 ARG 16 15.865 3.633 3.818 933 2HD ARG 16 HD3 ARG 16 14.267 3.874 3.142 934 HE ARG 16 HE ARG 16 15.314 6.078 2.234 935 1HH1 ARG 16 HH11 ARG 16 16.977 2.877 2.309 936 2HH1 ARG 16 HH12 ARG 16 18.102 3.398 1.049 937 1HH2 ARG 16 HH21 ARG 16 16.716 6.442 0.326 938 2HH2 ARG 16 HH22 ARG 16 17.887 5.200 -0.041 939 H SER 17 HN SER 17 11.169 8.163 5.494 940 HA SER 17 HA SER 17 11.707 10.275 3.550 941 1HB SER 17 HB2 SER 17 9.120 9.560 4.934 942 2HB SER 17 HB3 SER 17 9.335 10.707 3.611 943 HG SER 17 HG SER 17 9.631 7.883 3.551 944 H GLN 18 HN GLN 18 11.581 10.174 7.063 945 HA GLN 18 HA GLN 18 11.218 13.017 7.536 946 1HB GLN 18 HB2 GLN 18 12.753 10.907 9.141 947 2HB GLN 18 HB3 GLN 18 12.536 12.545 9.634 948 1HG GLN 18 HG2 GLN 18 10.260 10.566 9.236 949 2HG GLN 18 HG3 GLN 18 11.029 10.966 10.773 950 1HE2 GLN 18 HE22 GLN 18 8.273 11.411 10.613 951 2HE2 GLN 18 HE21 GLN 18 7.909 13.030 10.089 952 H MET 19 HN MET 19 13.963 10.792 7.101 953 HA MET 19 HA MET 19 15.979 12.756 7.479 954 1HB MET 19 HB2 MET 19 16.057 10.083 5.981 955 2HB MET 19 HB3 MET 19 17.477 10.961 6.556 956 1HG MET 19 HG2 MET 19 17.112 10.389 8.767 957 2HG MET 19 HG3 MET 19 15.376 10.305 8.582 958 1HE MET 19 HE1 MET 19 18.508 8.125 8.955 959 2HE MET 19 HE2 MET 19 18.286 6.888 7.696 960 3HE MET 19 HE3 MET 19 18.532 8.581 7.218 961 H ALA 20 HN ALA 20 14.400 11.386 4.568 962 HA ALA 20 HA ALA 20 15.929 12.813 2.656 963 1HB ALA 20 HB1 ALA 20 13.126 11.644 2.466 964 2HB ALA 20 HB2 ALA 20 14.135 12.143 1.102 965 3HB ALA 20 HB3 ALA 20 14.658 10.785 2.119 966 H GLU 21 HN GLU 21 12.752 13.698 4.218 967 HA GLU 21 HA GLU 21 12.602 16.031 2.606 968 1HB GLU 21 HB2 GLU 21 10.744 16.671 3.849 969 2HB GLU 21 HB3 GLU 21 10.699 14.901 3.788 970 1HG GLU 21 HG2 GLU 21 11.414 14.731 6.068 971 2HG GLU 21 HG3 GLU 21 11.727 16.469 6.160 972 H GLY 22 HN GLY 22 14.240 15.410 5.700 973 1HA GLY 22 HA2 GLY 22 14.942 18.132 6.289 974 2HA GLY 22 HA3 GLY 22 15.763 16.666 6.863 975 H TRP 23 HN TRP 23 16.710 15.459 4.621 976 HA TRP 23 HA TRP 23 18.988 16.903 3.793 977 1HB TRP 23 HB2 TRP 23 17.534 14.420 2.882 978 2HB TRP 23 HB3 TRP 23 18.687 15.139 1.773 979 HD1 TRP 23 HD1 TRP 23 18.575 12.863 4.668 980 HE1 TRP 23 HE1 TRP 23 20.915 12.269 5.456 981 HE3 TRP 23 HE3 TRP 23 21.209 16.310 1.964 982 HZ2 TRP 23 HZ2 TRP 23 23.631 13.138 4.947 983 HZ3 TRP 23 HZ3 TRP 23 23.695 16.299 2.022 984 HH2 TRP 23 HH2 TRP 23 24.912 14.738 3.518 985 H ALA 24 HN ALA 24 15.780 16.561 2.218 986 HA ALA 24 HA ALA 24 16.468 17.714 -0.206 987 1HB ALA 24 HB1 ALA 24 13.771 18.115 1.229 988 2HB ALA 24 HB2 ALA 24 14.074 18.118 -0.510 989 3HB ALA 24 HB3 ALA 24 14.221 16.610 0.406 990 H LYS 25 HN LYS 25 15.310 19.284 2.818 991 HA LYS 25 HA LYS 25 14.961 21.784 1.562 992 1HB LYS 25 HB2 LYS 25 15.042 20.826 4.433 993 2HB LYS 25 HB3 LYS 25 15.004 22.562 4.127 994 1HG LYS 25 HG2 LYS 25 12.992 20.682 2.822 995 2HG LYS 25 HG3 LYS 25 12.729 21.370 4.430 996 1HD LYS 25 HD2 LYS 25 12.747 23.612 3.619 997 2HD LYS 25 HD3 LYS 25 13.364 23.137 2.035 998 1HE LYS 25 HE2 LYS 25 11.243 21.887 1.585 999 2HE LYS 25 HE3 LYS 25 10.594 22.458 3.128 1000 1HZ LYS 25 HZ1 LYS 25 9.942 23.812 1.169 1001 2HZ LYS 25 HZ2 LYS 25 10.732 24.710 2.304 1002 3HZ LYS 25 HZ3 LYS 25 11.464 24.219 0.901 1003 H GLN 26 HN GLN 26 17.949 20.341 2.684 1004 HA GLN 26 HA GLN 26 19.215 22.909 2.955 1005 1HB GLN 26 HB2 GLN 26 21.182 21.866 3.478 1006 2HB GLN 26 HB3 GLN 26 19.934 20.926 4.251 1007 1HG GLN 26 HG2 GLN 26 20.492 19.031 3.151 1008 2HG GLN 26 HG3 GLN 26 20.646 19.815 1.592 1009 1HE2 GLN 26 HE22 GLN 26 22.442 17.904 3.422 1010 2HE2 GLN 26 HE21 GLN 26 24.018 18.625 3.206 1011 H TYR 27 HN TYR 27 18.400 21.017 0.179 1012 HA TYR 27 HA TYR 27 20.316 22.632 -1.438 1013 1HB TYR 27 HB2 TYR 27 20.306 19.758 -1.117 1014 2HB TYR 27 HB3 TYR 27 19.867 20.133 -2.769 1015 HD1 TYR 27 HD1 TYR 27 22.473 20.620 -0.165 1016 HD2 TYR 27 HD2 TYR 27 21.455 21.132 -4.320 1017 HE1 TYR 27 HE1 TYR 27 24.841 21.134 -0.670 1018 HE2 TYR 27 HE2 TYR 27 23.823 21.621 -4.850 1019 HH TYR 27 HH TYR 27 26.392 21.679 -2.329 1020 H LEU 28 HN LEU 28 17.030 21.616 -1.056 1021 HA LEU 28 HA LEU 28 16.281 22.590 -3.749 1022 1HB LEU 28 HB2 LEU 28 14.610 21.478 -1.445 1023 2HB LEU 28 HB3 LEU 28 14.010 21.970 -3.020 1024 HG LEU 28 HG LEU 28 15.744 19.588 -2.359 1025 1HD1 LEU 28 HD11 LEU 28 13.909 18.317 -3.286 1026 2HD1 LEU 28 HD12 LEU 28 13.230 19.471 -2.122 1027 3HD1 LEU 28 HD13 LEU 28 13.099 19.793 -3.855 1028 1HD2 LEU 28 HD21 LEU 28 16.664 20.590 -4.433 1029 2HD2 LEU 28 HD22 LEU 28 15.929 19.034 -4.708 1030 3HD2 LEU 28 HD23 LEU 28 15.052 20.518 -5.177 1031 H GLY 29 HN GLY 29 14.018 23.557 -1.405 1032 1HA GLY 29 HA2 GLY 29 15.093 25.643 0.007 1033 2HA GLY 29 HA3 GLY 29 14.828 26.342 -1.602 1034 H ASP 30 HN ASP 30 13.353 27.714 -0.152 1035 HA ASP 30 HA ASP 30 10.762 26.791 0.607 1036 1HB ASP 30 HB2 ASP 30 11.706 28.945 1.305 1037 2HB ASP 30 HB3 ASP 30 11.728 29.501 -0.371 1038 H GLU 31 HN GLU 31 12.254 27.381 -2.443 1039 HA GLU 31 HA GLU 31 10.154 27.658 -4.275 1040 1HB GLU 31 HB2 GLU 31 12.523 27.933 -4.763 1041 2HB GLU 31 HB3 GLU 31 12.856 26.249 -4.354 1042 1HG GLU 31 HG2 GLU 31 11.503 25.505 -6.271 1043 2HG GLU 31 HG3 GLU 31 11.185 27.189 -6.717 1044 H TRP 32 HN TRP 32 11.022 24.865 -2.308 1045 HA TRP 32 HA TRP 32 9.105 23.168 -3.838 1046 1HB TRP 32 HB2 TRP 32 11.652 22.364 -2.391 1047 2HB TRP 32 HB3 TRP 32 10.503 21.255 -3.124 1048 HD1 TRP 32 HD1 TRP 32 13.060 23.939 -4.128 1049 HE1 TRP 32 HE1 TRP 32 13.729 23.627 -6.579 1050 HE3 TRP 32 HE3 TRP 32 9.828 20.168 -5.374 1051 HZ2 TRP 32 HZ2 TRP 32 13.220 21.728 -8.673 1052 HZ3 TRP 32 HZ3 TRP 32 9.898 19.169 -7.641 1053 HH2 TRP 32 HH2 TRP 32 11.590 19.926 -9.301 1054 H LYS 33 HN LYS 33 7.934 21.631 -2.614 1055 HA LYS 33 HA LYS 33 7.872 21.991 0.358 1056 1HB LYS 33 HB2 LYS 33 5.499 21.597 -1.487 1057 2HB LYS 33 HB3 LYS 33 5.483 21.492 0.272 1058 1HG LYS 33 HG2 LYS 33 6.789 23.942 -0.190 1059 2HG LYS 33 HG3 LYS 33 5.571 23.901 -1.473 1060 1HD LYS 33 HD2 LYS 33 5.104 23.448 1.499 1061 2HD LYS 33 HD3 LYS 33 4.873 25.005 0.678 1062 1HE LYS 33 HE2 LYS 33 3.151 23.989 -0.803 1063 2HE LYS 33 HE3 LYS 33 3.329 22.445 0.042 1064 1HZ LYS 33 HZ1 LYS 33 1.450 23.701 0.884 1065 2HZ LYS 33 HZ2 LYS 33 2.556 23.548 2.068 1066 3HZ LYS 33 HZ3 LYS 33 2.389 24.970 1.278 1067 H VAL 34 HN VAL 34 7.838 19.989 1.442 1068 HA VAL 34 HA VAL 34 8.104 17.589 -0.278 1069 HB VAL 34 HB VAL 34 10.019 18.313 1.992 1070 1HG1 VAL 34 HG11 VAL 34 9.867 15.933 1.628 1071 2HG1 VAL 34 HG12 VAL 34 9.880 16.149 -0.124 1072 3HG1 VAL 34 HG13 VAL 34 11.350 16.474 0.821 1073 1HG2 VAL 34 HG21 VAL 34 10.417 18.678 -1.003 1074 2HG2 VAL 34 HG22 VAL 34 10.450 19.941 0.241 1075 3HG2 VAL 34 HG23 VAL 34 11.708 18.717 0.212 1076 H TYR 35 HN TYR 35 7.270 15.714 0.609 1077 HA TYR 35 HA TYR 35 6.075 15.885 3.341 1078 1HB TYR 35 HB2 TYR 35 4.539 16.421 1.260 1079 2HB TYR 35 HB3 TYR 35 4.604 14.691 0.989 1080 HD1 TYR 35 HD1 TYR 35 3.425 17.414 3.173 1081 HD2 TYR 35 HD2 TYR 35 3.448 13.135 2.588 1082 HE1 TYR 35 HE1 TYR 35 1.562 17.192 4.781 1083 HE2 TYR 35 HE2 TYR 35 1.586 12.902 4.202 1084 HH TYR 35 HH TYR 35 0.099 15.743 5.848 1085 H SER 36 HN SER 36 5.559 13.760 4.256 1086 HA SER 36 HA SER 36 7.168 11.515 3.173 1087 1HB SER 36 HB2 SER 36 7.835 11.189 5.613 1088 2HB SER 36 HB3 SER 36 8.588 12.548 4.760 1089 HG SER 36 HG SER 36 7.783 13.851 6.087 1090 H ALA 37 HN ALA 37 6.057 9.552 3.238 1091 HA ALA 37 HA ALA 37 3.731 9.302 5.029 1092 1HB ALA 37 HB1 ALA 37 2.924 10.428 3.013 1093 2HB ALA 37 HB2 ALA 37 3.696 9.181 2.002 1094 3HB ALA 37 HB3 ALA 37 2.321 8.766 3.052 1095 H GLY 38 HN GLY 38 2.613 7.120 4.600 1096 1HA GLY 38 HA2 GLY 38 3.771 4.894 3.382 1097 2HA GLY 38 HA3 GLY 38 4.405 4.959 5.030 1098 H ILE 39 HN ILE 39 3.003 2.816 4.697 1099 HA ILE 39 HA ILE 39 0.278 2.717 4.706 1100 HB ILE 39 HB ILE 39 1.389 0.737 4.553 1101 1HG1 ILE 39 HG12 ILE 39 0.312 0.432 7.373 1102 2HG1 ILE 39 HG13 ILE 39 -0.763 0.825 6.038 1103 1HG2 ILE 39 HG21 ILE 39 2.708 1.154 7.265 1104 2HG2 ILE 39 HG22 ILE 39 2.773 -0.337 6.344 1105 3HG2 ILE 39 HG23 ILE 39 3.484 1.106 5.667 1106 1HD1 ILE 39 HD11 ILE 39 0.088 -1.164 4.792 1107 2HD1 ILE 39 HD12 ILE 39 0.960 -1.662 6.261 1108 3HD1 ILE 39 HD13 ILE 39 -0.810 -1.551 6.278 1109 H GLU 40 HN GLU 40 2.139 3.020 7.760 1110 HA GLU 40 HA GLU 40 -0.279 4.091 9.128 1111 1HB GLU 40 HB2 GLU 40 0.217 2.758 11.078 1112 2HB GLU 40 HB3 GLU 40 -0.068 1.734 9.678 1113 1HG GLU 40 HG2 GLU 40 2.350 1.316 9.443 1114 2HG GLU 40 HG3 GLU 40 2.703 2.412 10.769 1115 H ALA 41 HN ALA 41 1.900 5.385 7.825 1116 HA ALA 41 HA ALA 41 4.084 6.121 9.463 1117 1HB ALA 41 HB1 ALA 41 2.685 7.291 7.031 1118 2HB ALA 41 HB2 ALA 41 4.240 7.913 7.638 1119 3HB ALA 41 HB3 ALA 41 4.109 6.231 7.050 1120 H HIS 42 HN HIS 42 4.517 7.967 10.569 1121 HA HIS 42 HA HIS 42 3.364 10.398 10.594 1122 1HB HIS 42 HB2 HIS 42 2.096 10.621 12.688 1123 2HB HIS 42 HB3 HIS 42 1.241 9.623 11.551 1124 HD1 HIS 42 HD1 HIS 42 3.051 9.393 14.930 1125 HD2 HIS 42 HD2 HIS 42 0.844 7.035 12.228 1126 HE1 HIS 42 HE1 HIS 42 2.479 7.244 16.162 1127 H GLY 43 HN GLY 43 5.251 7.955 12.041 1128 1HA GLY 43 HA2 GLY 43 6.066 9.256 14.399 1129 2HA GLY 43 HA3 GLY 43 6.831 7.865 13.623 1130 H LEU 44 HN LEU 44 8.249 9.730 14.960 1131 HA LEU 44 HA LEU 44 10.098 10.659 12.853 1132 1HB LEU 44 HB2 LEU 44 9.109 12.723 13.655 1133 2HB LEU 44 HB3 LEU 44 9.280 12.216 15.339 1134 HG LEU 44 HG LEU 44 11.741 12.329 15.165 1135 1HD1 LEU 44 HD11 LEU 44 12.804 13.352 13.184 1136 2HD1 LEU 44 HD12 LEU 44 12.111 11.779 12.808 1137 3HD1 LEU 44 HD13 LEU 44 11.267 13.272 12.309 1138 1HD2 LEU 44 HD21 LEU 44 10.457 14.875 14.127 1139 2HD2 LEU 44 HD22 LEU 44 10.455 14.344 15.823 1140 3HD2 LEU 44 HD23 LEU 44 11.982 14.730 15.015 1141 H ASN 45 HN ASN 45 11.080 8.672 13.086 1142 HA ASN 45 HA ASN 45 11.641 7.338 15.528 1143 1HB ASN 45 HB2 ASN 45 11.589 6.370 13.229 1144 2HB ASN 45 HB3 ASN 45 13.070 7.236 12.826 1145 1HD2 ASN 45 HD22 ASN 45 12.510 4.304 12.802 1146 2HD2 ASN 45 HD21 ASN 45 13.704 3.616 13.874 1147 HA PRO 46 HA PRO 46 14.930 10.093 16.911 1148 1HB PRO 46 HB2 PRO 46 16.295 8.431 18.666 1149 2HB PRO 46 HB3 PRO 46 14.813 9.366 19.035 1150 1HG PRO 46 HG2 PRO 46 15.035 6.461 18.193 1151 2HG PRO 46 HG3 PRO 46 14.044 7.158 19.515 1152 1HD PRO 46 HD2 PRO 46 12.949 6.570 17.120 1153 2HD PRO 46 HD3 PRO 46 12.477 8.064 17.977 1154 H ASN 47 HN ASN 47 15.511 6.948 15.367 1155 HA ASN 47 HA ASN 47 18.291 7.292 14.727 1156 1HB ASN 47 HB2 ASN 47 17.390 5.201 14.005 1157 2HB ASN 47 HB3 ASN 47 15.979 5.965 13.274 1158 1HD2 ASN 47 HD22 ASN 47 16.225 5.275 11.071 1159 2HD2 ASN 47 HD21 ASN 47 17.519 6.033 10.131 1160 H ALA 48 HN ALA 48 15.280 8.449 12.999 1161 HA ALA 48 HA ALA 48 16.756 9.629 10.880 1162 1HB ALA 48 HB1 ALA 48 14.673 11.040 10.559 1163 2HB ALA 48 HB2 ALA 48 14.388 9.299 10.622 1164 3HB ALA 48 HB3 ALA 48 14.006 10.325 12.032 1165 H VAL 49 HN VAL 49 15.702 10.884 14.056 1166 HA VAL 49 HA VAL 49 16.567 13.580 13.658 1167 HB VAL 49 HB VAL 49 16.611 12.048 16.293 1168 1HG1 VAL 49 HG11 VAL 49 16.322 15.029 15.685 1169 2HG1 VAL 49 HG12 VAL 49 16.248 14.279 17.292 1170 3HG1 VAL 49 HG13 VAL 49 17.759 14.241 16.378 1171 1HG2 VAL 49 HG21 VAL 49 14.329 12.946 16.654 1172 2HG2 VAL 49 HG22 VAL 49 14.323 13.592 14.996 1173 3HG2 VAL 49 HG23 VAL 49 14.361 11.840 15.286 1174 H LYS 50 HN LYS 50 18.357 10.767 15.050 1175 HA LYS 50 HA LYS 50 20.833 12.116 15.418 1176 1HB LYS 50 HB2 LYS 50 20.346 9.999 16.496 1177 2HB LYS 50 HB3 LYS 50 20.166 9.180 14.943 1178 1HG LYS 50 HG2 LYS 50 22.543 9.486 14.443 1179 2HG LYS 50 HG3 LYS 50 22.763 10.406 15.949 1180 1HD LYS 50 HD2 LYS 50 22.165 8.387 17.263 1181 2HD LYS 50 HD3 LYS 50 21.819 7.510 15.773 1182 1HE LYS 50 HE2 LYS 50 23.972 6.793 16.516 1183 2HE LYS 50 HE3 LYS 50 24.203 7.770 15.065 1184 1HZ LYS 50 HZ1 LYS 50 25.798 8.311 16.810 1185 2HZ LYS 50 HZ2 LYS 50 24.874 9.616 16.501 1186 3HZ LYS 50 HZ3 LYS 50 24.613 8.722 17.847 1187 H ALA 51 HN ALA 51 19.591 10.264 12.669 1188 HA ALA 51 HA ALA 51 21.751 10.093 10.986 1189 1HB ALA 51 HB1 ALA 51 18.824 10.462 10.304 1190 2HB ALA 51 HB2 ALA 51 20.081 9.871 9.219 1191 3HB ALA 51 HB3 ALA 51 19.659 8.934 10.672 1192 H MET 52 HN MET 52 19.440 12.836 11.448 1193 HA MET 52 HA MET 52 20.655 14.355 9.254 1194 1HB MET 52 HB2 MET 52 18.322 14.943 11.136 1195 2HB MET 52 HB3 MET 52 18.832 15.950 9.778 1196 1HG MET 52 HG2 MET 52 17.629 13.183 9.656 1197 2HG MET 52 HG3 MET 52 16.994 14.682 9.003 1198 1HE MET 52 HE1 MET 52 19.348 15.366 5.997 1199 2HE MET 52 HE2 MET 52 18.112 15.982 7.113 1200 3HE MET 52 HE3 MET 52 19.810 15.797 7.649 1201 H LYS 53 HN LYS 53 20.603 14.320 12.834 1202 HA LYS 53 HA LYS 53 22.105 16.737 13.155 1203 1HB LYS 53 HB2 LYS 53 22.072 14.199 14.844 1204 2HB LYS 53 HB3 LYS 53 22.814 15.708 15.346 1205 1HG LYS 53 HG2 LYS 53 19.866 15.571 14.623 1206 2HG LYS 53 HG3 LYS 53 20.453 15.124 16.222 1207 1HD LYS 53 HD2 LYS 53 21.292 17.383 16.593 1208 2HD LYS 53 HD3 LYS 53 20.873 17.849 14.922 1209 1HE LYS 53 HE2 LYS 53 18.502 17.376 15.338 1210 2HE LYS 53 HE3 LYS 53 18.853 16.792 16.964 1211 1HZ LYS 53 HZ1 LYS 53 19.301 18.955 17.685 1212 2HZ LYS 53 HZ2 LYS 53 19.474 19.567 16.177 1213 3HZ LYS 53 HZ3 LYS 53 17.987 19.125 16.704 1214 H GLU 54 HN GLU 54 23.107 13.471 12.062 1215 HA GLU 54 HA GLU 54 25.885 13.788 12.453 1216 1HB GLU 54 HB2 GLU 54 24.499 12.359 10.141 1217 2HB GLU 54 HB3 GLU 54 26.217 12.299 10.507 1218 1HG GLU 54 HG2 GLU 54 25.448 11.444 12.866 1219 2HG GLU 54 HG3 GLU 54 23.949 11.036 12.018 1220 H VAL 55 HN VAL 55 23.770 15.284 10.062 1221 HA VAL 55 HA VAL 55 26.107 16.658 8.838 1222 HB VAL 55 HB VAL 55 24.690 16.869 6.824 1223 1HG1 VAL 55 HG11 VAL 55 25.056 13.968 7.691 1224 2HG1 VAL 55 HG12 VAL 55 25.078 14.629 6.044 1225 3HG1 VAL 55 HG13 VAL 55 26.374 15.037 7.162 1226 1HG2 VAL 55 HG21 VAL 55 22.434 16.591 7.910 1227 2HG2 VAL 55 HG22 VAL 55 22.685 15.548 6.507 1228 3HG2 VAL 55 HG23 VAL 55 22.792 14.865 8.138 1229 H GLY 56 HN GLY 56 24.306 17.256 11.295 1230 1HA GLY 56 HA2 GLY 56 23.716 19.153 12.372 1231 2HA GLY 56 HA3 GLY 56 24.593 20.048 11.121 1232 H ILE 57 HN ILE 57 21.626 17.986 10.662 1233 HA ILE 57 HA ILE 57 20.108 20.494 10.019 1234 HB ILE 57 HB ILE 57 19.846 17.742 8.761 1235 1HG1 ILE 57 HG12 ILE 57 20.680 20.416 7.547 1236 2HG1 ILE 57 HG13 ILE 57 21.766 19.078 7.906 1237 1HG2 ILE 57 HG21 ILE 57 18.024 18.713 7.403 1238 2HG2 ILE 57 HG22 ILE 57 17.625 18.864 9.106 1239 3HG2 ILE 57 HG23 ILE 57 18.219 20.278 8.211 1240 1HD1 ILE 57 HD11 ILE 57 19.574 19.066 5.801 1241 2HD1 ILE 57 HD12 ILE 57 21.325 19.070 5.564 1242 3HD1 ILE 57 HD13 ILE 57 20.547 17.647 6.267 1243 H ASP 58 HN ASP 58 18.922 20.888 11.808 1244 HA ASP 58 HA ASP 58 18.085 18.759 13.626 1245 1HB ASP 58 HB2 ASP 58 18.418 21.008 14.529 1246 2HB ASP 58 HB3 ASP 58 17.233 21.675 13.393 1247 H ILE 59 HN ILE 59 16.142 17.713 13.630 1248 HA ILE 59 HA ILE 59 13.962 18.685 11.894 1249 HB ILE 59 HB ILE 59 13.378 16.499 11.148 1250 1HG1 ILE 59 HG12 ILE 59 16.026 15.394 12.220 1251 2HG1 ILE 59 HG13 ILE 59 14.482 15.191 13.045 1252 1HG2 ILE 59 HG21 ILE 59 15.056 16.222 9.401 1253 2HG2 ILE 59 HG22 ILE 59 14.937 17.943 9.782 1254 3HG2 ILE 59 HG23 ILE 59 16.304 16.999 10.404 1255 1HD1 ILE 59 HD11 ILE 59 13.559 14.118 10.959 1256 2HD1 ILE 59 HD12 ILE 59 15.217 14.082 10.318 1257 3HD1 ILE 59 HD13 ILE 59 14.814 13.211 11.811 1258 H SER 60 HN SER 60 14.721 18.495 14.945 1259 HA SER 60 HA SER 60 13.134 16.484 16.050 1260 1HB SER 60 HB2 SER 60 13.821 19.168 17.313 1261 2HB SER 60 HB3 SER 60 13.449 17.650 18.155 1262 HG SER 60 HG SER 60 15.717 18.352 16.597 1263 H ASN 61 HN ASN 61 12.010 19.295 14.475 1264 HA ASN 61 HA ASN 61 9.429 19.411 15.861 1265 1HB ASN 61 HB2 ASN 61 10.623 21.507 15.335 1266 2HB ASN 61 HB3 ASN 61 10.643 21.081 13.623 1267 1HD2 ASN 61 HD22 ASN 61 8.974 21.930 12.397 1268 2HD2 ASN 61 HD21 ASN 61 7.462 22.511 13.044 1269 H GLN 62 HN GLN 62 10.787 17.675 13.184 1270 HA GLN 62 HA GLN 62 8.688 17.989 11.293 1271 1HB GLN 62 HB2 GLN 62 10.885 15.932 11.484 1272 2HB GLN 62 HB3 GLN 62 9.660 16.022 10.201 1273 1HG GLN 62 HG2 GLN 62 10.320 18.336 9.674 1274 2HG GLN 62 HG3 GLN 62 11.639 18.214 10.842 1275 1HE2 GLN 62 HE22 GLN 62 11.329 15.131 9.317 1276 2HE2 GLN 62 HE21 GLN 62 12.581 15.378 8.114 1277 H THR 63 HN THR 63 7.503 16.045 10.468 1278 HA THR 63 HA THR 63 6.637 13.976 12.269 1279 HB THR 63 HB THR 63 5.373 15.945 13.126 1280 HG1 THR 63 HG1 THR 63 3.503 14.860 13.262 1281 1HG2 THR 63 HG21 THR 63 3.991 15.986 10.404 1282 2HG2 THR 63 HG22 THR 63 3.538 16.929 11.840 1283 3HG2 THR 63 HG23 THR 63 5.079 17.242 11.034 1284 H SER 64 HN SER 64 4.510 13.004 10.934 1285 HA SER 64 HA SER 64 4.806 13.209 8.030 1286 1HB SER 64 HB2 SER 64 5.297 10.569 9.507 1287 2HB SER 64 HB3 SER 64 4.938 10.702 7.781 1288 HG SER 64 HG SER 64 6.821 12.075 7.627 1289 H ASP 65 HN ASP 65 3.059 11.329 7.219 1290 HA ASP 65 HA ASP 65 0.878 10.864 9.085 1291 1HB ASP 65 HB2 ASP 65 0.406 13.159 8.013 1292 2HB ASP 65 HB3 ASP 65 0.394 12.314 6.454 1293 H ILE 66 HN ILE 66 -0.804 9.422 7.776 1294 HA ILE 66 HA ILE 66 0.588 7.392 6.307 1295 HB ILE 66 HB ILE 66 -1.752 6.610 5.845 1296 1HG1 ILE 66 HG12 ILE 66 -2.584 8.927 7.626 1297 2HG1 ILE 66 HG13 ILE 66 -2.807 8.889 5.873 1298 1HG2 ILE 66 HG21 ILE 66 -2.091 5.876 8.144 1299 2HG2 ILE 66 HG22 ILE 66 -0.368 5.947 7.765 1300 3HG2 ILE 66 HG23 ILE 66 -1.097 7.228 8.759 1301 1HD1 ILE 66 HD11 ILE 66 -4.230 6.841 6.150 1302 2HD1 ILE 66 HD12 ILE 66 -4.075 7.030 7.918 1303 3HD1 ILE 66 HD13 ILE 66 -4.877 8.285 6.961 1304 H ILE 67 HN ILE 67 -0.220 6.730 4.045 1305 HA ILE 67 HA ILE 67 0.367 8.654 2.162 1306 HB ILE 67 HB ILE 67 -0.181 7.237 0.517 1307 1HG1 ILE 67 HG12 ILE 67 -2.426 5.917 2.082 1308 2HG1 ILE 67 HG13 ILE 67 -2.616 7.148 0.828 1309 1HG2 ILE 67 HG21 ILE 67 1.356 6.156 2.176 1310 2HG2 ILE 67 HG22 ILE 67 -0.027 5.190 2.753 1311 3HG2 ILE 67 HG23 ILE 67 0.541 5.034 1.082 1312 1HD1 ILE 67 HD11 ILE 67 -3.081 5.233 -0.342 1313 2HD1 ILE 67 HD12 ILE 67 -1.393 5.545 -0.762 1314 3HD1 ILE 67 HD13 ILE 67 -1.776 4.291 0.445 1315 H ASP 68 HN ASP 68 -0.630 10.288 1.196 1316 HA ASP 68 HA ASP 68 -3.523 10.764 1.690 1317 1HB ASP 68 HB2 ASP 68 -2.206 11.833 3.508 1318 2HB ASP 68 HB3 ASP 68 -1.391 12.835 2.299 1319 H SER 69 HN SER 69 -4.037 10.436 -0.349 1320 HA SER 69 HA SER 69 -2.963 11.151 -2.706 1321 1HB SER 69 HB2 SER 69 -5.880 11.505 -1.995 1322 2HB SER 69 HB3 SER 69 -5.206 10.911 -3.529 1323 HG SER 69 HG SER 69 -6.100 9.360 -1.795 1324 H ASP 70 HN ASP 70 -4.175 13.548 -0.380 1325 HA ASP 70 HA ASP 70 -5.011 15.414 -2.444 1326 1HB ASP 70 HB2 ASP 70 -6.091 15.398 -0.223 1327 2HB ASP 70 HB3 ASP 70 -4.555 15.861 0.519 1328 H ILE 71 HN ILE 71 -2.074 14.551 -0.813 1329 HA ILE 71 HA ILE 71 -0.715 16.890 -2.043 1330 HB ILE 71 HB ILE 71 1.123 15.619 -0.432 1331 1HG1 ILE 71 HG12 ILE 71 -0.465 14.434 0.900 1332 2HG1 ILE 71 HG13 ILE 71 0.522 15.582 1.776 1333 1HG2 ILE 71 HG21 ILE 71 -0.392 18.204 0.028 1334 2HG2 ILE 71 HG22 ILE 71 1.139 17.754 0.819 1335 3HG2 ILE 71 HG23 ILE 71 1.081 17.972 -0.937 1336 1HD1 ILE 71 HD11 ILE 71 -2.437 15.851 1.165 1337 2HD1 ILE 71 HD12 ILE 71 -1.653 15.646 2.728 1338 3HD1 ILE 71 HD13 ILE 71 -1.451 17.168 1.848 1339 H LEU 72 HN LEU 72 -0.617 13.277 -1.663 1340 HA LEU 72 HA LEU 72 1.710 12.971 -3.235 1341 1HB LEU 72 HB2 LEU 72 0.641 11.188 -1.847 1342 2HB LEU 72 HB3 LEU 72 -0.597 10.997 -3.075 1343 HG LEU 72 HG LEU 72 2.384 10.730 -3.673 1344 1HD1 LEU 72 HD11 LEU 72 1.526 9.035 -1.913 1345 2HD1 LEU 72 HD12 LEU 72 0.645 8.301 -3.265 1346 3HD1 LEU 72 HD13 LEU 72 2.400 8.436 -3.328 1347 1HD2 LEU 72 HD21 LEU 72 -0.128 10.092 -5.231 1348 2HD2 LEU 72 HD22 LEU 72 1.410 10.797 -5.777 1349 3HD2 LEU 72 HD23 LEU 72 1.297 9.077 -5.477 1350 H ASN 73 HN ASN 73 -1.778 12.825 -4.324 1351 HA ASN 73 HA ASN 73 -0.993 12.380 -7.009 1352 1HB ASN 73 HB2 ASN 73 -3.135 12.076 -7.450 1353 2HB ASN 73 HB3 ASN 73 -3.419 12.201 -5.729 1354 1HD2 ASN 73 HD22 ASN 73 -3.928 14.504 -4.922 1355 2HD2 ASN 73 HD21 ASN 73 -4.813 15.568 -6.004 1356 H ASN 74 HN ASN 74 -1.126 15.315 -5.148 1357 HA ASN 74 HA ASN 74 -1.072 17.095 -7.455 1358 1HB ASN 74 HB2 ASN 74 -1.126 17.442 -4.457 1359 2HB ASN 74 HB3 ASN 74 -0.466 18.743 -5.415 1360 1HD2 ASN 74 HD22 ASN 74 -3.275 17.936 -3.979 1361 2HD2 ASN 74 HD21 ASN 74 -4.396 18.702 -5.090 1362 H ALA 75 HN ALA 75 1.299 15.193 -5.819 1363 HA ALA 75 HA ALA 75 3.477 17.033 -5.912 1364 1HB ALA 75 HB1 ALA 75 4.861 15.104 -5.443 1365 2HB ALA 75 HB2 ALA 75 3.399 15.022 -4.450 1366 3HB ALA 75 HB3 ALA 75 3.563 13.983 -5.887 1367 H ASP 76 HN ASP 76 5.398 16.664 -7.230 1368 HA ASP 76 HA ASP 76 4.780 16.204 -10.106 1369 1HB ASP 76 HB2 ASP 76 6.156 18.148 -9.484 1370 2HB ASP 76 HB3 ASP 76 7.330 17.085 -8.697 1371 H LEU 77 HN LEU 77 6.554 14.724 -7.384 1372 HA LEU 77 HA LEU 77 7.092 12.318 -8.954 1373 1HB LEU 77 HB2 LEU 77 9.082 13.586 -9.340 1374 2HB LEU 77 HB3 LEU 77 9.118 14.171 -7.683 1375 HG LEU 77 HG LEU 77 9.764 11.933 -6.865 1376 1HD1 LEU 77 HD11 LEU 77 10.077 10.057 -8.034 1377 2HD1 LEU 77 HD12 LEU 77 8.794 10.728 -9.058 1378 3HD1 LEU 77 HD13 LEU 77 10.509 10.883 -9.517 1379 1HD2 LEU 77 HD21 LEU 77 12.045 11.977 -7.749 1380 2HD2 LEU 77 HD22 LEU 77 11.529 13.058 -9.065 1381 3HD2 LEU 77 HD23 LEU 77 11.459 13.606 -7.382 1382 H VAL 78 HN VAL 78 6.850 10.520 -7.763 1383 HA VAL 78 HA VAL 78 6.809 10.628 -4.774 1384 HB VAL 78 HB VAL 78 5.725 8.419 -6.521 1385 1HG1 VAL 78 HG11 VAL 78 4.601 7.808 -4.377 1386 2HG1 VAL 78 HG12 VAL 78 6.356 7.819 -4.197 1387 3HG1 VAL 78 HG13 VAL 78 5.390 9.174 -3.575 1388 1HG2 VAL 78 HG21 VAL 78 4.269 10.846 -5.385 1389 2HG2 VAL 78 HG22 VAL 78 4.351 10.270 -7.066 1390 3HG2 VAL 78 HG23 VAL 78 3.480 9.319 -5.882 1391 H VAL 79 HN VAL 79 8.768 10.438 -4.102 1392 HA VAL 79 HA VAL 79 10.654 8.592 -5.396 1393 HB VAL 79 HB VAL 79 10.836 10.302 -2.891 1394 1HG1 VAL 79 HG11 VAL 79 13.285 9.706 -3.072 1395 2HG1 VAL 79 HG12 VAL 79 12.266 8.330 -2.698 1396 3HG1 VAL 79 HG13 VAL 79 12.854 8.547 -4.352 1397 1HG2 VAL 79 HG21 VAL 79 10.782 11.735 -4.833 1398 2HG2 VAL 79 HG22 VAL 79 12.447 11.635 -4.279 1399 3HG2 VAL 79 HG23 VAL 79 11.945 10.694 -5.697 1400 H THR 80 HN THR 80 10.110 6.469 -5.035 1401 HA THR 80 HA THR 80 8.943 5.622 -2.498 1402 HB THR 80 HB THR 80 10.652 3.815 -4.224 1403 HG1 THR 80 HG1 THR 80 9.383 4.626 -5.781 1404 1HG2 THR 80 HG21 THR 80 8.993 2.133 -3.579 1405 2HG2 THR 80 HG22 THR 80 9.789 2.891 -2.187 1406 3HG2 THR 80 HG23 THR 80 8.132 3.378 -2.608 1407 H LEU 81 HN LEU 81 10.020 5.205 -0.655 1408 HA LEU 81 HA LEU 81 12.982 5.016 -0.736 1409 1HB LEU 81 HB2 LEU 81 11.225 6.339 1.371 1410 2HB LEU 81 HB3 LEU 81 12.906 5.881 1.627 1411 HG LEU 81 HG LEU 81 11.833 7.970 -0.298 1412 1HD1 LEU 81 HD11 LEU 81 13.780 8.275 2.029 1413 2HD1 LEU 81 HD12 LEU 81 12.943 9.536 1.150 1414 3HD1 LEU 81 HD13 LEU 81 12.016 8.455 2.184 1415 1HD2 LEU 81 HD21 LEU 81 14.228 8.532 -0.779 1416 2HD2 LEU 81 HD22 LEU 81 14.727 7.058 0.076 1417 3HD2 LEU 81 HD23 LEU 81 13.769 6.952 -1.411 1418 H SER 82 HN SER 82 13.752 3.514 0.409 1419 HA SER 82 HA SER 82 14.141 1.900 1.938 1420 1HB SER 82 HB2 SER 82 11.137 1.679 2.485 1421 2HB SER 82 HB3 SER 82 12.425 0.872 3.359 1422 HG SER 82 HG SER 82 12.355 2.470 4.609 1423 H GLY 83 HN GLY 83 11.334 1.613 -0.182 1424 1HA GLY 83 HA2 GLY 83 11.130 0.043 -2.005 1425 2HA GLY 83 HA3 GLY 83 12.062 -1.143 -1.057 1426 H ASP 84 HN ASP 84 9.159 -1.236 -1.994 1427 HA ASP 84 HA ASP 84 7.580 -1.000 0.434 1428 1HB ASP 84 HB2 ASP 84 6.288 -0.990 -1.565 1429 2HB ASP 84 HB3 ASP 84 7.130 -2.401 -2.224 1430 H ALA 85 HN ALA 85 7.717 -2.339 2.120 1431 HA ALA 85 HA ALA 85 8.405 -5.217 1.680 1432 1HB ALA 85 HB1 ALA 85 9.246 -3.454 4.022 1433 2HB ALA 85 HB2 ALA 85 9.524 -5.202 3.877 1434 3HB ALA 85 HB3 ALA 85 10.313 -4.083 2.747 1435 H ALA 86 HN ALA 86 6.463 -2.763 3.349 1436 HA ALA 86 HA ALA 86 4.318 -4.684 3.752 1437 1HB ALA 86 HB1 ALA 86 5.710 -5.030 5.812 1438 2HB ALA 86 HB2 ALA 86 5.622 -3.301 6.170 1439 3HB ALA 86 HB3 ALA 86 4.151 -4.289 6.199 1440 H ASP 87 HN ASP 87 4.872 -2.105 2.193 1441 HA ASP 87 HA ASP 87 3.642 0.025 3.789 1442 1HB ASP 87 HB2 ASP 87 5.741 0.202 2.269 1443 2HB ASP 87 HB3 ASP 87 4.606 0.276 0.937 1444 H LYS 88 HN LYS 88 2.018 -2.325 2.577 1445 HA LYS 88 HA LYS 88 0.275 -2.843 1.301 1446 1HB LYS 88 HB2 LYS 88 -1.710 -1.528 1.340 1447 2HB LYS 88 HB3 LYS 88 -0.979 -1.635 2.919 1448 1HG LYS 88 HG2 LYS 88 -0.254 0.702 2.806 1449 2HG LYS 88 HG3 LYS 88 -0.686 0.781 1.095 1450 1HD LYS 88 HD2 LYS 88 -2.400 1.912 2.070 1451 2HD LYS 88 HD3 LYS 88 -3.107 0.311 1.856 1452 1HE LYS 88 HE2 LYS 88 -1.835 1.245 4.457 1453 2HE LYS 88 HE3 LYS 88 -3.510 1.604 4.069 1454 1HZ LYS 88 HZ1 LYS 88 -4.065 -0.692 4.107 1455 2HZ LYS 88 HZ2 LYS 88 -2.499 -1.180 4.236 1456 3HZ LYS 88 HZ3 LYS 88 -3.242 -0.387 5.458 1457 H CYS 89 HN CYS 89 2.511 -2.057 -0.119 1458 HA CYS 89 HA CYS 89 3.263 -1.546 -2.196 1459 1HB CYS 89 HB2 CYS 89 0.805 -3.059 -3.074 1460 2HB CYS 89 HB3 CYS 89 2.404 -3.110 -3.775 1461 HA PRO 90 HA PRO 90 -0.167 1.665 -2.820 1462 1HB PRO 90 HB2 PRO 90 2.137 3.598 -2.978 1463 2HB PRO 90 HB3 PRO 90 0.537 3.819 -2.206 1464 1HG PRO 90 HG2 PRO 90 2.690 3.265 -0.657 1465 2HG PRO 90 HG3 PRO 90 1.144 2.409 -0.362 1466 1HD PRO 90 HD2 PRO 90 3.528 1.457 -1.997 1467 2HD PRO 90 HD3 PRO 90 2.702 0.603 -0.682 1468 H MET 91 HN MET 91 -1.029 2.070 -4.857 1469 HA MET 91 HA MET 91 0.739 1.457 -7.092 1470 1HB MET 91 HB2 MET 91 -1.346 1.479 -8.461 1471 2HB MET 91 HB3 MET 91 -1.250 0.316 -7.169 1472 1HG MET 91 HG2 MET 91 -3.373 1.148 -7.001 1473 2HG MET 91 HG3 MET 91 -2.565 2.020 -5.735 1474 1HE MET 91 HE1 MET 91 -4.649 3.076 -5.853 1475 2HE MET 91 HE2 MET 91 -5.339 4.201 -7.130 1476 3HE MET 91 HE3 MET 91 -5.268 2.435 -7.369 1477 H THR 92 HN THR 92 0.231 4.448 -5.642 1478 HA THR 92 HA THR 92 0.620 6.555 -6.325 1479 HB THR 92 HB THR 92 2.641 6.735 -7.889 1480 HG1 THR 92 HG1 THR 92 2.265 4.583 -8.744 1481 1HG2 THR 92 HG21 THR 92 4.182 6.050 -6.123 1482 2HG2 THR 92 HG22 THR 92 2.763 6.835 -5.412 1483 3HG2 THR 92 HG23 THR 92 2.908 5.071 -5.347 1484 HA PRO 93 HA PRO 93 -2.308 6.444 -9.763 1485 1HB PRO 93 HB2 PRO 93 -3.524 8.901 -9.409 1486 2HB PRO 93 HB3 PRO 93 -3.860 7.463 -8.383 1487 1HG PRO 93 HG2 PRO 93 -1.905 9.693 -7.780 1488 2HG PRO 93 HG3 PRO 93 -3.221 9.041 -6.745 1489 1HD PRO 93 HD2 PRO 93 -0.705 8.145 -6.465 1490 2HD PRO 93 HD3 PRO 93 -2.051 6.965 -6.440 1491 HA PRO 94 HA PRO 94 0.372 7.996 -12.773 1492 1HB PRO 94 HB2 PRO 94 -1.209 8.218 -15.047 1493 2HB PRO 94 HB3 PRO 94 -0.701 6.683 -14.289 1494 1HG PRO 94 HG2 PRO 94 -3.298 8.199 -13.855 1495 2HG PRO 94 HG3 PRO 94 -3.083 6.461 -14.260 1496 1HD PRO 94 HD2 PRO 94 -3.445 7.198 -11.704 1497 2HD PRO 94 HD3 PRO 94 -2.187 5.984 -12.110 1498 H HIS 95 HN HIS 95 -1.583 10.260 -11.421 1499 HA HIS 95 HA HIS 95 -1.189 12.503 -13.219 1500 1HB HIS 95 HB2 HIS 95 -1.666 12.434 -10.211 1501 2HB HIS 95 HB3 HIS 95 -1.816 13.841 -11.251 1502 HD1 HIS 95 HD1 HIS 95 -4.313 13.288 -9.638 1503 HD2 HIS 95 HD2 HIS 95 -3.523 11.501 -13.377 1504 HE1 HIS 95 HE1 HIS 95 -6.552 12.508 -10.555 1505 H VAL 96 HN VAL 96 1.026 10.609 -11.404 1506 HA VAL 96 HA VAL 96 2.923 12.883 -11.071 1507 HB VAL 96 HB VAL 96 2.631 10.588 -9.099 1508 1HG1 VAL 96 HG11 VAL 96 4.633 11.940 -8.838 1509 2HG1 VAL 96 HG12 VAL 96 3.698 13.427 -8.940 1510 3HG1 VAL 96 HG13 VAL 96 3.527 12.368 -7.533 1511 1HG2 VAL 96 HG21 VAL 96 0.383 11.544 -9.087 1512 2HG2 VAL 96 HG22 VAL 96 1.253 12.012 -7.652 1513 3HG2 VAL 96 HG23 VAL 96 1.064 13.194 -8.960 1514 H LYS 97 HN LYS 97 5.166 12.339 -11.147 1515 HA LYS 97 HA LYS 97 5.931 9.955 -12.690 1516 1HB LYS 97 HB2 LYS 97 6.833 12.342 -12.925 1517 2HB LYS 97 HB3 LYS 97 7.645 12.113 -11.382 1518 1HG LYS 97 HG2 LYS 97 8.128 9.943 -13.366 1519 2HG LYS 97 HG3 LYS 97 8.639 11.532 -13.922 1520 1HD LYS 97 HD2 LYS 97 9.438 10.306 -11.293 1521 2HD LYS 97 HD3 LYS 97 10.399 10.152 -12.760 1522 1HE LYS 97 HE2 LYS 97 9.783 12.741 -11.259 1523 2HE LYS 97 HE3 LYS 97 11.355 11.936 -11.366 1524 1HZ LYS 97 HZ1 LYS 97 11.334 13.733 -12.854 1525 2HZ LYS 97 HZ2 LYS 97 11.307 12.390 -13.775 1526 3HZ LYS 97 HZ3 LYS 97 9.936 13.277 -13.588 1527 H ARG 98 HN ARG 98 7.539 8.371 -11.715 1528 HA ARG 98 HA ARG 98 7.797 8.510 -8.788 1529 1HB ARG 98 HB2 ARG 98 5.728 7.164 -9.232 1530 2HB ARG 98 HB3 ARG 98 6.709 6.032 -10.181 1531 1HG ARG 98 HG2 ARG 98 8.091 5.646 -8.035 1532 2HG ARG 98 HG3 ARG 98 6.862 6.617 -7.190 1533 1HD ARG 98 HD2 ARG 98 5.141 5.039 -7.958 1534 2HD ARG 98 HD3 ARG 98 6.376 4.038 -8.733 1535 HE ARG 98 HE ARG 98 7.350 4.220 -6.221 1536 1HH1 ARG 98 HH11 ARG 98 4.003 3.505 -7.159 1537 2HH1 ARG 98 HH12 ARG 98 3.738 2.389 -5.873 1538 1HH2 ARG 98 HH21 ARG 98 7.046 2.841 -4.566 1539 2HH2 ARG 98 HH22 ARG 98 5.556 1.968 -4.338 1540 H GLU 99 HN GLU 99 9.659 7.470 -8.032 1541 HA GLU 99 HA GLU 99 11.147 5.652 -9.717 1542 1HB GLU 99 HB2 GLU 99 11.957 7.942 -10.454 1543 2HB GLU 99 HB3 GLU 99 12.478 8.252 -8.794 1544 1HG GLU 99 HG2 GLU 99 14.069 6.379 -8.924 1545 2HG GLU 99 HG3 GLU 99 13.438 5.910 -10.504 1546 H HIS 100 HN HIS 100 12.553 4.373 -8.279 1547 HA HIS 100 HA HIS 100 12.118 4.825 -5.390 1548 1HB HIS 100 HB2 HIS 100 13.087 2.421 -5.319 1549 2HB HIS 100 HB3 HIS 100 11.461 2.629 -5.956 1550 HD1 HIS 100 HD1 HIS 100 11.006 1.694 -8.350 1551 HD2 HIS 100 HD2 HIS 100 15.081 2.090 -7.362 1552 HE1 HIS 100 HE1 HIS 100 12.314 0.661 -10.272 1553 H TRP 101 HN TRP 101 13.723 5.446 -4.085 1554 HA TRP 101 HA TRP 101 16.471 5.661 -5.257 1555 1HB TRP 101 HB2 TRP 101 15.080 7.455 -3.250 1556 2HB TRP 101 HB3 TRP 101 16.748 7.607 -3.737 1557 HD1 TRP 101 HD1 TRP 101 15.022 7.001 -6.887 1558 HE1 TRP 101 HE1 TRP 101 14.435 9.112 -8.113 1559 HE3 TRP 101 HE3 TRP 101 15.872 10.341 -3.103 1560 HZ2 TRP 101 HZ2 TRP 101 14.290 11.958 -7.540 1561 HZ3 TRP 101 HZ3 TRP 101 15.434 12.753 -3.481 1562 HH2 TRP 101 HH2 TRP 101 14.601 13.561 -5.660 1563 H GLY 102 HN GLY 102 14.950 3.536 -3.305 1564 1HA GLY 102 HA2 GLY 102 17.457 2.686 -2.285 1565 2HA GLY 102 HA3 GLY 102 16.466 3.314 -0.964 1566 H PHE 103 HN PHE 103 17.279 0.712 -1.078 1567 HA PHE 103 HA PHE 103 14.769 -0.818 -1.072 1568 1HB PHE 103 HB2 PHE 103 17.268 -1.628 -2.610 1569 2HB PHE 103 HB3 PHE 103 15.996 -2.751 -2.157 1570 HD1 PHE 103 HD1 PHE 103 13.523 -2.068 -2.832 1571 HD2 PHE 103 HD2 PHE 103 17.121 -0.719 -4.802 1572 HE1 PHE 103 HE1 PHE 103 12.234 -1.663 -4.914 1573 HE2 PHE 103 HE2 PHE 103 15.831 -0.348 -6.887 1574 HZ PHE 103 HZ PHE 103 13.387 -0.820 -6.948 1575 H ASP 104 HN ASP 104 16.219 0.419 1.014 1576 HA ASP 104 HA ASP 104 17.391 -1.720 2.649 1577 1HB ASP 104 HB2 ASP 104 19.272 -0.873 1.244 1578 2HB ASP 104 HB3 ASP 104 18.868 0.785 1.685 1579 H ASP 105 HN ASP 105 17.011 -1.070 4.913 1580 HA ASP 105 HA ASP 105 15.675 1.560 5.215 1581 1HB ASP 105 HB2 ASP 105 13.946 -0.110 4.735 1582 2HB ASP 105 HB3 ASP 105 14.421 -1.000 6.182 1583 HA PRO 106 HA PRO 106 18.421 1.315 8.646 1584 1HB PRO 106 HB2 PRO 106 18.248 3.824 9.592 1585 2HB PRO 106 HB3 PRO 106 18.868 3.498 7.943 1586 1HG PRO 106 HG2 PRO 106 16.066 4.361 8.757 1587 2HG PRO 106 HG3 PRO 106 17.088 5.032 7.449 1588 1HD PRO 106 HD2 PRO 106 15.155 3.087 7.071 1589 2HD PRO 106 HD3 PRO 106 16.608 3.232 6.042 1590 H ALA 107 HN ALA 107 14.993 1.881 9.166 1591 HA ALA 107 HA ALA 107 15.171 1.937 12.043 1592 1HB ALA 107 HB1 ALA 107 13.265 2.981 10.806 1593 2HB ALA 107 HB2 ALA 107 12.792 1.371 10.222 1594 3HB ALA 107 HB3 ALA 107 12.732 1.731 11.954 1595 H ARG 108 HN ARG 108 15.639 -0.384 9.585 1596 HA ARG 108 HA ARG 108 14.503 -2.637 11.207 1597 1HB ARG 108 HB2 ARG 108 15.636 -2.725 8.373 1598 2HB ARG 108 HB3 ARG 108 14.828 -4.022 9.245 1599 1HG ARG 108 HG2 ARG 108 13.573 -1.437 8.273 1600 2HG ARG 108 HG3 ARG 108 13.359 -3.032 7.563 1601 1HD ARG 108 HD2 ARG 108 12.470 -2.121 10.307 1602 2HD ARG 108 HD3 ARG 108 11.407 -2.391 8.903 1603 HE ARG 108 HE ARG 108 12.582 -4.816 9.173 1604 1HH1 ARG 108 HH11 ARG 108 10.839 -2.761 11.483 1605 2HH1 ARG 108 HH12 ARG 108 10.289 -4.073 12.457 1606 1HH2 ARG 108 HH21 ARG 108 11.861 -6.569 10.477 1607 2HH2 ARG 108 HH22 ARG 108 10.876 -6.287 11.860 1608 H ALA 109 HN ALA 109 17.412 -1.952 9.264 1609 HA ALA 109 HA ALA 109 19.487 -2.732 9.329 1610 1HB ALA 109 HB1 ALA 109 19.415 -2.264 12.311 1611 2HB ALA 109 HB2 ALA 109 20.799 -2.131 11.210 1612 3HB ALA 109 HB3 ALA 109 19.484 -0.948 11.117 1613 H GLN 110 HN GLN 110 21.165 -4.189 10.674 1614 HA GLN 110 HA GLN 110 20.039 -6.861 10.763 1615 1HB GLN 110 HB2 GLN 110 22.467 -6.344 10.225 1616 2HB GLN 110 HB3 GLN 110 22.717 -6.025 11.951 1617 1HG GLN 110 HG2 GLN 110 21.316 -8.586 11.399 1618 2HG GLN 110 HG3 GLN 110 22.923 -8.498 10.683 1619 1HE2 GLN 110 HE22 GLN 110 21.100 -8.410 13.754 1620 2HE2 GLN 110 HE21 GLN 110 22.469 -8.836 14.764 1621 H GLY 111 HN GLY 111 20.904 -4.381 13.169 1622 1HA GLY 111 HA2 GLY 111 19.095 -4.240 14.855 1623 2HA GLY 111 HA3 GLY 111 19.436 -5.969 15.190 1624 H THR 112 HN THR 112 22.410 -5.285 14.909 1625 HA THR 112 HA THR 112 22.815 -5.008 17.771 1626 HB THR 112 HB THR 112 25.186 -5.181 17.288 1627 HG1 THR 112 HG1 THR 112 25.855 -5.301 15.099 1628 1HG2 THR 112 HG21 THR 112 23.704 -7.223 17.105 1629 2HG2 THR 112 HG22 THR 112 23.760 -6.992 15.330 1630 3HG2 THR 112 HG23 THR 112 25.257 -7.318 16.234 1631 H GLU 113 HN GLU 113 24.382 -3.325 18.645 1632 HA GLU 113 HA GLU 113 23.294 -0.804 18.239 1633 1HB GLU 113 HB2 GLU 113 26.053 -1.577 19.314 1634 2HB GLU 113 HB3 GLU 113 25.278 0.002 19.571 1635 1HG GLU 113 HG2 GLU 113 23.369 -1.178 20.710 1636 2HG GLU 113 HG3 GLU 113 24.258 -2.696 20.557 1637 H GLU 114 HN GLU 114 26.164 -2.307 16.800 1638 HA GLU 114 HA GLU 114 27.064 0.070 15.456 1639 1HB GLU 114 HB2 GLU 114 28.560 -1.667 14.281 1640 2HB GLU 114 HB3 GLU 114 28.820 -1.387 16.016 1641 1HG GLU 114 HG2 GLU 114 27.474 -3.466 16.476 1642 2HG GLU 114 HG3 GLU 114 27.375 -3.710 14.716 1643 H GLU 115 HN GLU 115 25.080 -2.900 14.593 1644 HA GLU 115 HA GLU 115 25.311 -2.161 11.814 1645 1HB GLU 115 HB2 GLU 115 23.625 -4.203 13.243 1646 2HB GLU 115 HB3 GLU 115 23.568 -3.937 11.499 1647 1HG GLU 115 HG2 GLU 115 26.240 -4.433 12.878 1648 2HG GLU 115 HG3 GLU 115 25.184 -5.774 12.431 1649 H LYS 116 HN LYS 116 22.966 -1.513 14.418 1650 HA LYS 116 HA LYS 116 20.996 -0.264 12.768 1651 1HB LYS 116 HB2 LYS 116 21.799 0.345 15.642 1652 2HB LYS 116 HB3 LYS 116 20.397 1.020 14.831 1653 1HG LYS 116 HG2 LYS 116 20.300 -1.891 14.636 1654 2HG LYS 116 HG3 LYS 116 20.619 -1.400 16.292 1655 1HD LYS 116 HD2 LYS 116 18.351 -1.567 16.274 1656 2HD LYS 116 HD3 LYS 116 18.605 0.172 16.118 1657 1HE LYS 116 HE2 LYS 116 18.133 0.020 13.672 1658 2HE LYS 116 HE3 LYS 116 18.035 -1.757 13.817 1659 1HZ LYS 116 HZ1 LYS 116 15.823 -0.768 13.822 1660 2HZ LYS 116 HZ2 LYS 116 16.112 -1.478 15.257 1661 3HZ LYS 116 HZ3 LYS 116 16.180 0.148 15.130 1662 H TRP 117 HN TRP 117 23.775 1.188 14.543 1663 HA TRP 117 HA TRP 117 23.359 3.750 13.416 1664 1HB TRP 117 HB2 TRP 117 24.779 3.226 15.407 1665 2HB TRP 117 HB3 TRP 117 26.005 2.566 14.329 1666 HD1 TRP 117 HD1 TRP 117 24.725 5.577 12.689 1667 HE1 TRP 117 HE1 TRP 117 26.240 7.590 13.051 1668 HE3 TRP 117 HE3 TRP 117 27.507 3.749 16.585 1669 HZ2 TRP 117 HZ2 TRP 117 28.326 8.341 14.851 1670 HZ3 TRP 117 HZ3 TRP 117 29.259 5.167 17.626 1671 HH2 TRP 117 HH2 TRP 117 29.686 7.468 16.774 1672 H ALA 118 HN ALA 118 25.324 1.019 12.243 1673 HA ALA 118 HA ALA 118 26.470 2.327 10.036 1674 1HB ALA 118 HB1 ALA 118 26.867 -0.029 9.230 1675 2HB ALA 118 HB2 ALA 118 27.196 0.099 10.978 1676 3HB ALA 118 HB3 ALA 118 25.686 -0.615 10.428 1677 H PHE 119 HN PHE 119 23.333 0.574 10.222 1678 HA PHE 119 HA PHE 119 22.720 1.045 7.448 1679 1HB PHE 119 HB2 PHE 119 21.069 0.203 9.841 1680 2HB PHE 119 HB3 PHE 119 20.297 0.713 8.369 1681 HD1 PHE 119 HD1 PHE 119 19.434 -0.991 7.122 1682 HD2 PHE 119 HD2 PHE 119 23.286 -1.556 8.995 1683 HE1 PHE 119 HE1 PHE 119 19.564 -3.276 6.194 1684 HE2 PHE 119 HE2 PHE 119 23.400 -3.839 8.064 1685 HZ PHE 119 HZ PHE 119 21.537 -4.717 6.668 1686 H PHE 120 HN PHE 120 22.061 2.876 10.496 1687 HA PHE 120 HA PHE 120 20.395 4.885 9.419 1688 1HB PHE 120 HB2 PHE 120 22.604 5.373 11.457 1689 2HB PHE 120 HB3 PHE 120 21.212 6.355 11.154 1690 HD1 PHE 120 HD1 PHE 120 19.598 3.285 11.230 1691 HD2 PHE 120 HD2 PHE 120 21.883 5.884 13.803 1692 HE1 PHE 120 HE1 PHE 120 18.444 2.357 13.197 1693 HE2 PHE 120 HE2 PHE 120 20.740 4.922 15.780 1694 HZ PHE 120 HZ PHE 120 19.010 3.161 15.484 1695 H GLN 121 HN GLN 121 23.971 4.820 9.733 1696 HA GLN 121 HA GLN 121 24.387 7.316 8.541 1697 1HB GLN 121 HB2 GLN 121 25.901 6.195 10.083 1698 2HB GLN 121 HB3 GLN 121 26.297 4.970 8.862 1699 1HG GLN 121 HG2 GLN 121 27.341 6.576 7.433 1700 2HG GLN 121 HG3 GLN 121 26.622 7.938 8.313 1701 1HE2 GLN 121 HE22 GLN 121 27.199 8.176 10.697 1702 2HE2 GLN 121 HE21 GLN 121 28.862 7.826 11.131 1703 H ARG 122 HN ARG 122 24.619 3.988 7.136 1704 HA ARG 122 HA ARG 122 25.549 4.859 4.628 1705 1HB ARG 122 HB2 ARG 122 25.621 2.504 5.391 1706 2HB ARG 122 HB3 ARG 122 23.854 2.422 5.391 1707 1HG ARG 122 HG2 ARG 122 23.852 2.734 2.905 1708 2HG ARG 122 HG3 ARG 122 25.619 2.828 2.933 1709 1HD ARG 122 HD2 ARG 122 24.924 0.604 2.260 1710 2HD ARG 122 HD3 ARG 122 25.719 0.516 3.828 1711 HE ARG 122 HE ARG 122 22.732 0.443 3.373 1712 1HH1 ARG 122 HH11 ARG 122 25.508 -0.647 5.345 1713 2HH1 ARG 122 HH12 ARG 122 24.540 -1.699 6.307 1714 1HH2 ARG 122 HH21 ARG 122 21.514 -0.861 4.601 1715 2HH2 ARG 122 HH22 ARG 122 22.170 -1.797 5.909 1716 H VAL 123 HN VAL 123 22.183 4.306 5.827 1717 HA VAL 123 HA VAL 123 20.963 4.884 3.314 1718 HB VAL 123 HB VAL 123 19.932 4.791 6.169 1719 1HG1 VAL 123 HG11 VAL 123 18.415 6.280 5.138 1720 2HG1 VAL 123 HG12 VAL 123 18.438 5.381 3.601 1721 3HG1 VAL 123 HG13 VAL 123 17.655 4.698 5.035 1722 1HG2 VAL 123 HG21 VAL 123 20.637 2.623 5.079 1723 2HG2 VAL 123 HG22 VAL 123 18.906 2.680 5.406 1724 3HG2 VAL 123 HG23 VAL 123 19.507 2.951 3.756 1725 H ARG 124 HN ARG 124 21.651 7.074 6.178 1726 HA ARG 124 HA ARG 124 20.265 9.223 4.903 1727 1HB ARG 124 HB2 ARG 124 21.113 10.677 6.547 1728 2HB ARG 124 HB3 ARG 124 20.753 9.122 7.275 1729 1HG ARG 124 HG2 ARG 124 22.648 9.720 8.379 1730 2HG ARG 124 HG3 ARG 124 23.269 8.649 7.139 1731 1HD ARG 124 HD2 ARG 124 23.971 10.656 5.807 1732 2HD ARG 124 HD3 ARG 124 23.321 11.698 7.088 1733 HE ARG 124 HE ARG 124 24.968 10.233 8.563 1734 1HH1 ARG 124 HH21 ARG 124 25.741 11.634 5.364 1735 2HH1 ARG 124 HH22 ARG 124 27.426 11.730 5.710 1736 1HH2 ARG 124 HH11 ARG 124 27.024 10.338 8.976 1737 2HH2 ARG 124 HH12 ARG 124 28.223 10.976 7.861 1738 H ASP 125 HN ASP 125 23.625 8.133 4.606 1739 HA ASP 125 HA ASP 125 24.511 10.312 2.966 1740 1HB ASP 125 HB2 ASP 125 26.088 8.750 3.959 1741 2HB ASP 125 HB3 ASP 125 25.410 7.410 3.032 1742 H GLU 126 HN GLU 126 22.999 7.151 2.074 1743 HA GLU 126 HA GLU 126 23.024 7.516 -0.734 1744 1HB GLU 126 HB2 GLU 126 22.559 5.371 0.338 1745 2HB GLU 126 HB3 GLU 126 21.092 6.005 1.083 1746 1HG GLU 126 HG2 GLU 126 20.063 6.312 -1.149 1747 2HG GLU 126 HG3 GLU 126 21.535 5.699 -1.911 1748 H ILE 127 HN ILE 127 20.491 8.308 1.667 1749 HA ILE 127 HA ILE 127 18.577 9.426 -0.081 1750 HB ILE 127 HB ILE 127 19.238 9.689 2.869 1751 1HG1 ILE 127 HG12 ILE 127 16.766 8.639 1.413 1752 2HG1 ILE 127 HG13 ILE 127 18.159 7.628 1.867 1753 1HG2 ILE 127 HG21 ILE 127 17.194 10.963 3.264 1754 2HG2 ILE 127 HG22 ILE 127 18.302 11.896 2.279 1755 3HG2 ILE 127 HG23 ILE 127 16.924 11.088 1.503 1756 1HD1 ILE 127 HD11 ILE 127 16.189 8.994 3.717 1757 2HD1 ILE 127 HD12 ILE 127 16.489 7.269 3.513 1758 3HD1 ILE 127 HD13 ILE 127 17.722 8.290 4.280 1759 H GLY 128 HN GLY 128 21.177 11.098 1.820 1760 1HA GLY 128 HA2 GLY 128 20.497 13.684 0.914 1761 2HA GLY 128 HA3 GLY 128 22.084 13.161 1.560 1762 H ASN 129 HN ASN 129 22.905 11.315 -0.429 1763 HA ASN 129 HA ASN 129 23.842 13.055 -2.451 1764 1HB ASN 129 HB2 ASN 129 25.026 10.968 -1.997 1765 2HB ASN 129 HB3 ASN 129 23.607 10.015 -2.458 1766 1HD2 ASN 129 HD22 ASN 129 23.311 9.531 -4.682 1767 2HD2 ASN 129 HD21 ASN 129 24.092 10.407 -5.984 1768 H ARG 130 HN ARG 130 21.068 10.775 -2.481 1769 HA ARG 130 HA ARG 130 20.452 11.399 -5.232 1770 1HB ARG 130 HB2 ARG 130 18.818 10.100 -3.013 1771 2HB ARG 130 HB3 ARG 130 18.146 10.427 -4.603 1772 1HG ARG 130 HG2 ARG 130 20.494 8.598 -4.005 1773 2HG ARG 130 HG3 ARG 130 18.876 8.129 -4.506 1774 1HD ARG 130 HD2 ARG 130 21.017 9.493 -6.163 1775 2HD ARG 130 HD3 ARG 130 20.292 7.920 -6.425 1776 HE ARG 130 HE ARG 130 19.110 10.591 -6.979 1777 1HH1 ARG 130 HH11 ARG 130 18.708 7.064 -7.276 1778 2HH1 ARG 130 HH12 ARG 130 17.418 7.198 -8.420 1779 1HH2 ARG 130 HH21 ARG 130 17.383 10.724 -8.444 1780 2HH2 ARG 130 HH22 ARG 130 16.615 9.286 -9.048 1781 H LEU 131 HN LEU 131 19.281 12.861 -2.149 1782 HA LEU 131 HA LEU 131 17.439 14.591 -3.489 1783 1HB LEU 131 HB2 LEU 131 18.779 14.563 -0.782 1784 2HB LEU 131 HB3 LEU 131 18.223 16.120 -1.352 1785 HG LEU 131 HG LEU 131 16.528 15.229 0.001 1786 1HD1 LEU 131 HD11 LEU 131 15.833 16.451 -2.086 1787 2HD1 LEU 131 HD12 LEU 131 15.482 14.886 -2.837 1788 3HD1 LEU 131 HD13 LEU 131 14.610 15.382 -1.391 1789 1HD2 LEU 131 HD21 LEU 131 16.641 12.707 -1.671 1790 2HD2 LEU 131 HD22 LEU 131 16.994 12.918 0.045 1791 3HD2 LEU 131 HD23 LEU 131 15.332 13.109 -0.535 1792 H LYS 132 HN LYS 132 20.924 14.987 -2.710 1793 HA LYS 132 HA LYS 132 21.037 17.669 -3.643 1794 1HB LYS 132 HB2 LYS 132 22.646 16.488 -2.138 1795 2HB LYS 132 HB3 LYS 132 23.212 15.518 -3.507 1796 1HG LYS 132 HG2 LYS 132 24.009 17.561 -4.636 1797 2HG LYS 132 HG3 LYS 132 23.388 18.558 -3.312 1798 1HD LYS 132 HD2 LYS 132 25.473 16.366 -2.979 1799 2HD LYS 132 HD3 LYS 132 25.860 18.085 -3.210 1800 1HE LYS 132 HE2 LYS 132 24.581 18.624 -1.132 1801 2HE LYS 132 HE3 LYS 132 24.294 16.898 -0.877 1802 1HZ LYS 132 HZ1 LYS 132 26.695 16.585 -0.707 1803 2HZ LYS 132 HZ2 LYS 132 26.970 18.176 -0.954 1804 3HZ LYS 132 HZ3 LYS 132 26.202 17.680 0.393 1805 H GLU 133 HN GLU 133 21.675 14.503 -5.343 1806 HA GLU 133 HA GLU 133 22.119 15.733 -7.878 1807 1HB GLU 133 HB2 GLU 133 21.180 12.965 -7.039 1808 2HB GLU 133 HB3 GLU 133 21.004 13.479 -8.734 1809 1HG GLU 133 HG2 GLU 133 23.332 13.980 -8.933 1810 2HG GLU 133 HG3 GLU 133 23.632 13.605 -7.225 1811 H PHE 134 HN PHE 134 18.966 14.844 -6.255 1812 HA PHE 134 HA PHE 134 17.472 15.374 -8.583 1813 1HB PHE 134 HB2 PHE 134 16.494 14.285 -6.698 1814 2HB PHE 134 HB3 PHE 134 16.776 15.668 -5.641 1815 HD1 PHE 134 HD1 PHE 134 15.042 14.857 -8.861 1816 HD2 PHE 134 HD2 PHE 134 14.969 17.117 -5.209 1817 HE1 PHE 134 HE1 PHE 134 12.866 15.849 -9.538 1818 HE2 PHE 134 HE2 PHE 134 12.821 18.165 -5.904 1819 HZ PHE 134 HZ PHE 134 11.763 17.514 -8.060 1820 H ALA 135 HN ALA 135 18.641 17.630 -6.091 1821 HA ALA 135 HA ALA 135 17.386 19.960 -7.087 1822 1HB ALA 135 HB1 ALA 135 18.598 19.648 -4.855 1823 2HB ALA 135 HB2 ALA 135 20.114 19.834 -5.753 1824 3HB ALA 135 HB3 ALA 135 18.930 21.164 -5.718 1825 H GLU 136 HN GLU 136 20.228 18.215 -8.191 1826 HA GLU 136 HA GLU 136 21.289 20.391 -9.788 1827 1HB GLU 136 HB2 GLU 136 22.149 17.517 -9.332 1828 2HB GLU 136 HB3 GLU 136 23.024 18.621 -10.375 1829 1HG GLU 136 HG2 GLU 136 22.513 19.327 -7.465 1830 2HG GLU 136 HG3 GLU 136 23.807 18.234 -7.932 1831 H THR 137 HN THR 137 19.865 17.214 -10.243 1832 HA THR 137 HA THR 137 20.145 17.221 -13.137 1833 HB THR 137 HB THR 137 19.303 14.881 -12.881 1834 HG1 THR 137 HG1 THR 137 19.206 15.377 -10.126 1835 1HG2 THR 137 HG21 THR 137 21.484 15.638 -10.890 1836 2HG2 THR 137 HG22 THR 137 21.128 14.002 -11.482 1837 3HG2 THR 137 HG23 THR 137 21.685 15.258 -12.603 1838 H GLY 138 HN GLY 138 17.627 17.957 -10.799 1839 1HA GLY 138 HA2 GLY 138 15.399 18.285 -10.915 1840 2HA GLY 138 HA3 GLY 138 15.661 18.966 -12.546 1841 H LYS 139 HN LYS 139 16.043 15.777 -11.039 1842 HA LYS 139 HA LYS 139 15.739 14.091 -13.051 1843 1HB LYS 139 HB2 LYS 139 15.956 13.574 -10.522 1844 2HB LYS 139 HB3 LYS 139 14.180 13.592 -10.495 1845 1HG LYS 139 HG2 LYS 139 14.437 11.406 -10.795 1846 2HG LYS 139 HG3 LYS 139 14.449 11.865 -12.490 1847 1HD LYS 139 HD2 LYS 139 16.899 11.353 -10.737 1848 2HD LYS 139 HD3 LYS 139 16.224 10.227 -11.918 1849 1HE LYS 139 HE2 LYS 139 16.697 11.918 -13.725 1850 2HE LYS 139 HE3 LYS 139 17.475 12.948 -12.507 1851 1HZ LYS 139 HZ1 LYS 139 18.365 10.218 -13.247 1852 2HZ LYS 139 HZ2 LYS 139 19.084 11.602 -13.710 1853 3HZ LYS 139 HZ3 LYS 139 19.089 11.177 -12.136 Start of MODEL 10 1 1H MET 1 H1 MET 1 -22.927 -11.153 -7.816 2 2H MET 1 H2 MET 1 -24.566 -11.232 -7.756 3 3H MET 1 H3 MET 1 -23.836 -10.146 -8.761 4 HA MET 1 HA MET 1 -23.531 -13.048 -8.982 5 1HB MET 1 HB2 MET 1 -25.867 -12.373 -9.477 6 2HB MET 1 HB3 MET 1 -25.285 -11.226 -10.690 7 1HG MET 1 HG2 MET 1 -24.301 -13.105 -11.984 8 2HG MET 1 HG3 MET 1 -24.800 -14.234 -10.725 9 1HE MET 1 HE1 MET 1 -27.626 -12.138 -13.751 10 2HE MET 1 HE2 MET 1 -26.803 -11.202 -12.488 11 3HE MET 1 HE3 MET 1 -25.854 -12.019 -13.751 12 H ALA 2 HN ALA 2 -21.564 -13.362 -9.717 13 HA ALA 2 HA ALA 2 -19.680 -13.333 -10.813 14 1HB ALA 2 HB1 ALA 2 -20.944 -13.179 -12.936 15 2HB ALA 2 HB2 ALA 2 -20.838 -11.403 -12.854 16 3HB ALA 2 HB3 ALA 2 -19.367 -12.376 -13.010 17 H ILE 3 HN ILE 3 -17.754 -12.028 -11.231 18 HA ILE 3 HA ILE 3 -17.639 -9.593 -9.574 19 HB ILE 3 HB ILE 3 -15.622 -11.747 -10.295 20 1HG1 ILE 3 HG12 ILE 3 -15.022 -11.482 -7.875 21 2HG1 ILE 3 HG13 ILE 3 -16.348 -10.339 -7.697 22 1HG2 ILE 3 HG21 ILE 3 -14.970 -8.911 -9.373 23 2HG2 ILE 3 HG22 ILE 3 -13.823 -10.277 -9.405 24 3HG2 ILE 3 HG23 ILE 3 -14.476 -9.650 -10.911 25 1HD1 ILE 3 HD11 ILE 3 -16.860 -12.508 -6.832 26 2HD1 ILE 3 HD12 ILE 3 -17.966 -12.122 -8.151 27 3HD1 ILE 3 HD13 ILE 3 -16.625 -13.277 -8.419 28 H VAL 4 HN VAL 4 -17.999 -7.855 -10.738 29 HA VAL 4 HA VAL 4 -17.597 -7.726 -13.640 30 HB VAL 4 HB VAL 4 -18.615 -5.699 -11.635 31 1HG1 VAL 4 HG11 VAL 4 -19.824 -4.679 -13.559 32 2HG1 VAL 4 HG12 VAL 4 -18.089 -4.553 -13.725 33 3HG1 VAL 4 HG13 VAL 4 -18.976 -5.789 -14.657 34 1HG2 VAL 4 HG21 VAL 4 -20.917 -6.364 -12.432 35 2HG2 VAL 4 HG22 VAL 4 -20.178 -7.729 -13.286 36 3HG2 VAL 4 HG23 VAL 4 -20.109 -7.624 -11.512 37 H LYS 5 HN LYS 5 -16.423 -5.677 -14.417 38 HA LYS 5 HA LYS 5 -14.273 -4.843 -12.611 39 1HB LYS 5 HB2 LYS 5 -13.314 -6.477 -14.204 40 2HB LYS 5 HB3 LYS 5 -13.841 -5.451 -15.552 41 1HG LYS 5 HG2 LYS 5 -12.383 -3.623 -14.748 42 2HG LYS 5 HG3 LYS 5 -11.964 -4.556 -13.306 43 1HD LYS 5 HD2 LYS 5 -10.144 -4.629 -14.909 44 2HD LYS 5 HD3 LYS 5 -10.837 -6.247 -14.708 45 1HE LYS 5 HE2 LYS 5 -12.133 -5.953 -16.808 46 2HE LYS 5 HE3 LYS 5 -11.479 -4.316 -16.987 47 1HZ LYS 5 HZ1 LYS 5 -9.270 -5.267 -17.213 48 2HZ LYS 5 HZ2 LYS 5 -9.855 -6.794 -17.020 49 3HZ LYS 5 HZ3 LYS 5 -10.271 -5.918 -18.331 50 H ALA 6 HN ALA 6 -14.416 -2.761 -12.299 51 HA ALA 6 HA ALA 6 -16.186 -0.994 -13.829 52 1HB ALA 6 HB1 ALA 6 -14.543 -0.817 -11.307 53 2HB ALA 6 HB2 ALA 6 -15.100 0.655 -12.121 54 3HB ALA 6 HB3 ALA 6 -16.271 -0.510 -11.565 55 H THR 7 HN THR 7 -15.115 1.269 -14.281 56 HA THR 7 HA THR 7 -12.329 1.465 -14.652 57 HB THR 7 HB THR 7 -12.767 0.194 -16.693 58 HG1 THR 7 HG1 THR 7 -11.720 1.568 -18.055 59 1HG2 THR 7 HG21 THR 7 -14.019 1.206 -18.586 60 2HG2 THR 7 HG22 THR 7 -15.057 0.738 -17.241 61 3HG2 THR 7 HG23 THR 7 -14.645 2.454 -17.489 62 H ASP 8 HN ASP 8 -12.190 3.680 -16.083 63 HA ASP 8 HA ASP 8 -12.168 5.696 -14.437 64 1HB ASP 8 HB2 ASP 8 -11.214 5.862 -16.594 65 2HB ASP 8 HB3 ASP 8 -12.776 5.699 -17.394 66 H GLN 9 HN GLN 9 -15.227 5.049 -16.166 67 HA GLN 9 HA GLN 9 -16.596 6.902 -14.319 68 1HB GLN 9 HB2 GLN 9 -16.864 6.738 -17.337 69 2HB GLN 9 HB3 GLN 9 -18.145 7.419 -16.326 70 1HG GLN 9 HG2 GLN 9 -16.781 9.213 -15.557 71 2HG GLN 9 HG3 GLN 9 -15.303 8.461 -16.132 72 1HE2 GLN 9 HE22 GLN 9 -14.546 8.963 -18.152 73 2HE2 GLN 9 HE21 GLN 9 -15.450 9.887 -19.351 74 H SER 10 HN SER 10 -16.683 3.981 -16.359 75 HA SER 10 HA SER 10 -19.269 3.149 -15.837 76 1HB SER 10 HB2 SER 10 -16.869 1.316 -16.030 77 2HB SER 10 HB3 SER 10 -18.530 0.991 -16.552 78 HG SER 10 HG SER 10 -18.281 2.492 -18.203 79 H PHE 11 HN PHE 11 -16.555 3.185 -13.523 80 HA PHE 11 HA PHE 11 -17.474 1.343 -11.602 81 1HB PHE 11 HB2 PHE 11 -15.420 2.542 -11.203 82 2HB PHE 11 HB3 PHE 11 -16.208 4.084 -11.373 83 HD1 PHE 11 HD1 PHE 11 -17.301 5.183 -9.590 84 HD2 PHE 11 HD2 PHE 11 -15.851 1.130 -8.977 85 HE1 PHE 11 HE1 PHE 11 -17.497 5.470 -7.142 86 HE2 PHE 11 HE2 PHE 11 -15.999 1.492 -6.550 87 HZ PHE 11 HZ PHE 11 -16.816 3.627 -5.614 88 H SER 12 HN SER 12 -18.581 4.787 -12.055 89 HA SER 12 HA SER 12 -20.456 4.606 -9.931 90 1HB SER 12 HB2 SER 12 -20.688 6.322 -12.448 91 2HB SER 12 HB3 SER 12 -21.326 6.691 -10.839 92 HG SER 12 HG SER 12 -19.377 7.835 -11.267 93 H ALA 13 HN ALA 13 -20.743 4.077 -13.474 94 HA ALA 13 HA ALA 13 -23.536 3.861 -13.463 95 1HB ALA 13 HB1 ALA 13 -21.551 2.547 -15.375 96 2HB ALA 13 HB2 ALA 13 -23.266 2.866 -15.703 97 3HB ALA 13 HB3 ALA 13 -22.140 4.225 -15.484 98 H GLU 14 HN GLU 14 -21.016 1.408 -12.958 99 HA GLU 14 HA GLU 14 -22.804 -0.807 -12.861 100 1HB GLU 14 HB2 GLU 14 -19.906 -0.474 -12.037 101 2HB GLU 14 HB3 GLU 14 -20.747 -2.016 -11.957 102 1HG GLU 14 HG2 GLU 14 -20.419 -0.386 -14.503 103 2HG GLU 14 HG3 GLU 14 -19.365 -1.713 -14.012 104 H THR 15 HN THR 15 -22.112 1.646 -10.502 105 HA THR 15 HA THR 15 -22.834 -0.156 -8.250 106 HB THR 15 HB THR 15 -21.512 1.421 -6.869 107 HG1 THR 15 HG1 THR 15 -20.471 2.473 -9.237 108 1HG2 THR 15 HG21 THR 15 -20.174 -0.432 -7.515 109 2HG2 THR 15 HG22 THR 15 -20.020 0.128 -9.193 110 3HG2 THR 15 HG23 THR 15 -19.206 1.004 -7.898 111 H SER 16 HN SER 16 -24.236 2.212 -10.140 112 HA SER 16 HA SER 16 -25.233 4.004 -8.160 113 1HB SER 16 HB2 SER 16 -26.098 3.469 -11.016 114 2HB SER 16 HB3 SER 16 -26.744 4.769 -9.994 115 HG SER 16 HG SER 16 -23.987 4.421 -10.619 116 H GLU 17 HN GLU 17 -26.205 0.786 -8.705 117 HA GLU 17 HA GLU 17 -28.772 1.289 -7.379 118 1HB GLU 17 HB2 GLU 17 -28.425 -0.238 -10.001 119 2HB GLU 17 HB3 GLU 17 -29.866 -0.344 -8.983 120 1HG GLU 17 HG2 GLU 17 -30.208 2.122 -9.250 121 2HG GLU 17 HG3 GLU 17 -28.840 2.168 -10.368 122 H GLY 18 HN GLY 18 -29.506 -0.460 -6.129 123 1HA GLY 18 HA2 GLY 18 -29.396 -2.330 -4.884 124 2HA GLY 18 HA3 GLY 18 -28.260 -3.045 -6.047 125 H VAL 19 HN VAL 19 -27.335 -3.859 -4.005 126 HA VAL 19 HA VAL 19 -25.436 -1.913 -2.791 127 HB VAL 19 HB VAL 19 -26.256 -4.582 -1.585 128 1HG1 VAL 19 HG11 VAL 19 -25.018 -3.701 0.379 129 2HG1 VAL 19 HG12 VAL 19 -23.962 -3.871 -1.018 130 3HG1 VAL 19 HG13 VAL 19 -24.555 -2.269 -0.546 131 1HG2 VAL 19 HG21 VAL 19 -27.317 -1.783 -1.253 132 2HG2 VAL 19 HG22 VAL 19 -28.182 -3.316 -1.326 133 3HG2 VAL 19 HG23 VAL 19 -27.293 -2.865 0.136 134 H VAL 20 HN VAL 20 -23.465 -1.951 -3.391 135 HA VAL 20 HA VAL 20 -22.490 -4.216 -5.022 136 HB VAL 20 HB VAL 20 -22.284 -1.292 -5.869 137 1HG1 VAL 20 HG11 VAL 20 -21.557 -2.359 -8.011 138 2HG1 VAL 20 HG12 VAL 20 -20.472 -2.737 -6.657 139 3HG1 VAL 20 HG13 VAL 20 -21.632 -3.946 -7.217 140 1HG2 VAL 20 HG21 VAL 20 -24.602 -1.759 -6.124 141 2HG2 VAL 20 HG22 VAL 20 -23.896 -1.988 -7.723 142 3HG2 VAL 20 HG23 VAL 20 -24.306 -3.394 -6.732 143 H LEU 21 HN LEU 21 -20.663 -4.821 -4.196 144 HA LEU 21 HA LEU 21 -19.003 -3.025 -2.510 145 1HB LEU 21 HB2 LEU 21 -19.397 -5.290 -1.740 146 2HB LEU 21 HB3 LEU 21 -18.833 -5.974 -3.261 147 HG LEU 21 HG LEU 21 -16.902 -4.155 -1.844 148 1HD1 LEU 21 HD11 LEU 21 -17.541 -6.944 -0.787 149 2HD1 LEU 21 HD12 LEU 21 -16.220 -5.877 -0.265 150 3HD1 LEU 21 HD13 LEU 21 -17.890 -5.412 0.048 151 1HD2 LEU 21 HD21 LEU 21 -16.651 -6.898 -3.133 152 2HD2 LEU 21 HD22 LEU 21 -16.253 -5.359 -3.924 153 3HD2 LEU 21 HD23 LEU 21 -15.300 -5.913 -2.550 154 H ALA 22 HN ALA 22 -17.069 -2.139 -3.322 155 HA ALA 22 HA ALA 22 -16.215 -3.092 -5.954 156 1HB ALA 22 HB1 ALA 22 -15.761 -0.254 -4.969 157 2HB ALA 22 HB2 ALA 22 -15.451 -0.891 -6.597 158 3HB ALA 22 HB3 ALA 22 -17.116 -0.709 -6.045 159 H ASP 23 HN ASP 23 -13.966 -3.239 -6.247 160 HA ASP 23 HA ASP 23 -12.301 -3.329 -3.783 161 1HB ASP 23 HB2 ASP 23 -13.266 -5.532 -3.905 162 2HB ASP 23 HB3 ASP 23 -12.987 -5.624 -5.638 163 H PHE 24 HN PHE 24 -10.084 -3.264 -4.228 164 HA PHE 24 HA PHE 24 -9.315 -2.429 -6.989 165 1HB PHE 24 HB2 PHE 24 -8.730 -1.131 -4.311 166 2HB PHE 24 HB3 PHE 24 -7.932 -0.698 -5.809 167 HD1 PHE 24 HD1 PHE 24 -8.866 0.921 -7.228 168 HD2 PHE 24 HD2 PHE 24 -11.400 -0.903 -4.276 169 HE1 PHE 24 HE1 PHE 24 -10.719 2.489 -7.824 170 HE2 PHE 24 HE2 PHE 24 -13.257 0.574 -4.941 171 HZ PHE 24 HZ PHE 24 -12.912 2.306 -6.694 172 H TRP 25 HN TRP 25 -7.794 -3.760 -7.682 173 HA TRP 25 HA TRP 25 -6.020 -5.196 -5.785 174 1HB TRP 25 HB2 TRP 25 -6.554 -7.255 -6.631 175 2HB TRP 25 HB3 TRP 25 -8.133 -6.499 -6.616 176 HD1 TRP 25 HD1 TRP 25 -8.835 -5.384 -9.107 177 HE1 TRP 25 HE1 TRP 25 -8.317 -6.076 -11.476 178 HE3 TRP 25 HE3 TRP 25 -5.084 -8.708 -8.104 179 HZ2 TRP 25 HZ2 TRP 25 -6.194 -7.661 -12.831 180 HZ3 TRP 25 HZ3 TRP 25 -3.773 -9.720 -9.940 181 HH2 TRP 25 HH2 TRP 25 -4.322 -9.191 -12.306 182 H ALA 26 HN ALA 26 -3.980 -5.841 -6.884 183 HA ALA 26 HA ALA 26 -3.580 -5.650 -9.687 184 1HB ALA 26 HB1 ALA 26 -3.447 -3.337 -9.654 185 2HB ALA 26 HB2 ALA 26 -2.783 -3.325 -7.986 186 3HB ALA 26 HB3 ALA 26 -1.756 -3.728 -9.381 187 HA PRO 27 HA PRO 27 0.117 -7.944 -8.707 188 1HB PRO 27 HB2 PRO 27 1.611 -5.924 -10.382 189 2HB PRO 27 HB3 PRO 27 1.740 -7.711 -10.397 190 1HG PRO 27 HG2 PRO 27 0.266 -6.429 -12.287 191 2HG PRO 27 HG3 PRO 27 -0.389 -7.918 -11.519 192 1HD PRO 27 HD2 PRO 27 -1.043 -5.051 -10.944 193 2HD PRO 27 HD3 PRO 27 -2.125 -6.470 -11.052 194 H TRP 28 HN TRP 28 0.071 -4.495 -7.849 195 HA TRP 28 HA TRP 28 2.567 -4.199 -6.594 196 1HB TRP 28 HB2 TRP 28 0.005 -2.957 -5.645 197 2HB TRP 28 HB3 TRP 28 1.642 -2.336 -5.491 198 HD1 TRP 28 HD1 TRP 28 -1.321 -1.990 -7.464 199 HE1 TRP 28 HE1 TRP 28 -0.988 -0.763 -9.703 200 HE3 TRP 28 HE3 TRP 28 3.767 -2.107 -7.613 201 HZ2 TRP 28 HZ2 TRP 28 1.256 -0.048 -11.393 202 HZ3 TRP 28 HZ3 TRP 28 4.992 -1.139 -9.541 203 HH2 TRP 28 HH2 TRP 28 3.750 -0.114 -11.436 204 H CYS 29 HN CYS 29 -0.093 -6.217 -5.454 205 HA CYS 29 HA CYS 29 1.360 -6.474 -2.872 206 1HB CYS 29 HB2 CYS 29 -0.912 -4.894 -3.206 207 2HB CYS 29 HB3 CYS 29 -1.580 -6.406 -2.614 208 H GLY 30 HN GLY 30 0.823 -8.310 -1.617 209 1HA GLY 30 HA2 GLY 30 0.259 -10.752 -3.049 210 2HA GLY 30 HA3 GLY 30 0.474 -10.547 -1.303 211 HA PRO 31 HA PRO 31 -3.937 -10.428 -0.432 212 1HB PRO 31 HB2 PRO 31 -3.956 -7.405 -0.489 213 2HB PRO 31 HB3 PRO 31 -4.858 -8.514 0.608 214 1HG PRO 31 HG2 PRO 31 -2.522 -7.403 1.441 215 2HG PRO 31 HG3 PRO 31 -2.800 -9.155 1.716 216 1HD PRO 31 HD2 PRO 31 -1.155 -7.819 -0.425 217 2HD PRO 31 HD3 PRO 31 -0.792 -9.298 0.508 218 H SER 32 HN SER 32 -3.052 -8.233 -3.171 219 HA SER 32 HA SER 32 -5.577 -8.175 -4.400 220 1HB SER 32 HB2 SER 32 -2.871 -8.519 -5.766 221 2HB SER 32 HB3 SER 32 -4.283 -7.657 -6.390 222 HG SER 32 HG SER 32 -2.503 -6.405 -5.467 223 H LYS 33 HN LYS 33 -3.425 -10.874 -4.029 224 HA LYS 33 HA LYS 33 -5.091 -12.458 -5.930 225 1HB LYS 33 HB2 LYS 33 -2.465 -13.383 -4.767 226 2HB LYS 33 HB3 LYS 33 -3.434 -14.085 -6.059 227 1HG LYS 33 HG2 LYS 33 -1.795 -13.117 -7.296 228 2HG LYS 33 HG3 LYS 33 -3.007 -11.829 -7.332 229 1HD LYS 33 HD2 LYS 33 -1.796 -10.642 -5.535 230 2HD LYS 33 HD3 LYS 33 -0.669 -12.000 -5.371 231 1HE LYS 33 HE2 LYS 33 0.031 -11.624 -7.771 232 2HE LYS 33 HE3 LYS 33 -0.993 -10.180 -7.800 233 1HZ LYS 33 HZ1 LYS 33 1.338 -10.627 -6.021 234 2HZ LYS 33 HZ2 LYS 33 1.288 -9.590 -7.273 235 3HZ LYS 33 HZ3 LYS 33 0.357 -9.317 -5.940 236 H MET 34 HN MET 34 -5.393 -11.677 -2.816 237 HA MET 34 HA MET 34 -6.266 -14.423 -1.989 238 1HB MET 34 HB2 MET 34 -5.282 -12.206 -0.160 239 2HB MET 34 HB3 MET 34 -5.871 -13.801 0.317 240 1HG MET 34 HG2 MET 34 -4.015 -14.817 -1.066 241 2HG MET 34 HG3 MET 34 -3.344 -13.198 -1.263 242 1HE MET 34 HE1 MET 34 -2.260 -11.772 0.700 243 2HE MET 34 HE2 MET 34 -3.775 -11.842 1.638 244 3HE MET 34 HE3 MET 34 -2.235 -12.279 2.401 245 H ILE 35 HN ILE 35 -6.902 -10.869 -1.753 246 HA ILE 35 HA ILE 35 -9.577 -11.139 -0.872 247 HB ILE 35 HB ILE 35 -7.911 -9.069 -1.079 248 1HG1 ILE 35 HG12 ILE 35 -10.085 -7.561 -1.069 249 2HG1 ILE 35 HG13 ILE 35 -10.932 -9.116 -1.045 250 1HG2 ILE 35 HG21 ILE 35 -8.440 -7.493 -2.807 251 2HG2 ILE 35 HG22 ILE 35 -7.802 -8.975 -3.521 252 3HG2 ILE 35 HG23 ILE 35 -9.550 -8.631 -3.589 253 1HD1 ILE 35 HD11 ILE 35 -10.461 -8.201 1.242 254 2HD1 ILE 35 HD12 ILE 35 -9.659 -9.767 0.986 255 3HD1 ILE 35 HD13 ILE 35 -8.719 -8.260 0.889 256 H ALA 36 HN ALA 36 -8.030 -11.220 -4.092 257 HA ALA 36 HA ALA 36 -10.295 -11.140 -5.691 258 1HB ALA 36 HB1 ALA 36 -7.603 -12.509 -6.127 259 2HB ALA 36 HB2 ALA 36 -8.877 -12.443 -7.362 260 3HB ALA 36 HB3 ALA 36 -8.170 -10.947 -6.715 261 HA PRO 37 HA PRO 37 -10.933 -15.902 -5.471 262 1HB PRO 37 HB2 PRO 37 -9.778 -17.070 -3.121 263 2HB PRO 37 HB3 PRO 37 -9.320 -17.360 -4.833 264 1HG PRO 37 HG2 PRO 37 -8.053 -15.627 -2.777 265 2HG PRO 37 HG3 PRO 37 -7.298 -16.391 -4.204 266 1HD PRO 37 HD2 PRO 37 -7.869 -13.693 -4.077 267 2HD PRO 37 HD3 PRO 37 -7.869 -14.626 -5.589 268 H VAL 38 HN VAL 38 -10.447 -14.163 -2.341 269 HA VAL 38 HA VAL 38 -12.636 -15.291 -0.984 270 HB VAL 38 HB VAL 38 -10.967 -12.811 -0.778 271 1HG1 VAL 38 HG11 VAL 38 -12.197 -12.108 1.300 272 2HG1 VAL 38 HG12 VAL 38 -12.972 -11.723 -0.240 273 3HG1 VAL 38 HG13 VAL 38 -13.570 -13.091 0.715 274 1HG2 VAL 38 HG21 VAL 38 -11.648 -15.014 1.194 275 2HG2 VAL 38 HG22 VAL 38 -10.259 -15.022 0.085 276 3HG2 VAL 38 HG23 VAL 38 -10.371 -13.783 1.353 277 H LEU 39 HN LEU 39 -12.545 -12.514 -3.261 278 HA LEU 39 HA LEU 39 -15.307 -11.840 -2.860 279 1HB LEU 39 HB2 LEU 39 -13.414 -11.339 -5.193 280 2HB LEU 39 HB3 LEU 39 -15.060 -10.732 -5.142 281 HG LEU 39 HG LEU 39 -12.924 -10.109 -3.029 282 1HD1 LEU 39 HD11 LEU 39 -12.706 -7.943 -4.043 283 2HD1 LEU 39 HD12 LEU 39 -12.308 -9.188 -5.227 284 3HD1 LEU 39 HD13 LEU 39 -13.875 -8.348 -5.319 285 1HD2 LEU 39 HD21 LEU 39 -14.372 -8.279 -2.315 286 2HD2 LEU 39 HD22 LEU 39 -15.614 -8.808 -3.464 287 3HD2 LEU 39 HD23 LEU 39 -15.161 -9.837 -2.087 288 H GLU 40 HN GLU 40 -13.665 -13.995 -5.266 289 HA GLU 40 HA GLU 40 -16.089 -14.530 -6.663 290 1HB GLU 40 HB2 GLU 40 -13.582 -16.230 -6.450 291 2HB GLU 40 HB3 GLU 40 -14.930 -16.455 -7.594 292 1HG GLU 40 HG2 GLU 40 -14.499 -14.235 -8.570 293 2HG GLU 40 HG3 GLU 40 -13.135 -14.001 -7.484 294 H GLU 41 HN GLU 41 -14.533 -16.127 -3.830 295 HA GLU 41 HA GLU 41 -16.492 -18.184 -3.586 296 1HB GLU 41 HB2 GLU 41 -14.504 -16.986 -1.641 297 2HB GLU 41 HB3 GLU 41 -15.543 -18.348 -1.233 298 1HG GLU 41 HG2 GLU 41 -13.570 -18.321 -3.555 299 2HG GLU 41 HG3 GLU 41 -13.251 -19.026 -1.972 300 H LEU 42 HN LEU 42 -16.493 -14.831 -2.646 301 HA LEU 42 HA LEU 42 -18.739 -15.054 -0.789 302 1HB LEU 42 HB2 LEU 42 -16.986 -13.268 -0.626 303 2HB LEU 42 HB3 LEU 42 -17.362 -12.741 -2.253 304 HG LEU 42 HG LEU 42 -19.664 -12.066 -1.499 305 1HD1 LEU 42 HD11 LEU 42 -19.800 -13.466 0.548 306 2HD1 LEU 42 HD12 LEU 42 -18.391 -12.606 1.213 307 3HD1 LEU 42 HD13 LEU 42 -19.924 -11.743 0.942 308 1HD2 LEU 42 HD21 LEU 42 -17.237 -10.827 -0.129 309 2HD2 LEU 42 HD22 LEU 42 -17.851 -10.417 -1.740 310 3HD2 LEU 42 HD23 LEU 42 -18.820 -10.033 -0.309 311 H ASP 43 HN ASP 43 -18.290 -14.057 -4.226 312 HA ASP 43 HA ASP 43 -21.046 -13.371 -4.502 313 1HB ASP 43 HB2 ASP 43 -19.299 -12.510 -6.035 314 2HB ASP 43 HB3 ASP 43 -18.961 -14.151 -6.587 315 H GLN 44 HN GLN 44 -19.206 -16.347 -5.077 316 HA GLN 44 HA GLN 44 -21.270 -17.882 -6.248 317 1HB GLN 44 HB2 GLN 44 -18.875 -18.508 -4.502 318 2HB GLN 44 HB3 GLN 44 -19.972 -19.808 -5.008 319 1HG GLN 44 HG2 GLN 44 -19.597 -19.334 -7.347 320 2HG GLN 44 HG3 GLN 44 -18.648 -17.897 -6.946 321 1HE2 GLN 44 HE22 GLN 44 -16.617 -18.182 -5.844 322 2HE2 GLN 44 HE21 GLN 44 -15.769 -19.723 -5.719 323 H GLU 45 HN GLU 45 -20.902 -16.762 -2.925 324 HA GLU 45 HA GLU 45 -22.796 -18.742 -1.999 325 1HB GLU 45 HB2 GLU 45 -21.119 -18.825 -0.537 326 2HB GLU 45 HB3 GLU 45 -20.629 -17.140 -0.780 327 1HG GLU 45 HG2 GLU 45 -22.233 -16.273 0.586 328 2HG GLU 45 HG3 GLU 45 -23.215 -17.757 0.631 329 H MET 46 HN MET 46 -22.447 -15.213 -2.127 330 HA MET 46 HA MET 46 -25.370 -14.966 -1.582 331 1HB MET 46 HB2 MET 46 -24.801 -13.012 -0.186 332 2HB MET 46 HB3 MET 46 -24.316 -14.576 0.464 333 1HG MET 46 HG2 MET 46 -22.002 -14.191 -0.180 334 2HG MET 46 HG3 MET 46 -22.417 -12.690 -1.003 335 1HE MET 46 HE1 MET 46 -23.005 -10.614 0.022 336 2HE MET 46 HE2 MET 46 -24.447 -11.156 0.910 337 3HE MET 46 HE3 MET 46 -23.154 -10.198 1.746 338 H GLY 47 HN GLY 47 -23.448 -14.663 -4.067 339 1HA GLY 47 HA2 GLY 47 -23.807 -11.953 -4.916 340 2HA GLY 47 HA3 GLY 47 -23.483 -13.378 -5.948 341 H ASP 48 HN ASP 48 -26.133 -14.192 -4.312 342 HA ASP 48 HA ASP 48 -28.020 -13.536 -6.387 343 1HB ASP 48 HB2 ASP 48 -28.250 -15.619 -5.095 344 2HB ASP 48 HB3 ASP 48 -28.388 -14.694 -3.598 345 H LYS 49 HN LYS 49 -26.899 -12.042 -3.442 346 HA LYS 49 HA LYS 49 -29.045 -10.049 -3.587 347 1HB LYS 49 HB2 LYS 49 -27.223 -10.364 -1.221 348 2HB LYS 49 HB3 LYS 49 -28.869 -9.746 -1.299 349 1HG LYS 49 HG2 LYS 49 -29.323 -11.698 -0.283 350 2HG LYS 49 HG3 LYS 49 -29.393 -12.314 -1.948 351 1HD LYS 49 HD2 LYS 49 -27.342 -13.442 -1.753 352 2HD LYS 49 HD3 LYS 49 -26.741 -12.297 -0.540 353 1HE LYS 49 HE2 LYS 49 -27.037 -14.333 0.582 354 2HE LYS 49 HE3 LYS 49 -28.233 -13.173 1.151 355 1HZ LYS 49 HZ1 LYS 49 -29.895 -14.296 -0.250 356 2HZ LYS 49 HZ2 LYS 49 -28.784 -15.387 -0.761 357 3HZ LYS 49 HZ3 LYS 49 -29.233 -15.344 0.801 358 H LEU 50 HN LEU 50 -25.615 -10.602 -3.811 359 HA LEU 50 HA LEU 50 -24.943 -7.754 -3.446 360 1HB LEU 50 HB2 LEU 50 -23.964 -9.317 -1.829 361 2HB LEU 50 HB3 LEU 50 -23.375 -10.342 -3.139 362 HG LEU 50 HG LEU 50 -21.805 -8.555 -3.852 363 1HD1 LEU 50 HD11 LEU 50 -23.007 -6.548 -3.015 364 2HD1 LEU 50 HD12 LEU 50 -22.807 -7.124 -1.354 365 3HD1 LEU 50 HD13 LEU 50 -21.391 -6.646 -2.327 366 1HD2 LEU 50 HD21 LEU 50 -21.526 -9.310 -0.934 367 2HD2 LEU 50 HD22 LEU 50 -21.101 -10.335 -2.324 368 3HD2 LEU 50 HD23 LEU 50 -20.230 -8.819 -2.045 369 H LYS 51 HN LYS 51 -23.482 -6.764 -4.878 370 HA LYS 51 HA LYS 51 -22.655 -8.309 -7.301 371 1HB LYS 51 HB2 LYS 51 -24.474 -6.678 -7.814 372 2HB LYS 51 HB3 LYS 51 -23.485 -5.391 -7.119 373 1HG LYS 51 HG2 LYS 51 -21.758 -5.785 -8.893 374 2HG LYS 51 HG3 LYS 51 -22.788 -7.062 -9.580 375 1HD LYS 51 HD2 LYS 51 -24.598 -5.389 -9.923 376 2HD LYS 51 HD3 LYS 51 -23.561 -4.131 -9.214 377 1HE LYS 51 HE2 LYS 51 -21.877 -4.555 -11.028 378 2HE LYS 51 HE3 LYS 51 -22.994 -5.711 -11.765 379 1HZ LYS 51 HZ1 LYS 51 -24.587 -3.900 -12.034 380 2HZ LYS 51 HZ2 LYS 51 -23.557 -2.843 -11.287 381 3HZ LYS 51 HZ3 LYS 51 -23.155 -3.498 -12.739 382 H ILE 52 HN ILE 52 -20.480 -7.781 -8.006 383 HA ILE 52 HA ILE 52 -18.843 -6.297 -6.026 384 HB ILE 52 HB ILE 52 -18.294 -9.060 -7.169 385 1HG1 ILE 52 HG12 ILE 52 -18.793 -8.165 -4.291 386 2HG1 ILE 52 HG13 ILE 52 -19.903 -9.095 -5.302 387 1HG2 ILE 52 HG21 ILE 52 -16.207 -7.781 -7.100 388 2HG2 ILE 52 HG22 ILE 52 -16.549 -7.238 -5.446 389 3HG2 ILE 52 HG23 ILE 52 -16.192 -8.938 -5.793 390 1HD1 ILE 52 HD11 ILE 52 -18.951 -10.735 -3.971 391 2HD1 ILE 52 HD12 ILE 52 -18.017 -10.850 -5.478 392 3HD1 ILE 52 HD13 ILE 52 -17.328 -10.041 -4.069 393 H VAL 53 HN VAL 53 -17.369 -4.970 -7.057 394 HA VAL 53 HA VAL 53 -16.924 -5.365 -9.975 395 HB VAL 53 HB VAL 53 -17.465 -2.672 -8.655 396 1HG1 VAL 53 HG11 VAL 53 -16.159 -2.593 -10.662 397 2HG1 VAL 53 HG12 VAL 53 -17.351 -3.575 -11.552 398 3HG1 VAL 53 HG13 VAL 53 -17.787 -1.950 -10.973 399 1HG2 VAL 53 HG21 VAL 53 -19.679 -2.637 -9.662 400 2HG2 VAL 53 HG22 VAL 53 -19.488 -4.295 -10.261 401 3HG2 VAL 53 HG23 VAL 53 -19.568 -3.979 -8.527 402 H LYS 54 HN LYS 54 -14.731 -5.637 -10.262 403 HA LYS 54 HA LYS 54 -12.909 -4.569 -8.199 404 1HB LYS 54 HB2 LYS 54 -12.515 -6.540 -10.472 405 2HB LYS 54 HB3 LYS 54 -11.182 -5.889 -9.504 406 1HG LYS 54 HG2 LYS 54 -12.299 -6.701 -7.420 407 2HG LYS 54 HG3 LYS 54 -13.586 -7.398 -8.392 408 1HD LYS 54 HD2 LYS 54 -12.164 -9.198 -7.877 409 2HD LYS 54 HD3 LYS 54 -11.798 -8.783 -9.560 410 1HE LYS 54 HE2 LYS 54 -9.907 -7.256 -8.360 411 2HE LYS 54 HE3 LYS 54 -10.141 -8.369 -7.041 412 1HZ LYS 54 HZ1 LYS 54 -9.357 -9.089 -9.817 413 2HZ LYS 54 HZ2 LYS 54 -8.410 -9.174 -8.495 414 3HZ LYS 54 HZ3 LYS 54 -9.678 -10.201 -8.664 415 H ILE 55 HN ILE 55 -10.955 -3.407 -8.869 416 HA ILE 55 HA ILE 55 -11.025 -2.029 -11.482 417 HB ILE 55 HB ILE 55 -10.686 -0.936 -8.661 418 1HG1 ILE 55 HG12 ILE 55 -12.864 -0.584 -9.761 419 2HG1 ILE 55 HG13 ILE 55 -12.031 0.883 -9.274 420 1HG2 ILE 55 HG21 ILE 55 -9.633 1.132 -9.689 421 2HG2 ILE 55 HG22 ILE 55 -8.623 -0.316 -9.609 422 3HG2 ILE 55 HG23 ILE 55 -9.337 0.165 -11.152 423 1HD1 ILE 55 HD11 ILE 55 -12.181 -0.168 -12.117 424 2HD1 ILE 55 HD12 ILE 55 -13.043 1.230 -11.438 425 3HD1 ILE 55 HD13 ILE 55 -11.298 1.292 -11.613 426 H ASP 56 HN ASP 56 -9.139 -2.522 -12.504 427 HA ASP 56 HA ASP 56 -6.895 -3.823 -11.058 428 1HB ASP 56 HB2 ASP 56 -7.586 -4.804 -13.191 429 2HB ASP 56 HB3 ASP 56 -7.446 -3.248 -13.997 430 H VAL 57 HN VAL 57 -5.723 -2.292 -9.974 431 HA VAL 57 HA VAL 57 -5.729 0.406 -10.872 432 HB VAL 57 HB VAL 57 -4.435 0.962 -8.891 433 1HG1 VAL 57 HG11 VAL 57 -6.147 0.401 -7.250 434 2HG1 VAL 57 HG12 VAL 57 -6.878 0.846 -8.790 435 3HG1 VAL 57 HG13 VAL 57 -6.792 -0.871 -8.302 436 1HG2 VAL 57 HG21 VAL 57 -4.613 -1.962 -8.154 437 2HG2 VAL 57 HG22 VAL 57 -3.150 -1.217 -8.866 438 3HG2 VAL 57 HG23 VAL 57 -3.722 -0.693 -7.323 439 H ASP 58 HN ASP 58 -4.475 -1.193 -12.855 440 HA ASP 58 HA ASP 58 -2.162 0.639 -13.177 441 1HB ASP 58 HB2 ASP 58 -1.111 -1.486 -12.444 442 2HB ASP 58 HB3 ASP 58 -2.030 -2.377 -13.667 443 H GLU 59 HN GLU 59 -4.503 -1.763 -14.631 444 HA GLU 59 HA GLU 59 -4.192 -0.805 -17.295 445 1HB GLU 59 HB2 GLU 59 -4.872 -3.066 -16.849 446 2HB GLU 59 HB3 GLU 59 -6.101 -2.530 -15.669 447 1HG GLU 59 HG2 GLU 59 -7.457 -1.617 -17.212 448 2HG GLU 59 HG3 GLU 59 -6.252 -1.692 -18.516 449 H ASN 60 HN ASN 60 -6.582 -0.404 -14.684 450 HA ASN 60 HA ASN 60 -7.578 2.071 -15.925 451 1HB ASN 60 HB2 ASN 60 -9.888 1.413 -15.808 452 2HB ASN 60 HB3 ASN 60 -8.973 0.449 -16.945 453 1HD2 ASN 60 HD21 ASN 60 -9.995 0.282 -13.480 454 2HD2 ASN 60 HD22 ASN 60 -10.817 -1.261 -13.724 455 H GLN 61 HN GLN 61 -5.965 2.181 -13.919 456 HA GLN 61 HA GLN 61 -7.181 2.104 -11.346 457 1HB GLN 61 HB2 GLN 61 -5.111 2.772 -10.542 458 2HB GLN 61 HB3 GLN 61 -4.747 1.900 -12.040 459 1HG GLN 61 HG2 GLN 61 -4.432 4.032 -13.229 460 2HG GLN 61 HG3 GLN 61 -4.598 4.870 -11.680 461 1HE2 GLN 61 HE22 GLN 61 -3.130 3.845 -9.810 462 2HE2 GLN 61 HE21 GLN 61 -1.499 3.480 -10.273 463 H GLU 62 HN GLU 62 -7.790 4.204 -13.836 464 HA GLU 62 HA GLU 62 -7.490 6.797 -12.849 465 1HB GLU 62 HB2 GLU 62 -9.294 5.402 -14.823 466 2HB GLU 62 HB3 GLU 62 -9.513 7.138 -14.518 467 1HG GLU 62 HG2 GLU 62 -6.877 5.877 -15.392 468 2HG GLU 62 HG3 GLU 62 -8.078 6.507 -16.511 469 H THR 63 HN THR 63 -10.345 4.571 -12.441 470 HA THR 63 HA THR 63 -12.010 6.264 -10.963 471 HB THR 63 HB THR 63 -11.378 3.321 -10.529 472 HG1 THR 63 HG1 THR 63 -13.326 4.380 -12.282 473 1HG2 THR 63 HG21 THR 63 -12.857 4.179 -8.753 474 2HG2 THR 63 HG22 THR 63 -13.988 4.780 -9.982 475 3HG2 THR 63 HG23 THR 63 -13.669 3.031 -9.796 476 H ALA 64 HN ALA 64 -9.168 4.411 -9.954 477 HA ALA 64 HA ALA 64 -9.738 4.548 -7.135 478 1HB ALA 64 HB1 ALA 64 -8.455 2.741 -8.494 479 2HB ALA 64 HB2 ALA 64 -7.095 3.833 -8.502 480 3HB ALA 64 HB3 ALA 64 -7.744 3.233 -6.948 481 H GLY 65 HN GLY 65 -7.054 5.876 -9.113 482 1HA GLY 65 HA2 GLY 65 -6.099 7.889 -7.465 483 2HA GLY 65 HA3 GLY 65 -6.196 8.004 -9.237 484 H LYS 66 HN LYS 66 -8.992 8.167 -9.643 485 HA LYS 66 HA LYS 66 -9.468 10.907 -9.120 486 1HB LYS 66 HB2 LYS 66 -10.352 9.626 -11.004 487 2HB LYS 66 HB3 LYS 66 -11.400 8.691 -9.921 488 1HG LYS 66 HG2 LYS 66 -12.587 10.831 -9.328 489 2HG LYS 66 HG3 LYS 66 -11.572 11.679 -10.506 490 1HD LYS 66 HD2 LYS 66 -13.538 9.412 -11.072 491 2HD LYS 66 HD3 LYS 66 -13.769 11.124 -11.462 492 1HE LYS 66 HE2 LYS 66 -11.828 11.038 -13.016 493 2HE LYS 66 HE3 LYS 66 -11.574 9.336 -12.612 494 1HZ LYS 66 HZ1 LYS 66 -12.737 9.449 -14.621 495 2HZ LYS 66 HZ2 LYS 66 -13.764 8.847 -13.536 496 3HZ LYS 66 HZ3 LYS 66 -13.930 10.427 -14.014 497 H TYR 67 HN TYR 67 -10.706 7.945 -7.424 498 HA TYR 67 HA TYR 67 -12.370 9.462 -5.657 499 1HB TYR 67 HB2 TYR 67 -12.719 7.073 -6.184 500 2HB TYR 67 HB3 TYR 67 -11.221 6.669 -5.369 501 HD1 TYR 67 HD1 TYR 67 -14.720 7.803 -4.942 502 HD2 TYR 67 HD2 TYR 67 -11.093 6.715 -2.868 503 HE1 TYR 67 HE1 TYR 67 -15.973 7.692 -2.814 504 HE2 TYR 67 HE2 TYR 67 -12.342 6.570 -0.745 505 HH TYR 67 HH TYR 67 -15.845 7.327 -0.506 506 H GLY 68 HN GLY 68 -8.992 8.442 -5.685 507 1HA GLY 68 HA2 GLY 68 -7.221 9.401 -4.426 508 2HA GLY 68 HA3 GLY 68 -8.377 9.978 -3.208 509 H VAL 69 HN VAL 69 -7.140 6.946 -4.745 510 HA VAL 69 HA VAL 69 -7.834 5.448 -2.214 511 HB VAL 69 HB VAL 69 -7.881 4.576 -5.116 512 1HG1 VAL 69 HG11 VAL 69 -7.415 2.774 -2.743 513 2HG1 VAL 69 HG12 VAL 69 -8.050 2.217 -4.314 514 3HG1 VAL 69 HG13 VAL 69 -6.433 2.909 -4.207 515 1HG2 VAL 69 HG21 VAL 69 -9.955 5.300 -4.180 516 2HG2 VAL 69 HG22 VAL 69 -9.993 3.565 -4.483 517 3HG2 VAL 69 HG23 VAL 69 -9.797 4.171 -2.819 518 H MET 70 HN MET 70 -5.580 5.290 -4.897 519 HA MET 70 HA MET 70 -3.464 4.991 -5.167 520 1HB MET 70 HB2 MET 70 -1.947 6.521 -4.248 521 2HB MET 70 HB3 MET 70 -3.462 7.356 -4.573 522 1HG MET 70 HG2 MET 70 -3.984 7.618 -2.328 523 2HG MET 70 HG3 MET 70 -2.998 6.263 -1.839 524 1HE MET 70 HE1 MET 70 -0.512 6.136 -2.155 525 2HE MET 70 HE2 MET 70 0.014 7.276 -3.415 526 3HE MET 70 HE3 MET 70 0.595 7.452 -1.749 527 H SER 71 HN SER 71 -4.805 3.295 -2.892 528 HA SER 71 HA SER 71 -2.336 1.906 -2.107 529 1HB SER 71 HB2 SER 71 -3.418 1.635 0.156 530 2HB SER 71 HB3 SER 71 -2.777 3.212 -0.298 531 HG SER 71 HG SER 71 -4.887 3.933 -0.738 532 H ILE 72 HN ILE 72 -2.740 -0.306 -1.167 533 HA ILE 72 HA ILE 72 -5.077 -1.601 -2.357 534 HB ILE 72 HB ILE 72 -2.174 -2.220 -2.952 535 1HG1 ILE 72 HG12 ILE 72 -3.175 -0.445 -4.379 536 2HG1 ILE 72 HG13 ILE 72 -2.660 -1.847 -5.274 537 1HG2 ILE 72 HG21 ILE 72 -2.831 -4.064 -4.408 538 2HG2 ILE 72 HG22 ILE 72 -3.271 -4.436 -2.736 539 3HG2 ILE 72 HG23 ILE 72 -4.504 -3.933 -3.905 540 1HD1 ILE 72 HD11 ILE 72 -5.068 -0.718 -5.648 541 2HD1 ILE 72 HD12 ILE 72 -4.772 -2.467 -5.874 542 3HD1 ILE 72 HD13 ILE 72 -5.544 -1.836 -4.395 543 HA PRO 73 HA PRO 73 -5.923 -3.648 -2.352 544 1HB PRO 73 HB2 PRO 73 -7.520 -5.357 -1.025 545 2HB PRO 73 HB3 PRO 73 -5.916 -5.895 -1.621 546 1HG PRO 73 HG2 PRO 73 -6.659 -4.962 1.163 547 2HG PRO 73 HG3 PRO 73 -5.758 -6.424 0.728 548 1HD PRO 73 HD2 PRO 73 -4.530 -4.066 1.476 549 2HD PRO 73 HD3 PRO 73 -3.784 -5.174 0.288 550 H THR 74 HN THR 74 -7.755 -2.349 -2.587 551 HA THR 74 HA THR 74 -8.793 -1.080 -0.062 552 HB THR 74 HB THR 74 -8.495 0.246 -2.765 553 HG1 THR 74 HG1 THR 74 -6.628 0.626 -1.929 554 1HG2 THR 74 HG21 THR 74 -10.512 1.135 -1.737 555 2HG2 THR 74 HG22 THR 74 -9.702 1.253 -0.154 556 3HG2 THR 74 HG23 THR 74 -9.211 2.298 -1.487 557 H LEU 75 HN LEU 75 -10.918 -0.802 0.203 558 HA LEU 75 HA LEU 75 -12.815 -2.241 -1.605 559 1HB LEU 75 HB2 LEU 75 -11.874 -3.180 0.853 560 2HB LEU 75 HB3 LEU 75 -13.245 -2.210 1.365 561 HG LEU 75 HG LEU 75 -14.724 -3.559 -0.141 562 1HD1 LEU 75 HD11 LEU 75 -12.152 -5.169 -0.594 563 2HD1 LEU 75 HD12 LEU 75 -13.774 -5.799 -0.902 564 3HD1 LEU 75 HD13 LEU 75 -13.192 -4.409 -1.821 565 1HD2 LEU 75 HD21 LEU 75 -13.044 -5.127 1.877 566 2HD2 LEU 75 HD22 LEU 75 -14.416 -4.064 2.272 567 3HD2 LEU 75 HD23 LEU 75 -14.681 -5.544 1.346 568 H LEU 76 HN LEU 76 -14.454 -0.910 -2.162 569 HA LEU 76 HA LEU 76 -15.191 1.339 -0.404 570 1HB LEU 76 HB2 LEU 76 -15.379 1.433 -3.445 571 2HB LEU 76 HB3 LEU 76 -15.839 2.683 -2.308 572 HG LEU 76 HG LEU 76 -13.011 1.834 -3.073 573 1HD1 LEU 76 HD11 LEU 76 -12.877 4.072 -4.021 574 2HD1 LEU 76 HD12 LEU 76 -14.238 3.189 -4.729 575 3HD1 LEU 76 HD13 LEU 76 -14.535 4.432 -3.495 576 1HD2 LEU 76 HD21 LEU 76 -13.857 4.011 -1.110 577 2HD2 LEU 76 HD22 LEU 76 -13.048 2.493 -0.667 578 3HD2 LEU 76 HD23 LEU 76 -12.202 3.680 -1.664 579 H VAL 77 HN VAL 77 -17.163 0.632 0.377 580 HA VAL 77 HA VAL 77 -18.732 -1.253 -1.337 581 HB VAL 77 HB VAL 77 -18.917 -0.873 1.672 582 1HG1 VAL 77 HG11 VAL 77 -20.980 -1.727 0.643 583 2HG1 VAL 77 HG12 VAL 77 -20.055 -3.018 -0.162 584 3HG1 VAL 77 HG13 VAL 77 -20.175 -2.960 1.614 585 1HG2 VAL 77 HG21 VAL 77 -17.367 -2.883 -0.000 586 2HG2 VAL 77 HG22 VAL 77 -16.750 -1.820 1.282 587 3HG2 VAL 77 HG23 VAL 77 -17.815 -3.171 1.687 588 H LEU 78 HN LEU 78 -20.661 -0.605 -2.123 589 HA LEU 78 HA LEU 78 -21.632 2.070 -1.292 590 1HB LEU 78 HB2 LEU 78 -21.581 0.937 -4.129 591 2HB LEU 78 HB3 LEU 78 -22.129 2.519 -3.625 592 HG LEU 78 HG LEU 78 -19.561 2.631 -2.709 593 1HD1 LEU 78 HD11 LEU 78 -19.387 1.026 -5.303 594 2HD1 LEU 78 HD12 LEU 78 -18.033 1.677 -4.357 595 3HD1 LEU 78 HD13 LEU 78 -19.025 0.371 -3.705 596 1HD2 LEU 78 HD21 LEU 78 -20.467 3.276 -5.549 597 2HD2 LEU 78 HD22 LEU 78 -20.676 4.316 -4.123 598 3HD2 LEU 78 HD23 LEU 78 -19.053 3.960 -4.720 599 H LYS 79 HN LYS 79 -23.874 2.487 -1.755 600 HA LYS 79 HA LYS 79 -25.483 0.301 -2.745 601 1HB LYS 79 HB2 LYS 79 -27.173 0.414 -0.978 602 2HB LYS 79 HB3 LYS 79 -25.641 -0.274 -0.427 603 1HG LYS 79 HG2 LYS 79 -25.090 1.940 0.605 604 2HG LYS 79 HG3 LYS 79 -26.715 2.507 0.205 605 1HD LYS 79 HD2 LYS 79 -26.096 0.044 1.910 606 2HD LYS 79 HD3 LYS 79 -26.475 1.643 2.566 607 1HE LYS 79 HE2 LYS 79 -28.677 1.618 1.516 608 2HE LYS 79 HE3 LYS 79 -28.334 0.055 0.755 609 1HZ LYS 79 HZ1 LYS 79 -28.184 -0.933 2.962 610 2HZ LYS 79 HZ2 LYS 79 -28.525 0.511 3.674 611 3HZ LYS 79 HZ3 LYS 79 -29.645 -0.227 2.749 612 H ASP 80 HN ASP 80 -27.155 1.045 -3.866 613 HA ASP 80 HA ASP 80 -28.191 2.425 -5.242 614 1HB ASP 80 HB2 ASP 80 -29.558 2.476 -3.172 615 2HB ASP 80 HB3 ASP 80 -28.766 3.979 -2.695 616 H GLY 81 HN GLY 81 -25.349 3.059 -4.995 617 1HA GLY 81 HA2 GLY 81 -24.140 4.386 -6.391 618 2HA GLY 81 HA3 GLY 81 -25.424 5.609 -6.431 619 H GLU 82 HN GLU 82 -24.541 4.764 -3.216 620 HA GLU 82 HA GLU 82 -22.386 6.767 -3.130 621 1HB GLU 82 HB2 GLU 82 -23.339 7.849 -1.298 622 2HB GLU 82 HB3 GLU 82 -24.680 7.566 -2.437 623 1HG GLU 82 HG2 GLU 82 -25.399 5.623 -1.076 624 2HG GLU 82 HG3 GLU 82 -24.096 5.957 0.076 625 H VAL 83 HN VAL 83 -20.814 6.492 -1.480 626 HA VAL 83 HA VAL 83 -20.265 3.709 -0.739 627 HB VAL 83 HB VAL 83 -18.818 6.293 0.007 628 1HG1 VAL 83 HG11 VAL 83 -18.207 4.396 1.501 629 2HG1 VAL 83 HG12 VAL 83 -17.855 3.397 0.076 630 3HG1 VAL 83 HG13 VAL 83 -16.865 4.820 0.444 631 1HG2 VAL 83 HG21 VAL 83 -17.192 5.726 -1.762 632 2HG2 VAL 83 HG22 VAL 83 -18.165 4.336 -2.244 633 3HG2 VAL 83 HG23 VAL 83 -18.788 5.987 -2.463 634 H VAL 84 HN VAL 84 -20.555 2.790 1.122 635 HA VAL 84 HA VAL 84 -21.519 4.353 3.455 636 HB VAL 84 HB VAL 84 -23.023 2.456 3.973 637 1HG1 VAL 84 HG11 VAL 84 -23.785 4.589 2.910 638 2HG1 VAL 84 HG12 VAL 84 -23.689 3.795 1.326 639 3HG1 VAL 84 HG13 VAL 84 -24.821 3.208 2.563 640 1HG2 VAL 84 HG21 VAL 84 -23.711 0.858 2.284 641 2HG2 VAL 84 HG22 VAL 84 -22.581 1.539 1.098 642 3HG2 VAL 84 HG23 VAL 84 -21.972 0.700 2.543 643 H GLU 85 HN GLU 85 -19.338 1.876 2.197 644 HA GLU 85 HA GLU 85 -18.095 1.965 4.814 645 1HB GLU 85 HB2 GLU 85 -19.253 -0.495 3.641 646 2HB GLU 85 HB3 GLU 85 -17.529 -0.664 4.021 647 1HG GLU 85 HG2 GLU 85 -19.724 0.247 5.863 648 2HG GLU 85 HG3 GLU 85 -19.085 -1.402 5.751 649 H THR 86 HN THR 86 -15.849 1.335 4.755 650 HA THR 86 HA THR 86 -14.541 1.424 2.129 651 HB THR 86 HB THR 86 -13.500 3.493 3.954 652 HG1 THR 86 HG1 THR 86 -15.633 4.000 4.331 653 1HG2 THR 86 HG21 THR 86 -12.718 3.143 1.648 654 2HG2 THR 86 HG22 THR 86 -14.350 3.562 1.056 655 3HG2 THR 86 HG23 THR 86 -13.350 4.786 1.878 656 H SER 87 HN SER 87 -12.446 0.482 2.301 657 HA SER 87 HA SER 87 -11.156 0.234 4.923 658 1HB SER 87 HB2 SER 87 -12.015 -2.223 3.324 659 2HB SER 87 HB3 SER 87 -10.955 -2.231 4.738 660 HG SER 87 HG SER 87 -13.242 -0.904 5.276 661 H VAL 88 HN VAL 88 -8.936 -0.260 4.697 662 HA VAL 88 HA VAL 88 -7.934 -0.925 2.020 663 HB VAL 88 HB VAL 88 -7.619 1.376 1.963 664 1HG1 VAL 88 HG11 VAL 88 -6.398 2.728 3.584 665 2HG1 VAL 88 HG12 VAL 88 -7.857 2.044 4.300 666 3HG1 VAL 88 HG13 VAL 88 -6.272 1.343 4.690 667 1HG2 VAL 88 HG21 VAL 88 -4.969 0.077 2.716 668 2HG2 VAL 88 HG22 VAL 88 -5.761 0.048 1.125 669 3HG2 VAL 88 HG23 VAL 88 -5.186 1.578 1.803 670 H GLY 89 HN GLY 89 -7.750 -3.010 2.657 671 1HA GLY 89 HA2 GLY 89 -5.488 -3.998 3.825 672 2HA GLY 89 HA3 GLY 89 -6.583 -3.817 5.206 673 H PHE 90 HN PHE 90 -5.617 -6.332 4.306 674 HA PHE 90 HA PHE 90 -7.508 -7.668 2.629 675 1HB PHE 90 HB2 PHE 90 -5.239 -8.525 2.918 676 2HB PHE 90 HB3 PHE 90 -5.478 -8.686 4.651 677 HD1 PHE 90 HD1 PHE 90 -6.211 -10.741 5.558 678 HD2 PHE 90 HD2 PHE 90 -6.897 -9.922 1.373 679 HE1 PHE 90 HE1 PHE 90 -7.158 -13.013 5.264 680 HE2 PHE 90 HE2 PHE 90 -7.895 -12.181 1.110 681 HZ PHE 90 HZ PHE 90 -8.003 -13.735 3.038 682 H LYS 91 HN LYS 91 -9.159 -9.174 3.239 683 HA LYS 91 HA LYS 91 -9.830 -9.491 6.065 684 1HB LYS 91 HB2 LYS 91 -11.736 -8.291 4.006 685 2HB LYS 91 HB3 LYS 91 -12.337 -9.301 5.290 686 1HG LYS 91 HG2 LYS 91 -12.586 -7.310 6.331 687 2HG LYS 91 HG3 LYS 91 -10.959 -7.680 6.876 688 1HD LYS 91 HD2 LYS 91 -10.292 -5.688 6.002 689 2HD LYS 91 HD3 LYS 91 -10.577 -6.351 4.403 690 1HE LYS 91 HE2 LYS 91 -11.853 -4.434 4.349 691 2HE LYS 91 HE3 LYS 91 -13.062 -5.666 4.722 692 1HZ LYS 91 HZ1 LYS 91 -13.093 -3.548 6.081 693 2HZ LYS 91 HZ2 LYS 91 -13.084 -4.929 6.992 694 3HZ LYS 91 HZ3 LYS 91 -11.731 -4.027 6.812 695 HA PRO 92 HA PRO 92 -10.370 -13.550 4.113 696 1HB PRO 92 HB2 PRO 92 -11.425 -14.958 6.212 697 2HB PRO 92 HB3 PRO 92 -9.700 -14.487 6.128 698 1HG PRO 92 HG2 PRO 92 -11.952 -13.053 7.570 699 2HG PRO 92 HG3 PRO 92 -10.349 -13.525 8.222 700 1HD PRO 92 HD2 PRO 92 -10.797 -11.015 7.294 701 2HD PRO 92 HD3 PRO 92 -9.240 -11.832 6.988 702 H LYS 93 HN LYS 93 -12.260 -15.059 3.785 703 HA LYS 93 HA LYS 93 -14.376 -13.867 2.498 704 1HB LYS 93 HB2 LYS 93 -13.776 -16.130 2.067 705 2HB LYS 93 HB3 LYS 93 -13.955 -16.588 3.755 706 1HG LYS 93 HG2 LYS 93 -15.694 -17.586 2.503 707 2HG LYS 93 HG3 LYS 93 -16.380 -16.409 3.612 708 1HD LYS 93 HD2 LYS 93 -16.597 -14.793 1.672 709 2HD LYS 93 HD3 LYS 93 -16.055 -16.083 0.575 710 1HE LYS 93 HE2 LYS 93 -18.351 -16.432 2.560 711 2HE LYS 93 HE3 LYS 93 -18.632 -15.774 0.957 712 1HZ LYS 93 HZ1 LYS 93 -18.969 -18.213 1.248 713 2HZ LYS 93 HZ2 LYS 93 -18.023 -17.809 -0.033 714 3HZ LYS 93 HZ3 LYS 93 -17.355 -18.416 1.359 715 H GLU 94 HN GLU 94 -14.505 -15.071 5.905 716 HA GLU 94 HA GLU 94 -17.247 -14.404 6.134 717 1HB GLU 94 HB2 GLU 94 -15.121 -14.781 8.286 718 2HB GLU 94 HB3 GLU 94 -16.862 -14.636 8.596 719 1HG GLU 94 HG2 GLU 94 -17.278 -16.651 7.190 720 2HG GLU 94 HG3 GLU 94 -15.543 -16.825 6.923 721 H ALA 95 HN ALA 95 -14.291 -12.576 7.073 722 HA ALA 95 HA ALA 95 -15.681 -10.386 8.293 723 1HB ALA 95 HB1 ALA 95 -13.288 -10.771 8.690 724 2HB ALA 95 HB2 ALA 95 -12.957 -10.556 6.955 725 3HB ALA 95 HB3 ALA 95 -13.524 -9.183 7.925 726 H LEU 96 HN LEU 96 -14.626 -11.061 4.956 727 HA LEU 96 HA LEU 96 -15.341 -8.565 3.851 728 1HB LEU 96 HB2 LEU 96 -14.185 -10.860 2.881 729 2HB LEU 96 HB3 LEU 96 -15.796 -11.062 2.243 730 HG LEU 96 HG LEU 96 -14.553 -9.996 0.539 731 1HD1 LEU 96 HD11 LEU 96 -15.894 -7.600 1.804 732 2HD1 LEU 96 HD12 LEU 96 -15.537 -7.943 0.093 733 3HD1 LEU 96 HD13 LEU 96 -16.766 -8.884 0.951 734 1HD2 LEU 96 HD21 LEU 96 -12.624 -9.339 1.951 735 2HD2 LEU 96 HD22 LEU 96 -13.121 -8.040 0.852 736 3HD2 LEU 96 HD23 LEU 96 -13.553 -7.960 2.573 737 H GLN 97 HN GLN 97 -17.210 -11.621 4.105 738 HA GLN 97 HA GLN 97 -19.503 -10.528 2.851 739 1HB GLN 97 HB2 GLN 97 -20.451 -12.502 3.049 740 2HB GLN 97 HB3 GLN 97 -18.788 -13.024 3.263 741 1HG GLN 97 HG2 GLN 97 -19.151 -13.190 5.641 742 2HG GLN 97 HG3 GLN 97 -20.848 -12.674 5.438 743 1HE2 GLN 97 HE22 GLN 97 -21.899 -14.073 3.356 744 2HE2 GLN 97 HE21 GLN 97 -21.706 -15.801 3.584 745 H GLU 98 HN GLU 98 -18.550 -10.737 6.309 746 HA GLU 98 HA GLU 98 -20.984 -9.711 7.331 747 1HB GLU 98 HB2 GLU 98 -19.319 -10.780 8.724 748 2HB GLU 98 HB3 GLU 98 -18.139 -9.504 8.385 749 1HG GLU 98 HG2 GLU 98 -19.529 -7.853 9.544 750 2HG GLU 98 HG3 GLU 98 -20.813 -9.045 9.773 751 H LEU 99 HN LEU 99 -18.042 -8.051 6.223 752 HA LEU 99 HA LEU 99 -18.639 -5.473 7.068 753 1HB LEU 99 HB2 LEU 99 -16.464 -6.365 6.363 754 2HB LEU 99 HB3 LEU 99 -16.986 -6.410 4.689 755 HG LEU 99 HG LEU 99 -15.393 -4.619 5.385 756 1HD1 LEU 99 HD11 LEU 99 -16.728 -4.461 3.313 757 2HD1 LEU 99 HD12 LEU 99 -17.897 -3.434 4.179 758 3HD1 LEU 99 HD13 LEU 99 -16.214 -2.907 3.983 759 1HD2 LEU 99 HD21 LEU 99 -16.088 -2.674 6.583 760 2HD2 LEU 99 HD22 LEU 99 -17.756 -3.262 6.692 761 3HD2 LEU 99 HD23 LEU 99 -16.455 -4.103 7.573 762 H VAL 100 HN VAL 100 -19.566 -7.100 4.042 763 HA VAL 100 HA VAL 100 -21.048 -4.659 3.221 764 HB VAL 100 HB VAL 100 -19.784 -5.752 1.549 765 1HG1 VAL 100 HG11 VAL 100 -20.365 -7.897 0.563 766 2HG1 VAL 100 HG12 VAL 100 -19.955 -8.138 2.259 767 3HG1 VAL 100 HG13 VAL 100 -21.657 -8.155 1.756 768 1HG2 VAL 100 HG21 VAL 100 -21.395 -5.635 -0.186 769 2HG2 VAL 100 HG22 VAL 100 -22.732 -6.104 0.895 770 3HG2 VAL 100 HG23 VAL 100 -21.957 -4.523 1.063 771 H ASN 101 HN ASN 101 -21.774 -7.914 4.544 772 HA ASN 101 HA ASN 101 -24.523 -7.987 3.939 773 1HB ASN 101 HB2 ASN 101 -23.395 -9.955 4.721 774 2HB ASN 101 HB3 ASN 101 -23.022 -9.190 6.275 775 1HD2 ASN 101 HD22 ASN 101 -24.659 -9.089 7.883 776 2HD2 ASN 101 HD21 ASN 101 -26.231 -9.812 7.670 777 H LYS 102 HN LYS 102 -22.804 -6.347 6.576 778 HA LYS 102 HA LYS 102 -25.160 -5.770 8.097 779 1HB LYS 102 HB2 LYS 102 -23.721 -4.512 9.518 780 2HB LYS 102 HB3 LYS 102 -22.800 -5.897 8.930 781 1HG LYS 102 HG2 LYS 102 -21.928 -4.236 7.108 782 2HG LYS 102 HG3 LYS 102 -22.530 -2.995 8.236 783 1HD LYS 102 HD2 LYS 102 -21.168 -4.077 10.071 784 2HD LYS 102 HD3 LYS 102 -20.589 -5.260 8.875 785 1HE LYS 102 HE2 LYS 102 -18.893 -3.643 9.067 786 2HE LYS 102 HE3 LYS 102 -19.709 -3.418 7.505 787 1HZ LYS 102 HZ1 LYS 102 -20.833 -1.510 8.386 788 2HZ LYS 102 HZ2 LYS 102 -20.204 -1.741 9.899 789 3HZ LYS 102 HZ3 LYS 102 -19.236 -1.318 8.640 790 H HIS 103 HN HIS 103 -24.270 -4.438 5.103 791 HA HIS 103 HA HIS 103 -26.104 -2.112 5.551 792 1HB HIS 103 HB2 HIS 103 -23.675 -2.251 3.719 793 2HB HIS 103 HB3 HIS 103 -24.809 -0.907 3.828 794 HD1 HIS 103 HD1 HIS 103 -24.874 0.317 6.399 795 HD2 HIS 103 HD2 HIS 103 -21.644 -2.190 5.378 796 HE1 HIS 103 HE1 HIS 103 -23.038 0.798 8.088 797 H LEU 104 HN LEU 104 -25.244 -4.870 3.621 798 HA LEU 104 HA LEU 104 -26.808 -4.540 1.259 799 1HB LEU 104 HB2 LEU 104 -25.048 -6.128 1.417 800 2HB LEU 104 HB3 LEU 104 -25.730 -6.779 2.915 801 HG LEU 104 HG LEU 104 -27.500 -7.846 1.832 802 1HD1 LEU 104 HD11 LEU 104 -27.904 -6.194 -0.053 803 2HD1 LEU 104 HD12 LEU 104 -26.405 -6.760 -0.819 804 3HD1 LEU 104 HD13 LEU 104 -27.787 -7.851 -0.628 805 1HD2 LEU 104 HD21 LEU 104 -24.890 -8.365 0.370 806 2HD2 LEU 104 HD22 LEU 104 -25.346 -8.982 1.977 807 3HD2 LEU 104 HD23 LEU 104 -26.245 -9.502 0.557 808 1H MET 1 H1 MET 1 10.417 31.114 -12.618 809 2H MET 1 H2 MET 1 11.178 29.864 -11.862 810 3H MET 1 H3 MET 1 11.043 31.304 -11.115 811 HA MET 1 HA MET 1 8.710 31.134 -10.935 812 1HB MET 1 HB2 MET 1 7.452 29.219 -11.638 813 2HB MET 1 HB3 MET 1 8.310 29.882 -13.008 814 1HG MET 1 HG2 MET 1 8.445 27.559 -13.252 815 2HG MET 1 HG3 MET 1 10.044 28.058 -12.741 816 1HE MET 1 HE1 MET 1 6.778 26.119 -11.944 817 2HE MET 1 HE2 MET 1 6.992 25.581 -10.267 818 3HE MET 1 HE3 MET 1 6.676 27.291 -10.609 819 H GLU 2 HN GLU 2 7.606 29.726 -9.176 820 HA GLU 2 HA GLU 2 9.550 28.252 -7.507 821 1HB GLU 2 HB2 GLU 2 8.004 30.731 -6.623 822 2HB GLU 2 HB3 GLU 2 8.767 29.588 -5.515 823 1HG GLU 2 HG2 GLU 2 10.981 30.062 -6.532 824 2HG GLU 2 HG3 GLU 2 10.232 31.267 -7.587 825 H ASN 3 HN ASN 3 8.537 27.086 -5.850 826 HA ASN 3 HA ASN 3 7.280 25.690 -4.927 827 1HB ASN 3 HB2 ASN 3 4.766 27.093 -5.827 828 2HB ASN 3 HB3 ASN 3 4.919 25.759 -4.673 829 1HD2 ASN 3 HD21 ASN 3 6.323 26.217 -2.653 830 2HD2 ASN 3 HD22 ASN 3 6.317 27.842 -2.037 831 H LYS 4 HN LYS 4 7.170 23.878 -5.288 832 HA LYS 4 HA LYS 4 6.134 22.478 -7.606 833 1HB LYS 4 HB2 LYS 4 9.107 22.690 -6.867 834 2HB LYS 4 HB3 LYS 4 8.446 21.474 -7.974 835 1HG LYS 4 HG2 LYS 4 7.732 23.204 -9.538 836 2HG LYS 4 HG3 LYS 4 8.277 24.491 -8.452 837 1HD LYS 4 HD2 LYS 4 10.155 22.419 -9.559 838 2HD LYS 4 HD3 LYS 4 9.779 23.970 -10.345 839 1HE LYS 4 HE2 LYS 4 10.528 25.166 -8.278 840 2HE LYS 4 HE3 LYS 4 11.041 23.616 -7.599 841 1HZ LYS 4 HZ1 LYS 4 12.891 24.764 -8.653 842 2HZ LYS 4 HZ2 LYS 4 12.565 23.393 -9.493 843 3HZ LYS 4 HZ3 LYS 4 12.102 24.846 -10.084 844 H ILE 5 HN ILE 5 5.677 20.339 -6.813 845 HA ILE 5 HA ILE 5 6.181 20.024 -3.890 846 HB ILE 5 HB ILE 5 3.788 19.295 -5.618 847 1HG1 ILE 5 HG12 ILE 5 4.455 21.510 -3.676 848 2HG1 ILE 5 HG13 ILE 5 3.671 21.597 -5.247 849 1HG2 ILE 5 HG21 ILE 5 4.136 18.868 -2.636 850 2HG2 ILE 5 HG22 ILE 5 2.694 18.455 -3.625 851 3HG2 ILE 5 HG23 ILE 5 4.194 17.575 -3.857 852 1HD1 ILE 5 HD11 ILE 5 1.623 20.580 -4.213 853 2HD1 ILE 5 HD12 ILE 5 2.459 20.634 -2.637 854 3HD1 ILE 5 HD13 ILE 5 2.106 22.144 -3.499 855 H ILE 6 HN ILE 6 6.820 18.078 -3.129 856 HA ILE 6 HA ILE 6 7.212 15.800 -4.948 857 HB ILE 6 HB ILE 6 9.149 17.061 -5.442 858 1HG1 ILE 6 HG12 ILE 6 9.261 14.486 -4.880 859 2HG1 ILE 6 HG13 ILE 6 10.639 15.394 -5.420 860 1HG2 ILE 6 HG21 ILE 6 10.855 17.755 -3.774 861 2HG2 ILE 6 HG22 ILE 6 9.331 18.618 -3.628 862 3HG2 ILE 6 HG23 ILE 6 9.716 17.327 -2.478 863 1HD1 ILE 6 HD11 ILE 6 11.182 13.864 -3.572 864 2HD1 ILE 6 HD12 ILE 6 11.514 15.540 -3.120 865 3HD1 ILE 6 HD13 ILE 6 10.058 14.723 -2.499 866 H TYR 7 HN TYR 7 7.476 13.841 -3.823 867 HA TYR 7 HA TYR 7 6.689 13.995 -0.957 868 1HB TYR 7 HB2 TYR 7 5.118 13.225 -3.246 869 2HB TYR 7 HB3 TYR 7 5.484 11.762 -2.364 870 HD1 TYR 7 HD1 TYR 7 4.796 11.514 0.048 871 HD2 TYR 7 HD2 TYR 7 3.704 14.957 -2.308 872 HE1 TYR 7 HE1 TYR 7 3.046 12.112 1.702 873 HE2 TYR 7 HE2 TYR 7 1.955 15.519 -0.686 874 HH TYR 7 HH TYR 7 0.882 14.922 1.334 875 H PHE 8 HN PHE 8 7.236 12.244 0.310 876 HA PHE 8 HA PHE 8 8.956 10.115 -0.875 877 1HB PHE 8 HB2 PHE 8 9.076 11.459 1.859 878 2HB PHE 8 HB3 PHE 8 9.889 9.940 1.474 879 HD1 PHE 8 HD1 PHE 8 11.588 9.847 -0.361 880 HD2 PHE 8 HD2 PHE 8 10.029 13.585 1.109 881 HE1 PHE 8 HE1 PHE 8 13.394 11.066 -1.558 882 HE2 PHE 8 HE2 PHE 8 11.838 14.794 -0.111 883 HZ PHE 8 HZ PHE 8 13.451 13.528 -1.504 884 H LEU 9 HN LEU 9 8.206 8.048 -0.532 885 HA LEU 9 HA LEU 9 5.786 7.735 1.164 886 1HB LEU 9 HB2 LEU 9 5.371 8.005 -1.304 887 2HB LEU 9 HB3 LEU 9 6.368 6.583 -1.607 888 HG LEU 9 HG LEU 9 4.758 5.155 -0.431 889 1HD1 LEU 9 HD11 LEU 9 3.207 7.732 0.090 890 2HD1 LEU 9 HD12 LEU 9 2.566 6.092 0.339 891 3HD1 LEU 9 HD13 LEU 9 3.914 6.666 1.320 892 1HD2 LEU 9 HD21 LEU 9 4.360 5.562 -2.799 893 2HD2 LEU 9 HD22 LEU 9 2.782 5.613 -1.989 894 3HD2 LEU 9 HD23 LEU 9 3.561 7.110 -2.455 895 H SER 10 HN SER 10 6.259 6.270 2.742 896 HA SER 10 HA SER 10 8.421 4.270 2.241 897 1HB SER 10 HB2 SER 10 8.321 5.960 4.747 898 2HB SER 10 HB3 SER 10 9.687 5.087 4.063 899 HG SER 10 HG SER 10 9.431 6.729 2.273 900 H THR 11 HN THR 11 8.597 2.697 4.024 901 HA THR 11 HA THR 11 6.060 1.769 5.056 902 HB THR 11 HB THR 11 8.988 1.111 5.643 903 HG1 THR 11 HG1 THR 11 8.152 0.328 3.689 904 1HG2 THR 11 HG21 THR 11 7.949 -0.899 6.864 905 2HG2 THR 11 HG22 THR 11 7.877 0.649 7.712 906 3HG2 THR 11 HG23 THR 11 6.441 0.047 6.860 907 H GLY 12 HN GLY 12 5.127 2.319 6.900 908 1HA GLY 12 HA2 GLY 12 4.494 3.406 8.783 909 2HA GLY 12 HA3 GLY 12 6.130 3.024 9.298 910 H ASN 13 HN ASN 13 6.267 5.322 6.818 911 HA ASN 13 HA ASN 13 7.731 7.124 7.176 912 1HB ASN 13 HB2 ASN 13 6.301 8.057 5.803 913 2HB ASN 13 HB3 ASN 13 4.901 7.905 6.821 914 1HD2 ASN 13 HD22 ASN 13 8.060 9.619 6.704 915 2HD2 ASN 13 HD21 ASN 13 7.472 11.104 7.441 916 H SER 14 HN SER 14 8.706 6.379 9.085 917 HA SER 14 HA SER 14 8.260 8.190 11.391 918 1HB SER 14 HB2 SER 14 8.775 6.174 12.828 919 2HB SER 14 HB3 SER 14 7.212 6.149 11.998 920 HG SER 14 HG SER 14 8.286 4.159 11.839 921 H ALA 15 HN ALA 15 10.573 6.426 9.367 922 HA ALA 15 HA ALA 15 12.656 8.114 10.602 923 1HB ALA 15 HB1 ALA 15 14.342 6.357 10.324 924 2HB ALA 15 HB2 ALA 15 13.037 5.808 11.397 925 3HB ALA 15 HB3 ALA 15 13.111 5.226 9.728 926 H ARG 16 HN ARG 16 12.487 5.889 7.777 927 HA ARG 16 HA ARG 16 14.353 7.081 6.264 928 1HB ARG 16 HB2 ARG 16 11.870 6.276 4.698 929 2HB ARG 16 HB3 ARG 16 13.567 6.044 4.331 930 1HG ARG 16 HG2 ARG 16 12.863 3.892 4.803 931 2HG ARG 16 HG3 ARG 16 13.567 4.404 6.330 932 1HD ARG 16 HD2 ARG 16 10.872 5.203 6.558 933 2HD ARG 16 HD3 ARG 16 10.756 3.698 5.651 934 HE ARG 16 HE ARG 16 12.388 2.859 7.568 935 1HH1 ARG 16 HH11 ARG 16 9.223 4.367 7.914 936 2HH1 ARG 16 HH12 ARG 16 9.249 4.298 9.646 937 1HH2 ARG 16 HH21 ARG 16 12.048 2.158 9.542 938 2HH2 ARG 16 HH22 ARG 16 10.785 2.785 10.586 939 H SER 17 HN SER 17 10.886 8.100 5.956 940 HA SER 17 HA SER 17 11.463 10.014 3.957 941 1HB SER 17 HB2 SER 17 9.116 10.672 5.455 942 2HB SER 17 HB3 SER 17 9.232 10.047 3.812 943 HG SER 17 HG SER 17 9.041 8.013 4.528 944 H GLN 18 HN GLN 18 11.211 10.281 7.505 945 HA GLN 18 HA GLN 18 11.246 13.052 7.859 946 1HB GLN 18 HB2 GLN 18 12.675 10.882 9.454 947 2HB GLN 18 HB3 GLN 18 12.555 12.511 9.947 948 1HG GLN 18 HG2 GLN 18 11.044 10.985 11.128 949 2HG GLN 18 HG3 GLN 18 10.244 12.382 10.412 950 1HE2 GLN 18 HE22 GLN 18 8.132 11.494 10.376 951 2HE2 GLN 18 HE21 GLN 18 7.717 10.062 9.491 952 H MET 19 HN MET 19 13.885 10.732 7.315 953 HA MET 19 HA MET 19 15.971 12.638 7.673 954 1HB MET 19 HB2 MET 19 15.989 9.935 6.227 955 2HB MET 19 HB3 MET 19 17.424 10.811 6.751 956 1HG MET 19 HG2 MET 19 17.128 10.268 8.962 957 2HG MET 19 HG3 MET 19 15.388 10.293 8.858 958 1HE MET 19 HE1 MET 19 18.258 8.193 7.208 959 2HE MET 19 HE2 MET 19 18.448 8.056 9.001 960 3HE MET 19 HE3 MET 19 18.003 6.641 8.033 961 H ALA 20 HN ALA 20 14.414 11.150 4.782 962 HA ALA 20 HA ALA 20 15.933 12.532 2.847 963 1HB ALA 20 HB1 ALA 20 14.132 11.847 1.300 964 2HB ALA 20 HB2 ALA 20 14.679 10.514 2.319 965 3HB ALA 20 HB3 ALA 20 13.135 11.353 2.677 966 H GLU 21 HN GLU 21 12.798 13.520 4.356 967 HA GLU 21 HA GLU 21 12.600 15.784 2.643 968 1HB GLU 21 HB2 GLU 21 10.740 16.465 3.925 969 2HB GLU 21 HB3 GLU 21 10.697 14.704 3.831 970 1HG GLU 21 HG2 GLU 21 11.640 14.600 6.144 971 2HG GLU 21 HG3 GLU 21 11.589 16.362 6.217 972 H GLY 22 HN GLY 22 14.230 15.275 5.759 973 1HA GLY 22 HA2 GLY 22 14.915 18.026 6.279 974 2HA GLY 22 HA3 GLY 22 15.735 16.576 6.899 975 H TRP 23 HN TRP 23 16.648 15.297 4.674 976 HA TRP 23 HA TRP 23 18.921 16.701 3.761 977 1HB TRP 23 HB2 TRP 23 17.432 14.208 2.954 978 2HB TRP 23 HB3 TRP 23 18.547 14.893 1.785 979 HD1 TRP 23 HD1 TRP 23 18.517 12.726 4.775 980 HE1 TRP 23 HE1 TRP 23 20.877 12.162 5.517 981 HE3 TRP 23 HE3 TRP 23 21.069 16.038 1.834 982 HZ2 TRP 23 HZ2 TRP 23 23.588 13.054 4.923 983 HZ3 TRP 23 HZ3 TRP 23 23.552 16.069 1.850 984 HH2 TRP 23 HH2 TRP 23 24.818 14.594 3.396 985 H ALA 24 HN ALA 24 15.667 16.385 2.293 986 HA ALA 24 HA ALA 24 16.333 17.432 -0.183 987 1HB ALA 24 HB1 ALA 24 14.080 16.380 0.540 988 2HB ALA 24 HB2 ALA 24 13.664 17.958 1.224 989 3HB ALA 24 HB3 ALA 24 13.969 17.807 -0.512 990 H LYS 25 HN LYS 25 15.136 19.208 2.745 991 HA LYS 25 HA LYS 25 14.894 21.600 1.272 992 1HB LYS 25 HB2 LYS 25 14.250 20.753 3.919 993 2HB LYS 25 HB3 LYS 25 15.324 22.133 4.121 994 1HG LYS 25 HG2 LYS 25 13.131 23.025 4.018 995 2HG LYS 25 HG3 LYS 25 13.862 23.394 2.445 996 1HD LYS 25 HD2 LYS 25 12.711 21.334 1.527 997 2HD LYS 25 HD3 LYS 25 11.893 21.159 3.078 998 1HE LYS 25 HE2 LYS 25 11.692 23.567 1.171 999 2HE LYS 25 HE3 LYS 25 10.471 22.319 1.335 1000 1HZ LYS 25 HZ1 LYS 25 9.888 24.254 2.623 1001 2HZ LYS 25 HZ2 LYS 25 10.152 23.018 3.653 1002 3HZ LYS 25 HZ3 LYS 25 11.266 24.203 3.484 1003 H GLN 26 HN GLN 26 17.791 20.221 2.703 1004 HA GLN 26 HA GLN 26 19.123 22.751 2.755 1005 1HB GLN 26 HB2 GLN 26 21.059 21.689 3.413 1006 2HB GLN 26 HB3 GLN 26 19.764 20.850 4.226 1007 1HG GLN 26 HG2 GLN 26 20.243 18.862 3.244 1008 2HG GLN 26 HG3 GLN 26 20.508 19.541 1.654 1009 1HE2 GLN 26 HE22 GLN 26 22.108 17.625 3.575 1010 2HE2 GLN 26 HE21 GLN 26 23.729 18.252 3.444 1011 H TYR 27 HN TYR 27 18.383 20.614 0.139 1012 HA TYR 27 HA TYR 27 20.445 21.973 -1.534 1013 1HB TYR 27 HB2 TYR 27 20.105 19.153 -1.011 1014 2HB TYR 27 HB3 TYR 27 19.740 19.451 -2.697 1015 HD1 TYR 27 HD1 TYR 27 22.375 19.418 -0.145 1016 HD2 TYR 27 HD2 TYR 27 21.432 20.537 -4.203 1017 HE1 TYR 27 HE1 TYR 27 24.782 19.707 -0.614 1018 HE2 TYR 27 HE2 TYR 27 23.844 20.779 -4.702 1019 HH TYR 27 HH TYR 27 26.389 20.314 -2.205 1020 H LEU 28 HN LEU 28 17.074 21.129 -1.223 1021 HA LEU 28 HA LEU 28 16.390 22.102 -3.922 1022 1HB LEU 28 HB2 LEU 28 14.676 21.203 -1.558 1023 2HB LEU 28 HB3 LEU 28 14.073 21.726 -3.118 1024 HG LEU 28 HG LEU 28 15.650 19.212 -2.517 1025 1HD1 LEU 28 HD11 LEU 28 12.890 19.599 -3.753 1026 2HD1 LEU 28 HD12 LEU 28 13.639 18.076 -3.217 1027 3HD1 LEU 28 HD13 LEU 28 13.168 19.306 -2.029 1028 1HD2 LEU 28 HD21 LEU 28 15.443 18.615 -4.899 1029 2HD2 LEU 28 HD22 LEU 28 14.777 20.226 -5.258 1030 3HD2 LEU 28 HD23 LEU 28 16.449 20.040 -4.688 1031 H GLY 29 HN GLY 29 14.226 23.254 -1.569 1032 1HA GLY 29 HA2 GLY 29 15.403 25.133 -0.023 1033 2HA GLY 29 HA3 GLY 29 15.255 25.982 -1.576 1034 H ASP 30 HN ASP 30 13.793 27.300 -0.002 1035 HA ASP 30 HA ASP 30 11.126 26.442 0.523 1036 1HB ASP 30 HB2 ASP 30 12.161 28.438 1.529 1037 2HB ASP 30 HB3 ASP 30 12.251 29.206 -0.059 1038 H GLU 31 HN GLU 31 12.776 27.208 -2.390 1039 HA GLU 31 HA GLU 31 10.729 27.848 -4.229 1040 1HB GLU 31 HB2 GLU 31 13.106 28.011 -4.707 1041 2HB GLU 31 HB3 GLU 31 13.347 26.287 -4.403 1042 1HG GLU 31 HG2 GLU 31 12.010 25.708 -6.358 1043 2HG GLU 31 HG3 GLU 31 11.702 27.421 -6.697 1044 H TRP 32 HN TRP 32 11.353 24.861 -2.491 1045 HA TRP 32 HA TRP 32 9.326 23.424 -4.139 1046 1HB TRP 32 HB2 TRP 32 11.719 22.301 -2.637 1047 2HB TRP 32 HB3 TRP 32 10.504 21.361 -3.479 1048 HD1 TRP 32 HD1 TRP 32 13.355 23.840 -4.261 1049 HE1 TRP 32 HE1 TRP 32 14.315 23.311 -6.573 1050 HE3 TRP 32 HE3 TRP 32 9.989 20.269 -5.734 1051 HZ2 TRP 32 HZ2 TRP 32 13.814 21.453 -8.698 1052 HZ3 TRP 32 HZ3 TRP 32 10.217 19.187 -7.954 1053 HH2 TRP 32 HH2 TRP 32 12.135 19.745 -9.436 1054 H LYS 33 HN LYS 33 8.086 21.847 -2.899 1055 HA LYS 33 HA LYS 33 8.022 22.283 0.047 1056 1HB LYS 33 HB2 LYS 33 5.677 21.980 -1.874 1057 2HB LYS 33 HB3 LYS 33 5.528 21.731 -0.145 1058 1HG LYS 33 HG2 LYS 33 6.650 24.322 -1.281 1059 2HG LYS 33 HG3 LYS 33 4.914 24.074 -1.093 1060 1HD LYS 33 HD2 LYS 33 6.946 23.952 1.182 1061 2HD LYS 33 HD3 LYS 33 5.970 25.359 0.753 1062 1HE LYS 33 HE2 LYS 33 3.889 24.033 1.145 1063 2HE LYS 33 HE3 LYS 33 4.873 22.659 1.663 1064 1HZ LYS 33 HZ1 LYS 33 4.799 25.304 2.999 1065 2HZ LYS 33 HZ2 LYS 33 4.084 23.948 3.539 1066 3HZ LYS 33 HZ3 LYS 33 5.709 24.035 3.485 1067 H VAL 34 HN VAL 34 8.000 20.393 1.183 1068 HA VAL 34 HA VAL 34 8.286 17.906 -0.415 1069 HB VAL 34 HB VAL 34 10.048 18.694 1.941 1070 1HG1 VAL 34 HG11 VAL 34 9.875 16.285 1.442 1071 2HG1 VAL 34 HG12 VAL 34 10.304 16.594 -0.254 1072 3HG1 VAL 34 HG13 VAL 34 11.482 16.899 1.040 1073 1HG2 VAL 34 HG21 VAL 34 11.863 19.173 0.325 1074 2HG2 VAL 34 HG22 VAL 34 10.701 19.059 -1.016 1075 3HG2 VAL 34 HG23 VAL 34 10.571 20.346 0.204 1076 H TYR 35 HN TYR 35 7.240 16.187 0.464 1077 HA TYR 35 HA TYR 35 6.015 16.400 3.169 1078 1HB TYR 35 HB2 TYR 35 4.649 15.754 0.552 1079 2HB TYR 35 HB3 TYR 35 3.908 15.575 2.139 1080 HD1 TYR 35 HD1 TYR 35 4.724 17.880 -0.560 1081 HD2 TYR 35 HD2 TYR 35 3.357 17.601 3.521 1082 HE1 TYR 35 HE1 TYR 35 3.773 20.165 -0.727 1083 HE2 TYR 35 HE2 TYR 35 2.423 19.892 3.372 1084 HH TYR 35 HH TYR 35 2.540 21.830 0.347 1085 H SER 36 HN SER 36 5.061 14.206 3.764 1086 HA SER 36 HA SER 36 6.500 11.936 2.549 1087 1HB SER 36 HB2 SER 36 6.632 12.770 5.469 1088 2HB SER 36 HB3 SER 36 7.211 11.238 4.793 1089 HG SER 36 HG SER 36 8.579 13.402 5.050 1090 H ALA 37 HN ALA 37 5.495 9.901 2.970 1091 HA ALA 37 HA ALA 37 2.968 9.834 4.511 1092 1HB ALA 37 HB1 ALA 37 2.032 10.323 2.448 1093 2HB ALA 37 HB2 ALA 37 3.376 9.591 1.525 1094 3HB ALA 37 HB3 ALA 37 2.185 8.557 2.311 1095 H GLY 38 HN GLY 38 2.232 7.642 4.872 1096 1HA GLY 38 HA2 GLY 38 3.633 5.359 3.897 1097 2HA GLY 38 HA3 GLY 38 4.081 5.690 5.581 1098 H ILE 39 HN ILE 39 2.965 3.418 5.494 1099 HA ILE 39 HA ILE 39 0.348 3.008 4.913 1100 HB ILE 39 HB ILE 39 1.823 1.201 5.232 1101 1HG1 ILE 39 HG12 ILE 39 0.215 0.559 7.661 1102 2HG1 ILE 39 HG13 ILE 39 -0.710 1.071 6.251 1103 1HG2 ILE 39 HG21 ILE 39 2.162 1.899 8.187 1104 2HG2 ILE 39 HG22 ILE 39 2.746 0.458 7.400 1105 3HG2 ILE 39 HG23 ILE 39 3.380 2.023 6.888 1106 1HD1 ILE 39 HD11 ILE 39 1.272 -1.225 6.253 1107 2HD1 ILE 39 HD12 ILE 39 -0.505 -1.350 6.322 1108 3HD1 ILE 39 HD13 ILE 39 0.266 -0.683 4.883 1109 H GLU 40 HN GLU 40 1.393 3.473 8.279 1110 HA GLU 40 HA GLU 40 -1.210 4.646 9.093 1111 1HB GLU 40 HB2 GLU 40 0.172 2.150 10.159 1112 2HB GLU 40 HB3 GLU 40 -1.033 3.040 11.102 1113 1HG GLU 40 HG2 GLU 40 -1.463 1.658 8.433 1114 2HG GLU 40 HG3 GLU 40 -1.993 1.082 9.992 1115 H ALA 41 HN ALA 41 1.193 5.797 8.403 1116 HA ALA 41 HA ALA 41 3.281 5.985 10.282 1117 1HB ALA 41 HB1 ALA 41 2.363 7.662 7.927 1118 2HB ALA 41 HB2 ALA 41 3.933 7.823 8.743 1119 3HB ALA 41 HB3 ALA 41 3.508 6.309 7.887 1120 H HIS 42 HN HIS 42 3.872 7.566 11.655 1121 HA HIS 42 HA HIS 42 3.124 10.231 11.598 1122 1HB HIS 42 HB2 HIS 42 1.796 10.500 13.703 1123 2HB HIS 42 HB3 HIS 42 0.902 9.627 12.501 1124 HD1 HIS 42 HD1 HIS 42 2.718 9.004 15.841 1125 HD2 HIS 42 HD2 HIS 42 0.182 7.106 13.067 1126 HE1 HIS 42 HE1 HIS 42 1.907 6.862 16.962 1127 H GLY 43 HN GLY 43 5.463 8.257 12.136 1128 1HA GLY 43 HA2 GLY 43 6.109 8.757 14.976 1129 2HA GLY 43 HA3 GLY 43 6.929 7.657 13.878 1130 H LEU 44 HN LEU 44 8.474 9.182 15.410 1131 HA LEU 44 HA LEU 44 10.011 10.607 13.400 1132 1HB LEU 44 HB2 LEU 44 8.736 12.478 14.324 1133 2HB LEU 44 HB3 LEU 44 9.175 12.018 15.969 1134 HG LEU 44 HG LEU 44 11.525 12.592 15.564 1135 1HD1 LEU 44 HD11 LEU 44 12.226 13.695 13.436 1136 2HD1 LEU 44 HD12 LEU 44 11.852 11.986 13.229 1137 3HD1 LEU 44 HD13 LEU 44 10.679 13.224 12.706 1138 1HD2 LEU 44 HD21 LEU 44 9.661 14.771 14.541 1139 2HD2 LEU 44 HD22 LEU 44 9.984 14.389 16.246 1140 3HD2 LEU 44 HD23 LEU 44 11.284 15.011 15.217 1141 H ASN 45 HN ASN 45 11.006 8.572 13.648 1142 HA ASN 45 HA ASN 45 11.799 7.340 16.053 1143 1HB ASN 45 HB2 ASN 45 11.593 6.297 13.809 1144 2HB ASN 45 HB3 ASN 45 13.000 7.204 13.253 1145 1HD2 ASN 45 HD22 ASN 45 12.694 4.288 13.204 1146 2HD2 ASN 45 HD21 ASN 45 13.964 3.667 14.221 1147 HA PRO 46 HA PRO 46 15.143 10.152 17.140 1148 1HB PRO 46 HB2 PRO 46 16.589 8.572 18.899 1149 2HB PRO 46 HB3 PRO 46 15.118 9.511 19.297 1150 1HG PRO 46 HG2 PRO 46 15.324 6.577 18.559 1151 2HG PRO 46 HG3 PRO 46 14.393 7.319 19.900 1152 1HD PRO 46 HD2 PRO 46 13.191 6.634 17.583 1153 2HD PRO 46 HD3 PRO 46 12.747 8.157 18.405 1154 H ASN 47 HN ASN 47 15.675 6.940 15.682 1155 HA ASN 47 HA ASN 47 18.433 7.318 14.958 1156 1HB ASN 47 HB2 ASN 47 17.575 5.163 14.386 1157 2HB ASN 47 HB3 ASN 47 16.142 5.849 13.612 1158 1HD2 ASN 47 HD22 ASN 47 16.451 5.004 11.441 1159 2HD2 ASN 47 HD21 ASN 47 17.707 5.782 10.471 1160 H ALA 48 HN ALA 48 15.339 8.354 13.280 1161 HA ALA 48 HA ALA 48 16.742 9.439 11.071 1162 1HB ALA 48 HB1 ALA 48 14.014 10.149 12.286 1163 2HB ALA 48 HB2 ALA 48 14.634 10.894 10.813 1164 3HB ALA 48 HB3 ALA 48 14.393 9.144 10.854 1165 H VAL 49 HN VAL 49 15.763 10.823 14.214 1166 HA VAL 49 HA VAL 49 16.590 13.511 13.708 1167 HB VAL 49 HB VAL 49 16.706 12.075 16.393 1168 1HG1 VAL 49 HG11 VAL 49 16.363 15.029 15.689 1169 2HG1 VAL 49 HG12 VAL 49 16.334 14.336 17.322 1170 3HG1 VAL 49 HG13 VAL 49 17.825 14.284 16.375 1171 1HG2 VAL 49 HG21 VAL 49 14.434 11.803 15.455 1172 2HG2 VAL 49 HG22 VAL 49 14.426 12.949 16.786 1173 3HG2 VAL 49 HG23 VAL 49 14.354 13.544 15.113 1174 H LYS 50 HN LYS 50 18.435 10.759 15.141 1175 HA LYS 50 HA LYS 50 20.919 12.107 15.417 1176 1HB LYS 50 HB2 LYS 50 20.393 9.983 16.515 1177 2HB LYS 50 HB3 LYS 50 20.271 9.163 14.959 1178 1HG LYS 50 HG2 LYS 50 22.680 9.570 14.537 1179 2HG LYS 50 HG3 LYS 50 22.806 10.388 16.111 1180 1HD LYS 50 HD2 LYS 50 22.123 8.267 17.241 1181 2HD LYS 50 HD3 LYS 50 21.922 7.498 15.665 1182 1HE LYS 50 HE2 LYS 50 24.015 6.753 16.507 1183 2HE LYS 50 HE3 LYS 50 24.358 7.874 15.188 1184 1HZ LYS 50 HZ1 LYS 50 24.836 9.577 16.870 1185 2HZ LYS 50 HZ2 LYS 50 24.493 8.530 18.082 1186 3HZ LYS 50 HZ3 LYS 50 25.774 8.262 17.107 1187 H ALA 51 HN ALA 51 19.615 10.204 12.719 1188 HA ALA 51 HA ALA 51 21.748 10.058 10.985 1189 1HB ALA 51 HB1 ALA 51 19.699 8.828 10.714 1190 2HB ALA 51 HB2 ALA 51 18.792 10.324 10.401 1191 3HB ALA 51 HB3 ALA 51 20.028 9.796 9.253 1192 H MET 52 HN MET 52 19.457 12.795 11.543 1193 HA MET 52 HA MET 52 20.609 14.304 9.294 1194 1HB MET 52 HB2 MET 52 18.304 14.904 11.202 1195 2HB MET 52 HB3 MET 52 18.792 15.889 9.820 1196 1HG MET 52 HG2 MET 52 17.595 13.120 9.762 1197 2HG MET 52 HG3 MET 52 16.949 14.601 9.085 1198 1HE MET 52 HE1 MET 52 19.286 15.221 6.033 1199 2HE MET 52 HE2 MET 52 18.055 15.865 7.139 1200 3HE MET 52 HE3 MET 52 19.753 15.702 7.670 1201 H LYS 53 HN LYS 53 20.637 14.272 12.869 1202 HA LYS 53 HA LYS 53 22.129 16.699 13.154 1203 1HB LYS 53 HB2 LYS 53 22.175 14.156 14.837 1204 2HB LYS 53 HB3 LYS 53 22.904 15.676 15.325 1205 1HG LYS 53 HG2 LYS 53 19.942 15.482 14.684 1206 2HG LYS 53 HG3 LYS 53 20.582 15.052 16.267 1207 1HD LYS 53 HD2 LYS 53 21.382 17.325 16.612 1208 2HD LYS 53 HD3 LYS 53 20.916 17.782 14.951 1209 1HE LYS 53 HE2 LYS 53 18.565 17.278 15.420 1210 2HE LYS 53 HE3 LYS 53 18.959 16.687 17.034 1211 1HZ LYS 53 HZ1 LYS 53 18.057 19.013 16.800 1212 2HZ LYS 53 HZ2 LYS 53 19.382 18.847 17.766 1213 3HZ LYS 53 HZ3 LYS 53 19.532 19.475 16.262 1214 H GLU 54 HN GLU 54 23.119 13.440 12.052 1215 HA GLU 54 HA GLU 54 25.906 13.701 12.315 1216 1HB GLU 54 HB2 GLU 54 24.342 12.442 10.023 1217 2HB GLU 54 HB3 GLU 54 26.083 12.339 10.211 1218 1HG GLU 54 HG2 GLU 54 25.682 11.247 12.484 1219 2HG GLU 54 HG3 GLU 54 23.995 11.060 11.981 1220 H VAL 55 HN VAL 55 23.725 15.256 10.011 1221 HA VAL 55 HA VAL 55 26.019 16.649 8.729 1222 HB VAL 55 HB VAL 55 24.544 16.825 6.746 1223 1HG1 VAL 55 HG11 VAL 55 26.271 15.025 7.067 1224 2HG1 VAL 55 HG12 VAL 55 24.979 13.936 7.623 1225 3HG1 VAL 55 HG13 VAL 55 24.961 14.593 5.974 1226 1HG2 VAL 55 HG21 VAL 55 22.318 16.509 7.886 1227 2HG2 VAL 55 HG22 VAL 55 22.560 15.450 6.492 1228 3HG2 VAL 55 HG23 VAL 55 22.720 14.794 8.129 1229 H GLY 56 HN GLY 56 24.281 17.253 11.223 1230 1HA GLY 56 HA2 GLY 56 23.702 19.155 12.299 1231 2HA GLY 56 HA3 GLY 56 24.540 20.045 11.019 1232 H ILE 57 HN ILE 57 21.580 17.953 10.668 1233 HA ILE 57 HA ILE 57 20.023 20.440 10.029 1234 HB ILE 57 HB ILE 57 19.765 17.674 8.800 1235 1HG1 ILE 57 HG12 ILE 57 20.535 20.358 7.566 1236 2HG1 ILE 57 HG13 ILE 57 21.644 19.031 7.901 1237 1HG2 ILE 57 HG21 ILE 57 18.082 20.176 8.261 1238 2HG2 ILE 57 HG22 ILE 57 17.895 18.604 7.474 1239 3HG2 ILE 57 HG23 ILE 57 17.531 18.766 9.184 1240 1HD1 ILE 57 HD11 ILE 57 20.402 17.587 6.292 1241 2HD1 ILE 57 HD12 ILE 57 19.412 19.003 5.844 1242 3HD1 ILE 57 HD13 ILE 57 21.159 19.019 5.580 1243 H ASP 58 HN ASP 58 18.941 20.830 11.896 1244 HA ASP 58 HA ASP 58 18.122 18.684 13.706 1245 1HB ASP 58 HB2 ASP 58 18.482 20.914 14.645 1246 2HB ASP 58 HB3 ASP 58 17.288 21.609 13.536 1247 H ILE 59 HN ILE 59 16.169 17.659 13.729 1248 HA ILE 59 HA ILE 59 13.997 18.653 11.982 1249 HB ILE 59 HB ILE 59 13.391 16.475 11.276 1250 1HG1 ILE 59 HG12 ILE 59 16.025 15.323 12.327 1251 2HG1 ILE 59 HG13 ILE 59 14.503 15.188 13.210 1252 1HG2 ILE 59 HG21 ILE 59 16.323 16.973 10.549 1253 2HG2 ILE 59 HG22 ILE 59 15.122 16.133 9.551 1254 3HG2 ILE 59 HG23 ILE 59 14.945 17.866 9.875 1255 1HD1 ILE 59 HD11 ILE 59 14.779 13.161 11.985 1256 2HD1 ILE 59 HD12 ILE 59 13.465 14.077 11.239 1257 3HD1 ILE 59 HD13 ILE 59 15.065 14.021 10.462 1258 H SER 60 HN SER 60 14.787 18.399 15.055 1259 HA SER 60 HA SER 60 12.994 16.536 16.137 1260 1HB SER 60 HB2 SER 60 13.882 19.141 17.440 1261 2HB SER 60 HB3 SER 60 13.434 17.623 18.242 1262 HG SER 60 HG SER 60 15.737 18.258 16.705 1263 H ASN 61 HN ASN 61 12.257 19.458 14.538 1264 HA ASN 61 HA ASN 61 9.723 19.993 15.860 1265 1HB ASN 61 HB2 ASN 61 11.191 21.823 15.042 1266 2HB ASN 61 HB3 ASN 61 11.036 21.209 13.395 1267 1HD2 ASN 61 HD22 ASN 61 9.485 22.277 12.176 1268 2HD2 ASN 61 HD21 ASN 61 8.087 23.085 12.832 1269 H GLN 62 HN GLN 62 10.773 17.895 13.216 1270 HA GLN 62 HA GLN 62 8.883 18.283 11.337 1271 1HB GLN 62 HB2 GLN 62 10.466 15.881 12.179 1272 2HB GLN 62 HB3 GLN 62 9.167 15.673 11.001 1273 1HG GLN 62 HG2 GLN 62 10.089 17.547 9.631 1274 2HG GLN 62 HG3 GLN 62 11.450 17.660 10.751 1275 1HE2 GLN 62 HE22 GLN 62 12.722 17.231 8.810 1276 2HE2 GLN 62 HE21 GLN 62 12.950 15.558 8.265 1277 H THR 63 HN THR 63 7.060 17.337 10.650 1278 HA THR 63 HA THR 63 5.300 15.862 12.535 1279 HB THR 63 HB THR 63 3.445 16.881 11.151 1280 HG1 THR 63 HG1 THR 63 4.533 17.519 9.302 1281 1HG2 THR 63 HG21 THR 63 5.322 18.901 12.459 1282 2HG2 THR 63 HG22 THR 63 3.571 19.095 12.201 1283 3HG2 THR 63 HG23 THR 63 4.167 17.867 13.332 1284 H SER 64 HN SER 64 3.842 14.286 11.415 1285 HA SER 64 HA SER 64 4.981 12.998 8.999 1286 1HB SER 64 HB2 SER 64 4.682 11.692 11.726 1287 2HB SER 64 HB3 SER 64 5.347 10.935 10.267 1288 HG SER 64 HG SER 64 6.875 11.663 11.864 1289 H ASP 65 HN ASP 65 3.422 11.267 8.204 1290 HA ASP 65 HA ASP 65 0.722 11.250 9.276 1291 1HB ASP 65 HB2 ASP 65 0.951 13.581 8.240 1292 2HB ASP 65 HB3 ASP 65 1.226 12.787 6.688 1293 H ILE 66 HN ILE 66 -0.793 10.055 7.774 1294 HA ILE 66 HA ILE 66 0.499 7.851 6.435 1295 HB ILE 66 HB ILE 66 -1.900 7.234 5.927 1296 1HG1 ILE 66 HG12 ILE 66 -2.603 9.604 7.711 1297 2HG1 ILE 66 HG13 ILE 66 -2.754 9.637 5.950 1298 1HG2 ILE 66 HG21 ILE 66 -2.383 6.571 8.205 1299 2HG2 ILE 66 HG22 ILE 66 -0.663 6.438 7.838 1300 3HG2 ILE 66 HG23 ILE 66 -1.247 7.788 8.842 1301 1HD1 ILE 66 HD11 ILE 66 -4.343 7.705 6.102 1302 2HD1 ILE 66 HD12 ILE 66 -4.253 7.834 7.881 1303 3HD1 ILE 66 HD13 ILE 66 -4.902 9.178 6.928 1304 H ILE 67 HN ILE 67 -0.485 7.226 4.191 1305 HA ILE 67 HA ILE 67 0.182 9.082 2.210 1306 HB ILE 67 HB ILE 67 -0.398 7.538 0.680 1307 1HG1 ILE 67 HG12 ILE 67 -2.732 6.615 2.386 1308 2HG1 ILE 67 HG13 ILE 67 -2.792 7.597 0.915 1309 1HG2 ILE 67 HG21 ILE 67 1.088 6.453 2.413 1310 2HG2 ILE 67 HG22 ILE 67 -0.356 5.611 3.029 1311 3HG2 ILE 67 HG23 ILE 67 0.205 5.344 1.374 1312 1HD1 ILE 67 HD11 ILE 67 -3.415 5.485 0.182 1313 2HD1 ILE 67 HD12 ILE 67 -1.713 5.564 -0.293 1314 3HD1 ILE 67 HD13 ILE 67 -2.171 4.661 1.159 1315 H ASP 68 HN ASP 68 -0.842 10.684 1.178 1316 HA ASP 68 HA ASP 68 -3.720 11.154 1.666 1317 1HB ASP 68 HB2 ASP 68 -2.533 12.367 3.464 1318 2HB ASP 68 HB3 ASP 68 -1.675 13.314 2.242 1319 H SER 69 HN SER 69 -4.137 10.660 -0.354 1320 HA SER 69 HA SER 69 -3.057 11.240 -2.725 1321 1HB SER 69 HB2 SER 69 -6.003 11.608 -2.132 1322 2HB SER 69 HB3 SER 69 -5.270 10.879 -3.576 1323 HG SER 69 HG SER 69 -6.224 9.510 -1.719 1324 H ASP 70 HN ASP 70 -4.662 13.679 -0.656 1325 HA ASP 70 HA ASP 70 -5.480 15.392 -2.784 1326 1HB ASP 70 HB2 ASP 70 -6.412 15.440 -0.474 1327 2HB ASP 70 HB3 ASP 70 -4.875 16.124 0.093 1328 H ILE 71 HN ILE 71 -2.397 14.915 -1.284 1329 HA ILE 71 HA ILE 71 -1.303 17.320 -2.699 1330 HB ILE 71 HB ILE 71 -0.096 16.036 -0.287 1331 1HG1 ILE 71 HG12 ILE 71 -1.144 18.477 0.676 1332 2HG1 ILE 71 HG13 ILE 71 -2.474 17.817 -0.266 1333 1HG2 ILE 71 HG21 ILE 71 0.250 18.866 -1.321 1334 2HG2 ILE 71 HG22 ILE 71 1.097 18.083 0.039 1335 3HG2 ILE 71 HG23 ILE 71 1.375 17.524 -1.621 1336 1HD1 ILE 71 HD11 ILE 71 -2.224 15.656 0.977 1337 2HD1 ILE 71 HD12 ILE 71 -0.894 16.407 1.907 1338 3HD1 ILE 71 HD13 ILE 71 -2.554 17.037 2.057 1339 H LEU 72 HN LEU 72 -0.901 13.850 -1.766 1340 HA LEU 72 HA LEU 72 1.619 13.544 -3.031 1341 1HB LEU 72 HB2 LEU 72 0.647 12.094 -1.304 1342 2HB LEU 72 HB3 LEU 72 -0.522 11.453 -2.454 1343 HG LEU 72 HG LEU 72 2.458 11.315 -3.061 1344 1HD1 LEU 72 HD11 LEU 72 2.489 9.096 -1.894 1345 2HD1 LEU 72 HD12 LEU 72 2.319 10.481 -0.816 1346 3HD1 LEU 72 HD13 LEU 72 0.899 9.507 -1.188 1347 1HD2 LEU 72 HD21 LEU 72 1.709 9.113 -4.128 1348 2HD2 LEU 72 HD22 LEU 72 0.034 9.626 -3.845 1349 3HD2 LEU 72 HD23 LEU 72 1.088 10.560 -4.909 1350 H ASN 73 HN ASN 73 -1.734 12.946 -4.311 1351 HA ASN 73 HA ASN 73 -0.775 12.101 -6.854 1352 1HB ASN 73 HB2 ASN 73 -2.899 11.884 -7.480 1353 2HB ASN 73 HB3 ASN 73 -3.276 12.096 -5.785 1354 1HD2 ASN 73 HD22 ASN 73 -3.970 14.361 -5.122 1355 2HD2 ASN 73 HD21 ASN 73 -4.696 15.411 -6.327 1356 H ASN 74 HN ASN 74 -1.209 15.271 -5.383 1357 HA ASN 74 HA ASN 74 -1.105 16.787 -7.840 1358 1HB ASN 74 HB2 ASN 74 -1.307 17.418 -4.908 1359 2HB ASN 74 HB3 ASN 74 -0.612 18.655 -5.920 1360 1HD2 ASN 74 HD22 ASN 74 -3.487 17.904 -4.578 1361 2HD2 ASN 74 HD21 ASN 74 -4.549 18.542 -5.811 1362 H ALA 75 HN ALA 75 1.325 15.438 -5.699 1363 HA ALA 75 HA ALA 75 3.391 17.260 -6.110 1364 1HB ALA 75 HB1 ALA 75 4.872 15.445 -5.459 1365 2HB ALA 75 HB2 ALA 75 3.388 15.373 -4.496 1366 3HB ALA 75 HB3 ALA 75 3.627 14.237 -5.836 1367 H ASP 76 HN ASP 76 5.379 16.884 -7.317 1368 HA ASP 76 HA ASP 76 4.921 16.236 -10.175 1369 1HB ASP 76 HB2 ASP 76 6.142 18.306 -9.538 1370 2HB ASP 76 HB3 ASP 76 7.369 17.322 -8.729 1371 H LEU 77 HN LEU 77 6.409 14.849 -7.276 1372 HA LEU 77 HA LEU 77 7.257 12.497 -8.780 1373 1HB LEU 77 HB2 LEU 77 9.093 14.337 -8.712 1374 2HB LEU 77 HB3 LEU 77 9.149 14.069 -6.996 1375 HG LEU 77 HG LEU 77 10.161 12.369 -9.253 1376 1HD1 LEU 77 HD11 LEU 77 11.403 13.185 -6.613 1377 2HD1 LEU 77 HD12 LEU 77 12.203 12.422 -8.006 1378 3HD1 LEU 77 HD13 LEU 77 11.574 14.063 -8.149 1379 1HD2 LEU 77 HD21 LEU 77 10.733 10.527 -7.702 1380 2HD2 LEU 77 HD22 LEU 77 9.655 11.262 -6.501 1381 3HD2 LEU 77 HD23 LEU 77 9.013 10.637 -8.040 1382 H VAL 78 HN VAL 78 6.693 10.715 -7.606 1383 HA VAL 78 HA VAL 78 6.491 10.829 -4.632 1384 HB VAL 78 HB VAL 78 5.352 8.819 -6.592 1385 1HG1 VAL 78 HG11 VAL 78 4.125 7.993 -4.597 1386 2HG1 VAL 78 HG12 VAL 78 5.866 7.817 -4.382 1387 3HG1 VAL 78 HG13 VAL 78 5.004 9.143 -3.569 1388 1HG2 VAL 78 HG21 VAL 78 3.167 9.753 -5.975 1389 2HG2 VAL 78 HG22 VAL 78 3.954 10.991 -4.960 1390 3HG2 VAL 78 HG23 VAL 78 4.169 10.992 -6.715 1391 H VAL 79 HN VAL 79 8.578 10.553 -3.905 1392 HA VAL 79 HA VAL 79 10.265 8.535 -5.186 1393 HB VAL 79 HB VAL 79 10.689 10.073 -2.606 1394 1HG1 VAL 79 HG11 VAL 79 12.545 8.366 -4.331 1395 2HG1 VAL 79 HG12 VAL 79 13.068 9.349 -2.950 1396 3HG1 VAL 79 HG13 VAL 79 11.994 7.983 -2.687 1397 1HG2 VAL 79 HG21 VAL 79 10.637 11.648 -4.472 1398 2HG2 VAL 79 HG22 VAL 79 12.285 11.444 -3.895 1399 3HG2 VAL 79 HG23 VAL 79 11.783 10.631 -5.389 1400 H THR 80 HN THR 80 9.688 6.401 -4.820 1401 HA THR 80 HA THR 80 8.458 5.633 -2.237 1402 HB THR 80 HB THR 80 9.420 3.904 -4.541 1403 HG1 THR 80 HG1 THR 80 7.543 5.487 -4.673 1404 1HG2 THR 80 HG21 THR 80 9.328 2.654 -2.424 1405 2HG2 THR 80 HG22 THR 80 7.735 3.352 -2.054 1406 3HG2 THR 80 HG23 THR 80 7.934 2.207 -3.417 1407 H LEU 81 HN LEU 81 9.826 5.946 -0.597 1408 HA LEU 81 HA LEU 81 12.681 6.041 -1.107 1409 1HB LEU 81 HB2 LEU 81 11.228 7.602 0.350 1410 2HB LEU 81 HB3 LEU 81 11.257 6.307 1.554 1411 HG LEU 81 HG LEU 81 13.719 6.445 1.682 1412 1HD1 LEU 81 HD11 LEU 81 14.567 7.150 -0.407 1413 2HD1 LEU 81 HD12 LEU 81 13.360 8.439 -0.587 1414 3HD1 LEU 81 HD13 LEU 81 14.689 8.637 0.543 1415 1HD2 LEU 81 HD21 LEU 81 12.424 9.192 1.868 1416 2HD2 LEU 81 HD22 LEU 81 12.131 7.883 3.016 1417 3HD2 LEU 81 HD23 LEU 81 13.768 8.537 2.839 1418 H SER 82 HN SER 82 10.502 3.960 0.868 1419 HA SER 82 HA SER 82 12.636 2.309 1.819 1420 1HB SER 82 HB2 SER 82 9.628 1.770 1.654 1421 2HB SER 82 HB3 SER 82 10.790 0.921 2.691 1422 HG SER 82 HG SER 82 11.236 2.988 3.649 1423 H GLY 83 HN GLY 83 12.322 -0.193 1.362 1424 1HA GLY 83 HA2 GLY 83 12.202 -0.701 -1.575 1425 2HA GLY 83 HA3 GLY 83 12.761 -1.825 -0.322 1426 H ASP 84 HN ASP 84 11.187 -2.785 1.104 1427 HA ASP 84 HA ASP 84 8.377 -2.187 1.006 1428 1HB ASP 84 HB2 ASP 84 8.248 -3.545 -0.955 1429 2HB ASP 84 HB3 ASP 84 9.430 -4.703 -0.336 1430 H ALA 85 HN ALA 85 7.643 -2.689 3.030 1431 HA ALA 85 HA ALA 85 8.559 -5.046 4.443 1432 1HB ALA 85 HB1 ALA 85 10.326 -3.579 5.223 1433 2HB ALA 85 HB2 ALA 85 9.176 -2.279 5.574 1434 3HB ALA 85 HB3 ALA 85 9.155 -3.773 6.541 1435 H ALA 86 HN ALA 86 6.863 -1.872 4.877 1436 HA ALA 86 HA ALA 86 4.274 -3.175 5.103 1437 1HB ALA 86 HB1 ALA 86 4.904 -3.463 7.433 1438 2HB ALA 86 HB2 ALA 86 5.531 -1.821 7.550 1439 3HB ALA 86 HB3 ALA 86 3.783 -2.087 7.352 1440 H ASP 87 HN ASP 87 4.718 -1.777 3.025 1441 HA ASP 87 HA ASP 87 4.677 1.105 3.632 1442 1HB ASP 87 HB2 ASP 87 5.617 1.480 1.554 1443 2HB ASP 87 HB3 ASP 87 6.400 0.003 2.101 1444 H LYS 88 HN LYS 88 2.313 -1.159 3.034 1445 HA LYS 88 HA LYS 88 0.136 -1.097 2.523 1446 1HB LYS 88 HB2 LYS 88 0.403 1.388 3.439 1447 2HB LYS 88 HB3 LYS 88 0.030 1.818 1.777 1448 1HG LYS 88 HG2 LYS 88 -2.107 0.526 1.951 1449 2HG LYS 88 HG3 LYS 88 -1.661 0.021 3.576 1450 1HD LYS 88 HD2 LYS 88 -1.481 2.854 3.644 1451 2HD LYS 88 HD3 LYS 88 -2.912 2.526 2.670 1452 1HE LYS 88 HE2 LYS 88 -3.878 1.147 4.460 1453 2HE LYS 88 HE3 LYS 88 -2.375 1.232 5.377 1454 1HZ LYS 88 HZ1 LYS 88 -4.203 3.509 4.904 1455 2HZ LYS 88 HZ2 LYS 88 -3.877 2.742 6.339 1456 3HZ LYS 88 HZ3 LYS 88 -2.724 3.608 5.644 1457 H CYS 89 HN CYS 89 2.401 -1.283 0.469 1458 HA CYS 89 HA CYS 89 2.775 -1.257 -1.748 1459 1HB CYS 89 HB2 CYS 89 1.236 -2.910 -2.941 1460 2HB CYS 89 HB3 CYS 89 2.094 -3.451 -1.505 1461 HA PRO 90 HA PRO 90 -0.420 2.056 -2.521 1462 1HB PRO 90 HB2 PRO 90 1.964 3.756 -3.128 1463 2HB PRO 90 HB3 PRO 90 0.493 4.165 -2.190 1464 1HG PRO 90 HG2 PRO 90 2.821 3.650 -0.876 1465 2HG PRO 90 HG3 PRO 90 1.273 2.988 -0.269 1466 1HD PRO 90 HD2 PRO 90 3.318 1.630 -2.070 1467 2HD PRO 90 HD3 PRO 90 2.653 1.046 -0.529 1468 H MET 91 HN MET 91 -1.275 2.444 -4.603 1469 HA MET 91 HA MET 91 0.348 1.224 -6.769 1470 1HB MET 91 HB2 MET 91 -1.793 1.012 -7.952 1471 2HB MET 91 HB3 MET 91 -1.686 0.196 -6.384 1472 1HG MET 91 HG2 MET 91 -3.811 1.159 -6.504 1473 2HG MET 91 HG3 MET 91 -2.919 2.088 -5.353 1474 1HE MET 91 HE1 MET 91 -4.882 3.393 -5.683 1475 2HE MET 91 HE2 MET 91 -5.437 4.409 -7.103 1476 3HE MET 91 HE3 MET 91 -5.524 2.607 -7.126 1477 H THR 92 HN THR 92 0.189 4.243 -5.723 1478 HA THR 92 HA THR 92 0.340 6.325 -6.483 1479 HB THR 92 HB THR 92 2.252 6.623 -8.115 1480 HG1 THR 92 HG1 THR 92 2.046 4.543 -9.071 1481 1HG2 THR 92 HG21 THR 92 3.869 6.006 -6.394 1482 2HG2 THR 92 HG22 THR 92 2.434 6.701 -5.645 1483 3HG2 THR 92 HG23 THR 92 2.681 4.945 -5.601 1484 HA PRO 93 HA PRO 93 -2.636 6.421 -9.855 1485 1HB PRO 93 HB2 PRO 93 -3.735 8.898 -9.385 1486 2HB PRO 93 HB3 PRO 93 -4.102 7.443 -8.394 1487 1HG PRO 93 HG2 PRO 93 -2.119 9.623 -7.728 1488 2HG PRO 93 HG3 PRO 93 -3.410 8.886 -6.703 1489 1HD PRO 93 HD2 PRO 93 -0.824 8.051 -6.597 1490 2HD PRO 93 HD3 PRO 93 -2.184 6.891 -6.442 1491 HA PRO 94 HA PRO 94 0.329 7.934 -12.657 1492 1HB PRO 94 HB2 PRO 94 -1.051 8.116 -15.054 1493 2HB PRO 94 HB3 PRO 94 -0.630 6.586 -14.231 1494 1HG PRO 94 HG2 PRO 94 -3.228 8.151 -14.021 1495 2HG PRO 94 HG3 PRO 94 -3.016 6.407 -14.414 1496 1HD PRO 94 HD2 PRO 94 -3.562 7.116 -11.890 1497 2HD PRO 94 HD3 PRO 94 -2.262 5.923 -12.218 1498 H HIS 95 HN HIS 95 -1.798 10.202 -11.531 1499 HA HIS 95 HA HIS 95 -1.330 12.391 -13.337 1500 1HB HIS 95 HB2 HIS 95 -3.147 12.224 -11.593 1501 2HB HIS 95 HB3 HIS 95 -1.914 12.454 -10.350 1502 HD1 HIS 95 HD1 HIS 95 -1.332 14.955 -9.831 1503 HD2 HIS 95 HD2 HIS 95 -3.469 14.353 -13.405 1504 HE1 HIS 95 HE1 HIS 95 -1.950 17.282 -10.700 1505 H VAL 96 HN VAL 96 0.826 10.664 -11.218 1506 HA VAL 96 HA VAL 96 2.810 12.855 -11.403 1507 HB VAL 96 HB VAL 96 1.671 13.084 -9.288 1508 1HG1 VAL 96 HG11 VAL 96 1.772 11.403 -7.500 1509 2HG1 VAL 96 HG12 VAL 96 0.817 10.830 -8.865 1510 3HG1 VAL 96 HG13 VAL 96 2.472 10.222 -8.629 1511 1HG2 VAL 96 HG21 VAL 96 4.421 11.913 -8.785 1512 2HG2 VAL 96 HG22 VAL 96 4.112 13.496 -9.490 1513 3HG2 VAL 96 HG23 VAL 96 3.566 13.132 -7.837 1514 H LYS 97 HN LYS 97 5.006 12.209 -11.255 1515 HA LYS 97 HA LYS 97 5.709 9.673 -12.420 1516 1HB LYS 97 HB2 LYS 97 7.459 11.025 -13.021 1517 2HB LYS 97 HB3 LYS 97 6.777 12.301 -12.080 1518 1HG LYS 97 HG2 LYS 97 8.682 12.389 -11.075 1519 2HG LYS 97 HG3 LYS 97 8.136 11.078 -10.082 1520 1HD LYS 97 HD2 LYS 97 9.795 9.743 -10.804 1521 2HD LYS 97 HD3 LYS 97 9.294 9.957 -12.487 1522 1HE LYS 97 HE2 LYS 97 10.378 12.276 -12.347 1523 2HE LYS 97 HE3 LYS 97 11.178 11.759 -10.852 1524 1HZ LYS 97 HZ1 LYS 97 12.358 10.062 -12.098 1525 2HZ LYS 97 HZ2 LYS 97 11.531 10.432 -13.477 1526 3HZ LYS 97 HZ3 LYS 97 12.545 11.540 -12.822 1527 H ARG 98 HN ARG 98 7.096 8.059 -11.317 1528 HA ARG 98 HA ARG 98 7.403 8.389 -8.432 1529 1HB ARG 98 HB2 ARG 98 5.298 7.027 -8.635 1530 2HB ARG 98 HB3 ARG 98 6.202 5.838 -9.572 1531 1HG ARG 98 HG2 ARG 98 7.755 6.136 -7.212 1532 2HG ARG 98 HG3 ARG 98 6.140 6.322 -6.619 1533 1HD ARG 98 HD2 ARG 98 7.063 4.046 -8.475 1534 2HD ARG 98 HD3 ARG 98 7.268 3.949 -6.750 1535 HE ARG 98 HE ARG 98 4.620 4.169 -8.139 1536 1HH1 ARG 98 HH11 ARG 98 6.325 3.253 -5.153 1537 2HH1 ARG 98 HH12 ARG 98 5.147 2.059 -4.713 1538 1HH2 ARG 98 HH21 ARG 98 3.029 2.898 -7.434 1539 2HH2 ARG 98 HH22 ARG 98 3.117 1.942 -5.986 1540 H GLU 99 HN GLU 99 9.278 7.370 -7.703 1541 HA GLU 99 HA GLU 99 10.779 5.590 -9.460 1542 1HB GLU 99 HB2 GLU 99 11.252 8.128 -9.988 1543 2HB GLU 99 HB3 GLU 99 12.077 8.152 -8.433 1544 1HG GLU 99 HG2 GLU 99 13.591 6.349 -9.249 1545 2HG GLU 99 HG3 GLU 99 12.711 6.314 -10.792 1546 H HIS 100 HN HIS 100 11.981 4.197 -8.041 1547 HA HIS 100 HA HIS 100 11.852 4.863 -5.177 1548 1HB HIS 100 HB2 HIS 100 12.454 2.486 -4.793 1549 2HB HIS 100 HB3 HIS 100 10.938 2.714 -5.645 1550 HD1 HIS 100 HD1 HIS 100 14.294 2.689 -7.556 1551 HD2 HIS 100 HD2 HIS 100 10.886 0.341 -6.794 1552 HE1 HIS 100 HE1 HIS 100 14.418 0.699 -9.157 1553 H TRP 101 HN TRP 101 13.629 5.072 -3.856 1554 HA TRP 101 HA TRP 101 16.246 5.371 -5.310 1555 1HB TRP 101 HB2 TRP 101 15.020 7.175 -3.207 1556 2HB TRP 101 HB3 TRP 101 16.681 7.270 -3.750 1557 HD1 TRP 101 HD1 TRP 101 15.014 6.778 -6.900 1558 HE1 TRP 101 HE1 TRP 101 14.370 8.916 -8.051 1559 HE3 TRP 101 HE3 TRP 101 15.681 9.984 -2.962 1560 HZ2 TRP 101 HZ2 TRP 101 14.231 11.758 -7.382 1561 HZ3 TRP 101 HZ3 TRP 101 15.252 12.406 -3.261 1562 HH2 TRP 101 HH2 TRP 101 14.516 13.298 -5.449 1563 H GLY 102 HN GLY 102 15.063 5.304 -1.910 1564 1HA GLY 102 HA2 GLY 102 17.648 4.537 -0.922 1565 2HA GLY 102 HA3 GLY 102 16.136 4.590 0.001 1566 H PHE 103 HN PHE 103 14.551 2.797 -1.252 1567 HA PHE 103 HA PHE 103 13.967 0.689 -1.466 1568 1HB PHE 103 HB2 PHE 103 15.569 1.054 -3.452 1569 2HB PHE 103 HB3 PHE 103 16.666 -0.019 -2.598 1570 HD1 PHE 103 HD1 PHE 103 13.192 0.277 -3.986 1571 HD2 PHE 103 HD2 PHE 103 16.347 -2.413 -2.791 1572 HE1 PHE 103 HE1 PHE 103 11.928 -1.633 -4.941 1573 HE2 PHE 103 HE2 PHE 103 15.081 -4.318 -3.753 1574 HZ PHE 103 HZ PHE 103 12.868 -3.935 -4.824 1575 H ASP 104 HN ASP 104 15.156 1.464 1.130 1576 HA ASP 104 HA ASP 104 15.449 -1.183 2.305 1577 1HB ASP 104 HB2 ASP 104 17.788 -0.548 1.540 1578 2HB ASP 104 HB3 ASP 104 17.693 0.862 2.595 1579 H ASP 105 HN ASP 105 15.757 -0.792 4.816 1580 HA ASP 105 HA ASP 105 14.469 1.727 5.717 1581 1HB ASP 105 HB2 ASP 105 12.643 0.210 5.534 1582 2HB ASP 105 HB3 ASP 105 13.521 -1.059 6.384 1583 HA PRO 106 HA PRO 106 18.185 0.981 8.180 1584 1HB PRO 106 HB2 PRO 106 18.393 3.431 9.385 1585 2HB PRO 106 HB3 PRO 106 18.797 3.131 7.673 1586 1HG PRO 106 HG2 PRO 106 16.292 4.356 8.832 1587 2HG PRO 106 HG3 PRO 106 17.182 4.806 7.340 1588 1HD PRO 106 HD2 PRO 106 14.911 3.190 7.453 1589 2HD PRO 106 HD3 PRO 106 16.073 3.210 6.097 1590 H ALA 107 HN ALA 107 14.988 1.800 9.483 1591 HA ALA 107 HA ALA 107 15.656 1.420 12.238 1592 1HB ALA 107 HB1 ALA 107 12.953 1.131 10.898 1593 2HB ALA 107 HB2 ALA 107 13.274 1.517 12.595 1594 3HB ALA 107 HB3 ALA 107 13.665 2.713 11.334 1595 H ARG 108 HN ARG 108 16.101 -0.716 9.914 1596 HA ARG 108 HA ARG 108 15.149 -3.096 11.475 1597 1HB ARG 108 HB2 ARG 108 15.809 -3.142 8.545 1598 2HB ARG 108 HB3 ARG 108 14.921 -4.332 9.497 1599 1HG ARG 108 HG2 ARG 108 13.943 -1.618 8.598 1600 2HG ARG 108 HG3 ARG 108 13.455 -3.178 7.934 1601 1HD ARG 108 HD2 ARG 108 12.810 -2.008 10.639 1602 2HD ARG 108 HD3 ARG 108 11.677 -2.405 9.348 1603 HE ARG 108 HE ARG 108 12.092 -4.767 9.751 1604 1HH1 ARG 108 HH21 ARG 108 13.128 -2.594 12.416 1605 2HH1 ARG 108 HH22 ARG 108 12.860 -3.789 13.630 1606 1HH2 ARG 108 HH11 ARG 108 11.837 -6.332 11.391 1607 2HH2 ARG 108 HH12 ARG 108 12.167 -5.953 13.036 1608 H ALA 109 HN ALA 109 17.747 -1.307 11.231 1609 HA ALA 109 HA ALA 109 19.909 -2.758 10.421 1610 1HB ALA 109 HB1 ALA 109 19.882 -0.458 11.531 1611 2HB ALA 109 HB2 ALA 109 19.742 -1.297 13.091 1612 3HB ALA 109 HB3 ALA 109 21.175 -1.552 12.077 1613 H GLN 110 HN GLN 110 21.352 -4.174 11.437 1614 HA GLN 110 HA GLN 110 20.134 -6.471 12.361 1615 1HB GLN 110 HB2 GLN 110 22.357 -6.510 11.317 1616 2HB GLN 110 HB3 GLN 110 23.041 -5.578 12.656 1617 1HG GLN 110 HG2 GLN 110 23.704 -7.918 12.773 1618 2HG GLN 110 HG3 GLN 110 22.811 -7.412 14.193 1619 1HE2 GLN 110 HE22 GLN 110 20.574 -8.192 14.483 1620 2HE2 GLN 110 HE21 GLN 110 20.100 -9.695 13.707 1621 H GLY 111 HN GLY 111 21.822 -3.970 14.281 1622 1HA GLY 111 HA2 GLY 111 20.329 -3.457 16.220 1623 2HA GLY 111 HA3 GLY 111 20.586 -5.180 16.682 1624 H THR 112 HN THR 112 23.478 -4.728 15.703 1625 HA THR 112 HA THR 112 24.551 -4.289 18.368 1626 HB THR 112 HB THR 112 26.727 -4.637 17.362 1627 HG1 THR 112 HG1 THR 112 26.870 -4.924 15.100 1628 1HG2 THR 112 HG21 THR 112 24.809 -6.489 15.919 1629 2HG2 THR 112 HG22 THR 112 26.465 -6.832 16.469 1630 3HG2 THR 112 HG23 THR 112 25.167 -6.603 17.670 1631 H GLU 113 HN GLU 113 26.230 -2.592 18.777 1632 HA GLU 113 HA GLU 113 25.113 -0.092 18.351 1633 1HB GLU 113 HB2 GLU 113 28.026 -0.831 18.954 1634 2HB GLU 113 HB3 GLU 113 27.315 0.777 19.230 1635 1HG GLU 113 HG2 GLU 113 25.650 -0.290 20.791 1636 2HG GLU 113 HG3 GLU 113 26.499 -1.824 20.591 1637 H GLU 114 HN GLU 114 27.659 -1.776 16.572 1638 HA GLU 114 HA GLU 114 28.318 0.422 14.852 1639 1HB GLU 114 HB2 GLU 114 29.488 -1.476 13.560 1640 2HB GLU 114 HB3 GLU 114 30.103 -1.066 15.174 1641 1HG GLU 114 HG2 GLU 114 28.813 -3.027 16.086 1642 2HG GLU 114 HG3 GLU 114 28.350 -3.414 14.411 1643 H GLU 115 HN GLU 115 26.108 -2.533 14.605 1644 HA GLU 115 HA GLU 115 25.860 -1.989 11.784 1645 1HB GLU 115 HB2 GLU 115 24.384 -3.846 13.640 1646 2HB GLU 115 HB3 GLU 115 24.030 -3.698 11.917 1647 1HG GLU 115 HG2 GLU 115 26.884 -4.236 12.829 1648 2HG GLU 115 HG3 GLU 115 25.709 -5.548 12.714 1649 H LYS 116 HN LYS 116 24.084 -1.045 14.708 1650 HA LYS 116 HA LYS 116 21.836 0.105 13.352 1651 1HB LYS 116 HB2 LYS 116 23.150 0.890 15.996 1652 2HB LYS 116 HB3 LYS 116 21.629 1.538 15.406 1653 1HG LYS 116 HG2 LYS 116 21.409 -1.349 15.387 1654 2HG LYS 116 HG3 LYS 116 22.142 -0.853 16.908 1655 1HD LYS 116 HD2 LYS 116 19.914 -0.914 17.430 1656 2HD LYS 116 HD3 LYS 116 20.218 0.809 17.189 1657 1HE LYS 116 HE2 LYS 116 19.250 0.628 14.878 1658 2HE LYS 116 HE3 LYS 116 19.027 -1.117 15.136 1659 1HZ LYS 116 HZ1 LYS 116 16.976 0.114 15.542 1660 2HZ LYS 116 HZ2 LYS 116 17.469 -0.609 16.912 1661 3HZ LYS 116 HZ3 LYS 116 17.675 0.997 16.722 1662 H TRP 117 HN TRP 117 24.863 1.650 14.530 1663 HA TRP 117 HA TRP 117 24.173 4.119 13.301 1664 1HB TRP 117 HB2 TRP 117 25.959 3.590 15.112 1665 2HB TRP 117 HB3 TRP 117 27.043 3.257 13.768 1666 HD1 TRP 117 HD1 TRP 117 25.951 5.841 11.999 1667 HE1 TRP 117 HE1 TRP 117 26.670 8.171 12.641 1668 HE3 TRP 117 HE3 TRP 117 27.338 4.902 16.848 1669 HZ2 TRP 117 HZ2 TRP 117 27.827 9.461 14.921 1670 HZ3 TRP 117 HZ3 TRP 117 28.279 6.730 18.234 1671 HH2 TRP 117 HH2 TRP 117 28.549 9.019 17.288 1672 H ALA 118 HN ALA 118 25.997 1.291 12.059 1673 HA ALA 118 HA ALA 118 26.820 2.489 9.650 1674 1HB ALA 118 HB1 ALA 118 26.203 -0.435 10.336 1675 2HB ALA 118 HB2 ALA 118 27.144 0.093 8.921 1676 3HB ALA 118 HB3 ALA 118 27.758 0.360 10.570 1677 H PHE 119 HN PHE 119 23.767 0.711 10.357 1678 HA PHE 119 HA PHE 119 22.828 0.846 7.637 1679 1HB PHE 119 HB2 PHE 119 21.598 0.294 10.315 1680 2HB PHE 119 HB3 PHE 119 20.524 0.784 9.029 1681 HD1 PHE 119 HD1 PHE 119 23.423 -1.656 9.345 1682 HD2 PHE 119 HD2 PHE 119 19.416 -0.916 7.917 1683 HE1 PHE 119 HE1 PHE 119 23.260 -3.999 8.574 1684 HE2 PHE 119 HE2 PHE 119 19.269 -3.254 7.133 1685 HZ PHE 119 HZ PHE 119 21.183 -4.811 7.468 1686 H PHE 120 HN PHE 120 22.385 2.928 10.549 1687 HA PHE 120 HA PHE 120 20.584 4.769 9.400 1688 1HB PHE 120 HB2 PHE 120 22.777 5.428 11.401 1689 2HB PHE 120 HB3 PHE 120 21.292 6.309 11.110 1690 HD1 PHE 120 HD1 PHE 120 19.785 3.270 11.108 1691 HD2 PHE 120 HD2 PHE 120 22.159 5.678 13.790 1692 HE1 PHE 120 HE1 PHE 120 18.673 2.217 13.029 1693 HE2 PHE 120 HE2 PHE 120 21.040 4.608 15.725 1694 HZ PHE 120 HZ PHE 120 19.276 2.901 15.356 1695 H GLN 121 HN GLN 121 24.179 4.874 9.578 1696 HA GLN 121 HA GLN 121 24.455 7.345 8.292 1697 1HB GLN 121 HB2 GLN 121 26.098 6.305 9.759 1698 2HB GLN 121 HB3 GLN 121 26.435 5.047 8.559 1699 1HG GLN 121 HG2 GLN 121 27.345 6.657 7.010 1700 2HG GLN 121 HG3 GLN 121 26.725 8.015 7.964 1701 1HE2 GLN 121 HE22 GLN 121 27.530 8.150 10.330 1702 2HE2 GLN 121 HE21 GLN 121 29.225 7.768 10.576 1703 H ARG 122 HN ARG 122 24.757 3.969 6.922 1704 HA ARG 122 HA ARG 122 25.465 4.948 4.353 1705 1HB ARG 122 HB2 ARG 122 25.858 2.622 5.155 1706 2HB ARG 122 HB3 ARG 122 24.121 2.317 5.032 1707 1HG ARG 122 HG2 ARG 122 25.146 1.450 3.073 1708 2HG ARG 122 HG3 ARG 122 24.236 2.879 2.597 1709 1HD ARG 122 HD2 ARG 122 27.201 3.114 3.184 1710 2HD ARG 122 HD3 ARG 122 26.687 2.387 1.671 1711 HE ARG 122 HE ARG 122 26.697 5.182 2.318 1712 1HH1 ARG 122 HH21 ARG 122 24.961 2.778 0.302 1713 2HH1 ARG 122 HH22 ARG 122 24.489 4.003 -0.864 1714 1HH2 ARG 122 HH11 ARG 122 26.052 6.708 0.615 1715 2HH2 ARG 122 HH12 ARG 122 25.057 6.060 -0.689 1716 H VAL 123 HN VAL 123 22.220 4.098 5.731 1717 HA VAL 123 HA VAL 123 20.947 4.584 3.199 1718 HB VAL 123 HB VAL 123 19.791 4.392 6.000 1719 1HG1 VAL 123 HG11 VAL 123 17.648 3.855 4.754 1720 2HG1 VAL 123 HG12 VAL 123 18.161 5.537 4.623 1721 3HG1 VAL 123 HG13 VAL 123 18.429 4.419 3.267 1722 1HG2 VAL 123 HG21 VAL 123 20.933 2.304 5.167 1723 2HG2 VAL 123 HG22 VAL 123 19.186 2.093 5.290 1724 3HG2 VAL 123 HG23 VAL 123 19.941 2.366 3.705 1725 H ARG 124 HN ARG 124 21.453 6.738 6.121 1726 HA ARG 124 HA ARG 124 19.952 8.858 4.916 1727 1HB ARG 124 HB2 ARG 124 20.649 10.244 6.628 1728 2HB ARG 124 HB3 ARG 124 20.587 8.642 7.321 1729 1HG ARG 124 HG2 ARG 124 22.440 9.406 8.312 1730 2HG ARG 124 HG3 ARG 124 23.184 8.613 6.950 1731 1HD ARG 124 HD2 ARG 124 22.532 11.500 6.535 1732 2HD ARG 124 HD3 ARG 124 23.635 11.200 7.847 1733 HE ARG 124 HE ARG 124 24.105 10.656 4.973 1734 1HH1 ARG 124 HH11 ARG 124 25.426 10.361 8.257 1735 2HH1 ARG 124 HH12 ARG 124 27.060 10.677 7.767 1736 1HH2 ARG 124 HH21 ARG 124 26.389 10.722 4.284 1737 2HH2 ARG 124 HH22 ARG 124 27.588 10.798 5.504 1738 H ASP 125 HN ASP 125 23.332 7.867 4.598 1739 HA ASP 125 HA ASP 125 24.204 10.140 3.097 1740 1HB ASP 125 HB2 ASP 125 25.703 8.449 4.175 1741 2HB ASP 125 HB3 ASP 125 25.216 7.267 2.958 1742 H GLU 126 HN GLU 126 22.878 6.960 2.038 1743 HA GLU 126 HA GLU 126 23.043 7.509 -0.739 1744 1HB GLU 126 HB2 GLU 126 22.629 5.257 0.419 1745 2HB GLU 126 HB3 GLU 126 20.972 5.770 0.684 1746 1HG GLU 126 HG2 GLU 126 21.094 4.356 -1.286 1747 2HG GLU 126 HG3 GLU 126 20.630 5.987 -1.761 1748 H ILE 127 HN ILE 127 20.360 7.949 1.600 1749 HA ILE 127 HA ILE 127 18.421 9.079 -0.079 1750 HB ILE 127 HB ILE 127 19.110 9.247 2.863 1751 1HG1 ILE 127 HG12 ILE 127 16.625 8.321 1.379 1752 2HG1 ILE 127 HG13 ILE 127 17.962 7.249 1.798 1753 1HG2 ILE 127 HG21 ILE 127 17.090 10.554 3.331 1754 2HG2 ILE 127 HG22 ILE 127 18.265 11.494 2.438 1755 3HG2 ILE 127 HG23 ILE 127 16.867 10.814 1.576 1756 1HD1 ILE 127 HD11 ILE 127 17.490 7.759 4.244 1757 2HD1 ILE 127 HD12 ILE 127 16.029 8.619 3.711 1758 3HD1 ILE 127 HD13 ILE 127 16.195 6.891 3.375 1759 H GLY 128 HN GLY 128 20.985 10.820 1.816 1760 1HA GLY 128 HA2 GLY 128 20.316 13.386 0.885 1761 2HA GLY 128 HA3 GLY 128 21.913 12.865 1.493 1762 H ASN 129 HN ASN 129 22.678 11.005 -0.513 1763 HA ASN 129 HA ASN 129 23.573 12.787 -2.527 1764 1HB ASN 129 HB2 ASN 129 24.825 10.737 -2.000 1765 2HB ASN 129 HB3 ASN 129 23.467 9.738 -2.537 1766 1HD2 ASN 129 HD22 ASN 129 23.459 9.135 -4.731 1767 2HD2 ASN 129 HD21 ASN 129 24.258 10.047 -6.005 1768 H ARG 130 HN ARG 130 20.803 10.502 -2.525 1769 HA ARG 130 HA ARG 130 20.241 11.134 -5.333 1770 1HB ARG 130 HB2 ARG 130 18.400 9.822 -3.298 1771 2HB ARG 130 HB3 ARG 130 18.158 9.903 -5.045 1772 1HG ARG 130 HG2 ARG 130 20.292 8.356 -3.546 1773 2HG ARG 130 HG3 ARG 130 18.989 7.704 -4.520 1774 1HD ARG 130 HD2 ARG 130 20.054 8.427 -6.571 1775 2HD ARG 130 HD3 ARG 130 21.248 9.394 -5.685 1776 HE ARG 130 HE ARG 130 21.493 6.760 -4.739 1777 1HH1 ARG 130 HH11 ARG 130 22.267 8.670 -7.678 1778 2HH1 ARG 130 HH12 ARG 130 23.441 7.515 -8.215 1779 1HH2 ARG 130 HH21 ARG 130 23.087 5.491 -5.287 1780 2HH2 ARG 130 HH22 ARG 130 23.980 5.625 -6.793 1781 H LEU 131 HN LEU 131 19.160 12.533 -2.224 1782 HA LEU 131 HA LEU 131 17.291 14.303 -3.461 1783 1HB LEU 131 HB2 LEU 131 18.806 14.264 -0.847 1784 2HB LEU 131 HB3 LEU 131 18.286 15.835 -1.407 1785 HG LEU 131 HG LEU 131 16.641 15.090 0.054 1786 1HD1 LEU 131 HD11 LEU 131 15.385 14.581 -2.672 1787 2HD1 LEU 131 HD12 LEU 131 14.661 15.290 -1.240 1788 3HD1 LEU 131 HD13 LEU 131 15.894 16.189 -2.122 1789 1HD2 LEU 131 HD21 LEU 131 15.373 12.998 -0.204 1790 2HD2 LEU 131 HD22 LEU 131 16.517 12.478 -1.468 1791 3HD2 LEU 131 HD23 LEU 131 17.075 12.766 0.185 1792 H LYS 132 HN LYS 132 20.814 14.721 -2.788 1793 HA LYS 132 HA LYS 132 20.752 17.356 -3.875 1794 1HB LYS 132 HB2 LYS 132 22.925 17.537 -3.357 1795 2HB LYS 132 HB3 LYS 132 22.456 16.222 -2.278 1796 1HG LYS 132 HG2 LYS 132 23.369 14.647 -4.096 1797 2HG LYS 132 HG3 LYS 132 24.062 16.089 -4.848 1798 1HD LYS 132 HD2 LYS 132 24.565 15.119 -1.993 1799 2HD LYS 132 HD3 LYS 132 25.650 14.847 -3.371 1800 1HE LYS 132 HE2 LYS 132 25.854 17.348 -3.627 1801 2HE LYS 132 HE3 LYS 132 24.875 17.540 -2.164 1802 1HZ LYS 132 HZ1 LYS 132 27.502 16.164 -2.288 1803 2HZ LYS 132 HZ2 LYS 132 27.250 17.651 -1.683 1804 3HZ LYS 132 HZ3 LYS 132 26.607 16.354 -0.934 1805 H GLU 133 HN GLU 133 21.515 14.181 -5.386 1806 HA GLU 133 HA GLU 133 22.026 15.228 -7.985 1807 1HB GLU 133 HB2 GLU 133 20.803 12.604 -7.030 1808 2HB GLU 133 HB3 GLU 133 20.796 13.023 -8.762 1809 1HG GLU 133 HG2 GLU 133 23.086 13.064 -8.956 1810 2HG GLU 133 HG3 GLU 133 23.370 13.164 -7.208 1811 H PHE 134 HN PHE 134 18.799 14.434 -6.421 1812 HA PHE 134 HA PHE 134 17.375 15.064 -8.770 1813 1HB PHE 134 HB2 PHE 134 16.275 13.925 -7.039 1814 2HB PHE 134 HB3 PHE 134 16.713 15.118 -5.829 1815 HD1 PHE 134 HD1 PHE 134 14.780 15.998 -4.903 1816 HD2 PHE 134 HD2 PHE 134 15.015 15.533 -9.182 1817 HE1 PHE 134 HE1 PHE 134 12.544 17.034 -5.148 1818 HE2 PHE 134 HE2 PHE 134 12.765 16.545 -9.419 1819 HZ PHE 134 HZ PHE 134 11.515 17.272 -7.394 1820 H ALA 135 HN ALA 135 18.547 17.224 -6.188 1821 HA ALA 135 HA ALA 135 17.390 19.610 -7.163 1822 1HB ALA 135 HB1 ALA 135 18.535 19.298 -4.931 1823 2HB ALA 135 HB2 ALA 135 20.092 19.339 -5.780 1824 3HB ALA 135 HB3 ALA 135 19.020 20.758 -5.817 1825 H GLU 136 HN GLU 136 20.322 17.897 -8.159 1826 HA GLU 136 HA GLU 136 21.356 20.031 -9.795 1827 1HB GLU 136 HB2 GLU 136 22.136 17.121 -9.391 1828 2HB GLU 136 HB3 GLU 136 23.049 18.214 -10.410 1829 1HG GLU 136 HG2 GLU 136 22.559 18.960 -7.516 1830 2HG GLU 136 HG3 GLU 136 23.734 17.714 -7.922 1831 H THR 137 HN THR 137 19.884 16.886 -10.322 1832 HA THR 137 HA THR 137 20.194 16.931 -13.225 1833 HB THR 137 HB THR 137 19.434 14.576 -12.993 1834 HG1 THR 137 HG1 THR 137 19.211 15.031 -10.240 1835 1HG2 THR 137 HG21 THR 137 21.520 15.303 -10.890 1836 2HG2 THR 137 HG22 THR 137 21.184 13.680 -11.500 1837 3HG2 THR 137 HG23 THR 137 21.799 14.931 -12.595 1838 H GLY 138 HN GLY 138 17.677 17.610 -10.879 1839 1HA GLY 138 HA2 GLY 138 15.475 18.106 -11.036 1840 2HA GLY 138 HA3 GLY 138 15.628 18.261 -12.808 1841 H LYS 139 HN LYS 139 16.808 15.317 -11.551 1842 HA LYS 139 HA LYS 139 16.386 13.305 -12.392 1843 1HB LYS 139 HB2 LYS 139 15.665 13.502 -9.966 1844 2HB LYS 139 HB3 LYS 139 13.992 13.580 -10.540 1845 1HG LYS 139 HG2 LYS 139 14.368 11.324 -9.963 1846 2HG LYS 139 HG3 LYS 139 14.429 11.373 -11.710 1847 1HD LYS 139 HD2 LYS 139 16.263 10.031 -11.245 1848 2HD LYS 139 HD3 LYS 139 17.047 11.576 -11.444 1849 1HE LYS 139 HE2 LYS 139 17.854 11.549 -9.343 1850 2HE LYS 139 HE3 LYS 139 16.227 11.342 -8.681 1851 1HZ LYS 139 HZ1 LYS 139 16.436 8.958 -9.221 1852 2HZ LYS 139 HZ2 LYS 139 18.025 9.176 -9.577 1853 3HZ LYS 139 HZ3 LYS 139 17.488 9.453 -8.049 Start of MODEL 11 1 1H MET 1 H1 MET 1 -24.533 -9.388 -8.006 2 2H MET 1 H2 MET 1 -23.650 -10.572 -7.273 3 3H MET 1 H3 MET 1 -25.265 -10.493 -7.024 4 HA MET 1 HA MET 1 -24.641 -12.273 -8.532 5 1HB MET 1 HB2 MET 1 -26.220 -10.035 -9.892 6 2HB MET 1 HB3 MET 1 -26.117 -11.711 -10.442 7 1HG MET 1 HG2 MET 1 -27.099 -12.437 -8.240 8 2HG MET 1 HG3 MET 1 -27.344 -10.727 -7.848 9 1HE MET 1 HE1 MET 1 -29.852 -11.162 -7.319 10 2HE MET 1 HE2 MET 1 -30.980 -11.968 -8.430 11 3HE MET 1 HE3 MET 1 -29.640 -12.886 -7.708 12 H ALA 2 HN ALA 2 -22.673 -12.688 -9.293 13 HA ALA 2 HA ALA 2 -20.855 -12.763 -10.490 14 1HB ALA 2 HB1 ALA 2 -20.648 -11.858 -12.720 15 2HB ALA 2 HB2 ALA 2 -22.265 -12.549 -12.515 16 3HB ALA 2 HB3 ALA 2 -22.033 -10.784 -12.470 17 H ILE 3 HN ILE 3 -18.936 -11.518 -11.203 18 HA ILE 3 HA ILE 3 -18.431 -9.200 -9.450 19 HB ILE 3 HB ILE 3 -16.713 -11.463 -10.532 20 1HG1 ILE 3 HG12 ILE 3 -15.855 -11.496 -8.196 21 2HG1 ILE 3 HG13 ILE 3 -16.957 -10.193 -7.771 22 1HG2 ILE 3 HG21 ILE 3 -14.710 -10.243 -9.754 23 2HG2 ILE 3 HG22 ILE 3 -15.485 -9.360 -11.065 24 3HG2 ILE 3 HG23 ILE 3 -15.726 -8.830 -9.379 25 1HD1 ILE 3 HD11 ILE 3 -18.870 -11.677 -8.080 26 2HD1 ILE 3 HD12 ILE 3 -17.767 -12.998 -8.584 27 3HD1 ILE 3 HD13 ILE 3 -17.671 -12.298 -6.947 28 H VAL 4 HN VAL 4 -18.909 -7.420 -10.494 29 HA VAL 4 HA VAL 4 -19.041 -7.216 -13.381 30 HB VAL 4 HB VAL 4 -19.589 -5.208 -11.183 31 1HG1 VAL 4 HG11 VAL 4 -20.477 -5.228 -14.099 32 2HG1 VAL 4 HG12 VAL 4 -21.150 -4.168 -12.847 33 3HG1 VAL 4 HG13 VAL 4 -19.469 -3.997 -13.288 34 1HG2 VAL 4 HG21 VAL 4 -21.983 -5.831 -11.533 35 2HG2 VAL 4 HG22 VAL 4 -21.466 -7.166 -12.579 36 3HG2 VAL 4 HG23 VAL 4 -21.048 -7.150 -10.849 37 H LYS 5 HN LYS 5 -18.053 -5.104 -14.330 38 HA LYS 5 HA LYS 5 -15.324 -4.643 -13.316 39 1HB LYS 5 HB2 LYS 5 -15.280 -6.127 -15.276 40 2HB LYS 5 HB3 LYS 5 -16.301 -5.011 -16.177 41 1HG LYS 5 HG2 LYS 5 -14.051 -4.817 -16.944 42 2HG LYS 5 HG3 LYS 5 -14.496 -3.311 -16.146 43 1HD LYS 5 HD2 LYS 5 -13.233 -3.963 -14.131 44 2HD LYS 5 HD3 LYS 5 -12.848 -5.539 -14.840 45 1HE LYS 5 HE2 LYS 5 -12.039 -2.829 -15.991 46 2HE LYS 5 HE3 LYS 5 -10.991 -3.846 -14.995 47 1HZ LYS 5 HZ1 LYS 5 -10.576 -4.105 -17.380 48 2HZ LYS 5 HZ2 LYS 5 -11.036 -5.531 -16.706 49 3HZ LYS 5 HZ3 LYS 5 -12.084 -4.667 -17.621 50 H ALA 6 HN ALA 6 -15.164 -2.567 -12.679 51 HA ALA 6 HA ALA 6 -17.067 -0.484 -13.557 52 1HB ALA 6 HB1 ALA 6 -16.594 -0.235 -11.292 53 2HB ALA 6 HB2 ALA 6 -14.890 -0.704 -11.480 54 3HB ALA 6 HB3 ALA 6 -15.465 0.876 -12.019 55 H THR 7 HN THR 7 -15.977 1.662 -14.096 56 HA THR 7 HA THR 7 -13.337 1.800 -15.035 57 HB THR 7 HB THR 7 -14.167 0.744 -17.050 58 HG1 THR 7 HG1 THR 7 -12.722 2.480 -17.303 59 1HG2 THR 7 HG21 THR 7 -16.532 1.134 -17.021 60 2HG2 THR 7 HG22 THR 7 -16.300 2.899 -17.167 61 3HG2 THR 7 HG23 THR 7 -15.878 1.813 -18.510 62 H ASP 8 HN ASP 8 -13.180 4.157 -16.023 63 HA ASP 8 HA ASP 8 -13.037 5.894 -14.084 64 1HB ASP 8 HB2 ASP 8 -12.141 6.317 -16.250 65 2HB ASP 8 HB3 ASP 8 -13.744 6.436 -16.971 66 H GLN 9 HN GLN 9 -16.166 5.607 -15.810 67 HA GLN 9 HA GLN 9 -17.368 7.363 -13.750 68 1HB GLN 9 HB2 GLN 9 -17.823 7.316 -16.744 69 2HB GLN 9 HB3 GLN 9 -18.955 8.088 -15.622 70 1HG GLN 9 HG2 GLN 9 -17.357 9.709 -14.907 71 2HG GLN 9 HG3 GLN 9 -16.008 8.819 -15.581 72 1HE2 GLN 9 HE22 GLN 9 -15.166 9.675 -17.396 73 2HE2 GLN 9 HE21 GLN 9 -16.061 10.595 -18.604 74 H SER 10 HN SER 10 -17.787 4.512 -15.889 75 HA SER 10 HA SER 10 -20.354 3.827 -15.006 76 1HB SER 10 HB2 SER 10 -18.176 1.858 -15.726 77 2HB SER 10 HB3 SER 10 -19.928 1.660 -15.899 78 HG SER 10 HG SER 10 -19.008 2.237 -17.892 79 H PHE 11 HN PHE 11 -17.300 3.598 -13.198 80 HA PHE 11 HA PHE 11 -18.007 1.727 -11.206 81 1HB PHE 11 HB2 PHE 11 -15.825 2.745 -11.097 82 2HB PHE 11 HB3 PHE 11 -16.490 4.352 -11.147 83 HD1 PHE 11 HD1 PHE 11 -16.061 1.342 -8.831 84 HD2 PHE 11 HD2 PHE 11 -17.142 5.535 -9.220 85 HE1 PHE 11 HE1 PHE 11 -15.951 1.637 -6.395 86 HE2 PHE 11 HE2 PHE 11 -17.062 5.770 -6.761 87 HZ PHE 11 HZ PHE 11 -16.464 3.819 -5.342 88 H SER 12 HN SER 12 -18.862 5.266 -11.401 89 HA SER 12 HA SER 12 -20.396 5.248 -9.033 90 1HB SER 12 HB2 SER 12 -20.908 6.950 -11.512 91 2HB SER 12 HB3 SER 12 -21.222 7.385 -9.827 92 HG SER 12 HG SER 12 -19.290 8.356 -10.609 93 H ALA 13 HN ALA 13 -21.294 4.709 -12.471 94 HA ALA 13 HA ALA 13 -24.053 4.710 -12.007 95 1HB ALA 13 HB1 ALA 13 -22.520 3.221 -14.187 96 2HB ALA 13 HB2 ALA 13 -24.233 3.684 -14.239 97 3HB ALA 13 HB3 ALA 13 -22.977 4.944 -14.234 98 H GLU 14 HN GLU 14 -21.689 2.053 -11.887 99 HA GLU 14 HA GLU 14 -23.612 -0.000 -11.396 100 1HB GLU 14 HB2 GLU 14 -20.590 0.120 -11.178 101 2HB GLU 14 HB3 GLU 14 -21.501 -1.337 -10.803 102 1HG GLU 14 HG2 GLU 14 -21.539 0.110 -13.471 103 2HG GLU 14 HG3 GLU 14 -20.635 -1.362 -13.109 104 H THR 15 HN THR 15 -22.312 2.421 -9.291 105 HA THR 15 HA THR 15 -22.729 0.704 -6.894 106 HB THR 15 HB THR 15 -21.091 2.200 -5.809 107 HG1 THR 15 HG1 THR 15 -20.433 3.133 -8.357 108 1HG2 THR 15 HG21 THR 15 -20.028 0.243 -6.626 109 2HG2 THR 15 HG22 THR 15 -20.137 0.754 -8.325 110 3HG2 THR 15 HG23 THR 15 -19.042 1.588 -7.226 111 H SER 16 HN SER 16 -24.231 3.221 -8.550 112 HA SER 16 HA SER 16 -24.927 4.914 -6.340 113 1HB SER 16 HB2 SER 16 -26.046 4.664 -9.154 114 2HB SER 16 HB3 SER 16 -26.505 5.927 -7.998 115 HG SER 16 HG SER 16 -23.885 5.412 -8.985 116 H GLU 17 HN GLU 17 -26.073 1.794 -6.967 117 HA GLU 17 HA GLU 17 -28.517 2.292 -5.449 118 1HB GLU 17 HB2 GLU 17 -28.422 0.899 -8.166 119 2HB GLU 17 HB3 GLU 17 -29.780 0.783 -7.041 120 1HG GLU 17 HG2 GLU 17 -30.058 3.270 -7.161 121 2HG GLU 17 HG3 GLU 17 -28.791 3.326 -8.393 122 H GLY 18 HN GLY 18 -29.304 0.329 -4.413 123 1HA GLY 18 HA2 GLY 18 -29.108 -1.618 -3.321 124 2HA GLY 18 HA3 GLY 18 -28.017 -2.200 -4.597 125 H VAL 19 HN VAL 19 -26.738 -3.187 -2.989 126 HA VAL 19 HA VAL 19 -24.805 -1.335 -1.707 127 HB VAL 19 HB VAL 19 -25.633 -4.004 -0.528 128 1HG1 VAL 19 HG11 VAL 19 -24.236 -3.276 1.389 129 2HG1 VAL 19 HG12 VAL 19 -23.275 -3.383 -0.082 130 3HG1 VAL 19 HG13 VAL 19 -23.803 -1.798 0.522 131 1HG2 VAL 19 HG21 VAL 19 -26.462 -1.168 0.131 132 2HG2 VAL 19 HG22 VAL 19 -27.485 -2.587 -0.121 133 3HG2 VAL 19 HG23 VAL 19 -26.522 -2.440 1.354 134 H VAL 20 HN VAL 20 -22.813 -1.565 -2.262 135 HA VAL 20 HA VAL 20 -22.162 -3.749 -4.140 136 HB VAL 20 HB VAL 20 -21.788 -0.783 -4.742 137 1HG1 VAL 20 HG11 VAL 20 -21.373 -1.679 -7.043 138 2HG1 VAL 20 HG12 VAL 20 -20.176 -2.244 -5.864 139 3HG1 VAL 20 HG13 VAL 20 -21.486 -3.325 -6.390 140 1HG2 VAL 20 HG21 VAL 20 -23.609 -1.205 -6.488 141 2HG2 VAL 20 HG22 VAL 20 -24.001 -2.684 -5.623 142 3HG2 VAL 20 HG23 VAL 20 -24.166 -1.105 -4.827 143 H LEU 21 HN LEU 21 -20.365 -4.579 -3.641 144 HA LEU 21 HA LEU 21 -18.302 -3.217 -1.977 145 1HB LEU 21 HB2 LEU 21 -19.109 -5.462 -1.311 146 2HB LEU 21 HB3 LEU 21 -18.694 -6.094 -2.900 147 HG LEU 21 HG LEU 21 -16.273 -5.678 -2.420 148 1HD1 LEU 21 HD11 LEU 21 -17.381 -4.756 0.274 149 2HD1 LEU 21 HD12 LEU 21 -15.694 -5.214 0.014 150 3HD1 LEU 21 HD13 LEU 21 -16.359 -3.839 -0.874 151 1HD2 LEU 21 HD21 LEU 21 -17.330 -7.863 -1.915 152 2HD2 LEU 21 HD22 LEU 21 -16.023 -7.484 -0.787 153 3HD2 LEU 21 HD23 LEU 21 -17.713 -7.300 -0.273 154 H ALA 22 HN ALA 22 -17.195 -1.831 -3.478 155 HA ALA 22 HA ALA 22 -16.346 -3.043 -6.027 156 1HB ALA 22 HB1 ALA 22 -15.452 -0.847 -6.608 157 2HB ALA 22 HB2 ALA 22 -17.100 -0.643 -6.023 158 3HB ALA 22 HB3 ALA 22 -15.720 -0.260 -4.950 159 H ASP 23 HN ASP 23 -14.136 -3.343 -6.510 160 HA ASP 23 HA ASP 23 -12.243 -3.495 -4.237 161 1HB ASP 23 HB2 ASP 23 -13.266 -5.681 -4.272 162 2HB ASP 23 HB3 ASP 23 -13.155 -5.765 -6.031 163 H PHE 24 HN PHE 24 -10.090 -3.461 -4.897 164 HA PHE 24 HA PHE 24 -9.557 -2.630 -7.716 165 1HB PHE 24 HB2 PHE 24 -8.646 -1.424 -5.090 166 2HB PHE 24 HB3 PHE 24 -7.993 -0.982 -6.653 167 HD1 PHE 24 HD1 PHE 24 -8.867 0.875 -7.735 168 HD2 PHE 24 HD2 PHE 24 -11.362 -1.146 -4.873 169 HE1 PHE 24 HE1 PHE 24 -10.678 2.560 -8.087 170 HE2 PHE 24 HE2 PHE 24 -13.167 0.476 -5.282 171 HZ PHE 24 HZ PHE 24 -12.824 2.357 -6.873 172 H TRP 25 HN TRP 25 -8.124 -4.018 -8.553 173 HA TRP 25 HA TRP 25 -6.266 -5.519 -6.780 174 1HB TRP 25 HB2 TRP 25 -6.740 -7.536 -7.842 175 2HB TRP 25 HB3 TRP 25 -8.324 -6.850 -7.571 176 HD1 TRP 25 HD1 TRP 25 -9.165 -5.338 -9.855 177 HE1 TRP 25 HE1 TRP 25 -9.079 -5.947 -12.317 178 HE3 TRP 25 HE3 TRP 25 -5.600 -9.002 -9.626 179 HZ2 TRP 25 HZ2 TRP 25 -7.312 -7.516 -14.050 180 HZ3 TRP 25 HZ3 TRP 25 -4.626 -9.920 -11.704 181 HH2 TRP 25 HH2 TRP 25 -5.475 -9.182 -13.920 182 H ALA 26 HN ALA 26 -4.321 -6.288 -8.077 183 HA ALA 26 HA ALA 26 -3.878 -4.988 -10.665 184 1HB ALA 26 HB1 ALA 26 -3.509 -3.271 -8.814 185 2HB ALA 26 HB2 ALA 26 -2.153 -4.265 -8.267 186 3HB ALA 26 HB3 ALA 26 -2.141 -3.544 -9.910 187 HA PRO 27 HA PRO 27 -0.783 -8.223 -11.013 188 1HB PRO 27 HB2 PRO 27 0.960 -6.070 -12.209 189 2HB PRO 27 HB3 PRO 27 0.658 -7.739 -12.794 190 1HG PRO 27 HG2 PRO 27 -0.623 -5.655 -13.960 191 2HG PRO 27 HG3 PRO 27 -1.544 -7.146 -13.564 192 1HD PRO 27 HD2 PRO 27 -1.411 -4.561 -12.000 193 2HD PRO 27 HD3 PRO 27 -2.832 -5.559 -12.435 194 H TRP 28 HN TRP 28 0.025 -5.121 -9.436 195 HA TRP 28 HA TRP 28 2.603 -5.436 -8.615 196 1HB TRP 28 HB2 TRP 28 0.417 -4.129 -7.034 197 2HB TRP 28 HB3 TRP 28 2.161 -3.867 -6.896 198 HD1 TRP 28 HD1 TRP 28 -0.751 -2.482 -8.565 199 HE1 TRP 28 HE1 TRP 28 -0.153 -0.905 -10.488 200 HE3 TRP 28 HE3 TRP 28 4.242 -3.518 -8.891 201 HZ2 TRP 28 HZ2 TRP 28 2.251 -0.072 -11.888 202 HZ3 TRP 28 HZ3 TRP 28 5.673 -2.296 -10.504 203 HH2 TRP 28 HH2 TRP 28 4.690 -0.573 -12.005 204 H CYS 29 HN CYS 29 -0.105 -7.131 -6.919 205 HA CYS 29 HA CYS 29 2.007 -8.545 -5.389 206 1HB CYS 29 HB2 CYS 29 0.781 -7.844 -3.224 207 2HB CYS 29 HB3 CYS 29 1.829 -6.695 -4.025 208 H GLY 30 HN GLY 30 1.167 -10.086 -3.821 209 1HA GLY 30 HA2 GLY 30 -0.260 -12.089 -5.118 210 2HA GLY 30 HA3 GLY 30 0.135 -12.039 -3.397 211 HA PRO 31 HA PRO 31 -3.984 -11.211 -2.083 212 1HB PRO 31 HB2 PRO 31 -3.807 -8.206 -2.119 213 2HB PRO 31 HB3 PRO 31 -4.572 -9.279 -0.898 214 1HG PRO 31 HG2 PRO 31 -2.079 -8.284 -0.452 215 2HG PRO 31 HG3 PRO 31 -2.405 -10.017 -0.118 216 1HD PRO 31 HD2 PRO 31 -1.082 -8.779 -2.536 217 2HD PRO 31 HD3 PRO 31 -0.601 -10.242 -1.621 218 H SER 32 HN SER 32 -3.195 -9.025 -4.861 219 HA SER 32 HA SER 32 -5.825 -8.720 -5.822 220 1HB SER 32 HB2 SER 32 -3.256 -9.159 -7.414 221 2HB SER 32 HB3 SER 32 -4.657 -8.217 -7.924 222 HG SER 32 HG SER 32 -2.717 -7.140 -7.023 223 H LYS 33 HN LYS 33 -3.941 -11.602 -5.696 224 HA LYS 33 HA LYS 33 -5.863 -12.937 -7.535 225 1HB LYS 33 HB2 LYS 33 -3.144 -14.055 -6.881 226 2HB LYS 33 HB3 LYS 33 -4.321 -14.558 -8.094 227 1HG LYS 33 HG2 LYS 33 -2.818 -13.481 -9.438 228 2HG LYS 33 HG3 LYS 33 -3.952 -12.161 -9.125 229 1HD LYS 33 HD2 LYS 33 -2.419 -11.353 -7.305 230 2HD LYS 33 HD3 LYS 33 -1.319 -12.688 -7.661 231 1HE LYS 33 HE2 LYS 33 -1.042 -11.793 -9.992 232 2HE LYS 33 HE3 LYS 33 -2.091 -10.430 -9.571 233 1HZ LYS 33 HZ1 LYS 33 -0.475 -9.856 -7.823 234 2HZ LYS 33 HZ2 LYS 33 0.521 -11.062 -8.320 235 3HZ LYS 33 HZ3 LYS 33 0.229 -9.796 -9.303 236 H MET 34 HN MET 34 -5.726 -12.345 -4.414 237 HA MET 34 HA MET 34 -6.652 -15.078 -3.618 238 1HB MET 34 HB2 MET 34 -5.281 -13.028 -1.837 239 2HB MET 34 HB3 MET 34 -5.967 -14.574 -1.329 240 1HG MET 34 HG2 MET 34 -4.393 -15.726 -2.924 241 2HG MET 34 HG3 MET 34 -3.603 -14.175 -3.204 242 1HE MET 34 HE1 MET 34 -1.922 -13.419 0.270 243 2HE MET 34 HE2 MET 34 -2.125 -12.893 -1.412 244 3HE MET 34 HE3 MET 34 -3.498 -12.816 -0.278 245 H ILE 35 HN ILE 35 -6.993 -11.507 -3.082 246 HA ILE 35 HA ILE 35 -9.566 -11.638 -1.941 247 HB ILE 35 HB ILE 35 -7.792 -9.671 -2.238 248 1HG1 ILE 35 HG12 ILE 35 -9.822 -8.034 -1.873 249 2HG1 ILE 35 HG13 ILE 35 -10.791 -9.514 -1.874 250 1HG2 ILE 35 HG21 ILE 35 -8.428 -7.963 -3.809 251 2HG2 ILE 35 HG22 ILE 35 -7.973 -9.433 -4.673 252 3HG2 ILE 35 HG23 ILE 35 -9.691 -8.991 -4.506 253 1HD1 ILE 35 HD11 ILE 35 -9.378 -10.426 -0.041 254 2HD1 ILE 35 HD12 ILE 35 -8.341 -8.986 -0.112 255 3HD1 ILE 35 HD13 ILE 35 -10.041 -8.840 0.410 256 H ALA 36 HN ALA 36 -8.428 -11.643 -5.331 257 HA ALA 36 HA ALA 36 -10.867 -11.284 -6.600 258 1HB ALA 36 HB1 ALA 36 -8.889 -11.144 -7.890 259 2HB ALA 36 HB2 ALA 36 -8.365 -12.783 -7.492 260 3HB ALA 36 HB3 ALA 36 -9.783 -12.534 -8.533 261 HA PRO 37 HA PRO 37 -11.822 -16.004 -6.576 262 1HB PRO 37 HB2 PRO 37 -10.452 -17.412 -4.494 263 2HB PRO 37 HB3 PRO 37 -10.250 -17.598 -6.267 264 1HG PRO 37 HG2 PRO 37 -8.590 -16.114 -4.299 265 2HG PRO 37 HG3 PRO 37 -8.097 -16.810 -5.866 266 1HD PRO 37 HD2 PRO 37 -8.450 -14.099 -5.470 267 2HD PRO 37 HD3 PRO 37 -8.707 -14.907 -7.031 268 H VAL 38 HN VAL 38 -10.793 -14.531 -3.458 269 HA VAL 38 HA VAL 38 -12.861 -15.517 -1.807 270 HB VAL 38 HB VAL 38 -10.929 -13.254 -1.830 271 1HG1 VAL 38 HG11 VAL 38 -11.687 -12.503 0.408 272 2HG1 VAL 38 HG12 VAL 38 -12.682 -12.048 -0.987 273 3HG1 VAL 38 HG13 VAL 38 -13.227 -13.354 0.086 274 1HG2 VAL 38 HG21 VAL 38 -10.100 -14.380 0.161 275 2HG2 VAL 38 HG22 VAL 38 -11.501 -15.475 0.165 276 3HG2 VAL 38 HG23 VAL 38 -10.308 -15.563 -1.149 277 H LEU 39 HN LEU 39 -12.864 -12.689 -4.027 278 HA LEU 39 HA LEU 39 -15.486 -11.826 -3.218 279 1HB LEU 39 HB2 LEU 39 -13.920 -11.420 -5.795 280 2HB LEU 39 HB3 LEU 39 -15.496 -10.709 -5.518 281 HG LEU 39 HG LEU 39 -13.127 -10.277 -3.625 282 1HD1 LEU 39 HD11 LEU 39 -12.516 -9.521 -5.884 283 2HD1 LEU 39 HD12 LEU 39 -13.959 -8.474 -5.923 284 3HD1 LEU 39 HD13 LEU 39 -12.666 -8.201 -4.728 285 1HD2 LEU 39 HD21 LEU 39 -15.601 -8.561 -3.961 286 2HD2 LEU 39 HD22 LEU 39 -15.320 -9.711 -2.647 287 3HD2 LEU 39 HD23 LEU 39 -14.262 -8.304 -2.851 288 H GLU 40 HN GLU 40 -14.353 -13.977 -5.909 289 HA GLU 40 HA GLU 40 -16.971 -14.317 -6.966 290 1HB GLU 40 HB2 GLU 40 -14.581 -16.176 -7.163 291 2HB GLU 40 HB3 GLU 40 -16.081 -16.270 -8.114 292 1HG GLU 40 HG2 GLU 40 -15.647 -14.032 -9.058 293 2HG GLU 40 HG3 GLU 40 -14.134 -13.931 -8.166 294 H GLU 41 HN GLU 41 -15.199 -16.074 -4.379 295 HA GLU 41 HA GLU 41 -17.249 -18.032 -4.019 296 1HB GLU 41 HB2 GLU 41 -14.932 -17.103 -2.299 297 2HB GLU 41 HB3 GLU 41 -16.004 -18.420 -1.837 298 1HG GLU 41 HG2 GLU 41 -14.366 -18.370 -4.401 299 2HG GLU 41 HG3 GLU 41 -13.884 -19.189 -2.918 300 H LEU 42 HN LEU 42 -16.945 -14.714 -3.033 301 HA LEU 42 HA LEU 42 -18.852 -14.887 -0.804 302 1HB LEU 42 HB2 LEU 42 -17.017 -13.195 -0.835 303 2HB LEU 42 HB3 LEU 42 -17.612 -12.563 -2.359 304 HG LEU 42 HG LEU 42 -19.751 -11.874 -1.225 305 1HD1 LEU 42 HD11 LEU 42 -18.127 -12.602 1.251 306 2HD1 LEU 42 HD12 LEU 42 -19.638 -11.663 1.243 307 3HD1 LEU 42 HD13 LEU 42 -19.654 -13.364 0.755 308 1HD2 LEU 42 HD21 LEU 42 -17.158 -10.725 -0.104 309 2HD2 LEU 42 HD22 LEU 42 -17.908 -10.279 -1.648 310 3HD2 LEU 42 HD23 LEU 42 -18.741 -9.917 -0.130 311 H ASP 43 HN ASP 43 -18.816 -13.783 -4.242 312 HA ASP 43 HA ASP 43 -21.539 -12.949 -4.158 313 1HB ASP 43 HB2 ASP 43 -19.959 -12.129 -5.868 314 2HB ASP 43 HB3 ASP 43 -19.764 -13.766 -6.498 315 H GLN 44 HN GLN 44 -19.971 -16.023 -5.014 316 HA GLN 44 HA GLN 44 -22.287 -17.389 -5.914 317 1HB GLN 44 HB2 GLN 44 -19.714 -18.233 -4.557 318 2HB GLN 44 HB3 GLN 44 -20.962 -19.434 -4.938 319 1HG GLN 44 HG2 GLN 44 -20.895 -18.893 -7.289 320 2HG GLN 44 HG3 GLN 44 -19.805 -17.535 -6.991 321 1HE2 GLN 44 HE22 GLN 44 -17.650 -17.971 -6.267 322 2HE2 GLN 44 HE21 GLN 44 -16.895 -19.566 -6.301 323 H GLU 45 HN GLU 45 -21.388 -16.357 -2.682 324 HA GLU 45 HA GLU 45 -23.209 -18.256 -1.477 325 1HB GLU 45 HB2 GLU 45 -21.294 -18.404 -0.283 326 2HB GLU 45 HB3 GLU 45 -20.796 -16.744 -0.643 327 1HG GLU 45 HG2 GLU 45 -22.194 -15.813 0.956 328 2HG GLU 45 HG3 GLU 45 -23.071 -17.332 1.243 329 H MET 46 HN MET 46 -22.728 -14.748 -1.689 330 HA MET 46 HA MET 46 -25.531 -14.357 -0.762 331 1HB MET 46 HB2 MET 46 -24.711 -12.492 0.600 332 2HB MET 46 HB3 MET 46 -24.221 -14.092 1.154 333 1HG MET 46 HG2 MET 46 -21.979 -13.786 0.233 334 2HG MET 46 HG3 MET 46 -22.422 -12.242 -0.483 335 1HE MET 46 HE1 MET 46 -24.134 -10.680 1.599 336 2HE MET 46 HE2 MET 46 -22.743 -9.843 2.401 337 3HE MET 46 HE3 MET 46 -22.704 -10.181 0.652 338 H GLY 47 HN GLY 47 -23.831 -14.081 -3.427 339 1HA GLY 47 HA2 GLY 47 -24.097 -11.327 -4.180 340 2HA GLY 47 HA3 GLY 47 -23.973 -12.744 -5.263 341 H ASP 48 HN ASP 48 -26.488 -13.496 -3.438 342 HA ASP 48 HA ASP 48 -28.516 -12.683 -5.309 343 1HB ASP 48 HB2 ASP 48 -28.765 -14.764 -4.041 344 2HB ASP 48 HB3 ASP 48 -28.674 -13.880 -2.518 345 H LYS 49 HN LYS 49 -27.051 -11.297 -2.462 346 HA LYS 49 HA LYS 49 -29.115 -9.230 -2.336 347 1HB LYS 49 HB2 LYS 49 -26.973 -9.663 -0.268 348 2HB LYS 49 HB3 LYS 49 -28.551 -8.887 -0.120 349 1HG LYS 49 HG2 LYS 49 -29.084 -10.794 0.921 350 2HG LYS 49 HG3 LYS 49 -29.410 -11.372 -0.727 351 1HD LYS 49 HD2 LYS 49 -27.453 -12.695 -0.786 352 2HD LYS 49 HD3 LYS 49 -26.627 -11.638 0.379 353 1HE LYS 49 HE2 LYS 49 -27.000 -13.587 1.556 354 2HE LYS 49 HE3 LYS 49 -28.113 -12.355 2.160 355 1HZ LYS 49 HZ1 LYS 49 -29.892 -13.419 0.859 356 2HZ LYS 49 HZ2 LYS 49 -28.861 -14.577 0.327 357 3HZ LYS 49 HZ3 LYS 49 -29.240 -14.480 1.904 358 H LEU 50 HN LEU 50 -25.750 -9.844 -3.030 359 HA LEU 50 HA LEU 50 -24.978 -7.006 -2.774 360 1HB LEU 50 HB2 LEU 50 -23.946 -8.561 -1.188 361 2HB LEU 50 HB3 LEU 50 -23.502 -9.649 -2.502 362 HG LEU 50 HG LEU 50 -21.892 -7.964 -3.365 363 1HD1 LEU 50 HD11 LEU 50 -22.633 -6.452 -0.813 364 2HD1 LEU 50 HD12 LEU 50 -21.279 -6.060 -1.903 365 3HD1 LEU 50 HD13 LEU 50 -22.932 -5.899 -2.468 366 1HD2 LEU 50 HD21 LEU 50 -21.464 -8.699 -0.456 367 2HD2 LEU 50 HD22 LEU 50 -21.204 -9.780 -1.844 368 3HD2 LEU 50 HD23 LEU 50 -20.215 -8.320 -1.660 369 H LYS 51 HN LYS 51 -23.593 -6.091 -4.321 370 HA LYS 51 HA LYS 51 -23.024 -7.668 -6.797 371 1HB LYS 51 HB2 LYS 51 -24.621 -5.954 -7.426 372 2HB LYS 51 HB3 LYS 51 -23.726 -4.717 -6.538 373 1HG LYS 51 HG2 LYS 51 -21.847 -4.863 -8.081 374 2HG LYS 51 HG3 LYS 51 -22.576 -6.221 -8.934 375 1HD LYS 51 HD2 LYS 51 -23.995 -3.538 -8.746 376 2HD LYS 51 HD3 LYS 51 -22.697 -3.799 -9.918 377 1HE LYS 51 HE2 LYS 51 -23.862 -5.705 -10.909 378 2HE LYS 51 HE3 LYS 51 -25.174 -5.567 -9.723 379 1HZ LYS 51 HZ1 LYS 51 -25.702 -4.507 -11.861 380 2HZ LYS 51 HZ2 LYS 51 -25.715 -3.406 -10.654 381 3HZ LYS 51 HZ3 LYS 51 -24.444 -3.464 -11.691 382 H ILE 52 HN ILE 52 -20.871 -7.341 -7.612 383 HA ILE 52 HA ILE 52 -19.001 -5.997 -5.751 384 HB ILE 52 HB ILE 52 -18.741 -8.753 -7.034 385 1HG1 ILE 52 HG12 ILE 52 -18.852 -7.933 -4.100 386 2HG1 ILE 52 HG13 ILE 52 -20.129 -8.754 -4.995 387 1HG2 ILE 52 HG21 ILE 52 -16.693 -7.156 -5.432 388 2HG2 ILE 52 HG22 ILE 52 -16.507 -8.840 -5.966 389 3HG2 ILE 52 HG23 ILE 52 -16.586 -7.573 -7.159 390 1HD1 ILE 52 HD11 ILE 52 -18.412 -10.634 -5.410 391 2HD1 ILE 52 HD12 ILE 52 -17.498 -9.899 -4.085 392 3HD1 ILE 52 HD13 ILE 52 -19.146 -10.483 -3.801 393 H VAL 53 HN VAL 53 -17.321 -4.889 -6.916 394 HA VAL 53 HA VAL 53 -17.461 -5.087 -9.883 395 HB VAL 53 HB VAL 53 -17.493 -2.422 -8.418 396 1HG1 VAL 53 HG11 VAL 53 -16.630 -2.441 -10.701 397 2HG1 VAL 53 HG12 VAL 53 -18.104 -3.238 -11.296 398 3HG1 VAL 53 HG13 VAL 53 -18.193 -1.593 -10.636 399 1HG2 VAL 53 HG21 VAL 53 -19.843 -2.123 -8.985 400 2HG2 VAL 53 HG22 VAL 53 -19.949 -3.780 -9.605 401 3HG2 VAL 53 HG23 VAL 53 -19.645 -3.489 -7.889 402 H LYS 54 HN LYS 54 -15.392 -5.375 -10.651 403 HA LYS 54 HA LYS 54 -13.101 -4.778 -8.899 404 1HB LYS 54 HB2 LYS 54 -13.234 -5.915 -11.730 405 2HB LYS 54 HB3 LYS 54 -11.786 -5.846 -10.735 406 1HG LYS 54 HG2 LYS 54 -14.282 -7.393 -10.038 407 2HG LYS 54 HG3 LYS 54 -12.922 -8.097 -10.886 408 1HD LYS 54 HD2 LYS 54 -12.851 -6.943 -8.065 409 2HD LYS 54 HD3 LYS 54 -12.973 -8.650 -8.456 410 1HE LYS 54 HE2 LYS 54 -10.607 -6.821 -9.049 411 2HE LYS 54 HE3 LYS 54 -10.686 -8.039 -7.799 412 1HZ LYS 54 HZ1 LYS 54 -10.744 -8.600 -10.717 413 2HZ LYS 54 HZ2 LYS 54 -9.503 -8.887 -9.703 414 3HZ LYS 54 HZ3 LYS 54 -10.889 -9.743 -9.554 415 H ILE 55 HN ILE 55 -11.430 -3.367 -9.431 416 HA ILE 55 HA ILE 55 -11.559 -1.804 -11.938 417 HB ILE 55 HB ILE 55 -10.976 -0.945 -9.072 418 1HG1 ILE 55 HG12 ILE 55 -13.190 -0.444 -10.040 419 2HG1 ILE 55 HG13 ILE 55 -12.281 0.965 -9.529 420 1HG2 ILE 55 HG21 ILE 55 -9.687 0.225 -11.561 421 2HG2 ILE 55 HG22 ILE 55 -9.881 1.138 -10.050 422 3HG2 ILE 55 HG23 ILE 55 -8.934 -0.356 -10.061 423 1HD1 ILE 55 HD11 ILE 55 -13.367 1.469 -11.613 424 2HD1 ILE 55 HD12 ILE 55 -11.632 1.444 -11.879 425 3HD1 ILE 55 HD13 ILE 55 -12.626 0.070 -12.418 426 H ASP 56 HN ASP 56 -9.937 -2.562 -13.180 427 HA ASP 56 HA ASP 56 -7.540 -3.875 -11.990 428 1HB ASP 56 HB2 ASP 56 -8.548 -5.049 -13.906 429 2HB ASP 56 HB3 ASP 56 -8.487 -3.582 -14.871 430 H VAL 57 HN VAL 57 -6.733 -1.962 -11.028 431 HA VAL 57 HA VAL 57 -6.641 0.525 -11.854 432 HB VAL 57 HB VAL 57 -4.663 0.835 -10.405 433 1HG1 VAL 57 HG11 VAL 57 -5.598 -0.098 -8.387 434 2HG1 VAL 57 HG12 VAL 57 -6.902 0.449 -9.425 435 3HG1 VAL 57 HG13 VAL 57 -6.534 -1.293 -9.286 436 1HG2 VAL 57 HG21 VAL 57 -3.537 -1.097 -9.398 437 2HG2 VAL 57 HG22 VAL 57 -4.355 -2.164 -10.570 438 3HG2 VAL 57 HG23 VAL 57 -3.197 -0.926 -11.104 439 H ASP 58 HN ASP 58 -4.208 -1.851 -13.154 440 HA ASP 58 HA ASP 58 -2.531 0.134 -14.296 441 1HB ASP 58 HB2 ASP 58 -1.936 -2.276 -14.029 442 2HB ASP 58 HB3 ASP 58 -3.167 -2.699 -15.230 443 H GLU 59 HN GLU 59 -5.623 -1.106 -15.401 444 HA GLU 59 HA GLU 59 -5.412 0.352 -17.979 445 1HB GLU 59 HB2 GLU 59 -5.948 -1.811 -18.528 446 2HB GLU 59 HB3 GLU 59 -6.712 -2.152 -16.972 447 1HG GLU 59 HG2 GLU 59 -8.667 -0.913 -17.546 448 2HG GLU 59 HG3 GLU 59 -7.997 -0.466 -19.132 449 H ASN 60 HN ASN 60 -7.173 0.178 -14.911 450 HA ASN 60 HA ASN 60 -8.835 2.475 -15.765 451 1HB ASN 60 HB2 ASN 60 -9.691 -0.303 -15.224 452 2HB ASN 60 HB3 ASN 60 -10.586 0.841 -14.251 453 1HD2 ASN 60 HD22 ASN 60 -10.734 -0.686 -17.200 454 2HD2 ASN 60 HD21 ASN 60 -11.672 0.496 -18.066 455 H GLN 61 HN GLN 61 -6.582 2.387 -13.975 456 HA GLN 61 HA GLN 61 -7.547 2.866 -11.366 457 1HB GLN 61 HB2 GLN 61 -5.369 3.997 -10.896 458 2HB GLN 61 HB3 GLN 61 -5.252 2.414 -11.585 459 1HG GLN 61 HG2 GLN 61 -5.028 3.750 -13.894 460 2HG GLN 61 HG3 GLN 61 -4.590 5.058 -12.819 461 1HE2 GLN 61 HE22 GLN 61 -3.136 3.447 -10.764 462 2HE2 GLN 61 HE21 GLN 61 -1.687 2.888 -11.536 463 H GLU 62 HN GLU 62 -8.048 4.699 -14.153 464 HA GLU 62 HA GLU 62 -8.071 7.378 -13.287 465 1HB GLU 62 HB2 GLU 62 -9.647 5.684 -15.244 466 2HB GLU 62 HB3 GLU 62 -10.080 7.392 -15.000 467 1HG GLU 62 HG2 GLU 62 -7.725 8.032 -15.557 468 2HG GLU 62 HG3 GLU 62 -7.356 6.338 -15.883 469 H THR 63 HN THR 63 -10.248 4.668 -12.465 470 HA THR 63 HA THR 63 -12.159 6.392 -11.059 471 HB THR 63 HB THR 63 -11.545 3.423 -10.757 472 HG1 THR 63 HG1 THR 63 -12.160 3.752 -12.830 473 1HG2 THR 63 HG21 THR 63 -13.818 3.216 -9.898 474 2HG2 THR 63 HG22 THR 63 -12.894 4.304 -8.872 475 3HG2 THR 63 HG23 THR 63 -14.062 4.976 -10.034 476 H ALA 64 HN ALA 64 -9.328 4.412 -10.269 477 HA ALA 64 HA ALA 64 -9.622 4.480 -7.461 478 1HB ALA 64 HB1 ALA 64 -7.098 3.880 -9.095 479 2HB ALA 64 HB2 ALA 64 -7.504 3.264 -7.486 480 3HB ALA 64 HB3 ALA 64 -8.425 2.743 -8.895 481 H GLY 65 HN GLY 65 -6.800 5.823 -9.205 482 1HA GLY 65 HA2 GLY 65 -5.795 7.589 -7.382 483 2HA GLY 65 HA3 GLY 65 -5.812 7.895 -9.130 484 H LYS 66 HN LYS 66 -8.573 8.288 -9.574 485 HA LYS 66 HA LYS 66 -8.861 11.022 -8.848 486 1HB LYS 66 HB2 LYS 66 -9.809 10.056 -10.877 487 2HB LYS 66 HB3 LYS 66 -10.867 9.008 -9.904 488 1HG LYS 66 HG2 LYS 66 -12.097 10.964 -9.071 489 2HG LYS 66 HG3 LYS 66 -10.969 12.051 -9.899 490 1HD LYS 66 HD2 LYS 66 -13.048 11.844 -11.145 491 2HD LYS 66 HD3 LYS 66 -11.696 11.171 -12.078 492 1HE LYS 66 HE2 LYS 66 -12.381 8.871 -11.311 493 2HE LYS 66 HE3 LYS 66 -13.773 9.595 -10.485 494 1HZ LYS 66 HZ1 LYS 66 -14.456 10.422 -12.730 495 2HZ LYS 66 HZ2 LYS 66 -13.230 9.518 -13.398 496 3HZ LYS 66 HZ3 LYS 66 -14.427 8.779 -12.621 497 H TYR 67 HN TYR 67 -10.405 8.002 -7.468 498 HA TYR 67 HA TYR 67 -12.088 9.511 -5.719 499 1HB TYR 67 HB2 TYR 67 -12.596 7.184 -6.247 500 2HB TYR 67 HB3 TYR 67 -11.065 6.645 -5.577 501 HD1 TYR 67 HD1 TYR 67 -10.661 6.739 -3.077 502 HD2 TYR 67 HD2 TYR 67 -14.509 7.672 -4.798 503 HE1 TYR 67 HE1 TYR 67 -11.683 6.520 -0.859 504 HE2 TYR 67 HE2 TYR 67 -15.547 7.471 -2.558 505 HH TYR 67 HH TYR 67 -13.622 6.703 0.393 506 H GLY 68 HN GLY 68 -8.865 8.058 -5.541 507 1HA GLY 68 HA2 GLY 68 -7.111 9.211 -4.237 508 2HA GLY 68 HA3 GLY 68 -8.278 9.342 -2.898 509 H VAL 69 HN VAL 69 -6.655 6.915 -5.106 510 HA VAL 69 HA VAL 69 -6.629 4.939 -2.980 511 HB VAL 69 HB VAL 69 -7.938 4.415 -5.696 512 1HG1 VAL 69 HG11 VAL 69 -6.486 2.559 -5.191 513 2HG1 VAL 69 HG12 VAL 69 -7.120 2.464 -3.540 514 3HG1 VAL 69 HG13 VAL 69 -8.158 2.064 -4.938 515 1HG2 VAL 69 HG21 VAL 69 -9.880 3.576 -4.429 516 2HG2 VAL 69 HG22 VAL 69 -9.151 4.242 -2.940 517 3HG2 VAL 69 HG23 VAL 69 -9.601 5.306 -4.297 518 H MET 70 HN MET 70 -4.549 4.290 -3.109 519 HA MET 70 HA MET 70 -3.191 4.208 -5.718 520 1HB MET 70 HB2 MET 70 -1.358 5.555 -5.060 521 2HB MET 70 HB3 MET 70 -2.829 6.516 -4.948 522 1HG MET 70 HG2 MET 70 -2.867 6.344 -2.531 523 2HG MET 70 HG3 MET 70 -1.647 5.083 -2.594 524 1HE MET 70 HE1 MET 70 1.649 6.447 -3.101 525 2HE MET 70 HE2 MET 70 0.489 5.190 -3.545 526 3HE MET 70 HE3 MET 70 0.739 6.580 -4.629 527 H SER 71 HN SER 71 -4.172 2.249 -3.581 528 HA SER 71 HA SER 71 -1.758 0.732 -3.458 529 1HB SER 71 HB2 SER 71 -2.932 1.747 -0.922 530 2HB SER 71 HB3 SER 71 -2.264 0.106 -0.956 531 HG SER 71 HG SER 71 -0.869 2.354 -1.954 532 H ILE 72 HN ILE 72 -2.275 -1.513 -2.475 533 HA ILE 72 HA ILE 72 -4.860 -2.412 -3.572 534 HB ILE 72 HB ILE 72 -2.066 -3.388 -4.217 535 1HG1 ILE 72 HG12 ILE 72 -2.648 -1.314 -5.470 536 2HG1 ILE 72 HG13 ILE 72 -2.320 -2.704 -6.466 537 1HG2 ILE 72 HG21 ILE 72 -4.696 -4.531 -5.211 538 2HG2 ILE 72 HG22 ILE 72 -3.110 -4.879 -5.906 539 3HG2 ILE 72 HG23 ILE 72 -3.459 -5.367 -4.249 540 1HD1 ILE 72 HD11 ILE 72 -4.224 -1.464 -7.312 541 2HD1 ILE 72 HD12 ILE 72 -4.727 -3.071 -6.853 542 3HD1 ILE 72 HD13 ILE 72 -5.118 -1.687 -5.795 543 HA PRO 73 HA PRO 73 -6.006 -4.214 -3.527 544 1HB PRO 73 HB2 PRO 73 -7.729 -5.813 -2.220 545 2HB PRO 73 HB3 PRO 73 -6.283 -6.480 -3.044 546 1HG PRO 73 HG2 PRO 73 -6.661 -5.884 -0.110 547 2HG PRO 73 HG3 PRO 73 -5.932 -7.332 -0.856 548 1HD PRO 73 HD2 PRO 73 -4.477 -5.153 0.122 549 2HD PRO 73 HD3 PRO 73 -3.876 -6.225 -1.170 550 H THR 74 HN THR 74 -7.564 -2.617 -3.516 551 HA THR 74 HA THR 74 -8.310 -1.467 -0.850 552 HB THR 74 HB THR 74 -8.257 -0.132 -3.562 553 HG1 THR 74 HG1 THR 74 -6.317 0.077 -2.734 554 1HG2 THR 74 HG21 THR 74 -10.246 0.719 -2.487 555 2HG2 THR 74 HG22 THR 74 -9.397 0.899 -0.939 556 3HG2 THR 74 HG23 THR 74 -8.966 1.918 -2.312 557 H LEU 75 HN LEU 75 -10.454 -1.177 -0.329 558 HA LEU 75 HA LEU 75 -12.552 -2.340 -2.098 559 1HB LEU 75 HB2 LEU 75 -12.413 -2.455 0.942 560 2HB LEU 75 HB3 LEU 75 -13.802 -2.916 -0.023 561 HG LEU 75 HG LEU 75 -11.120 -4.348 -0.070 562 1HD1 LEU 75 HD11 LEU 75 -13.754 -5.166 1.266 563 2HD1 LEU 75 HD12 LEU 75 -12.183 -6.019 1.312 564 3HD1 LEU 75 HD13 LEU 75 -12.366 -4.468 2.115 565 1HD2 LEU 75 HD21 LEU 75 -12.395 -4.622 -2.183 566 2HD2 LEU 75 HD22 LEU 75 -12.339 -6.133 -1.268 567 3HD2 LEU 75 HD23 LEU 75 -13.821 -5.139 -1.280 568 H LEU 76 HN LEU 76 -14.275 -0.989 -2.292 569 HA LEU 76 HA LEU 76 -14.560 1.257 -0.421 570 1HB LEU 76 HB2 LEU 76 -15.269 1.536 -3.361 571 2HB LEU 76 HB3 LEU 76 -15.344 2.754 -2.091 572 HG LEU 76 HG LEU 76 -12.814 1.635 -3.358 573 1HD1 LEU 76 HD11 LEU 76 -14.094 3.117 -4.833 574 2HD1 LEU 76 HD12 LEU 76 -14.135 4.368 -3.572 575 3HD1 LEU 76 HD13 LEU 76 -12.592 3.888 -4.309 576 1HD2 LEU 76 HD21 LEU 76 -11.626 3.412 -2.107 577 2HD2 LEU 76 HD22 LEU 76 -13.140 3.845 -1.280 578 3HD2 LEU 76 HD23 LEU 76 -12.386 2.264 -1.005 579 H VAL 77 HN VAL 77 -16.370 0.669 0.661 580 HA VAL 77 HA VAL 77 -18.331 -1.104 -0.717 581 HB VAL 77 HB VAL 77 -18.403 -0.562 2.246 582 1HG1 VAL 77 HG11 VAL 77 -19.360 -2.783 2.313 583 2HG1 VAL 77 HG12 VAL 77 -20.250 -1.748 1.189 584 3HG1 VAL 77 HG13 VAL 77 -19.120 -2.970 0.557 585 1HG2 VAL 77 HG21 VAL 77 -16.076 -1.207 2.019 586 2HG2 VAL 77 HG22 VAL 77 -16.990 -2.585 2.632 587 3HG2 VAL 77 HG23 VAL 77 -16.500 -2.526 0.926 588 H LEU 78 HN LEU 78 -20.139 -0.157 -1.450 589 HA LEU 78 HA LEU 78 -20.954 2.454 -0.292 590 1HB LEU 78 HB2 LEU 78 -21.071 1.545 -3.207 591 2HB LEU 78 HB3 LEU 78 -21.930 2.929 -2.553 592 HG LEU 78 HG LEU 78 -19.500 3.632 -1.700 593 1HD1 LEU 78 HD11 LEU 78 -17.763 3.138 -3.350 594 2HD1 LEU 78 HD12 LEU 78 -18.358 1.628 -2.656 595 3HD1 LEU 78 HD13 LEU 78 -18.884 2.115 -4.275 596 1HD2 LEU 78 HD21 LEU 78 -20.949 5.015 -3.097 597 2HD2 LEU 78 HD22 LEU 78 -19.287 5.057 -3.698 598 3HD2 LEU 78 HD23 LEU 78 -20.505 4.073 -4.537 599 H LYS 79 HN LYS 79 -23.185 2.870 -0.227 600 HA LYS 79 HA LYS 79 -25.032 0.743 -1.024 601 1HB LYS 79 HB2 LYS 79 -26.350 0.918 1.041 602 2HB LYS 79 HB3 LYS 79 -24.752 0.258 1.323 603 1HG LYS 79 HG2 LYS 79 -24.870 1.617 3.112 604 2HG LYS 79 HG3 LYS 79 -24.120 2.733 1.983 605 1HD LYS 79 HD2 LYS 79 -25.776 3.897 3.247 606 2HD LYS 79 HD3 LYS 79 -26.387 3.785 1.602 607 1HE LYS 79 HE2 LYS 79 -27.831 1.870 2.251 608 2HE LYS 79 HE3 LYS 79 -27.169 1.919 3.889 609 1HZ LYS 79 HZ1 LYS 79 -28.138 4.126 4.149 610 2HZ LYS 79 HZ2 LYS 79 -28.742 4.095 2.629 611 3HZ LYS 79 HZ3 LYS 79 -29.295 3.052 3.752 612 H ASP 80 HN ASP 80 -26.763 1.640 -1.991 613 HA ASP 80 HA ASP 80 -27.830 3.125 -3.241 614 1HB ASP 80 HB2 ASP 80 -28.997 3.076 -1.045 615 2HB ASP 80 HB3 ASP 80 -28.142 4.546 -0.575 616 H GLY 81 HN GLY 81 -24.930 3.754 -3.147 617 1HA GLY 81 HA2 GLY 81 -23.769 5.187 -4.494 618 2HA GLY 81 HA3 GLY 81 -25.089 6.374 -4.461 619 H GLU 82 HN GLU 82 -23.999 5.211 -1.356 620 HA GLU 82 HA GLU 82 -22.004 7.357 -1.123 621 1HB GLU 82 HB2 GLU 82 -22.861 8.118 0.877 622 2HB GLU 82 HB3 GLU 82 -24.316 7.798 -0.088 623 1HG GLU 82 HG2 GLU 82 -24.615 5.653 1.125 624 2HG GLU 82 HG3 GLU 82 -23.197 6.025 2.112 625 H VAL 83 HN VAL 83 -20.202 6.877 0.191 626 HA VAL 83 HA VAL 83 -19.543 4.030 0.491 627 HB VAL 83 HB VAL 83 -18.006 6.546 1.276 628 1HG1 VAL 83 HG11 VAL 83 -17.049 3.664 0.935 629 2HG1 VAL 83 HG12 VAL 83 -16.006 5.064 1.249 630 3HG1 VAL 83 HG13 VAL 83 -17.157 4.543 2.475 631 1HG2 VAL 83 HG21 VAL 83 -16.713 6.243 -0.767 632 2HG2 VAL 83 HG22 VAL 83 -17.647 4.814 -1.213 633 3HG2 VAL 83 HG23 VAL 83 -18.405 6.424 -1.206 634 H VAL 84 HN VAL 84 -19.519 2.900 2.255 635 HA VAL 84 HA VAL 84 -20.161 4.164 4.872 636 HB VAL 84 HB VAL 84 -21.494 2.048 5.313 637 1HG1 VAL 84 HG11 VAL 84 -22.612 3.967 3.244 638 2HG1 VAL 84 HG12 VAL 84 -23.524 3.014 4.446 639 3HG1 VAL 84 HG13 VAL 84 -22.454 4.308 4.979 640 1HG2 VAL 84 HG21 VAL 84 -21.606 1.837 2.267 641 2HG2 VAL 84 HG22 VAL 84 -20.749 0.705 3.338 642 3HG2 VAL 84 HG23 VAL 84 -22.506 0.868 3.437 643 H GLU 85 HN GLU 85 -18.225 1.856 3.045 644 HA GLU 85 HA GLU 85 -16.520 1.723 5.356 645 1HB GLU 85 HB2 GLU 85 -17.956 -0.702 4.339 646 2HB GLU 85 HB3 GLU 85 -16.217 -0.911 4.525 647 1HG GLU 85 HG2 GLU 85 -18.088 0.101 6.662 648 2HG GLU 85 HG3 GLU 85 -17.567 -1.575 6.485 649 H THR 86 HN THR 86 -14.371 0.908 4.793 650 HA THR 86 HA THR 86 -13.574 1.048 1.968 651 HB THR 86 HB THR 86 -12.351 3.093 3.827 652 HG1 THR 86 HG1 THR 86 -14.852 3.281 2.598 653 1HG2 THR 86 HG21 THR 86 -11.416 2.566 1.548 654 2HG2 THR 86 HG22 THR 86 -12.984 3.105 0.879 655 3HG2 THR 86 HG23 THR 86 -11.926 4.257 1.733 656 H SER 87 HN SER 87 -11.422 0.089 1.820 657 HA SER 87 HA SER 87 -9.829 -0.294 4.244 658 1HB SER 87 HB2 SER 87 -11.027 -2.642 2.708 659 2HB SER 87 HB3 SER 87 -9.603 -2.785 3.746 660 HG SER 87 HG SER 87 -11.796 -1.498 4.857 661 H VAL 88 HN VAL 88 -7.666 -0.738 3.707 662 HA VAL 88 HA VAL 88 -6.931 -0.943 0.846 663 HB VAL 88 HB VAL 88 -5.734 1.075 2.791 664 1HG1 VAL 88 HG11 VAL 88 -4.428 1.810 0.826 665 2HG1 VAL 88 HG12 VAL 88 -4.102 0.100 1.156 666 3HG1 VAL 88 HG13 VAL 88 -5.185 0.536 -0.168 667 1HG2 VAL 88 HG21 VAL 88 -7.485 1.506 0.345 668 2HG2 VAL 88 HG22 VAL 88 -7.892 1.910 2.027 669 3HG2 VAL 88 HG23 VAL 88 -6.602 2.787 1.204 670 H GLY 89 HN GLY 89 -6.938 -3.130 1.629 671 1HA GLY 89 HA2 GLY 89 -4.601 -4.360 2.382 672 2HA GLY 89 HA3 GLY 89 -5.420 -4.029 3.921 673 H PHE 90 HN PHE 90 -4.958 -6.667 2.879 674 HA PHE 90 HA PHE 90 -7.264 -7.620 1.469 675 1HB PHE 90 HB2 PHE 90 -6.234 -9.791 1.627 676 2HB PHE 90 HB3 PHE 90 -5.024 -8.597 1.211 677 HD1 PHE 90 HD1 PHE 90 -6.237 -10.881 3.880 678 HD2 PHE 90 HD2 PHE 90 -3.141 -8.112 2.693 679 HE1 PHE 90 HE1 PHE 90 -4.813 -11.664 5.751 680 HE2 PHE 90 HE2 PHE 90 -1.725 -8.902 4.568 681 HZ PHE 90 HZ PHE 90 -2.556 -10.675 6.103 682 H LYS 91 HN LYS 91 -8.610 -9.468 2.267 683 HA LYS 91 HA LYS 91 -8.997 -9.752 5.151 684 1HB LYS 91 HB2 LYS 91 -10.824 -8.188 3.374 685 2HB LYS 91 HB3 LYS 91 -11.635 -9.479 4.251 686 1HG LYS 91 HG2 LYS 91 -10.932 -8.632 6.378 687 2HG LYS 91 HG3 LYS 91 -9.855 -7.450 5.659 688 1HD LYS 91 HD2 LYS 91 -12.771 -7.330 4.911 689 2HD LYS 91 HD3 LYS 91 -12.342 -6.864 6.550 690 1HE LYS 91 HE2 LYS 91 -11.003 -5.667 4.077 691 2HE LYS 91 HE3 LYS 91 -12.419 -4.970 4.859 692 1HZ LYS 91 HZ1 LYS 91 -9.741 -5.211 6.051 693 2HZ LYS 91 HZ2 LYS 91 -10.620 -3.858 5.716 694 3HZ LYS 91 HZ3 LYS 91 -11.076 -4.840 6.930 695 HA PRO 92 HA PRO 92 -9.813 -13.815 3.232 696 1HB PRO 92 HB2 PRO 92 -10.630 -15.243 5.414 697 2HB PRO 92 HB3 PRO 92 -8.921 -14.772 5.164 698 1HG PRO 92 HG2 PRO 92 -11.019 -13.358 6.836 699 2HG PRO 92 HG3 PRO 92 -9.361 -13.837 7.326 700 1HD PRO 92 HD2 PRO 92 -9.878 -11.309 6.474 701 2HD PRO 92 HD3 PRO 92 -8.366 -12.134 6.011 702 H LYS 93 HN LYS 93 -11.819 -15.285 3.051 703 HA LYS 93 HA LYS 93 -13.839 -13.628 2.119 704 1HB LYS 93 HB2 LYS 93 -13.204 -16.250 1.740 705 2HB LYS 93 HB3 LYS 93 -14.600 -16.470 2.780 706 1HG LYS 93 HG2 LYS 93 -15.150 -14.486 0.670 707 2HG LYS 93 HG3 LYS 93 -14.489 -15.954 -0.024 708 1HD LYS 93 HD2 LYS 93 -16.976 -15.769 1.724 709 2HD LYS 93 HD3 LYS 93 -16.896 -15.896 -0.038 710 1HE LYS 93 HE2 LYS 93 -15.637 -18.100 0.280 711 2HE LYS 93 HE3 LYS 93 -16.106 -18.017 1.982 712 1HZ LYS 93 HZ1 LYS 93 -17.697 -19.304 0.690 713 2HZ LYS 93 HZ2 LYS 93 -18.438 -17.958 1.264 714 3HZ LYS 93 HZ3 LYS 93 -18.010 -18.031 -0.307 715 H GLU 94 HN GLU 94 -13.798 -15.310 5.273 716 HA GLU 94 HA GLU 94 -16.485 -14.611 5.906 717 1HB GLU 94 HB2 GLU 94 -14.092 -15.218 7.699 718 2HB GLU 94 HB3 GLU 94 -15.764 -15.040 8.267 719 1HG GLU 94 HG2 GLU 94 -16.461 -16.938 6.809 720 2HG GLU 94 HG3 GLU 94 -14.791 -17.148 6.281 721 H ALA 95 HN ALA 95 -13.339 -12.976 6.597 722 HA ALA 95 HA ALA 95 -14.452 -10.827 8.122 723 1HB ALA 95 HB1 ALA 95 -12.052 -10.732 6.264 724 2HB ALA 95 HB2 ALA 95 -12.394 -9.679 7.651 725 3HB ALA 95 HB3 ALA 95 -11.982 -11.382 7.940 726 H LEU 96 HN LEU 96 -14.000 -11.443 4.668 727 HA LEU 96 HA LEU 96 -14.589 -8.805 3.879 728 1HB LEU 96 HB2 LEU 96 -13.375 -10.648 2.527 729 2HB LEU 96 HB3 LEU 96 -14.964 -11.330 2.181 730 HG LEU 96 HG LEU 96 -15.664 -9.219 1.092 731 1HD1 LEU 96 HD11 LEU 96 -12.938 -8.254 2.047 732 2HD1 LEU 96 HD12 LEU 96 -13.796 -7.497 0.669 733 3HD1 LEU 96 HD13 LEU 96 -14.522 -7.473 2.271 734 1HD2 LEU 96 HD21 LEU 96 -12.914 -10.170 0.213 735 2HD2 LEU 96 HD22 LEU 96 -14.490 -10.882 -0.266 736 3HD2 LEU 96 HD23 LEU 96 -14.040 -9.248 -0.787 737 H GLN 97 HN GLN 97 -16.601 -11.765 3.972 738 HA GLN 97 HA GLN 97 -18.986 -10.446 3.151 739 1HB GLN 97 HB2 GLN 97 -20.028 -12.347 3.392 740 2HB GLN 97 HB3 GLN 97 -18.402 -13.012 3.345 741 1HG GLN 97 HG2 GLN 97 -18.425 -13.216 5.745 742 2HG GLN 97 HG3 GLN 97 -20.095 -12.575 5.798 743 1HE2 GLN 97 HE22 GLN 97 -21.461 -13.888 3.750 744 2HE2 GLN 97 HE21 GLN 97 -21.337 -15.626 3.963 745 H GLU 98 HN GLU 98 -17.386 -10.853 6.376 746 HA GLU 98 HA GLU 98 -19.528 -9.766 7.839 747 1HB GLU 98 HB2 GLU 98 -17.682 -10.933 8.896 748 2HB GLU 98 HB3 GLU 98 -16.550 -9.653 8.435 749 1HG GLU 98 HG2 GLU 98 -17.736 -8.039 9.844 750 2HG GLU 98 HG3 GLU 98 -18.977 -9.237 10.225 751 H LEU 99 HN LEU 99 -16.735 -8.099 6.342 752 HA LEU 99 HA LEU 99 -17.168 -5.514 7.242 753 1HB LEU 99 HB2 LEU 99 -15.198 -6.376 5.902 754 2HB LEU 99 HB3 LEU 99 -16.234 -6.379 4.481 755 HG LEU 99 HG LEU 99 -16.580 -3.800 5.015 756 1HD1 LEU 99 HD11 LEU 99 -15.490 -3.813 7.218 757 2HD1 LEU 99 HD12 LEU 99 -13.983 -4.398 6.492 758 3HD1 LEU 99 HD13 LEU 99 -14.604 -2.783 6.084 759 1HD2 LEU 99 HD21 LEU 99 -14.513 -3.314 3.690 760 2HD2 LEU 99 HD22 LEU 99 -14.089 -5.042 3.839 761 3HD2 LEU 99 HD23 LEU 99 -15.573 -4.561 3.011 762 H VAL 100 HN VAL 100 -18.615 -7.147 4.433 763 HA VAL 100 HA VAL 100 -20.022 -4.652 3.734 764 HB VAL 100 HB VAL 100 -18.894 -5.870 2.013 765 1HG1 VAL 100 HG11 VAL 100 -19.306 -8.230 2.773 766 2HG1 VAL 100 HG12 VAL 100 -21.003 -8.074 2.306 767 3HG1 VAL 100 HG13 VAL 100 -19.722 -7.966 1.082 768 1HG2 VAL 100 HG21 VAL 100 -20.625 -5.711 0.346 769 2HG2 VAL 100 HG22 VAL 100 -21.911 -5.929 1.548 770 3HG2 VAL 100 HG23 VAL 100 -20.938 -4.455 1.551 771 H ASN 101 HN ASN 101 -20.871 -7.920 5.077 772 HA ASN 101 HA ASN 101 -23.640 -7.703 4.774 773 1HB ASN 101 HB2 ASN 101 -23.942 -9.572 5.816 774 2HB ASN 101 HB3 ASN 101 -22.238 -9.785 5.597 775 1HD2 ASN 101 HD22 ASN 101 -21.138 -8.239 7.771 776 2HD2 ASN 101 HD21 ASN 101 -21.787 -8.864 9.266 777 H LYS 102 HN LYS 102 -21.599 -6.035 7.055 778 HA LYS 102 HA LYS 102 -23.726 -5.533 8.947 779 1HB LYS 102 HB2 LYS 102 -22.097 -4.400 10.241 780 2HB LYS 102 HB3 LYS 102 -21.287 -5.779 9.499 781 1HG LYS 102 HG2 LYS 102 -20.583 -4.046 7.669 782 2HG LYS 102 HG3 LYS 102 -20.992 -2.859 8.929 783 1HD LYS 102 HD2 LYS 102 -19.460 -4.083 10.520 784 2HD LYS 102 HD3 LYS 102 -19.061 -5.218 9.211 785 1HE LYS 102 HE2 LYS 102 -17.310 -3.653 9.328 786 2HE LYS 102 HE3 LYS 102 -18.242 -3.374 7.841 787 1HZ LYS 102 HZ1 LYS 102 -19.199 -1.438 8.799 788 2HZ LYS 102 HZ2 LYS 102 -18.568 -1.748 10.298 789 3HZ LYS 102 HZ3 LYS 102 -17.581 -1.330 9.057 790 H HIS 103 HN HIS 103 -23.127 -4.252 5.885 791 HA HIS 103 HA HIS 103 -24.831 -1.872 6.503 792 1HB HIS 103 HB2 HIS 103 -22.638 -2.079 4.402 793 2HB HIS 103 HB3 HIS 103 -23.707 -0.702 4.670 794 HD1 HIS 103 HD1 HIS 103 -23.397 0.483 7.240 795 HD2 HIS 103 HD2 HIS 103 -20.422 -2.145 5.824 796 HE1 HIS 103 HE1 HIS 103 -21.360 0.851 8.715 797 H LEU 104 HN LEU 104 -24.100 -4.574 4.353 798 HA LEU 104 HA LEU 104 -26.026 -4.249 2.295 799 1HB LEU 104 HB2 LEU 104 -24.187 -5.791 2.233 800 2HB LEU 104 HB3 LEU 104 -24.786 -6.589 3.675 801 HG LEU 104 HG LEU 104 -25.013 -7.797 1.533 802 1HD1 LEU 104 HD11 LEU 104 -27.667 -7.503 2.957 803 2HD1 LEU 104 HD12 LEU 104 -27.017 -8.911 2.111 804 3HD1 LEU 104 HD13 LEU 104 -26.257 -8.374 3.614 805 1HD2 LEU 104 HD21 LEU 104 -25.703 -6.085 0.044 806 2HD2 LEU 104 HD22 LEU 104 -26.980 -7.284 0.116 807 3HD2 LEU 104 HD23 LEU 104 -27.192 -5.760 0.974 808 1H MET 1 H1 MET 1 8.179 26.988 -12.809 809 2H MET 1 H2 MET 1 8.213 28.585 -12.470 810 3H MET 1 H3 MET 1 7.376 28.052 -13.771 811 HA MET 1 HA MET 1 5.877 28.621 -11.976 812 1HB MET 1 HB2 MET 1 6.043 25.634 -12.580 813 2HB MET 1 HB3 MET 1 4.730 26.389 -11.683 814 1HG MET 1 HG2 MET 1 5.503 26.978 -14.561 815 2HG MET 1 HG3 MET 1 4.110 26.062 -14.017 816 1HE MET 1 HE1 MET 1 2.778 27.730 -11.669 817 2HE MET 1 HE2 MET 1 1.674 28.747 -12.616 818 3HE MET 1 HE3 MET 1 1.910 27.045 -13.064 819 H GLU 2 HN GLU 2 6.003 29.120 -9.855 820 HA GLU 2 HA GLU 2 8.003 27.985 -8.122 821 1HB GLU 2 HB2 GLU 2 7.162 30.324 -8.042 822 2HB GLU 2 HB3 GLU 2 5.577 29.740 -7.524 823 1HG GLU 2 HG2 GLU 2 6.581 28.819 -5.460 824 2HG GLU 2 HG3 GLU 2 8.187 29.316 -6.004 825 H ASN 3 HN ASN 3 7.818 26.323 -6.693 826 HA ASN 3 HA ASN 3 7.159 24.640 -5.498 827 1HB ASN 3 HB2 ASN 3 4.237 25.158 -5.920 828 2HB ASN 3 HB3 ASN 3 5.037 24.079 -4.781 829 1HD2 ASN 3 HD22 ASN 3 7.128 26.100 -3.833 830 2HD2 ASN 3 HD21 ASN 3 6.196 27.198 -2.879 831 H LYS 4 HN LYS 4 7.405 22.807 -6.101 832 HA LYS 4 HA LYS 4 6.066 21.461 -8.358 833 1HB LYS 4 HB2 LYS 4 9.050 21.468 -7.690 834 2HB LYS 4 HB3 LYS 4 8.300 20.374 -8.854 835 1HG LYS 4 HG2 LYS 4 7.774 22.222 -10.346 836 2HG LYS 4 HG3 LYS 4 8.313 23.414 -9.145 837 1HD LYS 4 HD2 LYS 4 10.588 22.432 -9.177 838 2HD LYS 4 HD3 LYS 4 10.095 21.304 -10.443 839 1HE LYS 4 HE2 LYS 4 9.983 24.349 -10.683 840 2HE LYS 4 HE3 LYS 4 11.363 23.374 -11.195 841 1HZ LYS 4 HZ1 LYS 4 9.912 22.229 -12.768 842 2HZ LYS 4 HZ2 LYS 4 8.632 23.150 -12.327 843 3HZ LYS 4 HZ3 LYS 4 9.923 23.829 -13.058 844 H ILE 5 HN ILE 5 5.169 19.564 -7.447 845 HA ILE 5 HA ILE 5 5.903 19.178 -4.612 846 HB ILE 5 HB ILE 5 3.447 18.393 -6.182 847 1HG1 ILE 5 HG12 ILE 5 4.227 20.576 -4.252 848 2HG1 ILE 5 HG13 ILE 5 3.358 20.682 -5.773 849 1HG2 ILE 5 HG21 ILE 5 2.517 17.490 -4.104 850 2HG2 ILE 5 HG22 ILE 5 4.003 16.641 -4.485 851 3HG2 ILE 5 HG23 ILE 5 4.018 17.899 -3.224 852 1HD1 ILE 5 HD11 ILE 5 1.884 21.197 -3.946 853 2HD1 ILE 5 HD12 ILE 5 1.376 19.632 -4.640 854 3HD1 ILE 5 HD13 ILE 5 2.297 19.687 -3.108 855 H ILE 6 HN ILE 6 6.671 17.324 -3.789 856 HA ILE 6 HA ILE 6 7.177 15.001 -5.537 857 HB ILE 6 HB ILE 6 9.012 16.393 -6.019 858 1HG1 ILE 6 HG12 ILE 6 9.349 13.886 -5.552 859 2HG1 ILE 6 HG13 ILE 6 10.692 14.945 -5.869 860 1HG2 ILE 6 HG21 ILE 6 9.109 18.001 -4.273 861 2HG2 ILE 6 HG22 ILE 6 9.537 16.774 -3.065 862 3HG2 ILE 6 HG23 ILE 6 10.676 17.203 -4.363 863 1HD1 ILE 6 HD11 ILE 6 9.934 13.980 -3.083 864 2HD1 ILE 6 HD12 ILE 6 11.252 13.371 -4.106 865 3HD1 ILE 6 HD13 ILE 6 11.316 15.019 -3.495 866 H TYR 7 HN TYR 7 7.572 13.079 -4.343 867 HA TYR 7 HA TYR 7 6.630 13.246 -1.506 868 1HB TYR 7 HB2 TYR 7 5.085 12.680 -3.666 869 2HB TYR 7 HB3 TYR 7 5.773 11.099 -3.431 870 HD1 TYR 7 HD1 TYR 7 3.489 13.663 -2.173 871 HD2 TYR 7 HD2 TYR 7 5.142 9.742 -1.394 872 HE1 TYR 7 HE1 TYR 7 1.534 13.093 -0.766 873 HE2 TYR 7 HE2 TYR 7 3.113 9.140 -0.194 874 HH TYR 7 HH TYR 7 0.404 11.431 0.338 875 H PHE 8 HN PHE 8 7.418 11.661 -0.129 876 HA PHE 8 HA PHE 8 9.286 9.589 -1.207 877 1HB PHE 8 HB2 PHE 8 9.045 10.786 1.556 878 2HB PHE 8 HB3 PHE 8 10.157 9.485 1.115 879 HD1 PHE 8 HD1 PHE 8 11.716 10.164 -1.020 880 HD2 PHE 8 HD2 PHE 8 10.043 12.846 1.905 881 HE1 PHE 8 HE1 PHE 8 13.361 11.903 -1.682 882 HE2 PHE 8 HE2 PHE 8 11.731 14.532 1.303 883 HZ PHE 8 HZ PHE 8 13.355 14.103 -0.499 884 H LEU 9 HN LEU 9 8.730 7.463 -0.684 885 HA LEU 9 HA LEU 9 6.283 7.046 0.951 886 1HB LEU 9 HB2 LEU 9 5.848 7.262 -1.523 887 2HB LEU 9 HB3 LEU 9 6.902 5.880 -1.796 888 HG LEU 9 HG LEU 9 5.343 4.450 -0.476 889 1HD1 LEU 9 HD11 LEU 9 3.535 6.911 -0.427 890 2HD1 LEU 9 HD12 LEU 9 3.130 5.273 0.136 891 3HD1 LEU 9 HD13 LEU 9 4.343 6.229 0.993 892 1HD2 LEU 9 HD21 LEU 9 4.162 6.079 -2.777 893 2HD2 LEU 9 HD22 LEU 9 5.068 4.555 -2.891 894 3HD2 LEU 9 HD23 LEU 9 3.449 4.586 -2.162 895 H SER 10 HN SER 10 6.978 5.718 2.664 896 HA SER 10 HA SER 10 8.899 3.567 2.005 897 1HB SER 10 HB2 SER 10 10.501 4.337 3.619 898 2HB SER 10 HB3 SER 10 10.235 5.571 2.399 899 HG SER 10 HG SER 10 9.441 6.877 3.846 900 H THR 11 HN THR 11 9.285 2.020 3.657 901 HA THR 11 HA THR 11 6.958 0.930 4.592 902 HB THR 11 HB THR 11 9.726 0.344 5.754 903 HG1 THR 11 HG1 THR 11 10.171 0.377 3.648 904 1HG2 THR 11 HG21 THR 11 8.910 -2.010 5.574 905 2HG2 THR 11 HG22 THR 11 7.922 -1.031 6.667 906 3HG2 THR 11 HG23 THR 11 7.334 -1.394 5.027 907 H GLY 12 HN GLY 12 5.734 1.117 6.360 908 1HA GLY 12 HA2 GLY 12 4.937 1.863 8.420 909 2HA GLY 12 HA3 GLY 12 6.523 1.361 9.007 910 H ASN 13 HN ASN 13 5.790 3.958 6.686 911 HA ASN 13 HA ASN 13 7.884 5.440 7.263 912 1HB ASN 13 HB2 ASN 13 6.662 6.073 5.368 913 2HB ASN 13 HB3 ASN 13 5.333 6.733 6.321 914 1HD2 ASN 13 HD22 ASN 13 8.887 6.981 5.888 915 2HD2 ASN 13 HD21 ASN 13 9.009 8.576 6.653 916 H SER 14 HN SER 14 8.725 5.729 9.143 917 HA SER 14 HA SER 14 7.763 8.129 10.576 918 1HB SER 14 HB2 SER 14 8.760 5.593 11.947 919 2HB SER 14 HB3 SER 14 8.241 7.088 12.736 920 HG SER 14 HG SER 14 6.685 5.246 11.242 921 H ALA 15 HN ALA 15 10.259 6.775 8.787 922 HA ALA 15 HA ALA 15 12.306 8.263 10.300 923 1HB ALA 15 HB1 ALA 15 13.892 6.403 10.159 924 2HB ALA 15 HB2 ALA 15 12.421 5.908 11.019 925 3HB ALA 15 HB3 ALA 15 12.679 5.392 9.347 926 H ARG 16 HN ARG 16 12.137 6.283 7.246 927 HA ARG 16 HA ARG 16 14.426 7.563 6.169 928 1HB ARG 16 HB2 ARG 16 12.146 6.043 4.861 929 2HB ARG 16 HB3 ARG 16 13.516 6.636 3.931 930 1HG ARG 16 HG2 ARG 16 15.008 5.165 4.797 931 2HG ARG 16 HG3 ARG 16 14.252 5.095 6.385 932 1HD ARG 16 HD2 ARG 16 12.585 3.950 4.194 933 2HD ARG 16 HD3 ARG 16 14.108 3.127 4.453 934 HE ARG 16 HE ARG 16 13.441 2.402 6.539 935 1HH1 ARG 16 HH11 ARG 16 10.807 4.623 5.437 936 2HH1 ARG 16 HH12 ARG 16 9.686 3.786 6.464 937 1HH2 ARG 16 HH21 ARG 16 11.940 1.453 7.723 938 2HH2 ARG 16 HH22 ARG 16 10.307 2.094 7.828 939 H SER 17 HN SER 17 10.987 8.193 5.310 940 HA SER 17 HA SER 17 11.578 10.213 3.440 941 1HB SER 17 HB2 SER 17 9.094 9.933 5.145 942 2HB SER 17 HB3 SER 17 9.235 10.706 3.573 943 HG SER 17 HG SER 17 8.414 8.605 3.324 944 H GLN 18 HN GLN 18 11.087 10.351 6.954 945 HA GLN 18 HA GLN 18 10.837 13.107 7.382 946 1HB GLN 18 HB2 GLN 18 12.150 10.910 9.044 947 2HB GLN 18 HB3 GLN 18 11.922 12.511 9.625 948 1HG GLN 18 HG2 GLN 18 10.331 10.888 10.510 949 2HG GLN 18 HG3 GLN 18 9.530 12.252 9.724 950 1HE2 GLN 18 HE22 GLN 18 7.468 11.133 9.293 951 2HE2 GLN 18 HE21 GLN 18 7.397 9.838 8.129 952 H MET 19 HN MET 19 13.764 10.987 7.402 953 HA MET 19 HA MET 19 15.512 13.199 7.833 954 1HB MET 19 HB2 MET 19 17.332 11.732 7.471 955 2HB MET 19 HB3 MET 19 16.147 10.952 8.497 956 1HG MET 19 HG2 MET 19 15.597 9.388 6.812 957 2HG MET 19 HG3 MET 19 16.241 10.402 5.526 958 1HE MET 19 HE1 MET 19 18.519 7.575 8.251 959 2HE MET 19 HE2 MET 19 17.105 8.578 8.726 960 3HE MET 19 HE3 MET 19 16.938 7.322 7.451 961 H ALA 20 HN ALA 20 14.360 11.493 4.894 962 HA ALA 20 HA ALA 20 16.027 12.787 3.033 963 1HB ALA 20 HB1 ALA 20 14.477 11.964 1.364 964 2HB ALA 20 HB2 ALA 20 14.799 10.720 2.576 965 3HB ALA 20 HB3 ALA 20 13.259 11.620 2.609 966 H GLU 21 HN GLU 21 12.773 13.769 4.246 967 HA GLU 21 HA GLU 21 12.720 16.026 2.495 968 1HB GLU 21 HB2 GLU 21 10.737 16.686 3.524 969 2HB GLU 21 HB3 GLU 21 10.699 14.923 3.489 970 1HG GLU 21 HG2 GLU 21 11.236 14.830 5.858 971 2HG GLU 21 HG3 GLU 21 11.449 16.588 5.909 972 H GLY 22 HN GLY 22 14.109 15.554 5.712 973 1HA GLY 22 HA2 GLY 22 14.694 18.333 6.246 974 2HA GLY 22 HA3 GLY 22 15.528 16.913 6.911 975 H TRP 23 HN TRP 23 16.601 15.633 4.794 976 HA TRP 23 HA TRP 23 18.858 17.098 3.948 977 1HB TRP 23 HB2 TRP 23 17.509 14.516 3.164 978 2HB TRP 23 HB3 TRP 23 18.662 15.198 2.027 979 HD1 TRP 23 HD1 TRP 23 18.525 13.191 5.121 980 HE1 TRP 23 HE1 TRP 23 20.841 12.780 6.065 981 HE3 TRP 23 HE3 TRP 23 21.165 16.382 2.137 982 HZ2 TRP 23 HZ2 TRP 23 23.561 13.711 5.591 983 HZ3 TRP 23 HZ3 TRP 23 23.642 16.544 2.350 984 HH2 TRP 23 HH2 TRP 23 24.839 15.229 4.083 985 H ALA 24 HN ALA 24 15.696 16.641 2.380 986 HA ALA 24 HA ALA 24 16.452 17.578 -0.121 987 1HB ALA 24 HB1 ALA 24 14.276 16.393 0.366 988 2HB ALA 24 HB2 ALA 24 13.691 17.840 1.209 989 3HB ALA 24 HB3 ALA 24 14.014 17.909 -0.516 990 H LYS 25 HN LYS 25 14.936 19.440 2.627 991 HA LYS 25 HA LYS 25 14.608 21.687 0.942 992 1HB LYS 25 HB2 LYS 25 13.817 20.983 3.621 993 2HB LYS 25 HB3 LYS 25 14.607 22.557 3.704 994 1HG LYS 25 HG2 LYS 25 12.252 22.922 3.282 995 2HG LYS 25 HG3 LYS 25 13.161 23.364 1.833 996 1HD LYS 25 HD2 LYS 25 12.610 20.964 0.961 997 2HD LYS 25 HD3 LYS 25 11.553 20.828 2.351 998 1HE LYS 25 HE2 LYS 25 10.309 21.416 0.324 999 2HE LYS 25 HE3 LYS 25 10.175 22.709 1.520 1000 1HZ LYS 25 HZ1 LYS 25 12.171 22.823 -0.685 1001 2HZ LYS 25 HZ2 LYS 25 10.643 23.372 -0.876 1002 3HZ LYS 25 HZ3 LYS 25 11.625 24.044 0.251 1003 H GLN 26 HN GLN 26 17.445 20.786 2.761 1004 HA GLN 26 HA GLN 26 18.537 23.424 2.572 1005 1HB GLN 26 HB2 GLN 26 20.639 22.552 3.203 1006 2HB GLN 26 HB3 GLN 26 19.389 21.912 4.266 1007 1HG GLN 26 HG2 GLN 26 19.603 19.740 3.471 1008 2HG GLN 26 HG3 GLN 26 20.162 20.243 1.889 1009 1HE2 GLN 26 HE22 GLN 26 21.692 18.378 2.431 1010 2HE2 GLN 26 HE21 GLN 26 23.192 18.803 3.211 1011 H TYR 27 HN TYR 27 17.993 21.122 0.081 1012 HA TYR 27 HA TYR 27 19.781 22.676 -1.729 1013 1HB TYR 27 HB2 TYR 27 19.561 19.696 -1.345 1014 2HB TYR 27 HB3 TYR 27 19.805 20.297 -2.968 1015 HD1 TYR 27 HD1 TYR 27 21.449 19.654 0.194 1016 HD2 TYR 27 HD2 TYR 27 21.749 21.768 -3.548 1017 HE1 TYR 27 HE1 TYR 27 23.841 20.090 0.652 1018 HE2 TYR 27 HE2 TYR 27 24.165 22.159 -3.138 1019 HH TYR 27 HH TYR 27 25.812 21.088 -0.124 1020 H LEU 28 HN LEU 28 16.577 21.606 -1.155 1021 HA LEU 28 HA LEU 28 15.752 22.145 -3.943 1022 1HB LEU 28 HB2 LEU 28 14.468 20.300 -1.866 1023 2HB LEU 28 HB3 LEU 28 13.744 20.775 -3.389 1024 HG LEU 28 HG LEU 28 16.144 18.979 -2.972 1025 1HD1 LEU 28 HD11 LEU 28 13.834 18.010 -2.729 1026 2HD1 LEU 28 HD12 LEU 28 13.453 18.561 -4.367 1027 3HD1 LEU 28 HD13 LEU 28 14.708 17.335 -4.110 1028 1HD2 LEU 28 HD21 LEU 28 15.057 20.053 -5.615 1029 2HD2 LEU 28 HD22 LEU 28 16.662 20.375 -4.919 1030 3HD2 LEU 28 HD23 LEU 28 16.245 18.744 -5.426 1031 H GLY 29 HN GLY 29 15.616 24.305 -3.441 1032 1HA GLY 29 HA2 GLY 29 14.609 25.575 -1.141 1033 2HA GLY 29 HA3 GLY 29 14.780 26.298 -2.747 1034 H ASP 30 HN ASP 30 12.819 27.498 -1.892 1035 HA ASP 30 HA ASP 30 10.272 26.337 -1.556 1036 1HB ASP 30 HB2 ASP 30 10.860 28.647 -0.949 1037 2HB ASP 30 HB3 ASP 30 11.011 29.067 -2.658 1038 H GLU 31 HN GLU 31 12.123 26.661 -4.413 1039 HA GLU 31 HA GLU 31 10.259 26.572 -6.518 1040 1HB GLU 31 HB2 GLU 31 12.661 26.847 -6.787 1041 2HB GLU 31 HB3 GLU 31 12.975 25.266 -6.074 1042 1HG GLU 31 HG2 GLU 31 11.928 24.159 -8.002 1043 2HG GLU 31 HG3 GLU 31 11.506 25.728 -8.697 1044 H TRP 32 HN TRP 32 10.940 24.217 -3.998 1045 HA TRP 32 HA TRP 32 9.242 22.175 -5.329 1046 1HB TRP 32 HB2 TRP 32 11.634 21.693 -3.532 1047 2HB TRP 32 HB3 TRP 32 10.655 20.467 -4.329 1048 HD1 TRP 32 HD1 TRP 32 13.290 23.130 -5.064 1049 HE1 TRP 32 HE1 TRP 32 14.227 22.856 -7.426 1050 HE3 TRP 32 HE3 TRP 32 10.315 19.287 -6.678 1051 HZ2 TRP 32 HZ2 TRP 32 13.938 21.033 -9.619 1052 HZ3 TRP 32 HZ3 TRP 32 10.637 18.335 -8.947 1053 HH2 TRP 32 HH2 TRP 32 12.446 19.187 -10.427 1054 H LYS 33 HN LYS 33 8.002 20.874 -3.892 1055 HA LYS 33 HA LYS 33 7.849 21.697 -1.052 1056 1HB LYS 33 HB2 LYS 33 5.850 22.348 -2.953 1057 2HB LYS 33 HB3 LYS 33 5.250 20.864 -2.232 1058 1HG LYS 33 HG2 LYS 33 6.081 23.397 -0.747 1059 2HG LYS 33 HG3 LYS 33 4.428 22.930 -1.118 1060 1HD LYS 33 HD2 LYS 33 6.311 21.389 0.732 1061 2HD LYS 33 HD3 LYS 33 5.045 22.504 1.238 1062 1HE LYS 33 HE2 LYS 33 3.306 21.099 0.263 1063 2HE LYS 33 HE3 LYS 33 4.506 19.980 -0.395 1064 1HZ LYS 33 HZ1 LYS 33 3.476 19.254 1.712 1065 2HZ LYS 33 HZ2 LYS 33 5.106 19.313 1.802 1066 3HZ LYS 33 HZ3 LYS 33 4.184 20.485 2.505 1067 H VAL 34 HN VAL 34 7.796 19.840 0.251 1068 HA VAL 34 HA VAL 34 7.880 17.273 -1.222 1069 HB VAL 34 HB VAL 34 10.019 18.325 -0.635 1070 1HG1 VAL 34 HG11 VAL 34 10.834 18.378 1.671 1071 2HG1 VAL 34 HG12 VAL 34 9.459 19.468 1.449 1072 3HG1 VAL 34 HG13 VAL 34 9.223 17.914 2.264 1073 1HG2 VAL 34 HG21 VAL 34 9.778 15.857 -0.870 1074 2HG2 VAL 34 HG22 VAL 34 11.114 16.388 0.154 1075 3HG2 VAL 34 HG23 VAL 34 9.622 15.744 0.899 1076 H TYR 35 HN TYR 35 7.172 15.384 -0.082 1077 HA TYR 35 HA TYR 35 5.796 15.744 2.499 1078 1HB TYR 35 HB2 TYR 35 4.186 16.168 0.526 1079 2HB TYR 35 HB3 TYR 35 4.397 14.476 0.121 1080 HD1 TYR 35 HD1 TYR 35 3.340 12.720 1.526 1081 HD2 TYR 35 HD2 TYR 35 3.046 16.884 2.600 1082 HE1 TYR 35 HE1 TYR 35 1.488 12.179 3.064 1083 HE2 TYR 35 HE2 TYR 35 1.200 16.354 4.163 1084 HH TYR 35 HH TYR 35 -0.082 13.025 4.575 1085 H SER 36 HN SER 36 5.120 13.555 3.345 1086 HA SER 36 HA SER 36 7.002 11.369 2.608 1087 1HB SER 36 HB2 SER 36 6.640 12.855 5.261 1088 2HB SER 36 HB3 SER 36 7.511 11.332 5.112 1089 HG SER 36 HG SER 36 8.489 13.697 4.859 1090 H ALA 37 HN ALA 37 5.793 9.420 2.579 1091 HA ALA 37 HA ALA 37 3.752 9.054 4.654 1092 1HB ALA 37 HB1 ALA 37 3.153 8.557 1.738 1093 2HB ALA 37 HB2 ALA 37 2.021 8.618 3.095 1094 3HB ALA 37 HB3 ALA 37 2.743 10.116 2.498 1095 H GLY 38 HN GLY 38 2.719 6.723 4.131 1096 1HA GLY 38 HA2 GLY 38 3.959 4.731 2.646 1097 2HA GLY 38 HA3 GLY 38 4.779 4.758 4.213 1098 H ILE 39 HN ILE 39 3.774 2.512 4.365 1099 HA ILE 39 HA ILE 39 1.007 2.321 5.025 1100 HB ILE 39 HB ILE 39 2.326 0.455 4.029 1101 1HG1 ILE 39 HG12 ILE 39 1.473 -0.262 6.849 1102 2HG1 ILE 39 HG13 ILE 39 0.290 0.256 5.638 1103 1HG2 ILE 39 HG21 ILE 39 3.945 -0.794 5.387 1104 2HG2 ILE 39 HG22 ILE 39 4.491 0.877 5.141 1105 3HG2 ILE 39 HG23 ILE 39 3.786 0.365 6.702 1106 1HD1 ILE 39 HD11 ILE 39 2.015 -2.220 5.639 1107 2HD1 ILE 39 HD12 ILE 39 0.243 -2.081 5.613 1108 3HD1 ILE 39 HD13 ILE 39 1.180 -1.626 4.185 1109 H GLU 40 HN GLU 40 0.580 1.989 6.988 1110 HA GLU 40 HA GLU 40 0.199 2.757 9.264 1111 1HB GLU 40 HB2 GLU 40 2.446 0.706 9.194 1112 2HB GLU 40 HB3 GLU 40 1.668 1.188 10.702 1113 1HG GLU 40 HG2 GLU 40 0.015 0.119 8.395 1114 2HG GLU 40 HG3 GLU 40 0.869 -0.955 9.492 1115 H ALA 41 HN ALA 41 1.143 4.924 8.436 1116 HA ALA 41 HA ALA 41 3.755 5.599 9.699 1117 1HB ALA 41 HB1 ALA 41 3.770 7.290 7.821 1118 2HB ALA 41 HB2 ALA 41 3.764 5.584 7.274 1119 3HB ALA 41 HB3 ALA 41 2.293 6.551 7.214 1120 H HIS 42 HN HIS 42 3.889 7.296 10.966 1121 HA HIS 42 HA HIS 42 2.735 9.695 10.784 1122 1HB HIS 42 HB2 HIS 42 1.134 9.871 12.733 1123 2HB HIS 42 HB3 HIS 42 0.487 8.949 11.415 1124 HD1 HIS 42 HD1 HIS 42 1.874 8.420 14.984 1125 HD2 HIS 42 HD2 HIS 42 -0.103 6.374 11.876 1126 HE1 HIS 42 HE1 HIS 42 1.123 6.193 15.958 1127 H GLY 43 HN GLY 43 4.803 7.516 12.246 1128 1HA GLY 43 HA2 GLY 43 5.294 8.897 14.733 1129 2HA GLY 43 HA3 GLY 43 6.229 7.596 13.986 1130 H LEU 44 HN LEU 44 7.637 9.473 15.156 1131 HA LEU 44 HA LEU 44 9.168 10.581 12.911 1132 1HB LEU 44 HB2 LEU 44 7.958 12.550 13.694 1133 2HB LEU 44 HB3 LEU 44 8.370 12.195 15.373 1134 HG LEU 44 HG LEU 44 10.753 12.631 14.926 1135 1HD1 LEU 44 HD11 LEU 44 9.877 13.210 12.065 1136 2HD1 LEU 44 HD12 LEU 44 11.456 13.642 12.752 1137 3HD1 LEU 44 HD13 LEU 44 11.009 11.943 12.606 1138 1HD2 LEU 44 HD21 LEU 44 8.936 14.847 13.903 1139 2HD2 LEU 44 HD22 LEU 44 9.317 14.498 15.601 1140 3HD2 LEU 44 HD23 LEU 44 10.593 15.052 14.508 1141 H ASN 45 HN ASN 45 10.343 8.716 13.204 1142 HA ASN 45 HA ASN 45 11.039 7.480 15.640 1143 1HB ASN 45 HB2 ASN 45 11.086 6.431 13.402 1144 2HB ASN 45 HB3 ASN 45 12.428 7.473 12.921 1145 1HD2 ASN 45 HD22 ASN 45 12.661 4.678 12.660 1146 2HD2 ASN 45 HD21 ASN 45 13.809 4.117 13.841 1147 HA PRO 46 HA PRO 46 14.045 10.553 16.982 1148 1HB PRO 46 HB2 PRO 46 15.432 9.103 18.897 1149 2HB PRO 46 HB3 PRO 46 13.870 9.943 19.140 1150 1HG PRO 46 HG2 PRO 46 14.341 7.020 18.489 1151 2HG PRO 46 HG3 PRO 46 13.241 7.716 19.723 1152 1HD PRO 46 HD2 PRO 46 12.312 6.910 17.319 1153 2HD PRO 46 HD3 PRO 46 11.687 8.410 18.064 1154 H ASN 47 HN ASN 47 14.898 7.380 15.625 1155 HA ASN 47 HA ASN 47 17.686 7.914 15.133 1156 1HB ASN 47 HB2 ASN 47 16.987 5.703 14.529 1157 2HB ASN 47 HB3 ASN 47 15.605 6.308 13.609 1158 1HD2 ASN 47 HD22 ASN 47 16.132 5.479 11.485 1159 2HD2 ASN 47 HD21 ASN 47 17.442 6.275 10.623 1160 H ALA 48 HN ALA 48 14.678 8.762 13.196 1161 HA ALA 48 HA ALA 48 16.206 9.916 11.113 1162 1HB ALA 48 HB1 ALA 48 14.061 11.108 10.505 1163 2HB ALA 48 HB2 ALA 48 13.922 9.368 10.717 1164 3HB ALA 48 HB3 ALA 48 13.317 10.471 11.981 1165 H VAL 49 HN VAL 49 14.849 11.260 14.118 1166 HA VAL 49 HA VAL 49 15.515 13.996 13.648 1167 HB VAL 49 HB VAL 49 15.487 12.590 16.351 1168 1HG1 VAL 49 HG11 VAL 49 16.429 14.881 16.408 1169 2HG1 VAL 49 HG12 VAL 49 14.983 15.503 15.579 1170 3HG1 VAL 49 HG13 VAL 49 14.857 14.819 17.212 1171 1HG2 VAL 49 HG21 VAL 49 13.168 13.851 14.819 1172 2HG2 VAL 49 HG22 VAL 49 13.346 12.130 15.219 1173 3HG2 VAL 49 HG23 VAL 49 13.116 13.299 16.510 1174 H LYS 50 HN LYS 50 17.419 11.401 15.293 1175 HA LYS 50 HA LYS 50 19.751 12.973 15.736 1176 1HB LYS 50 HB2 LYS 50 19.362 10.890 16.910 1177 2HB LYS 50 HB3 LYS 50 19.356 9.968 15.403 1178 1HG LYS 50 HG2 LYS 50 21.724 10.427 15.034 1179 2HG LYS 50 HG3 LYS 50 21.774 11.498 16.449 1180 1HD LYS 50 HD2 LYS 50 21.299 9.610 17.935 1181 2HD LYS 50 HD3 LYS 50 21.104 8.518 16.544 1182 1HE LYS 50 HE2 LYS 50 23.436 8.853 15.889 1183 2HE LYS 50 HE3 LYS 50 23.662 10.060 17.163 1184 1HZ LYS 50 HZ1 LYS 50 23.092 7.189 17.631 1185 2HZ LYS 50 HZ2 LYS 50 24.543 7.919 17.824 1186 3HZ LYS 50 HZ3 LYS 50 23.298 8.311 18.802 1187 H ALA 51 HN ALA 51 18.775 10.940 13.008 1188 HA ALA 51 HA ALA 51 21.060 10.803 11.502 1189 1HB ALA 51 HB1 ALA 51 18.222 11.008 10.454 1190 2HB ALA 51 HB2 ALA 51 19.606 10.294 9.632 1191 3HB ALA 51 HB3 ALA 51 18.989 9.536 11.101 1192 H MET 52 HN MET 52 18.651 13.464 11.731 1193 HA MET 52 HA MET 52 20.036 15.021 9.665 1194 1HB MET 52 HB2 MET 52 17.471 15.516 11.256 1195 2HB MET 52 HB3 MET 52 18.075 16.506 9.922 1196 1HG MET 52 HG2 MET 52 17.043 13.678 9.794 1197 2HG MET 52 HG3 MET 52 16.433 15.107 8.973 1198 1HE MET 52 HE1 MET 52 19.142 15.778 6.276 1199 2HE MET 52 HE2 MET 52 17.729 16.357 7.197 1200 3HE MET 52 HE3 MET 52 19.356 16.323 7.945 1201 H LYS 53 HN LYS 53 19.550 15.069 13.214 1202 HA LYS 53 HA LYS 53 20.806 17.594 13.633 1203 1HB LYS 53 HB2 LYS 53 20.786 15.063 15.340 1204 2HB LYS 53 HB3 LYS 53 21.402 16.606 15.910 1205 1HG LYS 53 HG2 LYS 53 18.546 16.327 14.903 1206 2HG LYS 53 HG3 LYS 53 18.998 15.928 16.560 1207 1HD LYS 53 HD2 LYS 53 19.735 18.217 16.965 1208 2HD LYS 53 HD3 LYS 53 19.448 18.649 15.260 1209 1HE LYS 53 HE2 LYS 53 17.062 18.131 15.485 1210 2HE LYS 53 HE3 LYS 53 17.288 17.583 17.146 1211 1HZ LYS 53 HZ1 LYS 53 17.632 19.767 17.858 1212 2HZ LYS 53 HZ2 LYS 53 17.940 20.351 16.359 1213 3HZ LYS 53 HZ3 LYS 53 16.419 19.902 16.749 1214 H GLU 54 HN GLU 54 22.213 14.397 12.843 1215 HA GLU 54 HA GLU 54 24.891 15.002 13.501 1216 1HB GLU 54 HB2 GLU 54 23.750 13.255 11.297 1217 2HB GLU 54 HB3 GLU 54 25.473 13.404 11.609 1218 1HG GLU 54 HG2 GLU 54 24.691 12.755 14.117 1219 2HG GLU 54 HG3 GLU 54 23.388 11.980 13.206 1220 H VAL 55 HN VAL 55 22.991 15.973 10.662 1221 HA VAL 55 HA VAL 55 25.333 17.471 9.614 1222 HB VAL 55 HB VAL 55 24.071 17.526 7.486 1223 1HG1 VAL 55 HG11 VAL 55 24.637 15.279 6.855 1224 2HG1 VAL 55 HG12 VAL 55 25.821 15.822 8.040 1225 3HG1 VAL 55 HG13 VAL 55 24.533 14.700 8.531 1226 1HG2 VAL 55 HG21 VAL 55 22.181 16.067 7.076 1227 2HG2 VAL 55 HG22 VAL 55 22.187 15.475 8.746 1228 3HG2 VAL 55 HG23 VAL 55 21.752 17.164 8.396 1229 H GLY 56 HN GLY 56 23.256 18.131 11.864 1230 1HA GLY 56 HA2 GLY 56 22.548 20.078 12.769 1231 2HA GLY 56 HA3 GLY 56 23.497 20.927 11.539 1232 H ILE 57 HN ILE 57 20.642 18.722 11.021 1233 HA ILE 57 HA ILE 57 19.099 21.105 10.031 1234 HB ILE 57 HB ILE 57 19.103 18.276 8.948 1235 1HG1 ILE 57 HG12 ILE 57 19.978 20.933 7.730 1236 2HG1 ILE 57 HG13 ILE 57 21.031 19.600 8.198 1237 1HG2 ILE 57 HG21 ILE 57 16.804 19.279 8.998 1238 2HG2 ILE 57 HG22 ILE 57 17.413 20.677 8.089 1239 3HG2 ILE 57 HG23 ILE 57 17.391 19.066 7.357 1240 1HD1 ILE 57 HD11 ILE 57 19.069 19.629 5.889 1241 2HD1 ILE 57 HD12 ILE 57 20.834 19.517 5.854 1242 3HD1 ILE 57 HD13 ILE 57 19.894 18.158 6.470 1243 H ASP 58 HN ASP 58 17.752 21.518 11.760 1244 HA ASP 58 HA ASP 58 16.898 19.413 13.596 1245 1HB ASP 58 HB2 ASP 58 17.029 21.691 14.444 1246 2HB ASP 58 HB3 ASP 58 15.918 22.266 13.190 1247 H ILE 59 HN ILE 59 15.035 18.236 13.503 1248 HA ILE 59 HA ILE 59 12.923 19.026 11.596 1249 HB ILE 59 HB ILE 59 12.493 16.814 10.909 1250 1HG1 ILE 59 HG12 ILE 59 15.085 15.836 12.208 1251 2HG1 ILE 59 HG13 ILE 59 13.480 15.578 12.893 1252 1HG2 ILE 59 HG21 ILE 59 15.437 17.454 10.353 1253 2HG2 ILE 59 HG22 ILE 59 14.351 16.529 9.300 1254 3HG2 ILE 59 HG23 ILE 59 14.057 18.253 9.570 1255 1HD1 ILE 59 HD11 ILE 59 14.021 13.583 11.736 1256 2HD1 ILE 59 HD12 ILE 59 12.804 14.411 10.762 1257 3HD1 ILE 59 HD13 ILE 59 14.513 14.449 10.271 1258 H SER 60 HN SER 60 13.509 18.937 14.708 1259 HA SER 60 HA SER 60 11.845 16.938 15.750 1260 1HB SER 60 HB2 SER 60 12.363 19.663 17.006 1261 2HB SER 60 HB3 SER 60 12.027 18.132 17.837 1262 HG SER 60 HG SER 60 14.337 18.955 16.405 1263 H ASN 61 HN ASN 61 10.913 19.745 14.033 1264 HA ASN 61 HA ASN 61 8.277 20.076 15.191 1265 1HB ASN 61 HB2 ASN 61 9.588 21.981 14.279 1266 2HB ASN 61 HB3 ASN 61 9.555 21.233 12.680 1267 1HD2 ASN 61 HD22 ASN 61 7.964 22.075 11.339 1268 2HD2 ASN 61 HD21 ASN 61 6.463 22.767 11.891 1269 H GLN 62 HN GLN 62 9.645 17.934 12.738 1270 HA GLN 62 HA GLN 62 7.792 18.014 10.777 1271 1HB GLN 62 HB2 GLN 62 9.628 15.869 11.776 1272 2HB GLN 62 HB3 GLN 62 8.398 15.438 10.587 1273 1HG GLN 62 HG2 GLN 62 9.117 17.333 9.131 1274 2HG GLN 62 HG3 GLN 62 10.412 17.687 10.280 1275 1HE2 GLN 62 HE22 GLN 62 11.861 17.315 8.488 1276 2HE2 GLN 62 HE21 GLN 62 12.287 15.662 8.004 1277 H THR 63 HN THR 63 6.128 16.821 10.080 1278 HA THR 63 HA THR 63 4.519 15.161 11.945 1279 HB THR 63 HB THR 63 2.534 16.092 10.715 1280 HG1 THR 63 HG1 THR 63 3.467 16.862 8.827 1281 1HG2 THR 63 HG21 THR 63 3.325 17.092 12.880 1282 2HG2 THR 63 HG22 THR 63 4.305 18.248 11.947 1283 3HG2 THR 63 HG23 THR 63 2.529 18.275 11.824 1284 H SER 64 HN SER 64 3.213 13.495 10.792 1285 HA SER 64 HA SER 64 4.292 12.534 8.211 1286 1HB SER 64 HB2 SER 64 4.358 10.940 10.789 1287 2HB SER 64 HB3 SER 64 5.034 10.445 9.234 1288 HG SER 64 HG SER 64 6.389 11.271 11.072 1289 H ASP 65 HN ASP 65 2.889 10.682 7.407 1290 HA ASP 65 HA ASP 65 0.471 9.960 8.827 1291 1HB ASP 65 HB2 ASP 65 -0.061 12.278 7.918 1292 2HB ASP 65 HB3 ASP 65 0.241 11.644 6.299 1293 H ILE 66 HN ILE 66 -0.914 8.505 7.244 1294 HA ILE 66 HA ILE 66 0.803 6.711 5.763 1295 HB ILE 66 HB ILE 66 -1.461 5.713 5.159 1296 1HG1 ILE 66 HG12 ILE 66 -2.569 7.479 7.359 1297 2HG1 ILE 66 HG13 ILE 66 -2.709 7.910 5.643 1298 1HG2 ILE 66 HG21 ILE 66 -1.679 4.641 7.363 1299 2HG2 ILE 66 HG22 ILE 66 0.015 4.851 6.922 1300 3HG2 ILE 66 HG23 ILE 66 -0.739 5.950 8.111 1301 1HD1 ILE 66 HD11 ILE 66 -3.787 5.393 6.953 1302 2HD1 ILE 66 HD12 ILE 66 -4.716 6.795 6.386 1303 3HD1 ILE 66 HD13 ILE 66 -3.864 5.767 5.208 1304 H ILE 67 HN ILE 67 0.049 5.989 3.531 1305 HA ILE 67 HA ILE 67 0.561 7.821 1.569 1306 HB ILE 67 HB ILE 67 0.082 6.231 0.024 1307 1HG1 ILE 67 HG12 ILE 67 -2.282 5.204 1.625 1308 2HG1 ILE 67 HG13 ILE 67 -2.326 6.227 0.186 1309 1HG2 ILE 67 HG21 ILE 67 0.177 4.387 2.417 1310 2HG2 ILE 67 HG22 ILE 67 0.777 4.126 0.768 1311 3HG2 ILE 67 HG23 ILE 67 1.556 5.336 1.789 1312 1HD1 ILE 67 HD11 ILE 67 -1.014 4.148 -0.914 1313 2HD1 ILE 67 HD12 ILE 67 -1.898 3.302 0.359 1314 3HD1 ILE 67 HD13 ILE 67 -2.784 4.278 -0.842 1315 H ASP 68 HN ASP 68 -0.477 9.429 0.564 1316 HA ASP 68 HA ASP 68 -3.390 9.793 0.998 1317 1HB ASP 68 HB2 ASP 68 -2.136 10.953 2.821 1318 2HB ASP 68 HB3 ASP 68 -1.389 11.998 1.595 1319 H SER 69 HN SER 69 -3.757 9.341 -1.100 1320 HA SER 69 HA SER 69 -2.593 10.226 -3.392 1321 1HB SER 69 HB2 SER 69 -5.553 10.085 -2.799 1322 2HB SER 69 HB3 SER 69 -4.785 9.843 -4.385 1323 HG SER 69 HG SER 69 -3.801 7.973 -3.537 1324 H ASP 70 HN ASP 70 -4.222 12.438 -1.126 1325 HA ASP 70 HA ASP 70 -5.273 14.140 -3.233 1326 1HB ASP 70 HB2 ASP 70 -6.356 14.103 -1.038 1327 2HB ASP 70 HB3 ASP 70 -4.874 14.710 -0.284 1328 H ILE 71 HN ILE 71 -2.310 13.807 -1.391 1329 HA ILE 71 HA ILE 71 -1.177 16.181 -2.771 1330 HB ILE 71 HB ILE 71 0.799 15.063 -1.195 1331 1HG1 ILE 71 HG12 ILE 71 -0.580 13.757 0.193 1332 2HG1 ILE 71 HG13 ILE 71 0.243 15.053 1.031 1333 1HG2 ILE 71 HG21 ILE 71 0.559 17.396 -1.720 1334 2HG2 ILE 71 HG22 ILE 71 -0.899 17.523 -0.709 1335 3HG2 ILE 71 HG23 ILE 71 0.686 17.198 0.035 1336 1HD1 ILE 71 HD11 ILE 71 -1.889 14.889 2.026 1337 2HD1 ILE 71 HD12 ILE 71 -1.972 16.345 1.023 1338 3HD1 ILE 71 HD13 ILE 71 -2.731 14.824 0.483 1339 H LEU 72 HN LEU 72 -0.754 12.584 -2.346 1340 HA LEU 72 HA LEU 72 1.596 12.548 -3.905 1341 1HB LEU 72 HB2 LEU 72 0.939 10.615 -2.542 1342 2HB LEU 72 HB3 LEU 72 -0.407 10.270 -3.593 1343 HG LEU 72 HG LEU 72 2.220 10.576 -5.013 1344 1HD1 LEU 72 HD11 LEU 72 1.926 8.576 -2.822 1345 2HD1 LEU 72 HD12 LEU 72 2.802 8.131 -4.314 1346 3HD1 LEU 72 HD13 LEU 72 3.311 9.517 -3.370 1347 1HD2 LEU 72 HD21 LEU 72 1.420 8.447 -6.121 1348 2HD2 LEU 72 HD22 LEU 72 -0.073 8.587 -5.162 1349 3HD2 LEU 72 HD23 LEU 72 0.367 9.830 -6.333 1350 H ASN 73 HN ASN 73 -1.855 12.070 -5.038 1351 HA ASN 73 HA ASN 73 -0.936 11.444 -7.635 1352 1HB ASN 73 HB2 ASN 73 -3.078 11.237 -8.288 1353 2HB ASN 73 HB3 ASN 73 -3.399 11.230 -6.565 1354 1HD2 ASN 73 HD22 ASN 73 -4.109 13.387 -5.607 1355 2HD2 ASN 73 HD21 ASN 73 -4.937 14.536 -6.644 1356 H ASN 74 HN ASN 74 -1.433 14.517 -5.996 1357 HA ASN 74 HA ASN 74 -1.305 16.188 -8.356 1358 1HB ASN 74 HB2 ASN 74 -1.383 16.665 -5.364 1359 2HB ASN 74 HB3 ASN 74 -0.849 17.956 -6.413 1360 1HD2 ASN 74 HD22 ASN 74 -3.612 16.791 -4.948 1361 2HD2 ASN 74 HD21 ASN 74 -4.781 17.490 -6.047 1362 H ALA 75 HN ALA 75 1.109 14.478 -6.551 1363 HA ALA 75 HA ALA 75 3.213 16.410 -6.746 1364 1HB ALA 75 HB1 ALA 75 3.430 13.386 -6.463 1365 2HB ALA 75 HB2 ALA 75 4.659 14.593 -6.067 1366 3HB ALA 75 HB3 ALA 75 3.168 14.504 -5.108 1367 H ASP 76 HN ASP 76 5.121 16.081 -8.033 1368 HA ASP 76 HA ASP 76 4.540 15.287 -10.846 1369 1HB ASP 76 HB2 ASP 76 5.866 17.356 -10.367 1370 2HB ASP 76 HB3 ASP 76 7.108 16.348 -9.602 1371 H LEU 77 HN LEU 77 6.443 14.218 -7.998 1372 HA LEU 77 HA LEU 77 7.197 11.776 -9.421 1373 1HB LEU 77 HB2 LEU 77 8.872 13.472 -9.906 1374 2HB LEU 77 HB3 LEU 77 9.110 13.799 -8.207 1375 HG LEU 77 HG LEU 77 10.862 12.497 -9.504 1376 1HD1 LEU 77 HD11 LEU 77 11.590 11.219 -7.662 1377 2HD1 LEU 77 HD12 LEU 77 10.766 12.656 -7.018 1378 3HD1 LEU 77 HD13 LEU 77 9.956 11.090 -6.985 1379 1HD2 LEU 77 HD21 LEU 77 10.720 10.224 -9.957 1380 2HD2 LEU 77 HD22 LEU 77 9.304 9.971 -8.936 1381 3HD2 LEU 77 HD23 LEU 77 9.121 10.834 -10.464 1382 H VAL 78 HN VAL 78 7.383 10.017 -8.164 1383 HA VAL 78 HA VAL 78 7.169 10.239 -5.191 1384 HB VAL 78 HB VAL 78 6.022 8.164 -7.074 1385 1HG1 VAL 78 HG11 VAL 78 4.956 7.231 -5.044 1386 2HG1 VAL 78 HG12 VAL 78 6.711 7.165 -4.898 1387 3HG1 VAL 78 HG13 VAL 78 5.803 8.423 -4.031 1388 1HG2 VAL 78 HG21 VAL 78 4.666 10.298 -5.369 1389 2HG2 VAL 78 HG22 VAL 78 4.769 10.277 -7.131 1390 3HG2 VAL 78 HG23 VAL 78 3.848 9.025 -6.304 1391 H VAL 79 HN VAL 79 9.074 9.942 -4.368 1392 HA VAL 79 HA VAL 79 11.032 8.044 -5.497 1393 HB VAL 79 HB VAL 79 11.032 9.828 -3.024 1394 1HG1 VAL 79 HG11 VAL 79 13.369 9.388 -2.732 1395 2HG1 VAL 79 HG12 VAL 79 12.603 7.803 -2.877 1396 3HG1 VAL 79 HG13 VAL 79 13.480 8.501 -4.249 1397 1HG2 VAL 79 HG21 VAL 79 11.104 11.229 -4.958 1398 2HG2 VAL 79 HG22 VAL 79 12.705 11.210 -4.228 1399 3HG2 VAL 79 HG23 VAL 79 12.403 10.247 -5.692 1400 H THR 80 HN THR 80 10.030 5.950 -5.182 1401 HA THR 80 HA THR 80 8.988 5.268 -2.539 1402 HB THR 80 HB THR 80 10.056 3.490 -4.771 1403 HG1 THR 80 HG1 THR 80 7.978 5.012 -4.695 1404 1HG2 THR 80 HG21 THR 80 8.684 1.724 -3.675 1405 2HG2 THR 80 HG22 THR 80 9.986 2.279 -2.612 1406 3HG2 THR 80 HG23 THR 80 8.325 2.851 -2.337 1407 H LEU 81 HN LEU 81 10.235 4.926 -0.735 1408 HA LEU 81 HA LEU 81 13.196 4.939 -1.066 1409 1HB LEU 81 HB2 LEU 81 12.091 7.196 -0.669 1410 2HB LEU 81 HB3 LEU 81 11.545 6.586 0.881 1411 HG LEU 81 HG LEU 81 13.991 6.221 1.511 1412 1HD1 LEU 81 HD11 LEU 81 15.708 7.386 0.189 1413 2HD1 LEU 81 HD12 LEU 81 14.970 6.122 -0.780 1414 3HD1 LEU 81 HD13 LEU 81 14.508 7.814 -1.045 1415 1HD2 LEU 81 HD21 LEU 81 12.659 8.219 2.182 1416 2HD2 LEU 81 HD22 LEU 81 14.378 8.573 1.973 1417 3HD2 LEU 81 HD23 LEU 81 13.217 9.061 0.723 1418 H SER 82 HN SER 82 12.487 2.511 -0.725 1419 HA SER 82 HA SER 82 13.539 1.909 1.867 1420 1HB SER 82 HB2 SER 82 10.716 0.971 1.105 1421 2HB SER 82 HB3 SER 82 11.692 0.180 2.356 1422 HG SER 82 HG SER 82 11.519 2.913 2.552 1423 H GLY 83 HN GLY 83 13.427 -0.793 1.858 1424 1HA GLY 83 HA2 GLY 83 13.614 -1.930 -0.845 1425 2HA GLY 83 HA3 GLY 83 15.058 -2.030 0.189 1426 H ASP 84 HN ASP 84 11.545 -2.215 1.022 1427 HA ASP 84 HA ASP 84 11.793 -5.023 1.819 1428 1HB ASP 84 HB2 ASP 84 12.417 -3.813 3.874 1429 2HB ASP 84 HB3 ASP 84 10.953 -2.830 3.755 1430 H ALA 85 HN ALA 85 9.677 -5.997 2.112 1431 HA ALA 85 HA ALA 85 7.904 -4.970 0.034 1432 1HB ALA 85 HB1 ALA 85 7.843 -7.564 1.636 1433 2HB ALA 85 HB2 ALA 85 6.910 -7.213 0.167 1434 3HB ALA 85 HB3 ALA 85 8.676 -7.321 0.079 1435 H ALA 86 HN ALA 86 7.848 -4.685 3.494 1436 HA ALA 86 HA ALA 86 5.071 -5.178 3.898 1437 1HB ALA 86 HB1 ALA 86 6.592 -5.294 5.765 1438 2HB ALA 86 HB2 ALA 86 7.065 -3.601 5.574 1439 3HB ALA 86 HB3 ALA 86 5.415 -4.003 6.085 1440 H ASP 87 HN ASP 87 6.586 -2.407 2.452 1441 HA ASP 87 HA ASP 87 4.736 -0.380 3.305 1442 1HB ASP 87 HB2 ASP 87 7.106 -0.052 2.586 1443 2HB ASP 87 HB3 ASP 87 6.596 -0.321 0.926 1444 H LYS 88 HN LYS 88 3.103 -2.444 2.390 1445 HA LYS 88 HA LYS 88 1.504 -3.142 0.952 1446 1HB LYS 88 HB2 LYS 88 1.248 -0.226 0.081 1447 2HB LYS 88 HB3 LYS 88 0.049 -1.508 -0.125 1448 1HG LYS 88 HG2 LYS 88 -0.069 -1.755 2.350 1449 2HG LYS 88 HG3 LYS 88 0.983 -0.316 2.473 1450 1HD LYS 88 HD2 LYS 88 -0.703 1.020 1.277 1451 2HD LYS 88 HD3 LYS 88 -1.783 -0.383 1.225 1452 1HE LYS 88 HE2 LYS 88 -0.664 0.829 3.796 1453 2HE LYS 88 HE3 LYS 88 -2.211 1.313 3.097 1454 1HZ LYS 88 HZ1 LYS 88 -2.459 -0.370 4.836 1455 2HZ LYS 88 HZ2 LYS 88 -3.049 -0.916 3.430 1456 3HZ LYS 88 HZ3 LYS 88 -1.604 -1.462 3.972 1457 H CYS 89 HN CYS 89 0.835 -2.118 -1.643 1458 HA CYS 89 HA CYS 89 3.217 -2.393 -3.364 1459 1HB CYS 89 HB2 CYS 89 1.485 -3.778 -4.874 1460 2HB CYS 89 HB3 CYS 89 2.508 -4.560 -3.704 1461 HA PRO 90 HA PRO 90 0.118 1.079 -3.658 1462 1HB PRO 90 HB2 PRO 90 2.506 2.814 -4.108 1463 2HB PRO 90 HB3 PRO 90 1.055 3.105 -3.087 1464 1HG PRO 90 HG2 PRO 90 3.414 2.384 -1.934 1465 2HG PRO 90 HG3 PRO 90 1.852 1.757 -1.349 1466 1HD PRO 90 HD2 PRO 90 3.837 0.436 -3.253 1467 2HD PRO 90 HD3 PRO 90 3.048 -0.252 -1.821 1468 H MET 91 HN MET 91 -0.900 1.474 -5.637 1469 HA MET 91 HA MET 91 0.642 0.618 -7.975 1470 1HB MET 91 HB2 MET 91 -1.531 0.517 -9.120 1471 2HB MET 91 HB3 MET 91 -1.423 -0.451 -7.644 1472 1HG MET 91 HG2 MET 91 -3.517 0.486 -7.663 1473 2HG MET 91 HG3 MET 91 -2.624 1.347 -6.433 1474 1HE MET 91 HE1 MET 91 -4.440 2.756 -6.423 1475 2HE MET 91 HE2 MET 91 -5.152 3.841 -7.729 1476 3HE MET 91 HE3 MET 91 -5.297 2.049 -7.800 1477 H THR 92 HN THR 92 0.500 3.479 -6.541 1478 HA THR 92 HA THR 92 0.608 5.662 -7.100 1479 HB THR 92 HB THR 92 2.627 6.002 -8.688 1480 HG1 THR 92 HG1 THR 92 2.497 3.891 -9.582 1481 1HG2 THR 92 HG21 THR 92 2.923 4.413 -6.099 1482 2HG2 THR 92 HG22 THR 92 4.164 5.444 -6.851 1483 3HG2 THR 92 HG23 THR 92 2.698 6.168 -6.211 1484 HA PRO 93 HA PRO 93 -2.325 5.837 -10.563 1485 1HB PRO 93 HB2 PRO 93 -3.466 8.289 -9.992 1486 2HB PRO 93 HB3 PRO 93 -3.853 6.805 -9.050 1487 1HG PRO 93 HG2 PRO 93 -1.795 8.895 -8.334 1488 2HG PRO 93 HG3 PRO 93 -3.140 8.241 -7.335 1489 1HD PRO 93 HD2 PRO 93 -0.698 7.206 -7.106 1490 2HD PRO 93 HD3 PRO 93 -2.102 6.092 -7.200 1491 HA PRO 94 HA PRO 94 0.866 7.407 -13.119 1492 1HB PRO 94 HB2 PRO 94 -0.391 7.689 -15.603 1493 2HB PRO 94 HB3 PRO 94 0.128 6.157 -14.842 1494 1HG PRO 94 HG2 PRO 94 -2.606 7.473 -14.717 1495 2HG PRO 94 HG3 PRO 94 -2.211 5.768 -15.129 1496 1HD PRO 94 HD2 PRO 94 -2.964 6.388 -12.636 1497 2HD PRO 94 HD3 PRO 94 -1.555 5.295 -12.885 1498 H HIS 95 HN HIS 95 -1.245 9.687 -12.056 1499 HA HIS 95 HA HIS 95 -0.537 11.911 -13.769 1500 1HB HIS 95 HB2 HIS 95 -2.500 11.782 -12.172 1501 2HB HIS 95 HB3 HIS 95 -1.358 11.918 -10.842 1502 HD1 HIS 95 HD1 HIS 95 0.366 14.334 -12.427 1503 HD2 HIS 95 HD2 HIS 95 -3.741 14.052 -11.555 1504 HE1 HIS 95 HE1 HIS 95 -0.533 16.727 -12.421 1505 H VAL 96 HN VAL 96 1.086 10.042 -11.233 1506 HA VAL 96 HA VAL 96 3.303 12.009 -11.074 1507 HB VAL 96 HB VAL 96 4.112 10.242 -9.364 1508 1HG1 VAL 96 HG11 VAL 96 2.724 11.271 -7.578 1509 2HG1 VAL 96 HG12 VAL 96 3.482 12.411 -8.691 1510 3HG1 VAL 96 HG13 VAL 96 1.744 12.047 -8.840 1511 1HG2 VAL 96 HG21 VAL 96 1.193 9.547 -9.058 1512 2HG2 VAL 96 HG22 VAL 96 2.326 8.502 -9.961 1513 3HG2 VAL 96 HG23 VAL 96 2.596 8.845 -8.251 1514 H LYS 97 HN LYS 97 5.394 11.415 -11.362 1515 HA LYS 97 HA LYS 97 6.060 9.092 -13.108 1516 1HB LYS 97 HB2 LYS 97 6.672 11.491 -13.663 1517 2HB LYS 97 HB3 LYS 97 7.671 11.522 -12.221 1518 1HG LYS 97 HG2 LYS 97 8.182 9.312 -14.196 1519 2HG LYS 97 HG3 LYS 97 8.517 10.942 -14.757 1520 1HD LYS 97 HD2 LYS 97 9.681 9.694 -12.268 1521 2HD LYS 97 HD3 LYS 97 10.509 9.805 -13.807 1522 1HE LYS 97 HE2 LYS 97 9.600 12.242 -12.167 1523 2HE LYS 97 HE3 LYS 97 11.236 11.590 -12.178 1524 1HZ LYS 97 HZ1 LYS 97 11.034 13.436 -13.700 1525 2HZ LYS 97 HZ2 LYS 97 11.360 12.089 -14.556 1526 3HZ LYS 97 HZ3 LYS 97 9.849 12.713 -14.547 1527 H ARG 98 HN ARG 98 7.869 7.682 -12.172 1528 HA ARG 98 HA ARG 98 8.223 7.914 -9.240 1529 1HB ARG 98 HB2 ARG 98 5.989 6.778 -9.608 1530 2HB ARG 98 HB3 ARG 98 6.836 5.516 -10.506 1531 1HG ARG 98 HG2 ARG 98 8.213 5.173 -8.272 1532 2HG ARG 98 HG3 ARG 98 6.938 6.161 -7.534 1533 1HD ARG 98 HD2 ARG 98 5.273 4.530 -8.481 1534 2HD ARG 98 HD3 ARG 98 6.610 3.544 -9.079 1535 HE ARG 98 HE ARG 98 7.252 3.833 -6.446 1536 1HH1 ARG 98 HH11 ARG 98 4.177 2.811 -7.906 1537 2HH1 ARG 98 HH12 ARG 98 3.830 1.647 -6.688 1538 1HH2 ARG 98 HH21 ARG 98 6.721 2.547 -4.773 1539 2HH2 ARG 98 HH22 ARG 98 5.364 1.450 -4.829 1540 H GLU 99 HN GLU 99 9.937 6.748 -8.459 1541 HA GLU 99 HA GLU 99 11.035 4.526 -9.850 1542 1HB GLU 99 HB2 GLU 99 12.174 6.309 -11.130 1543 2HB GLU 99 HB3 GLU 99 12.731 7.057 -9.647 1544 1HG GLU 99 HG2 GLU 99 14.501 5.769 -10.781 1545 2HG GLU 99 HG3 GLU 99 14.175 5.115 -9.185 1546 H HIS 100 HN HIS 100 12.570 3.477 -8.381 1547 HA HIS 100 HA HIS 100 12.079 4.200 -5.547 1548 1HB HIS 100 HB2 HIS 100 12.238 1.927 -4.949 1549 2HB HIS 100 HB3 HIS 100 11.071 2.052 -6.253 1550 HD1 HIS 100 HD1 HIS 100 13.128 1.725 -8.786 1551 HD2 HIS 100 HD2 HIS 100 12.990 -0.520 -5.209 1552 HE1 HIS 100 HE1 HIS 100 14.134 -0.537 -9.314 1553 H TRP 101 HN TRP 101 13.775 4.426 -4.184 1554 HA TRP 101 HA TRP 101 16.533 4.198 -5.314 1555 1HB TRP 101 HB2 TRP 101 15.259 6.636 -4.021 1556 2HB TRP 101 HB3 TRP 101 16.929 6.506 -4.540 1557 HD1 TRP 101 HD1 TRP 101 13.451 7.158 -5.897 1558 HE1 TRP 101 HE1 TRP 101 13.665 8.191 -8.227 1559 HE3 TRP 101 HE3 TRP 101 18.379 6.078 -6.848 1560 HZ2 TRP 101 HZ2 TRP 101 15.547 8.237 -10.329 1561 HZ3 TRP 101 HZ3 TRP 101 19.343 6.597 -9.074 1562 HH2 TRP 101 HH2 TRP 101 17.949 7.671 -10.834 1563 H GLY 102 HN GLY 102 14.634 3.298 -2.685 1564 1HA GLY 102 HA2 GLY 102 16.400 4.158 -0.524 1565 2HA GLY 102 HA3 GLY 102 15.042 3.036 -0.404 1566 H PHE 103 HN PHE 103 15.493 0.931 -1.794 1567 HA PHE 103 HA PHE 103 16.478 -1.053 -1.898 1568 1HB PHE 103 HB2 PHE 103 19.190 0.270 -2.012 1569 2HB PHE 103 HB3 PHE 103 18.689 -1.248 -2.731 1570 HD1 PHE 103 HD1 PHE 103 16.615 -0.967 -4.504 1571 HD2 PHE 103 HD2 PHE 103 19.482 2.083 -3.447 1572 HE1 PHE 103 HE1 PHE 103 16.196 0.191 -6.660 1573 HE2 PHE 103 HE2 PHE 103 19.070 3.218 -5.610 1574 HZ PHE 103 HZ PHE 103 17.420 2.276 -7.220 1575 H ASP 104 HN ASP 104 16.351 0.421 0.864 1576 HA ASP 104 HA ASP 104 17.788 -1.504 2.503 1577 1HB ASP 104 HB2 ASP 104 19.398 0.450 1.624 1578 2HB ASP 104 HB3 ASP 104 18.552 1.411 2.825 1579 H ASP 105 HN ASP 105 17.448 -0.666 4.894 1580 HA ASP 105 HA ASP 105 15.299 1.229 5.286 1581 1HB ASP 105 HB2 ASP 105 13.943 -0.748 4.841 1582 2HB ASP 105 HB3 ASP 105 14.764 -1.627 6.136 1583 HA PRO 106 HA PRO 106 18.586 1.221 8.329 1584 1HB PRO 106 HB2 PRO 106 18.384 3.806 9.236 1585 2HB PRO 106 HB3 PRO 106 19.097 3.357 7.660 1586 1HG PRO 106 HG2 PRO 106 16.311 4.372 8.281 1587 2HG PRO 106 HG3 PRO 106 17.388 4.859 6.937 1588 1HD PRO 106 HD2 PRO 106 15.358 3.001 6.703 1589 2HD PRO 106 HD3 PRO 106 16.827 2.932 5.693 1590 H ALA 107 HN ALA 107 15.251 2.106 9.176 1591 HA ALA 107 HA ALA 107 15.645 2.457 11.968 1592 1HB ALA 107 HB1 ALA 107 13.660 3.290 10.742 1593 2HB ALA 107 HB2 ALA 107 13.179 1.618 10.367 1594 3HB ALA 107 HB3 ALA 107 13.172 2.184 12.048 1595 H ARG 108 HN ARG 108 15.795 -0.256 9.975 1596 HA ARG 108 HA ARG 108 14.649 -2.198 11.938 1597 1HB ARG 108 HB2 ARG 108 16.026 -2.909 9.313 1598 2HB ARG 108 HB3 ARG 108 14.914 -3.896 10.252 1599 1HG ARG 108 HG2 ARG 108 14.203 -1.319 8.833 1600 2HG ARG 108 HG3 ARG 108 14.013 -2.897 8.105 1601 1HD ARG 108 HD2 ARG 108 12.628 -2.334 10.733 1602 2HD ARG 108 HD3 ARG 108 11.986 -1.607 9.267 1603 HE ARG 108 HE ARG 108 11.946 -4.435 9.987 1604 1HH1 ARG 108 HH11 ARG 108 11.570 -2.080 7.263 1605 2HH1 ARG 108 HH12 ARG 108 10.599 -3.231 6.355 1606 1HH2 ARG 108 HH21 ARG 108 10.663 -5.847 8.590 1607 2HH2 ARG 108 HH22 ARG 108 10.163 -5.229 7.027 1608 H ALA 109 HN ALA 109 17.673 -1.619 10.181 1609 HA ALA 109 HA ALA 109 19.737 -2.420 10.339 1610 1HB ALA 109 HB1 ALA 109 20.956 -1.689 12.238 1611 2HB ALA 109 HB2 ALA 109 19.621 -0.541 12.027 1612 3HB ALA 109 HB3 ALA 109 19.530 -1.798 13.287 1613 H GLN 110 HN GLN 110 21.398 -3.736 11.821 1614 HA GLN 110 HA GLN 110 20.352 -6.435 12.048 1615 1HB GLN 110 HB2 GLN 110 22.774 -5.873 11.523 1616 2HB GLN 110 HB3 GLN 110 22.978 -5.437 13.228 1617 1HG GLN 110 HG2 GLN 110 21.674 -8.075 12.812 1618 2HG GLN 110 HG3 GLN 110 23.293 -7.976 12.128 1619 1HE2 GLN 110 HE22 GLN 110 21.393 -7.756 15.148 1620 2HE2 GLN 110 HE21 GLN 110 22.750 -8.072 16.212 1621 H GLY 111 HN GLY 111 21.110 -3.786 14.307 1622 1HA GLY 111 HA2 GLY 111 19.259 -3.593 15.947 1623 2HA GLY 111 HA3 GLY 111 19.655 -5.283 16.405 1624 H THR 112 HN THR 112 22.608 -4.522 16.127 1625 HA THR 112 HA THR 112 22.937 -4.043 18.971 1626 HB THR 112 HB THR 112 25.321 -4.189 18.556 1627 HG1 THR 112 HG1 THR 112 26.051 -4.427 16.399 1628 1HG2 THR 112 HG21 THR 112 25.466 -6.387 17.640 1629 2HG2 THR 112 HG22 THR 112 23.894 -6.274 18.471 1630 3HG2 THR 112 HG23 THR 112 23.982 -6.157 16.689 1631 H GLU 113 HN GLU 113 24.434 -2.273 19.773 1632 HA GLU 113 HA GLU 113 23.275 0.182 19.194 1633 1HB GLU 113 HB2 GLU 113 26.031 -0.421 20.384 1634 2HB GLU 113 HB3 GLU 113 25.178 1.131 20.541 1635 1HG GLU 113 HG2 GLU 113 23.291 -0.084 21.683 1636 2HG GLU 113 HG3 GLU 113 24.257 -1.562 21.632 1637 H GLU 114 HN GLU 114 26.203 -1.314 17.881 1638 HA GLU 114 HA GLU 114 27.053 1.019 16.420 1639 1HB GLU 114 HB2 GLU 114 28.628 -0.737 15.379 1640 2HB GLU 114 HB3 GLU 114 28.854 -0.318 17.089 1641 1HG GLU 114 HG2 GLU 114 27.600 -2.411 17.702 1642 2HG GLU 114 HG3 GLU 114 27.521 -2.798 15.968 1643 H GLU 115 HN GLU 115 25.221 -2.090 15.707 1644 HA GLU 115 HA GLU 115 25.488 -1.526 12.899 1645 1HB GLU 115 HB2 GLU 115 23.842 -3.537 14.416 1646 2HB GLU 115 HB3 GLU 115 23.830 -3.392 12.658 1647 1HG GLU 115 HG2 GLU 115 26.471 -3.694 14.143 1648 2HG GLU 115 HG3 GLU 115 25.478 -5.099 13.752 1649 H LYS 116 HN LYS 116 23.062 -0.781 15.388 1650 HA LYS 116 HA LYS 116 21.054 0.240 13.643 1651 1HB LYS 116 HB2 LYS 116 21.874 1.101 16.450 1652 2HB LYS 116 HB3 LYS 116 20.453 1.705 15.622 1653 1HG LYS 116 HG2 LYS 116 20.446 -1.237 15.677 1654 2HG LYS 116 HG3 LYS 116 20.682 -0.555 17.281 1655 1HD LYS 116 HD2 LYS 116 18.406 -0.845 17.155 1656 2HD LYS 116 HD3 LYS 116 18.628 0.888 16.908 1657 1HE LYS 116 HE2 LYS 116 18.344 0.546 14.440 1658 2HE LYS 116 HE3 LYS 116 18.184 -1.205 14.727 1659 1HZ LYS 116 HZ1 LYS 116 16.017 -0.115 14.491 1660 2HZ LYS 116 HZ2 LYS 116 16.173 -0.780 15.973 1661 3HZ LYS 116 HZ3 LYS 116 16.312 0.836 15.787 1662 H TRP 117 HN TRP 117 23.755 2.000 15.251 1663 HA TRP 117 HA TRP 117 23.153 4.383 13.803 1664 1HB TRP 117 HB2 TRP 117 24.595 4.138 15.906 1665 2HB TRP 117 HB3 TRP 117 25.916 3.693 14.835 1666 HD1 TRP 117 HD1 TRP 117 24.494 6.209 12.805 1667 HE1 TRP 117 HE1 TRP 117 25.323 8.580 13.271 1668 HE3 TRP 117 HE3 TRP 117 26.491 5.416 17.449 1669 HZ2 TRP 117 HZ2 TRP 117 26.738 9.918 15.358 1670 HZ3 TRP 117 HZ3 TRP 117 27.553 7.292 18.681 1671 HH2 TRP 117 HH2 TRP 117 27.689 9.554 17.651 1672 H ALA 118 HN ALA 118 25.322 1.646 13.052 1673 HA ALA 118 HA ALA 118 26.497 2.728 10.753 1674 1HB ALA 118 HB1 ALA 118 27.209 0.614 11.954 1675 2HB ALA 118 HB2 ALA 118 25.773 -0.187 11.314 1676 3HB ALA 118 HB3 ALA 118 27.033 0.373 10.197 1677 H PHE 119 HN PHE 119 23.410 0.905 11.008 1678 HA PHE 119 HA PHE 119 22.852 1.008 8.191 1679 1HB PHE 119 HB2 PHE 119 21.333 0.360 10.688 1680 2HB PHE 119 HB3 PHE 119 20.384 0.892 9.335 1681 HD1 PHE 119 HD1 PHE 119 19.525 -0.732 7.887 1682 HD2 PHE 119 HD2 PHE 119 23.237 -1.512 9.958 1683 HE1 PHE 119 HE1 PHE 119 19.560 -3.022 6.967 1684 HE2 PHE 119 HE2 PHE 119 23.274 -3.801 9.010 1685 HZ PHE 119 HZ PHE 119 21.434 -4.567 7.521 1686 H PHE 120 HN PHE 120 21.928 3.124 10.970 1687 HA PHE 120 HA PHE 120 20.308 4.916 9.516 1688 1HB PHE 120 HB2 PHE 120 22.186 5.746 11.750 1689 2HB PHE 120 HB3 PHE 120 20.712 6.530 11.221 1690 HD1 PHE 120 HD1 PHE 120 21.364 6.014 14.042 1691 HD2 PHE 120 HD2 PHE 120 19.249 3.527 11.224 1692 HE1 PHE 120 HE1 PHE 120 20.092 4.979 15.898 1693 HE2 PHE 120 HE2 PHE 120 17.970 2.521 13.070 1694 HZ PHE 120 HZ PHE 120 18.374 3.247 15.420 1695 H GLN 121 HN GLN 121 23.828 5.015 10.127 1696 HA GLN 121 HA GLN 121 24.379 7.473 8.881 1697 1HB GLN 121 HB2 GLN 121 25.793 6.331 10.527 1698 2HB GLN 121 HB3 GLN 121 26.089 4.996 9.411 1699 1HG GLN 121 HG2 GLN 121 27.296 6.506 7.883 1700 2HG GLN 121 HG3 GLN 121 26.964 7.874 8.963 1701 1HE2 GLN 121 HE22 GLN 121 27.669 7.403 11.410 1702 2HE2 GLN 121 HE21 GLN 121 29.249 6.690 11.574 1703 H ARG 122 HN ARG 122 24.605 4.091 7.623 1704 HA ARG 122 HA ARG 122 25.691 4.781 5.118 1705 1HB ARG 122 HB2 ARG 122 25.665 2.485 6.016 1706 2HB ARG 122 HB3 ARG 122 23.897 2.444 5.947 1707 1HG ARG 122 HG2 ARG 122 24.009 2.644 3.446 1708 2HG ARG 122 HG3 ARG 122 25.774 2.680 3.551 1709 1HD ARG 122 HD2 ARG 122 25.045 0.473 2.933 1710 2HD ARG 122 HD3 ARG 122 25.743 0.402 4.549 1711 HE ARG 122 HE ARG 122 22.825 0.274 3.818 1712 1HH1 ARG 122 HH11 ARG 122 25.320 -0.416 6.283 1713 2HH1 ARG 122 HH12 ARG 122 24.242 -1.350 7.254 1714 1HH2 ARG 122 HH21 ARG 122 21.464 -0.818 5.070 1715 2HH2 ARG 122 HH22 ARG 122 21.946 -1.566 6.573 1716 H VAL 123 HN VAL 123 22.242 4.227 6.073 1717 HA VAL 123 HA VAL 123 21.321 4.795 3.409 1718 HB VAL 123 HB VAL 123 19.778 4.782 6.029 1719 1HG1 VAL 123 HG11 VAL 123 18.518 5.954 4.310 1720 2HG1 VAL 123 HG12 VAL 123 18.856 4.684 3.115 1721 3HG1 VAL 123 HG13 VAL 123 17.805 4.364 4.503 1722 1HG2 VAL 123 HG21 VAL 123 20.836 2.579 5.579 1723 2HG2 VAL 123 HG22 VAL 123 19.108 2.471 5.268 1724 3HG2 VAL 123 HG23 VAL 123 20.249 2.629 3.912 1725 H ARG 124 HN ARG 124 21.599 6.853 6.382 1726 HA ARG 124 HA ARG 124 20.342 9.125 5.306 1727 1HB ARG 124 HB2 ARG 124 20.780 8.790 7.631 1728 2HB ARG 124 HB3 ARG 124 22.525 8.790 7.399 1729 1HG ARG 124 HG2 ARG 124 20.779 11.197 6.792 1730 2HG ARG 124 HG3 ARG 124 21.321 10.840 8.407 1731 1HD ARG 124 HD2 ARG 124 23.087 11.559 6.063 1732 2HD ARG 124 HD3 ARG 124 22.798 12.499 7.525 1733 HE ARG 124 HE ARG 124 24.804 10.562 7.111 1734 1HH1 ARG 124 HH11 ARG 124 22.636 11.614 9.781 1735 2HH1 ARG 124 HH12 ARG 124 23.603 10.736 10.964 1736 1HH2 ARG 124 HH21 ARG 124 26.146 9.792 8.860 1737 2HH2 ARG 124 HH22 ARG 124 25.514 9.875 10.493 1738 H ASP 125 HN ASP 125 23.812 8.181 5.090 1739 HA ASP 125 HA ASP 125 24.698 10.488 3.717 1740 1HB ASP 125 HB2 ASP 125 26.238 8.822 4.621 1741 2HB ASP 125 HB3 ASP 125 25.628 7.596 3.507 1742 H GLU 126 HN GLU 126 23.317 7.410 2.399 1743 HA GLU 126 HA GLU 126 23.585 8.296 -0.319 1744 1HB GLU 126 HB2 GLU 126 23.479 5.907 0.421 1745 2HB GLU 126 HB3 GLU 126 21.773 6.127 0.816 1746 1HG GLU 126 HG2 GLU 126 22.013 5.055 -1.355 1747 2HG GLU 126 HG3 GLU 126 21.274 6.636 -1.557 1748 H ILE 127 HN ILE 127 20.882 8.437 2.042 1749 HA ILE 127 HA ILE 127 18.894 9.452 0.289 1750 HB ILE 127 HB ILE 127 19.354 9.299 3.247 1751 1HG1 ILE 127 HG12 ILE 127 16.969 8.765 1.438 1752 2HG1 ILE 127 HG13 ILE 127 18.175 7.561 1.906 1753 1HG2 ILE 127 HG21 ILE 127 18.738 11.633 3.136 1754 2HG2 ILE 127 HG22 ILE 127 17.323 11.236 2.126 1755 3HG2 ILE 127 HG23 ILE 127 17.443 10.692 3.823 1756 1HD1 ILE 127 HD11 ILE 127 16.067 8.859 3.684 1757 2HD1 ILE 127 HD12 ILE 127 16.195 7.160 3.196 1758 3HD1 ILE 127 HD13 ILE 127 17.376 7.848 4.325 1759 H GLY 128 HN GLY 128 21.425 11.181 2.222 1760 1HA GLY 128 HA2 GLY 128 20.603 13.776 1.335 1761 2HA GLY 128 HA3 GLY 128 22.202 13.321 2.001 1762 H ASN 129 HN ASN 129 23.121 11.497 0.049 1763 HA ASN 129 HA ASN 129 23.970 13.157 -2.076 1764 1HB ASN 129 HB2 ASN 129 25.219 11.134 -1.631 1765 2HB ASN 129 HB3 ASN 129 23.782 10.128 -1.849 1766 1HD2 ASN 129 HD22 ASN 129 23.631 9.120 -3.849 1767 2HD2 ASN 129 HD21 ASN 129 24.061 9.927 -5.371 1768 H ARG 130 HN ARG 130 21.261 10.833 -1.955 1769 HA ARG 130 HA ARG 130 20.442 11.147 -4.639 1770 1HB ARG 130 HB2 ARG 130 19.741 9.337 -3.021 1771 2HB ARG 130 HB3 ARG 130 18.730 10.515 -2.195 1772 1HG ARG 130 HG2 ARG 130 17.326 9.214 -3.556 1773 2HG ARG 130 HG3 ARG 130 17.396 10.793 -4.322 1774 1HD ARG 130 HD2 ARG 130 19.188 8.463 -5.178 1775 2HD ARG 130 HD3 ARG 130 17.542 8.642 -5.770 1776 HE ARG 130 HE ARG 130 19.866 10.113 -6.657 1777 1HH1 ARG 130 HH11 ARG 130 16.291 10.264 -6.458 1778 2HH1 ARG 130 HH12 ARG 130 16.175 11.422 -7.758 1779 1HH2 ARG 130 HH21 ARG 130 19.666 11.572 -8.278 1780 2HH2 ARG 130 HH22 ARG 130 18.081 12.272 -8.703 1781 H LEU 131 HN LEU 131 19.511 13.042 -1.694 1782 HA LEU 131 HA LEU 131 17.678 14.624 -3.264 1783 1HB LEU 131 HB2 LEU 131 18.616 14.619 -0.418 1784 2HB LEU 131 HB3 LEU 131 18.072 16.161 -1.048 1785 HG LEU 131 HG LEU 131 16.232 15.037 0.011 1786 1HD1 LEU 131 HD11 LEU 131 15.914 16.402 -2.158 1787 2HD1 LEU 131 HD12 LEU 131 15.630 14.850 -2.973 1788 3HD1 LEU 131 HD13 LEU 131 14.575 15.367 -1.676 1789 1HD2 LEU 131 HD21 LEU 131 16.969 12.706 -0.255 1790 2HD2 LEU 131 HD22 LEU 131 15.299 12.922 -0.751 1791 3HD2 LEU 131 HD23 LEU 131 16.557 12.757 -1.985 1792 H LYS 132 HN LYS 132 21.100 15.098 -2.347 1793 HA LYS 132 HA LYS 132 21.196 17.769 -3.423 1794 1HB LYS 132 HB2 LYS 132 22.818 16.678 -1.842 1795 2HB LYS 132 HB3 LYS 132 23.364 15.627 -3.161 1796 1HG LYS 132 HG2 LYS 132 24.094 17.659 -4.425 1797 2HG LYS 132 HG3 LYS 132 23.599 18.672 -3.058 1798 1HD LYS 132 HD2 LYS 132 25.642 16.414 -2.924 1799 2HD LYS 132 HD3 LYS 132 26.051 18.134 -3.112 1800 1HE LYS 132 HE2 LYS 132 24.965 18.612 -0.929 1801 2HE LYS 132 HE3 LYS 132 24.616 16.891 -0.724 1802 1HZ LYS 132 HZ1 LYS 132 26.636 17.524 0.441 1803 2HZ LYS 132 HZ2 LYS 132 27.011 16.474 -0.746 1804 3HZ LYS 132 HZ3 LYS 132 27.331 18.066 -0.928 1805 H GLU 133 HN GLU 133 21.695 14.480 -4.871 1806 HA GLU 133 HA GLU 133 22.122 15.433 -7.535 1807 1HB GLU 133 HB2 GLU 133 20.890 12.917 -6.318 1808 2HB GLU 133 HB3 GLU 133 20.748 13.212 -8.052 1809 1HG GLU 133 HG2 GLU 133 23.009 13.029 -8.454 1810 2HG GLU 133 HG3 GLU 133 23.430 13.063 -6.717 1811 H PHE 134 HN PHE 134 19.068 14.974 -5.641 1812 HA PHE 134 HA PHE 134 17.415 15.210 -7.856 1813 1HB PHE 134 HB2 PHE 134 16.916 14.758 -5.331 1814 2HB PHE 134 HB3 PHE 134 16.674 16.495 -5.214 1815 HD1 PHE 134 HD1 PHE 134 15.060 17.440 -7.266 1816 HD2 PHE 134 HD2 PHE 134 15.076 13.444 -5.634 1817 HE1 PHE 134 HE1 PHE 134 12.851 17.002 -8.293 1818 HE2 PHE 134 HE2 PHE 134 12.842 13.053 -6.566 1819 HZ PHE 134 HZ PHE 134 11.740 14.804 -7.979 1820 H ALA 135 HN ALA 135 18.881 17.768 -5.888 1821 HA ALA 135 HA ALA 135 17.788 20.006 -7.219 1822 1HB ALA 135 HB1 ALA 135 19.722 21.209 -6.194 1823 2HB ALA 135 HB2 ALA 135 18.877 20.156 -5.054 1824 3HB ALA 135 HB3 ALA 135 20.435 19.634 -5.753 1825 H GLU 136 HN GLU 136 20.465 17.895 -8.128 1826 HA GLU 136 HA GLU 136 21.481 19.691 -10.150 1827 1HB GLU 136 HB2 GLU 136 22.253 16.885 -9.278 1828 2HB GLU 136 HB3 GLU 136 23.129 17.789 -10.501 1829 1HG GLU 136 HG2 GLU 136 22.751 18.879 -7.688 1830 2HG GLU 136 HG3 GLU 136 24.031 17.748 -8.092 1831 H THR 137 HN THR 137 19.721 16.654 -9.989 1832 HA THR 137 HA THR 137 19.741 16.308 -12.929 1833 HB THR 137 HB THR 137 19.278 13.946 -12.414 1834 HG1 THR 137 HG1 THR 137 19.390 14.737 -9.705 1835 1HG2 THR 137 HG21 THR 137 21.679 14.715 -12.388 1836 2HG2 THR 137 HG22 THR 137 21.568 14.894 -10.619 1837 3HG2 THR 137 HG23 THR 137 21.364 13.307 -11.355 1838 H GLY 138 HN GLY 138 17.591 17.349 -10.463 1839 1HA GLY 138 HA2 GLY 138 15.408 17.929 -10.475 1840 2HA GLY 138 HA3 GLY 138 15.405 17.745 -12.238 1841 H LYS 139 HN LYS 139 16.212 14.981 -10.102 1842 HA LYS 139 HA LYS 139 13.671 13.676 -10.298 1843 1HB LYS 139 HB2 LYS 139 14.102 13.299 -12.531 1844 2HB LYS 139 HB3 LYS 139 15.841 13.319 -12.356 1845 1HG LYS 139 HG2 LYS 139 14.058 11.040 -11.433 1846 2HG LYS 139 HG3 LYS 139 14.760 11.154 -13.039 1847 1HD LYS 139 HD2 LYS 139 16.175 10.586 -10.438 1848 2HD LYS 139 HD3 LYS 139 16.168 9.669 -11.920 1849 1HE LYS 139 HE2 LYS 139 17.563 12.354 -11.549 1850 2HE LYS 139 HE3 LYS 139 18.335 10.779 -11.400 1851 1HZ LYS 139 HZ1 LYS 139 17.107 11.812 -13.896 1852 2HZ LYS 139 HZ2 LYS 139 18.703 11.664 -13.595 1853 3HZ LYS 139 HZ3 LYS 139 17.782 10.333 -13.724 Start of MODEL 12 1 1H MET 1 H1 MET 1 -23.467 -12.279 -7.784 2 2H MET 1 H2 MET 1 -24.955 -11.574 -7.700 3 3H MET 1 H3 MET 1 -23.673 -10.746 -8.297 4 HA MET 1 HA MET 1 -25.103 -13.012 -9.473 5 1HB MET 1 HB2 MET 1 -25.985 -10.727 -9.937 6 2HB MET 1 HB3 MET 1 -24.447 -10.287 -10.679 7 1HG MET 1 HG2 MET 1 -26.115 -10.904 -12.366 8 2HG MET 1 HG3 MET 1 -24.736 -11.991 -12.401 9 1HE MET 1 HE1 MET 1 -29.007 -13.097 -10.938 10 2HE MET 1 HE2 MET 1 -27.995 -11.982 -10.001 11 3HE MET 1 HE3 MET 1 -28.536 -11.534 -11.637 12 H ALA 2 HN ALA 2 -22.156 -10.950 -10.162 13 HA ALA 2 HA ALA 2 -20.500 -13.299 -10.444 14 1HB ALA 2 HB1 ALA 2 -21.437 -13.106 -12.771 15 2HB ALA 2 HB2 ALA 2 -20.933 -11.401 -12.814 16 3HB ALA 2 HB3 ALA 2 -19.718 -12.691 -12.721 17 H ILE 3 HN ILE 3 -18.222 -12.456 -10.882 18 HA ILE 3 HA ILE 3 -17.749 -9.934 -9.449 19 HB ILE 3 HB ILE 3 -15.959 -12.273 -10.247 20 1HG1 ILE 3 HG12 ILE 3 -15.260 -12.062 -7.847 21 2HG1 ILE 3 HG13 ILE 3 -16.541 -10.874 -7.619 22 1HG2 ILE 3 HG21 ILE 3 -14.729 -10.210 -10.862 23 2HG2 ILE 3 HG22 ILE 3 -15.124 -9.489 -9.286 24 3HG2 ILE 3 HG23 ILE 3 -14.047 -10.907 -9.396 25 1HD1 ILE 3 HD11 ILE 3 -18.224 -12.635 -8.153 26 2HD1 ILE 3 HD12 ILE 3 -16.885 -13.807 -8.371 27 3HD1 ILE 3 HD13 ILE 3 -17.183 -13.035 -6.803 28 H VAL 4 HN VAL 4 -18.511 -8.443 -10.787 29 HA VAL 4 HA VAL 4 -18.127 -8.405 -13.669 30 HB VAL 4 HB VAL 4 -19.203 -6.325 -11.714 31 1HG1 VAL 4 HG11 VAL 4 -19.618 -6.552 -14.726 32 2HG1 VAL 4 HG12 VAL 4 -20.533 -5.473 -13.651 33 3HG1 VAL 4 HG13 VAL 4 -18.819 -5.218 -13.848 34 1HG2 VAL 4 HG21 VAL 4 -20.578 -8.312 -11.482 35 2HG2 VAL 4 HG22 VAL 4 -21.479 -7.142 -12.425 36 3HG2 VAL 4 HG23 VAL 4 -20.687 -8.500 -13.247 37 H LYS 5 HN LYS 5 -17.175 -6.197 -14.527 38 HA LYS 5 HA LYS 5 -14.826 -5.411 -12.969 39 1HB LYS 5 HB2 LYS 5 -13.358 -5.359 -14.793 40 2HB LYS 5 HB3 LYS 5 -14.034 -6.973 -14.718 41 1HG LYS 5 HG2 LYS 5 -14.817 -4.790 -16.709 42 2HG LYS 5 HG3 LYS 5 -13.725 -6.136 -17.005 43 1HD LYS 5 HD2 LYS 5 -15.652 -7.730 -16.560 44 2HD LYS 5 HD3 LYS 5 -16.712 -6.317 -16.458 45 1HE LYS 5 HE2 LYS 5 -16.948 -7.187 -18.646 46 2HE LYS 5 HE3 LYS 5 -16.074 -5.659 -18.766 47 1HZ LYS 5 HZ1 LYS 5 -15.099 -7.378 -20.160 48 2HZ LYS 5 HZ2 LYS 5 -14.020 -6.945 -19.022 49 3HZ LYS 5 HZ3 LYS 5 -14.839 -8.357 -18.886 50 H ALA 6 HN ALA 6 -14.265 -3.286 -13.140 51 HA ALA 6 HA ALA 6 -16.365 -1.443 -14.197 52 1HB ALA 6 HB1 ALA 6 -14.783 -1.530 -11.643 53 2HB ALA 6 HB2 ALA 6 -15.328 0.011 -12.309 54 3HB ALA 6 HB3 ALA 6 -16.510 -1.204 -11.914 55 H THR 7 HN THR 7 -15.353 0.792 -14.513 56 HA THR 7 HA THR 7 -12.571 1.163 -14.759 57 HB THR 7 HB THR 7 -12.822 -0.002 -16.879 58 HG1 THR 7 HG1 THR 7 -11.878 1.535 -18.136 59 1HG2 THR 7 HG21 THR 7 -15.131 0.321 -17.471 60 2HG2 THR 7 HG22 THR 7 -14.919 2.086 -17.595 61 3HG2 THR 7 HG23 THR 7 -14.129 0.995 -18.755 62 H ASP 8 HN ASP 8 -12.604 3.540 -16.078 63 HA ASP 8 HA ASP 8 -12.995 5.358 -14.173 64 1HB ASP 8 HB2 ASP 8 -11.817 5.801 -16.231 65 2HB ASP 8 HB3 ASP 8 -13.319 5.768 -17.152 66 H GLN 9 HN GLN 9 -15.677 4.499 -16.376 67 HA GLN 9 HA GLN 9 -17.495 6.150 -14.722 68 1HB GLN 9 HB2 GLN 9 -17.303 5.956 -17.742 69 2HB GLN 9 HB3 GLN 9 -18.722 6.618 -16.915 70 1HG GLN 9 HG2 GLN 9 -17.487 8.442 -15.977 71 2HG GLN 9 HG3 GLN 9 -15.942 7.704 -16.353 72 1HE2 GLN 9 HE22 GLN 9 -14.881 8.734 -17.941 73 2HE2 GLN 9 HE21 GLN 9 -15.626 9.460 -19.364 74 H SER 10 HN SER 10 -17.091 3.215 -16.752 75 HA SER 10 HA SER 10 -19.646 2.159 -16.346 76 1HB SER 10 HB2 SER 10 -17.093 0.533 -16.398 77 2HB SER 10 HB3 SER 10 -18.709 0.058 -16.948 78 HG SER 10 HG SER 10 -17.445 0.666 -18.725 79 H PHE 11 HN PHE 11 -16.985 2.492 -14.001 80 HA PHE 11 HA PHE 11 -17.836 0.697 -11.984 81 1HB PHE 11 HB2 PHE 11 -15.776 1.964 -11.695 82 2HB PHE 11 HB3 PHE 11 -16.602 3.470 -11.945 83 HD1 PHE 11 HD1 PHE 11 -16.378 0.580 -9.434 84 HD2 PHE 11 HD2 PHE 11 -17.436 4.732 -10.185 85 HE1 PHE 11 HE1 PHE 11 -16.463 1.046 -7.016 86 HE2 PHE 11 HE2 PHE 11 -17.582 5.120 -7.751 87 HZ PHE 11 HZ PHE 11 -17.050 3.293 -6.163 88 H SER 12 HN SER 12 -18.819 4.168 -12.500 89 HA SER 12 HA SER 12 -20.732 4.159 -10.457 90 1HB SER 12 HB2 SER 12 -20.949 5.723 -13.065 91 2HB SER 12 HB3 SER 12 -21.469 6.235 -11.451 92 HG SER 12 HG SER 12 -19.490 7.229 -12.044 93 H ALA 13 HN ALA 13 -21.034 3.441 -13.959 94 HA ALA 13 HA ALA 13 -23.819 3.302 -13.972 95 1HB ALA 13 HB1 ALA 13 -23.563 2.151 -16.130 96 2HB ALA 13 HB2 ALA 13 -22.365 3.459 -15.983 97 3HB ALA 13 HB3 ALA 13 -21.873 1.762 -15.747 98 H GLU 14 HN GLU 14 -21.420 0.799 -13.181 99 HA GLU 14 HA GLU 14 -23.361 -1.295 -12.900 100 1HB GLU 14 HB2 GLU 14 -20.399 -1.065 -12.301 101 2HB GLU 14 HB3 GLU 14 -21.311 -2.509 -11.893 102 1HG GLU 14 HG2 GLU 14 -21.065 -1.348 -14.692 103 2HG GLU 14 HG3 GLU 14 -20.149 -2.714 -14.060 104 H THR 15 HN THR 15 -22.413 1.274 -10.769 105 HA THR 15 HA THR 15 -23.072 -0.370 -8.371 106 HB THR 15 HB THR 15 -21.546 1.192 -7.188 107 HG1 THR 15 HG1 THR 15 -20.688 2.060 -9.697 108 1HG2 THR 15 HG21 THR 15 -19.364 0.616 -8.449 109 2HG2 THR 15 HG22 THR 15 -20.326 -0.729 -7.812 110 3HG2 THR 15 HG23 THR 15 -20.357 -0.336 -9.545 111 H SER 16 HN SER 16 -24.386 2.185 -10.190 112 HA SER 16 HA SER 16 -25.159 3.859 -7.983 113 1HB SER 16 HB2 SER 16 -26.065 3.810 -10.888 114 2HB SER 16 HB3 SER 16 -26.466 5.082 -9.719 115 HG SER 16 HG SER 16 -23.888 4.317 -10.633 116 H GLU 17 HN GLU 17 -26.390 0.851 -8.695 117 HA GLU 17 HA GLU 17 -28.962 1.489 -7.448 118 1HB GLU 17 HB2 GLU 17 -28.677 -0.081 -10.048 119 2HB GLU 17 HB3 GLU 17 -30.133 -0.044 -9.047 120 1HG GLU 17 HG2 GLU 17 -30.273 2.433 -9.376 121 2HG GLU 17 HG3 GLU 17 -28.889 2.346 -10.472 122 H GLY 18 HN GLY 18 -29.868 -0.349 -6.325 123 1HA GLY 18 HA2 GLY 18 -29.808 -2.252 -5.100 124 2HA GLY 18 HA3 GLY 18 -28.615 -2.921 -6.229 125 H VAL 19 HN VAL 19 -27.541 -3.776 -4.395 126 HA VAL 19 HA VAL 19 -25.650 -1.837 -3.181 127 HB VAL 19 HB VAL 19 -26.617 -4.390 -1.816 128 1HG1 VAL 19 HG11 VAL 19 -25.260 -3.536 0.085 129 2HG1 VAL 19 HG12 VAL 19 -24.249 -3.877 -1.321 130 3HG1 VAL 19 HG13 VAL 19 -24.678 -2.199 -0.925 131 1HG2 VAL 19 HG21 VAL 19 -27.208 -1.440 -1.370 132 2HG2 VAL 19 HG22 VAL 19 -28.370 -2.741 -1.686 133 3HG2 VAL 19 HG23 VAL 19 -27.519 -2.670 -0.141 134 H VAL 20 HN VAL 20 -23.662 -2.064 -3.672 135 HA VAL 20 HA VAL 20 -22.828 -4.412 -5.251 136 HB VAL 20 HB VAL 20 -22.567 -1.514 -6.175 137 1HG1 VAL 20 HG11 VAL 20 -21.775 -2.633 -8.280 138 2HG1 VAL 20 HG12 VAL 20 -20.708 -2.918 -6.894 139 3HG1 VAL 20 HG13 VAL 20 -21.807 -4.191 -7.418 140 1HG2 VAL 20 HG21 VAL 20 -24.529 -3.678 -7.031 141 2HG2 VAL 20 HG22 VAL 20 -24.872 -2.041 -6.453 142 3HG2 VAL 20 HG23 VAL 20 -24.140 -2.275 -8.033 143 H LEU 21 HN LEU 21 -21.039 -5.066 -4.400 144 HA LEU 21 HA LEU 21 -19.273 -3.304 -2.785 145 1HB LEU 21 HB2 LEU 21 -19.780 -5.539 -1.969 146 2HB LEU 21 HB3 LEU 21 -19.200 -6.280 -3.455 147 HG LEU 21 HG LEU 21 -17.285 -4.505 -1.931 148 1HD1 LEU 21 HD11 LEU 21 -18.307 -5.816 -0.127 149 2HD1 LEU 21 HD12 LEU 21 -18.075 -7.319 -1.046 150 3HD1 LEU 21 HD13 LEU 21 -16.673 -6.414 -0.445 151 1HD2 LEU 21 HD21 LEU 21 -15.643 -6.152 -2.719 152 2HD2 LEU 21 HD22 LEU 21 -16.929 -7.212 -3.296 153 3HD2 LEU 21 HD23 LEU 21 -16.622 -5.658 -4.089 154 H ALA 22 HN ALA 22 -17.353 -2.461 -3.674 155 HA ALA 22 HA ALA 22 -16.514 -3.540 -6.290 156 1HB ALA 22 HB1 ALA 22 -16.271 -0.645 -5.401 157 2HB ALA 22 HB2 ALA 22 -15.738 -1.315 -6.961 158 3HB ALA 22 HB3 ALA 22 -17.461 -1.248 -6.585 159 H ASP 23 HN ASP 23 -14.340 -3.940 -6.479 160 HA ASP 23 HA ASP 23 -12.644 -3.672 -4.037 161 1HB ASP 23 HB2 ASP 23 -13.583 -5.925 -4.066 162 2HB ASP 23 HB3 ASP 23 -13.137 -6.116 -5.767 163 H PHE 24 HN PHE 24 -10.512 -3.364 -4.453 164 HA PHE 24 HA PHE 24 -9.743 -2.700 -7.256 165 1HB PHE 24 HB2 PHE 24 -9.299 -1.295 -4.615 166 2HB PHE 24 HB3 PHE 24 -8.481 -0.850 -6.084 167 HD1 PHE 24 HD1 PHE 24 -12.045 -1.297 -4.791 168 HD2 PHE 24 HD2 PHE 24 -9.346 0.910 -7.307 169 HE1 PHE 24 HE1 PHE 24 -13.890 0.199 -5.435 170 HE2 PHE 24 HE2 PHE 24 -11.217 2.433 -7.948 171 HZ PHE 24 HZ PHE 24 -13.486 2.075 -7.021 172 H TRP 25 HN TRP 25 -8.055 -3.951 -7.858 173 HA TRP 25 HA TRP 25 -6.222 -5.097 -5.816 174 1HB TRP 25 HB2 TRP 25 -6.500 -7.257 -6.598 175 2HB TRP 25 HB3 TRP 25 -8.143 -6.661 -6.497 176 HD1 TRP 25 HD1 TRP 25 -8.939 -5.539 -9.023 177 HE1 TRP 25 HE1 TRP 25 -8.707 -6.496 -11.356 178 HE3 TRP 25 HE3 TRP 25 -5.221 -8.893 -8.052 179 HZ2 TRP 25 HZ2 TRP 25 -6.674 -8.172 -12.748 180 HZ3 TRP 25 HZ3 TRP 25 -4.100 -10.098 -9.898 181 HH2 TRP 25 HH2 TRP 25 -4.817 -9.731 -12.249 182 H ALA 26 HN ALA 26 -4.119 -5.674 -6.745 183 HA ALA 26 HA ALA 26 -3.663 -5.513 -9.565 184 1HB ALA 26 HB1 ALA 26 -3.448 -3.153 -9.340 185 2HB ALA 26 HB2 ALA 26 -2.637 -3.315 -7.750 186 3HB ALA 26 HB3 ALA 26 -1.785 -3.732 -9.250 187 HA PRO 27 HA PRO 27 -0.507 -8.310 -8.476 188 1HB PRO 27 HB2 PRO 27 1.435 -6.730 -10.166 189 2HB PRO 27 HB3 PRO 27 1.132 -8.497 -10.153 190 1HG PRO 27 HG2 PRO 27 0.016 -6.961 -12.087 191 2HG PRO 27 HG3 PRO 27 -0.998 -8.204 -11.273 192 1HD PRO 27 HD2 PRO 27 -0.865 -5.240 -10.732 193 2HD PRO 27 HD3 PRO 27 -2.288 -6.312 -10.899 194 H TRP 28 HN TRP 28 0.110 -4.978 -7.575 195 HA TRP 28 HA TRP 28 2.704 -4.997 -6.603 196 1HB TRP 28 HB2 TRP 28 0.413 -3.493 -5.405 197 2HB TRP 28 HB3 TRP 28 2.126 -3.066 -5.399 198 HD1 TRP 28 HD1 TRP 28 -0.918 -2.297 -7.078 199 HE1 TRP 28 HE1 TRP 28 -0.622 -1.134 -9.350 200 HE3 TRP 28 HE3 TRP 28 4.043 -3.250 -7.766 201 HZ2 TRP 28 HZ2 TRP 28 1.508 -0.792 -11.282 202 HZ3 TRP 28 HZ3 TRP 28 5.186 -2.516 -9.840 203 HH2 TRP 28 HH2 TRP 28 3.931 -1.293 -11.605 204 H CYS 29 HN CYS 29 -0.022 -6.614 -5.002 205 HA CYS 29 HA CYS 29 1.874 -7.472 -2.908 206 1HB CYS 29 HB2 CYS 29 0.156 -6.613 -1.131 207 2HB CYS 29 HB3 CYS 29 1.335 -5.542 -1.846 208 H GLY 30 HN GLY 30 0.807 -8.822 -1.220 209 1HA GLY 30 HA2 GLY 30 -0.200 -11.134 -2.450 210 2HA GLY 30 HA3 GLY 30 -0.084 -10.827 -0.715 211 HA PRO 31 HA PRO 31 -4.399 -10.257 -0.132 212 1HB PRO 31 HB2 PRO 31 -4.465 -7.273 -0.506 213 2HB PRO 31 HB3 PRO 31 -5.307 -8.269 0.729 214 1HG PRO 31 HG2 PRO 31 -2.992 -6.994 1.373 215 2HG PRO 31 HG3 PRO 31 -3.222 -8.701 1.872 216 1HD PRO 31 HD2 PRO 31 -1.665 -7.620 -0.481 217 2HD PRO 31 HD3 PRO 31 -1.204 -8.914 0.670 218 H SER 32 HN SER 32 -3.345 -8.346 -3.012 219 HA SER 32 HA SER 32 -5.787 -8.347 -4.395 220 1HB SER 32 HB2 SER 32 -3.004 -8.783 -5.565 221 2HB SER 32 HB3 SER 32 -4.360 -7.934 -6.318 222 HG SER 32 HG SER 32 -2.694 -6.619 -5.387 223 H LYS 33 HN LYS 33 -3.840 -11.060 -3.584 224 HA LYS 33 HA LYS 33 -5.399 -12.742 -5.487 225 1HB LYS 33 HB2 LYS 33 -2.765 -13.610 -4.319 226 2HB LYS 33 HB3 LYS 33 -3.734 -14.333 -5.601 227 1HG LYS 33 HG2 LYS 33 -2.091 -13.375 -6.859 228 2HG LYS 33 HG3 LYS 33 -3.293 -12.078 -6.897 229 1HD LYS 33 HD2 LYS 33 -2.075 -10.943 -5.043 230 2HD LYS 33 HD3 LYS 33 -0.923 -12.283 -4.978 231 1HE LYS 33 HE2 LYS 33 -0.274 -11.775 -7.362 232 2HE LYS 33 HE3 LYS 33 -1.355 -10.374 -7.321 233 1HZ LYS 33 HZ1 LYS 33 1.043 -10.792 -5.627 234 2HZ LYS 33 HZ2 LYS 33 0.887 -9.662 -6.793 235 3HZ LYS 33 HZ3 LYS 33 -0.011 -9.549 -5.426 236 H MET 34 HN MET 34 -5.754 -11.760 -2.485 237 HA MET 34 HA MET 34 -6.615 -14.442 -1.464 238 1HB MET 34 HB2 MET 34 -5.618 -12.107 0.209 239 2HB MET 34 HB3 MET 34 -6.256 -13.641 0.807 240 1HG MET 34 HG2 MET 34 -4.407 -14.822 -0.430 241 2HG MET 34 HG3 MET 34 -3.699 -13.248 -0.793 242 1HE MET 34 HE1 MET 34 -2.594 -11.964 2.760 243 2HE MET 34 HE2 MET 34 -2.628 -11.631 1.017 244 3HE MET 34 HE3 MET 34 -4.136 -11.591 1.967 245 H ILE 35 HN ILE 35 -7.218 -10.866 -1.437 246 HA ILE 35 HA ILE 35 -9.911 -11.083 -0.591 247 HB ILE 35 HB ILE 35 -8.248 -9.021 -0.839 248 1HG1 ILE 35 HG12 ILE 35 -10.391 -7.503 -0.946 249 2HG1 ILE 35 HG13 ILE 35 -11.274 -9.036 -0.949 250 1HG2 ILE 35 HG21 ILE 35 -8.741 -7.526 -2.653 251 2HG2 ILE 35 HG22 ILE 35 -8.067 -9.033 -3.283 252 3HG2 ILE 35 HG23 ILE 35 -9.814 -8.713 -3.416 253 1HD1 ILE 35 HD11 ILE 35 -10.925 -8.098 1.343 254 2HD1 ILE 35 HD12 ILE 35 -10.131 -9.677 1.166 255 3HD1 ILE 35 HD13 ILE 35 -9.164 -8.182 1.098 256 H ALA 36 HN ALA 36 -8.308 -11.308 -3.780 257 HA ALA 36 HA ALA 36 -10.546 -11.260 -5.401 258 1HB ALA 36 HB1 ALA 36 -9.115 -12.540 -7.047 259 2HB ALA 36 HB2 ALA 36 -8.375 -11.080 -6.362 260 3HB ALA 36 HB3 ALA 36 -7.866 -12.670 -5.790 261 HA PRO 37 HA PRO 37 -11.196 -16.027 -5.062 262 1HB PRO 37 HB2 PRO 37 -10.120 -17.093 -2.629 263 2HB PRO 37 HB3 PRO 37 -9.605 -17.459 -4.310 264 1HG PRO 37 HG2 PRO 37 -8.405 -15.640 -2.289 265 2HG PRO 37 HG3 PRO 37 -7.602 -16.472 -3.648 266 1HD PRO 37 HD2 PRO 37 -8.165 -13.772 -3.662 267 2HD PRO 37 HD3 PRO 37 -8.111 -14.767 -5.134 268 H VAL 38 HN VAL 38 -10.795 -14.124 -2.018 269 HA VAL 38 HA VAL 38 -13.094 -15.095 -0.699 270 HB VAL 38 HB VAL 38 -11.347 -12.684 -0.525 271 1HG1 VAL 38 HG11 VAL 38 -13.410 -11.617 -0.175 272 2HG1 VAL 38 HG12 VAL 38 -14.008 -12.897 0.875 273 3HG1 VAL 38 HG13 VAL 38 -12.660 -11.845 1.417 274 1HG2 VAL 38 HG21 VAL 38 -10.859 -13.581 1.656 275 2HG2 VAL 38 HG22 VAL 38 -12.141 -14.802 1.489 276 3HG2 VAL 38 HG23 VAL 38 -10.713 -14.870 0.440 277 H LEU 39 HN LEU 39 -12.809 -12.554 -3.232 278 HA LEU 39 HA LEU 39 -15.548 -11.731 -3.063 279 1HB LEU 39 HB2 LEU 39 -13.777 -11.846 -5.550 280 2HB LEU 39 HB3 LEU 39 -15.319 -11.044 -5.432 281 HG LEU 39 HG LEU 39 -12.753 -10.263 -4.020 282 1HD1 LEU 39 HD11 LEU 39 -12.760 -8.372 -5.436 283 2HD1 LEU 39 HD12 LEU 39 -12.973 -9.797 -6.457 284 3HD1 LEU 39 HD13 LEU 39 -14.364 -8.754 -6.092 285 1HD2 LEU 39 HD21 LEU 39 -13.975 -8.254 -3.214 286 2HD2 LEU 39 HD22 LEU 39 -15.499 -8.988 -3.762 287 3HD2 LEU 39 HD23 LEU 39 -14.548 -9.748 -2.469 288 H GLU 40 HN GLU 40 -13.930 -14.258 -5.087 289 HA GLU 40 HA GLU 40 -16.334 -14.946 -6.443 290 1HB GLU 40 HB2 GLU 40 -13.824 -16.604 -6.035 291 2HB GLU 40 HB3 GLU 40 -15.147 -16.911 -7.196 292 1HG GLU 40 HG2 GLU 40 -14.684 -14.752 -8.304 293 2HG GLU 40 HG3 GLU 40 -13.337 -14.466 -7.206 294 H GLU 41 HN GLU 41 -14.816 -16.155 -3.441 295 HA GLU 41 HA GLU 41 -16.717 -18.218 -2.916 296 1HB GLU 41 HB2 GLU 41 -14.681 -16.773 -1.189 297 2HB GLU 41 HB3 GLU 41 -15.713 -18.069 -0.583 298 1HG GLU 41 HG2 GLU 41 -14.841 -19.604 -2.331 299 2HG GLU 41 HG3 GLU 41 -13.732 -18.354 -2.880 300 H LEU 42 HN LEU 42 -16.921 -14.804 -2.604 301 HA LEU 42 HA LEU 42 -19.084 -14.891 -0.577 302 1HB LEU 42 HB2 LEU 42 -17.337 -13.039 -0.629 303 2HB LEU 42 HB3 LEU 42 -17.784 -12.671 -2.279 304 HG LEU 42 HG LEU 42 -20.061 -11.972 -1.509 305 1HD1 LEU 42 HD11 LEU 42 -20.144 -13.247 0.599 306 2HD1 LEU 42 HD12 LEU 42 -18.716 -12.366 1.194 307 3HD1 LEU 42 HD13 LEU 42 -20.245 -11.503 0.931 308 1HD2 LEU 42 HD21 LEU 42 -18.191 -10.337 -1.866 309 2HD2 LEU 42 HD22 LEU 42 -19.285 -9.837 -0.565 310 3HD2 LEU 42 HD23 LEU 42 -17.704 -10.548 -0.175 311 H ASP 43 HN ASP 43 -18.586 -14.226 -4.072 312 HA ASP 43 HA ASP 43 -21.323 -13.551 -4.449 313 1HB ASP 43 HB2 ASP 43 -19.548 -12.856 -6.058 314 2HB ASP 43 HB3 ASP 43 -19.183 -14.542 -6.400 315 H GLN 44 HN GLN 44 -19.522 -16.596 -4.822 316 HA GLN 44 HA GLN 44 -21.757 -17.993 -5.884 317 1HB GLN 44 HB2 GLN 44 -20.471 -19.952 -5.689 318 2HB GLN 44 HB3 GLN 44 -19.358 -18.631 -6.058 319 1HG GLN 44 HG2 GLN 44 -18.835 -18.529 -3.557 320 2HG GLN 44 HG3 GLN 44 -19.786 -20.000 -3.361 321 1HE2 GLN 44 HE22 GLN 44 -17.060 -18.664 -5.295 322 2HE2 GLN 44 HE21 GLN 44 -16.161 -20.173 -5.407 323 H GLU 45 HN GLU 45 -21.383 -16.723 -2.700 324 HA GLU 45 HA GLU 45 -23.104 -18.763 -1.580 325 1HB GLU 45 HB2 GLU 45 -21.320 -18.728 -0.213 326 2HB GLU 45 HB3 GLU 45 -20.930 -17.035 -0.539 327 1HG GLU 45 HG2 GLU 45 -22.445 -16.196 0.907 328 2HG GLU 45 HG3 GLU 45 -23.462 -17.653 0.956 329 H MET 46 HN MET 46 -22.752 -15.226 -1.851 330 HA MET 46 HA MET 46 -25.676 -14.974 -1.330 331 1HB MET 46 HB2 MET 46 -25.107 -12.911 -0.096 332 2HB MET 46 HB3 MET 46 -24.629 -14.426 0.672 333 1HG MET 46 HG2 MET 46 -22.313 -14.104 -0.028 334 2HG MET 46 HG3 MET 46 -22.725 -12.653 -0.935 335 1HE MET 46 HE1 MET 46 -24.771 -11.044 1.008 336 2HE MET 46 HE2 MET 46 -23.451 -10.040 1.737 337 3HE MET 46 HE3 MET 46 -23.385 -10.527 0.021 338 H GLY 47 HN GLY 47 -23.805 -14.817 -3.862 339 1HA GLY 47 HA2 GLY 47 -24.167 -12.154 -4.849 340 2HA GLY 47 HA3 GLY 47 -23.869 -13.637 -5.810 341 H ASP 48 HN ASP 48 -26.497 -14.329 -4.083 342 HA ASP 48 HA ASP 48 -28.428 -13.822 -6.160 343 1HB ASP 48 HB2 ASP 48 -28.632 -15.799 -4.719 344 2HB ASP 48 HB3 ASP 48 -28.736 -14.771 -3.289 345 H LYS 49 HN LYS 49 -27.237 -12.096 -3.354 346 HA LYS 49 HA LYS 49 -29.429 -10.159 -3.579 347 1HB LYS 49 HB2 LYS 49 -27.544 -10.345 -1.243 348 2HB LYS 49 HB3 LYS 49 -29.186 -9.720 -1.302 349 1HG LYS 49 HG2 LYS 49 -29.648 -11.616 -0.193 350 2HG LYS 49 HG3 LYS 49 -29.716 -12.332 -1.818 351 1HD LYS 49 HD2 LYS 49 -27.653 -13.423 -1.563 352 2HD LYS 49 HD3 LYS 49 -27.073 -12.224 -0.395 353 1HE LYS 49 HE2 LYS 49 -27.361 -14.267 0.768 354 2HE LYS 49 HE3 LYS 49 -28.507 -13.068 1.350 355 1HZ LYS 49 HZ1 LYS 49 -30.238 -14.170 0.017 356 2HZ LYS 49 HZ2 LYS 49 -29.170 -15.297 -0.506 357 3HZ LYS 49 HZ3 LYS 49 -29.570 -15.215 1.067 358 H LEU 50 HN LEU 50 -26.034 -10.571 -4.084 359 HA LEU 50 HA LEU 50 -25.520 -7.662 -3.906 360 1HB LEU 50 HB2 LEU 50 -24.634 -8.916 -1.996 361 2HB LEU 50 HB3 LEU 50 -23.872 -10.078 -3.084 362 HG LEU 50 HG LEU 50 -22.316 -8.336 -3.879 363 1HD1 LEU 50 HD11 LEU 50 -23.636 -6.302 -3.488 364 2HD1 LEU 50 HD12 LEU 50 -23.640 -6.599 -1.742 365 3HD1 LEU 50 HD13 LEU 50 -22.127 -6.208 -2.598 366 1HD2 LEU 50 HD21 LEU 50 -20.944 -8.253 -1.871 367 2HD2 LEU 50 HD22 LEU 50 -22.355 -8.640 -0.858 368 3HD2 LEU 50 HD23 LEU 50 -21.721 -9.838 -2.011 369 H LYS 51 HN LYS 51 -24.072 -6.781 -5.364 370 HA LYS 51 HA LYS 51 -23.090 -8.547 -7.589 371 1HB LYS 51 HB2 LYS 51 -24.721 -6.755 -8.322 372 2HB LYS 51 HB3 LYS 51 -23.614 -5.555 -7.656 373 1HG LYS 51 HG2 LYS 51 -21.828 -6.560 -9.265 374 2HG LYS 51 HG3 LYS 51 -23.169 -7.401 -10.036 375 1HD LYS 51 HD2 LYS 51 -22.822 -4.386 -9.710 376 2HD LYS 51 HD3 LYS 51 -22.517 -5.310 -11.179 377 1HE LYS 51 HE2 LYS 51 -24.914 -5.940 -11.298 378 2HE LYS 51 HE3 LYS 51 -25.233 -5.016 -9.818 379 1HZ LYS 51 HZ1 LYS 51 -24.465 -3.030 -10.981 380 2HZ LYS 51 HZ2 LYS 51 -24.178 -3.883 -12.348 381 3HZ LYS 51 HZ3 LYS 51 -25.726 -3.715 -11.800 382 H ILE 52 HN ILE 52 -20.808 -8.252 -8.087 383 HA ILE 52 HA ILE 52 -19.271 -6.619 -6.159 384 HB ILE 52 HB ILE 52 -18.896 -9.510 -6.978 385 1HG1 ILE 52 HG12 ILE 52 -18.558 -8.549 -4.141 386 2HG1 ILE 52 HG13 ILE 52 -20.192 -8.513 -4.763 387 1HG2 ILE 52 HG21 ILE 52 -16.864 -7.626 -5.711 388 2HG2 ILE 52 HG22 ILE 52 -16.729 -9.395 -5.731 389 3HG2 ILE 52 HG23 ILE 52 -16.716 -8.496 -7.252 390 1HD1 ILE 52 HD11 ILE 52 -20.122 -10.866 -5.334 391 2HD1 ILE 52 HD12 ILE 52 -18.432 -10.986 -4.763 392 3HD1 ILE 52 HD13 ILE 52 -19.753 -10.625 -3.626 393 H VAL 53 HN VAL 53 -17.604 -5.484 -7.228 394 HA VAL 53 HA VAL 53 -17.245 -6.026 -10.128 395 HB VAL 53 HB VAL 53 -17.460 -3.212 -8.999 396 1HG1 VAL 53 HG11 VAL 53 -16.367 -3.416 -11.136 397 2HG1 VAL 53 HG12 VAL 53 -17.724 -4.365 -11.797 398 3HG1 VAL 53 HG13 VAL 53 -17.964 -2.669 -11.342 399 1HG2 VAL 53 HG21 VAL 53 -19.770 -4.770 -10.239 400 2HG2 VAL 53 HG22 VAL 53 -19.652 -4.233 -8.556 401 3HG2 VAL 53 HG23 VAL 53 -19.749 -3.037 -9.846 402 H LYS 54 HN LYS 54 -15.121 -5.828 -10.828 403 HA LYS 54 HA LYS 54 -13.091 -5.247 -8.750 404 1HB LYS 54 HB2 LYS 54 -13.374 -7.437 -10.370 405 2HB LYS 54 HB3 LYS 54 -12.372 -6.418 -11.428 406 1HG LYS 54 HG2 LYS 54 -10.805 -7.571 -10.341 407 2HG LYS 54 HG3 LYS 54 -10.926 -6.136 -9.296 408 1HD LYS 54 HD2 LYS 54 -12.385 -7.358 -7.745 409 2HD LYS 54 HD3 LYS 54 -12.369 -8.794 -8.786 410 1HE LYS 54 HE2 LYS 54 -9.901 -7.468 -7.644 411 2HE LYS 54 HE3 LYS 54 -10.744 -8.790 -6.824 412 1HZ LYS 54 HZ1 LYS 54 -8.860 -9.604 -8.141 413 2HZ LYS 54 HZ2 LYS 54 -10.253 -10.211 -8.751 414 3HZ LYS 54 HZ3 LYS 54 -9.479 -8.983 -9.509 415 H ILE 55 HN ILE 55 -11.460 -3.691 -9.083 416 HA ILE 55 HA ILE 55 -11.324 -2.292 -11.698 417 HB ILE 55 HB ILE 55 -11.154 -1.224 -8.840 418 1HG1 ILE 55 HG12 ILE 55 -13.300 -0.982 -10.131 419 2HG1 ILE 55 HG13 ILE 55 -12.608 0.476 -9.459 420 1HG2 ILE 55 HG21 ILE 55 -9.092 -0.574 -9.734 421 2HG2 ILE 55 HG22 ILE 55 -9.774 -0.056 -11.277 422 3HG2 ILE 55 HG23 ILE 55 -10.127 0.859 -9.788 423 1HD1 ILE 55 HD11 ILE 55 -13.444 0.952 -11.679 424 2HD1 ILE 55 HD12 ILE 55 -11.704 1.146 -11.668 425 3HD1 ILE 55 HD13 ILE 55 -12.413 -0.318 -12.383 426 H ASP 56 HN ASP 56 -9.352 -2.761 -12.630 427 HA ASP 56 HA ASP 56 -7.188 -3.992 -11.010 428 1HB ASP 56 HB2 ASP 56 -7.675 -5.025 -13.168 429 2HB ASP 56 HB3 ASP 56 -7.479 -3.479 -13.991 430 H VAL 57 HN VAL 57 -6.040 -2.468 -9.919 431 HA VAL 57 HA VAL 57 -6.120 0.258 -10.808 432 HB VAL 57 HB VAL 57 -5.059 0.859 -8.725 433 1HG1 VAL 57 HG11 VAL 57 -6.903 0.298 -7.284 434 2HG1 VAL 57 HG12 VAL 57 -7.477 0.641 -8.919 435 3HG1 VAL 57 HG13 VAL 57 -7.384 -1.048 -8.341 436 1HG2 VAL 57 HG21 VAL 57 -3.665 -1.090 -8.225 437 2HG2 VAL 57 HG22 VAL 57 -4.854 -0.806 -6.940 438 3HG2 VAL 57 HG23 VAL 57 -5.121 -2.109 -8.072 439 H ASP 58 HN ASP 58 -4.746 -1.194 -12.690 440 HA ASP 58 HA ASP 58 -2.463 0.664 -12.863 441 1HB ASP 58 HB2 ASP 58 -1.361 -1.396 -12.035 442 2HB ASP 58 HB3 ASP 58 -2.161 -2.350 -13.293 443 H GLU 59 HN GLU 59 -4.581 -1.885 -14.444 444 HA GLU 59 HA GLU 59 -4.094 -0.959 -17.094 445 1HB GLU 59 HB2 GLU 59 -4.670 -3.249 -16.677 446 2HB GLU 59 HB3 GLU 59 -6.014 -2.784 -15.595 447 1HG GLU 59 HG2 GLU 59 -7.325 -1.998 -17.240 448 2HG GLU 59 HG3 GLU 59 -6.031 -1.984 -18.457 449 H ASN 60 HN ASN 60 -6.714 -0.658 -14.704 450 HA ASN 60 HA ASN 60 -7.753 1.722 -16.090 451 1HB ASN 60 HB2 ASN 60 -10.044 0.953 -16.031 452 2HB ASN 60 HB3 ASN 60 -9.033 0.010 -17.103 453 1HD2 ASN 60 HD22 ASN 60 -10.145 -0.132 -13.658 454 2HD2 ASN 60 HD21 ASN 60 -10.875 -1.723 -13.885 455 H GLN 61 HN GLN 61 -6.234 2.018 -14.070 456 HA GLN 61 HA GLN 61 -7.476 1.849 -11.516 457 1HB GLN 61 HB2 GLN 61 -5.466 2.640 -10.661 458 2HB GLN 61 HB3 GLN 61 -5.008 1.780 -12.135 459 1HG GLN 61 HG2 GLN 61 -4.787 3.926 -13.338 460 2HG GLN 61 HG3 GLN 61 -5.105 4.782 -11.829 461 1HE2 GLN 61 HE22 GLN 61 -3.654 3.967 -9.851 462 2HE2 GLN 61 HE21 GLN 61 -1.977 3.708 -10.227 463 H GLU 62 HN GLU 62 -8.220 3.881 -13.989 464 HA GLU 62 HA GLU 62 -7.916 6.505 -13.126 465 1HB GLU 62 HB2 GLU 62 -9.812 5.013 -14.937 466 2HB GLU 62 HB3 GLU 62 -10.012 6.765 -14.717 467 1HG GLU 62 HG2 GLU 62 -7.477 5.381 -15.708 468 2HG GLU 62 HG3 GLU 62 -8.698 6.104 -16.744 469 H THR 63 HN THR 63 -10.783 4.326 -12.554 470 HA THR 63 HA THR 63 -12.305 6.118 -11.043 471 HB THR 63 HB THR 63 -11.945 3.132 -10.583 472 HG1 THR 63 HG1 THR 63 -13.711 3.101 -12.202 473 1HG2 THR 63 HG21 THR 63 -13.429 4.299 -8.922 474 2HG2 THR 63 HG22 THR 63 -14.455 4.829 -10.276 475 3HG2 THR 63 HG23 THR 63 -14.245 3.093 -9.907 476 H ALA 64 HN ALA 64 -9.530 4.133 -10.113 477 HA ALA 64 HA ALA 64 -9.989 4.243 -7.276 478 1HB ALA 64 HB1 ALA 64 -7.355 3.559 -8.671 479 2HB ALA 64 HB2 ALA 64 -8.043 2.887 -7.185 480 3HB ALA 64 HB3 ALA 64 -8.749 2.489 -8.755 481 H GLY 65 HN GLY 65 -7.269 5.482 -9.234 482 1HA GLY 65 HA2 GLY 65 -6.307 7.526 -7.667 483 2HA GLY 65 HA3 GLY 65 -6.368 7.596 -9.446 484 H LYS 66 HN LYS 66 -9.213 7.860 -9.847 485 HA LYS 66 HA LYS 66 -9.602 10.617 -9.311 486 1HB LYS 66 HB2 LYS 66 -10.692 9.529 -11.160 487 2HB LYS 66 HB3 LYS 66 -11.541 8.409 -10.079 488 1HG LYS 66 HG2 LYS 66 -12.934 10.175 -9.196 489 2HG LYS 66 HG3 LYS 66 -11.948 11.419 -9.985 490 1HD LYS 66 HD2 LYS 66 -14.040 11.075 -11.177 491 2HD LYS 66 HD3 LYS 66 -12.646 10.643 -12.185 492 1HE LYS 66 HE2 LYS 66 -13.072 8.204 -11.490 493 2HE LYS 66 HE3 LYS 66 -14.596 8.765 -10.778 494 1HZ LYS 66 HZ1 LYS 66 -13.771 8.848 -13.622 495 2HZ LYS 66 HZ2 LYS 66 -14.964 7.971 -12.999 496 3HZ LYS 66 HZ3 LYS 66 -15.141 9.608 -13.063 497 H TYR 67 HN TYR 67 -10.870 7.685 -7.580 498 HA TYR 67 HA TYR 67 -12.294 9.313 -5.711 499 1HB TYR 67 HB2 TYR 67 -11.773 6.387 -6.042 500 2HB TYR 67 HB3 TYR 67 -12.125 6.949 -4.421 501 HD1 TYR 67 HD1 TYR 67 -13.497 7.376 -7.921 502 HD2 TYR 67 HD2 TYR 67 -14.325 7.082 -3.696 503 HE1 TYR 67 HE1 TYR 67 -15.917 7.535 -8.393 504 HE2 TYR 67 HE2 TYR 67 -16.749 7.233 -4.158 505 HH TYR 67 HH TYR 67 -18.067 7.654 -7.474 506 H GLY 68 HN GLY 68 -8.967 8.617 -6.104 507 1HA GLY 68 HA2 GLY 68 -7.145 9.353 -4.944 508 2HA GLY 68 HA3 GLY 68 -8.221 10.132 -3.767 509 H VAL 69 HN VAL 69 -7.412 6.696 -4.817 510 HA VAL 69 HA VAL 69 -7.834 5.896 -2.003 511 HB VAL 69 HB VAL 69 -8.566 3.918 -2.663 512 1HG1 VAL 69 HG11 VAL 69 -10.230 5.724 -2.798 513 2HG1 VAL 69 HG12 VAL 69 -9.928 5.841 -4.543 514 3HG1 VAL 69 HG13 VAL 69 -10.627 4.367 -3.867 515 1HG2 VAL 69 HG21 VAL 69 -7.264 3.121 -4.429 516 2HG2 VAL 69 HG22 VAL 69 -8.919 3.162 -5.029 517 3HG2 VAL 69 HG23 VAL 69 -7.785 4.451 -5.496 518 H MET 70 HN MET 70 -5.861 5.286 -4.824 519 HA MET 70 HA MET 70 -3.724 4.911 -5.166 520 1HB MET 70 HB2 MET 70 -3.031 6.198 -2.563 521 2HB MET 70 HB3 MET 70 -2.185 6.293 -4.109 522 1HG MET 70 HG2 MET 70 -4.232 7.645 -4.932 523 2HG MET 70 HG3 MET 70 -4.724 7.716 -3.241 524 1HE MET 70 HE1 MET 70 -3.134 8.471 -1.320 525 2HE MET 70 HE2 MET 70 -1.626 7.773 -1.967 526 3HE MET 70 HE3 MET 70 -1.696 9.493 -1.521 527 H SER 71 HN SER 71 -5.209 2.996 -3.188 528 HA SER 71 HA SER 71 -2.828 1.680 -2.020 529 1HB SER 71 HB2 SER 71 -5.553 2.091 -0.771 530 2HB SER 71 HB3 SER 71 -4.161 1.313 0.004 531 HG SER 71 HG SER 71 -4.569 4.014 -0.701 532 H ILE 72 HN ILE 72 -3.202 -0.614 -1.463 533 HA ILE 72 HA ILE 72 -5.552 -1.822 -2.699 534 HB ILE 72 HB ILE 72 -2.714 -2.814 -3.166 535 1HG1 ILE 72 HG12 ILE 72 -3.807 -2.546 -5.659 536 2HG1 ILE 72 HG13 ILE 72 -4.706 -1.286 -4.835 537 1HG2 ILE 72 HG21 ILE 72 -3.684 -4.439 -4.662 538 2HG2 ILE 72 HG22 ILE 72 -4.343 -4.728 -3.052 539 3HG2 ILE 72 HG23 ILE 72 -5.311 -3.854 -4.299 540 1HD1 ILE 72 HD11 ILE 72 -2.583 -0.166 -4.289 541 2HD1 ILE 72 HD12 ILE 72 -1.680 -1.606 -4.882 542 3HD1 ILE 72 HD13 ILE 72 -2.649 -0.652 -5.990 543 HA PRO 73 HA PRO 73 -6.598 -3.726 -2.518 544 1HB PRO 73 HB2 PRO 73 -8.369 -5.148 -1.078 545 2HB PRO 73 HB3 PRO 73 -6.852 -5.885 -1.686 546 1HG PRO 73 HG2 PRO 73 -7.446 -4.823 1.070 547 2HG PRO 73 HG3 PRO 73 -6.637 -6.352 0.639 548 1HD PRO 73 HD2 PRO 73 -5.297 -4.000 1.325 549 2HD PRO 73 HD3 PRO 73 -4.587 -5.240 0.263 550 H THR 74 HN THR 74 -8.127 -2.168 -2.904 551 HA THR 74 HA THR 74 -9.187 -0.647 -0.552 552 HB THR 74 HB THR 74 -8.791 0.280 -3.420 553 HG1 THR 74 HG1 THR 74 -7.084 0.778 -2.371 554 1HG2 THR 74 HG21 THR 74 -9.999 2.311 -2.768 555 2HG2 THR 74 HG22 THR 74 -11.083 0.948 -2.674 556 3HG2 THR 74 HG23 THR 74 -10.385 1.613 -1.178 557 H LEU 75 HN LEU 75 -11.376 -0.589 -0.292 558 HA LEU 75 HA LEU 75 -13.120 -2.273 -2.036 559 1HB LEU 75 HB2 LEU 75 -12.125 -3.307 0.245 560 2HB LEU 75 HB3 LEU 75 -13.274 -2.206 0.984 561 HG LEU 75 HG LEU 75 -15.009 -3.342 -0.693 562 1HD1 LEU 75 HD11 LEU 75 -14.410 -5.795 -0.949 563 2HD1 LEU 75 HD12 LEU 75 -13.439 -4.704 -1.951 564 3HD1 LEU 75 HD13 LEU 75 -12.753 -5.416 -0.478 565 1HD2 LEU 75 HD21 LEU 75 -13.919 -4.637 1.839 566 2HD2 LEU 75 HD22 LEU 75 -15.172 -3.387 1.720 567 3HD2 LEU 75 HD23 LEU 75 -15.496 -5.008 1.094 568 H LEU 76 HN LEU 76 -14.926 -1.120 -2.525 569 HA LEU 76 HA LEU 76 -15.755 1.091 -0.760 570 1HB LEU 76 HB2 LEU 76 -16.030 1.183 -3.782 571 2HB LEU 76 HB3 LEU 76 -16.447 2.432 -2.612 572 HG LEU 76 HG LEU 76 -13.637 1.569 -3.415 573 1HD1 LEU 76 HD11 LEU 76 -13.530 3.776 -4.481 574 2HD1 LEU 76 HD12 LEU 76 -14.860 2.823 -5.148 575 3HD1 LEU 76 HD13 LEU 76 -15.203 4.121 -3.987 576 1HD2 LEU 76 HD21 LEU 76 -13.647 2.352 -1.074 577 2HD2 LEU 76 HD22 LEU 76 -12.853 3.523 -2.125 578 3HD2 LEU 76 HD23 LEU 76 -14.511 3.827 -1.560 579 H VAL 77 HN VAL 77 -17.623 0.265 0.095 580 HA VAL 77 HA VAL 77 -19.329 -1.555 -1.546 581 HB VAL 77 HB VAL 77 -19.582 -0.668 1.349 582 1HG1 VAL 77 HG11 VAL 77 -21.128 -2.772 -0.228 583 2HG1 VAL 77 HG12 VAL 77 -21.276 -2.469 1.523 584 3HG1 VAL 77 HG13 VAL 77 -21.777 -1.232 0.371 585 1HG2 VAL 77 HG21 VAL 77 -18.613 -3.310 0.172 586 2HG2 VAL 77 HG22 VAL 77 -17.644 -2.151 1.109 587 3HG2 VAL 77 HG23 VAL 77 -18.967 -3.024 1.890 588 H LEU 78 HN LEU 78 -20.872 -0.611 -2.772 589 HA LEU 78 HA LEU 78 -21.742 2.152 -2.117 590 1HB LEU 78 HB2 LEU 78 -21.637 0.790 -4.839 591 2HB LEU 78 HB3 LEU 78 -22.268 2.393 -4.496 592 HG LEU 78 HG LEU 78 -19.742 2.573 -3.383 593 1HD1 LEU 78 HD11 LEU 78 -18.118 1.627 -4.882 594 2HD1 LEU 78 HD12 LEU 78 -19.189 0.309 -4.400 595 3HD1 LEU 78 HD13 LEU 78 -19.373 1.049 -5.993 596 1HD2 LEU 78 HD21 LEU 78 -19.160 3.967 -5.303 597 2HD2 LEU 78 HD22 LEU 78 -20.489 3.265 -6.252 598 3HD2 LEU 78 HD23 LEU 78 -20.832 4.257 -4.818 599 H LYS 79 HN LYS 79 -23.937 2.650 -2.408 600 HA LYS 79 HA LYS 79 -25.846 0.441 -2.782 601 1HB LYS 79 HB2 LYS 79 -25.451 0.136 -0.540 602 2HB LYS 79 HB3 LYS 79 -25.221 1.862 -0.223 603 1HG LYS 79 HG2 LYS 79 -27.558 2.308 -0.274 604 2HG LYS 79 HG3 LYS 79 -27.937 0.657 -0.826 605 1HD LYS 79 HD2 LYS 79 -26.955 -0.259 1.264 606 2HD LYS 79 HD3 LYS 79 -26.561 1.363 1.822 607 1HE LYS 79 HE2 LYS 79 -29.345 0.238 1.365 608 2HE LYS 79 HE3 LYS 79 -28.525 0.466 2.918 609 1HZ LYS 79 HZ1 LYS 79 -28.555 2.858 2.525 610 2HZ LYS 79 HZ2 LYS 79 -29.334 2.659 1.096 611 3HZ LYS 79 HZ3 LYS 79 -30.065 2.256 2.491 612 H ASP 80 HN ASP 80 -27.356 1.151 -3.881 613 HA ASP 80 HA ASP 80 -28.567 2.432 -5.291 614 1HB ASP 80 HB2 ASP 80 -29.805 2.093 -3.159 615 2HB ASP 80 HB3 ASP 80 -29.315 3.706 -2.644 616 H GLY 81 HN GLY 81 -25.844 3.668 -5.043 617 1HA GLY 81 HA2 GLY 81 -25.713 5.569 -6.781 618 2HA GLY 81 HA3 GLY 81 -26.524 6.518 -5.533 619 H GLU 82 HN GLU 82 -24.910 5.161 -3.313 620 HA GLU 82 HA GLU 82 -22.426 6.685 -3.751 621 1HB GLU 82 HB2 GLU 82 -22.882 7.974 -1.800 622 2HB GLU 82 HB3 GLU 82 -24.343 7.979 -2.809 623 1HG GLU 82 HG2 GLU 82 -25.337 6.217 -1.344 624 2HG GLU 82 HG3 GLU 82 -23.924 6.319 -0.293 625 H VAL 83 HN VAL 83 -20.768 6.370 -2.094 626 HA VAL 83 HA VAL 83 -20.430 3.612 -1.228 627 HB VAL 83 HB VAL 83 -18.883 6.126 -0.447 628 1HG1 VAL 83 HG11 VAL 83 -18.412 4.183 1.023 629 2HG1 VAL 83 HG12 VAL 83 -18.064 3.186 -0.405 630 3HG1 VAL 83 HG13 VAL 83 -17.018 4.557 0.015 631 1HG2 VAL 83 HG21 VAL 83 -18.798 5.873 -2.916 632 2HG2 VAL 83 HG22 VAL 83 -17.237 5.511 -2.181 633 3HG2 VAL 83 HG23 VAL 83 -18.277 4.186 -2.725 634 H VAL 84 HN VAL 84 -20.972 2.718 0.596 635 HA VAL 84 HA VAL 84 -21.984 4.403 2.835 636 HB VAL 84 HB VAL 84 -23.536 2.575 3.348 637 1HG1 VAL 84 HG11 VAL 84 -25.233 3.186 1.725 638 2HG1 VAL 84 HG12 VAL 84 -24.255 4.603 2.122 639 3HG1 VAL 84 HG13 VAL 84 -23.994 3.756 0.584 640 1HG2 VAL 84 HG21 VAL 84 -22.442 0.698 2.142 641 2HG2 VAL 84 HG22 VAL 84 -24.151 0.871 1.740 642 3HG2 VAL 84 HG23 VAL 84 -22.914 1.435 0.595 643 H GLU 85 HN GLU 85 -19.778 1.860 1.823 644 HA GLU 85 HA GLU 85 -18.586 2.063 4.435 645 1HB GLU 85 HB2 GLU 85 -19.880 -0.453 3.512 646 2HB GLU 85 HB3 GLU 85 -18.179 -0.669 3.933 647 1HG GLU 85 HG2 GLU 85 -20.231 0.671 5.693 648 2HG GLU 85 HG3 GLU 85 -19.806 -1.046 5.779 649 H THR 86 HN THR 86 -16.366 1.294 4.418 650 HA THR 86 HA THR 86 -15.087 1.224 1.754 651 HB THR 86 HB THR 86 -13.974 3.268 3.606 652 HG1 THR 86 HG1 THR 86 -16.086 3.890 3.869 653 1HG2 THR 86 HG21 THR 86 -13.687 4.491 1.494 654 2HG2 THR 86 HG22 THR 86 -13.111 2.822 1.334 655 3HG2 THR 86 HG23 THR 86 -14.710 3.280 0.674 656 H SER 87 HN SER 87 -12.934 0.355 1.906 657 HA SER 87 HA SER 87 -11.638 0.153 4.505 658 1HB SER 87 HB2 SER 87 -12.459 -2.353 2.969 659 2HB SER 87 HB3 SER 87 -11.202 -2.322 4.215 660 HG SER 87 HG SER 87 -13.600 -1.104 4.892 661 H VAL 88 HN VAL 88 -9.409 -0.180 4.278 662 HA VAL 88 HA VAL 88 -8.298 -0.191 1.540 663 HB VAL 88 HB VAL 88 -7.599 1.920 3.631 664 1HG1 VAL 88 HG11 VAL 88 -6.840 1.417 0.732 665 2HG1 VAL 88 HG12 VAL 88 -6.382 2.893 1.630 666 3HG1 VAL 88 HG13 VAL 88 -5.734 1.320 2.111 667 1HG2 VAL 88 HG21 VAL 88 -9.810 2.463 2.747 668 2HG2 VAL 88 HG22 VAL 88 -8.620 3.531 2.010 669 3HG2 VAL 88 HG23 VAL 88 -9.257 2.151 1.085 670 H GLY 89 HN GLY 89 -8.265 -2.367 2.491 671 1HA GLY 89 HA2 GLY 89 -5.873 -3.395 3.405 672 2HA GLY 89 HA3 GLY 89 -6.757 -3.006 4.888 673 H PHE 90 HN PHE 90 -6.088 -5.639 4.238 674 HA PHE 90 HA PHE 90 -8.037 -7.052 2.735 675 1HB PHE 90 HB2 PHE 90 -5.763 -7.874 3.101 676 2HB PHE 90 HB3 PHE 90 -6.016 -7.918 4.838 677 HD1 PHE 90 HD1 PHE 90 -7.217 -9.461 1.620 678 HD2 PHE 90 HD2 PHE 90 -6.849 -9.872 5.903 679 HE1 PHE 90 HE1 PHE 90 -8.100 -11.777 1.486 680 HE2 PHE 90 HE2 PHE 90 -7.688 -12.199 5.747 681 HZ PHE 90 HZ PHE 90 -8.316 -13.155 3.537 682 H LYS 91 HN LYS 91 -9.570 -8.664 3.501 683 HA LYS 91 HA LYS 91 -10.310 -8.738 6.315 684 1HB LYS 91 HB2 LYS 91 -11.907 -7.223 4.368 685 2HB LYS 91 HB3 LYS 91 -12.818 -8.622 4.943 686 1HG LYS 91 HG2 LYS 91 -12.575 -7.937 7.240 687 2HG LYS 91 HG3 LYS 91 -11.504 -6.615 6.817 688 1HD LYS 91 HD2 LYS 91 -14.334 -6.818 5.718 689 2HD LYS 91 HD3 LYS 91 -14.033 -6.152 7.316 690 1HE LYS 91 HE2 LYS 91 -12.691 -5.097 4.783 691 2HE LYS 91 HE3 LYS 91 -14.191 -4.452 5.442 692 1HZ LYS 91 HZ1 LYS 91 -12.960 -3.976 7.524 693 2HZ LYS 91 HZ2 LYS 91 -11.556 -4.389 6.777 694 3HZ LYS 91 HZ3 LYS 91 -12.464 -3.134 6.220 695 HA PRO 92 HA PRO 92 -10.660 -12.932 4.608 696 1HB PRO 92 HB2 PRO 92 -11.693 -14.288 6.745 697 2HB PRO 92 HB3 PRO 92 -10.005 -13.694 6.714 698 1HG PRO 92 HG2 PRO 92 -12.432 -12.349 7.944 699 2HG PRO 92 HG3 PRO 92 -10.845 -12.674 8.718 700 1HD PRO 92 HD2 PRO 92 -11.351 -10.244 7.621 701 2HD PRO 92 HD3 PRO 92 -9.750 -11.003 7.429 702 H LYS 93 HN LYS 93 -12.491 -14.590 4.313 703 HA LYS 93 HA LYS 93 -14.472 -13.364 2.859 704 1HB LYS 93 HB2 LYS 93 -13.646 -15.990 3.288 705 2HB LYS 93 HB3 LYS 93 -15.264 -16.034 3.958 706 1HG LYS 93 HG2 LYS 93 -14.433 -15.236 1.147 707 2HG LYS 93 HG3 LYS 93 -15.231 -16.722 1.610 708 1HD LYS 93 HD2 LYS 93 -16.457 -13.931 1.770 709 2HD LYS 93 HD3 LYS 93 -16.692 -15.074 0.470 710 1HE LYS 93 HE2 LYS 93 -17.527 -15.590 3.360 711 2HE LYS 93 HE3 LYS 93 -18.581 -14.941 2.109 712 1HZ LYS 93 HZ1 LYS 93 -17.399 -17.647 2.135 713 2HZ LYS 93 HZ2 LYS 93 -18.982 -17.210 2.222 714 3HZ LYS 93 HZ3 LYS 93 -18.171 -17.014 0.820 715 H GLU 94 HN GLU 94 -14.853 -14.631 6.185 716 HA GLU 94 HA GLU 94 -17.617 -14.032 6.303 717 1HB GLU 94 HB2 GLU 94 -15.517 -14.322 8.506 718 2HB GLU 94 HB3 GLU 94 -17.268 -14.224 8.796 719 1HG GLU 94 HG2 GLU 94 -17.613 -16.275 7.428 720 2HG GLU 94 HG3 GLU 94 -15.872 -16.402 7.169 721 H ALA 95 HN ALA 95 -14.729 -12.122 7.277 722 HA ALA 95 HA ALA 95 -16.252 -10.037 8.528 723 1HB ALA 95 HB1 ALA 95 -13.815 -10.478 8.937 724 2HB ALA 95 HB2 ALA 95 -13.503 -9.930 7.260 725 3HB ALA 95 HB3 ALA 95 -14.172 -8.804 8.472 726 H LEU 96 HN LEU 96 -15.061 -10.658 5.236 727 HA LEU 96 HA LEU 96 -15.747 -8.086 4.217 728 1HB LEU 96 HB2 LEU 96 -14.276 -10.104 3.161 729 2HB LEU 96 HB3 LEU 96 -15.823 -10.541 2.454 730 HG LEU 96 HG LEU 96 -15.988 -8.066 1.661 731 1HD1 LEU 96 HD11 LEU 96 -13.726 -6.929 1.452 732 2HD1 LEU 96 HD12 LEU 96 -14.283 -7.048 3.127 733 3HD1 LEU 96 HD13 LEU 96 -13.057 -8.174 2.518 734 1HD2 LEU 96 HD21 LEU 96 -13.600 -9.550 0.529 735 2HD2 LEU 96 HD22 LEU 96 -15.293 -9.980 0.157 736 3HD2 LEU 96 HD23 LEU 96 -14.653 -8.392 -0.300 737 H GLN 97 HN GLN 97 -17.494 -11.214 4.229 738 HA GLN 97 HA GLN 97 -19.787 -10.174 2.894 739 1HB GLN 97 HB2 GLN 97 -20.666 -12.167 3.053 740 2HB GLN 97 HB3 GLN 97 -18.990 -12.626 3.304 741 1HG GLN 97 HG2 GLN 97 -19.496 -12.731 5.732 742 2HG GLN 97 HG3 GLN 97 -21.216 -12.479 5.332 743 1HE2 GLN 97 HE22 GLN 97 -21.809 -14.048 3.190 744 2HE2 GLN 97 HE21 GLN 97 -21.185 -15.684 3.344 745 H GLU 98 HN GLU 98 -18.847 -10.337 6.357 746 HA GLU 98 HA GLU 98 -21.318 -9.369 7.340 747 1HB GLU 98 HB2 GLU 98 -19.675 -10.397 8.781 748 2HB GLU 98 HB3 GLU 98 -18.516 -9.091 8.477 749 1HG GLU 98 HG2 GLU 98 -19.991 -7.475 9.586 750 2HG GLU 98 HG3 GLU 98 -21.244 -8.707 9.779 751 H LEU 99 HN LEU 99 -18.371 -7.576 6.333 752 HA LEU 99 HA LEU 99 -19.184 -5.020 7.041 753 1HB LEU 99 HB2 LEU 99 -16.909 -5.709 6.173 754 2HB LEU 99 HB3 LEU 99 -17.611 -5.798 4.564 755 HG LEU 99 HG LEU 99 -18.359 -3.234 5.212 756 1HD1 LEU 99 HD11 LEU 99 -17.324 -3.298 7.430 757 2HD1 LEU 99 HD12 LEU 99 -15.754 -3.683 6.707 758 3HD1 LEU 99 HD13 LEU 99 -16.523 -2.118 6.378 759 1HD2 LEU 99 HD21 LEU 99 -17.236 -3.892 3.201 760 2HD2 LEU 99 HD22 LEU 99 -16.427 -2.483 3.913 761 3HD2 LEU 99 HD23 LEU 99 -15.696 -4.098 4.065 762 H VAL 100 HN VAL 100 -19.932 -6.826 4.064 763 HA VAL 100 HA VAL 100 -21.379 -4.503 3.010 764 HB VAL 100 HB VAL 100 -20.121 -5.708 1.493 765 1HG1 VAL 100 HG11 VAL 100 -20.259 -8.023 2.420 766 2HG1 VAL 100 HG12 VAL 100 -21.926 -8.148 1.845 767 3HG1 VAL 100 HG13 VAL 100 -20.584 -7.964 0.693 768 1HG2 VAL 100 HG21 VAL 100 -21.674 -5.896 -0.312 769 2HG2 VAL 100 HG22 VAL 100 -23.034 -6.215 0.788 770 3HG2 VAL 100 HG23 VAL 100 -22.268 -4.619 0.760 771 H ASN 101 HN ASN 101 -22.210 -7.701 4.423 772 HA ASN 101 HA ASN 101 -24.949 -7.786 3.858 773 1HB ASN 101 HB2 ASN 101 -23.796 -9.711 4.703 774 2HB ASN 101 HB3 ASN 101 -23.410 -8.885 6.220 775 1HD2 ASN 101 HD22 ASN 101 -25.007 -8.732 7.847 776 2HD2 ASN 101 HD21 ASN 101 -26.579 -9.474 7.699 777 H LYS 102 HN LYS 102 -23.258 -6.073 6.479 778 HA LYS 102 HA LYS 102 -25.642 -5.496 7.948 779 1HB LYS 102 HB2 LYS 102 -24.269 -4.239 9.411 780 2HB LYS 102 HB3 LYS 102 -23.291 -5.588 8.833 781 1HG LYS 102 HG2 LYS 102 -22.426 -3.892 7.061 782 2HG LYS 102 HG3 LYS 102 -23.091 -2.669 8.165 783 1HD LYS 102 HD2 LYS 102 -21.719 -3.623 10.028 784 2HD LYS 102 HD3 LYS 102 -21.119 -4.879 8.923 785 1HE LYS 102 HE2 LYS 102 -19.422 -3.268 9.031 786 2HE LYS 102 HE3 LYS 102 -20.213 -3.129 7.444 787 1HZ LYS 102 HZ1 LYS 102 -19.736 -0.972 8.473 788 2HZ LYS 102 HZ2 LYS 102 -21.332 -1.166 8.194 789 3HZ LYS 102 HZ3 LYS 102 -20.737 -1.314 9.731 790 H HIS 103 HN HIS 103 -24.694 -4.173 4.965 791 HA HIS 103 HA HIS 103 -26.591 -1.883 5.364 792 1HB HIS 103 HB2 HIS 103 -24.193 -2.026 3.492 793 2HB HIS 103 HB3 HIS 103 -25.341 -0.693 3.606 794 HD1 HIS 103 HD1 HIS 103 -25.351 0.589 6.136 795 HD2 HIS 103 HD2 HIS 103 -22.163 -1.988 5.151 796 HE1 HIS 103 HE1 HIS 103 -23.513 1.059 7.827 797 H LEU 104 HN LEU 104 -25.652 -4.654 3.469 798 HA LEU 104 HA LEU 104 -27.179 -4.336 1.091 799 1HB LEU 104 HB2 LEU 104 -25.413 -5.895 1.211 800 2HB LEU 104 HB3 LEU 104 -26.041 -6.562 2.722 801 HG LEU 104 HG LEU 104 -27.831 -7.678 1.648 802 1HD1 LEU 104 HD11 LEU 104 -26.705 -6.624 -1.003 803 2HD1 LEU 104 HD12 LEU 104 -28.082 -7.722 -0.800 804 3HD1 LEU 104 HD13 LEU 104 -28.216 -6.052 -0.266 805 1HD2 LEU 104 HD21 LEU 104 -25.157 -8.152 0.276 806 2HD2 LEU 104 HD22 LEU 104 -25.672 -8.786 1.856 807 3HD2 LEU 104 HD23 LEU 104 -26.497 -9.316 0.395 808 1H MET 1 H1 MET 1 4.382 26.622 -10.660 809 2H MET 1 H2 MET 1 5.904 26.236 -10.206 810 3H MET 1 H3 MET 1 4.762 26.537 -9.069 811 HA MET 1 HA MET 1 5.812 28.465 -11.019 812 1HB MET 1 HB2 MET 1 3.442 28.871 -10.366 813 2HB MET 1 HB3 MET 1 3.944 29.038 -8.682 814 1HG MET 1 HG2 MET 1 5.381 30.968 -9.328 815 2HG MET 1 HG3 MET 1 4.935 30.731 -11.016 816 1HE MET 1 HE1 MET 1 2.203 32.462 -7.691 817 2HE MET 1 HE2 MET 1 2.704 30.761 -7.644 818 3HE MET 1 HE3 MET 1 3.922 32.051 -7.505 819 H GLU 2 HN GLU 2 5.550 28.542 -7.388 820 HA GLU 2 HA GLU 2 8.529 28.591 -7.210 821 1HB GLU 2 HB2 GLU 2 6.528 30.522 -5.960 822 2HB GLU 2 HB3 GLU 2 8.220 30.388 -5.458 823 1HG GLU 2 HG2 GLU 2 8.954 30.953 -7.766 824 2HG GLU 2 HG3 GLU 2 7.272 31.226 -8.219 825 H ASN 3 HN ASN 3 6.689 26.448 -6.870 826 HA ASN 3 HA ASN 3 7.738 25.280 -4.584 827 1HB ASN 3 HB2 ASN 3 4.719 25.583 -4.537 828 2HB ASN 3 HB3 ASN 3 5.673 24.339 -3.707 829 1HD2 ASN 3 HD22 ASN 3 7.637 25.382 -2.271 830 2HD2 ASN 3 HD21 ASN 3 7.097 26.705 -1.298 831 H LYS 4 HN LYS 4 8.082 23.475 -5.339 832 HA LYS 4 HA LYS 4 6.597 22.081 -7.494 833 1HB LYS 4 HB2 LYS 4 9.548 21.913 -6.717 834 2HB LYS 4 HB3 LYS 4 8.778 20.903 -7.939 835 1HG LYS 4 HG2 LYS 4 8.458 22.822 -9.408 836 2HG LYS 4 HG3 LYS 4 9.024 23.941 -8.146 837 1HD LYS 4 HD2 LYS 4 11.209 22.797 -8.092 838 2HD LYS 4 HD3 LYS 4 10.671 21.693 -9.376 839 1HE LYS 4 HE2 LYS 4 10.419 23.625 -10.909 840 2HE LYS 4 HE3 LYS 4 10.912 24.728 -9.610 841 1HZ LYS 4 HZ1 LYS 4 12.724 24.164 -11.143 842 2HZ LYS 4 HZ2 LYS 4 13.089 23.746 -9.608 843 3HZ LYS 4 HZ3 LYS 4 12.646 22.596 -10.711 844 H ILE 5 HN ILE 5 5.524 20.291 -6.549 845 HA ILE 5 HA ILE 5 6.253 19.881 -3.712 846 HB ILE 5 HB ILE 5 3.716 19.236 -5.227 847 1HG1 ILE 5 HG12 ILE 5 4.626 21.326 -3.223 848 2HG1 ILE 5 HG13 ILE 5 3.821 21.553 -4.770 849 1HG2 ILE 5 HG21 ILE 5 4.207 17.449 -3.574 850 2HG2 ILE 5 HG22 ILE 5 4.406 18.694 -2.306 851 3HG2 ILE 5 HG23 ILE 5 2.826 18.403 -3.089 852 1HD1 ILE 5 HD11 ILE 5 1.731 20.581 -3.739 853 2HD1 ILE 5 HD12 ILE 5 2.591 20.543 -2.177 854 3HD1 ILE 5 HD13 ILE 5 2.303 22.094 -2.987 855 H ILE 6 HN ILE 6 6.822 17.955 -2.887 856 HA ILE 6 HA ILE 6 7.165 15.641 -4.683 857 HB ILE 6 HB ILE 6 9.197 16.979 -4.943 858 1HG1 ILE 6 HG12 ILE 6 9.623 14.398 -3.395 859 2HG1 ILE 6 HG13 ILE 6 9.247 14.540 -5.113 860 1HG2 ILE 6 HG21 ILE 6 9.212 18.124 -2.715 861 2HG2 ILE 6 HG22 ILE 6 9.749 16.596 -1.978 862 3HG2 ILE 6 HG23 ILE 6 10.764 17.444 -3.162 863 1HD1 ILE 6 HD11 ILE 6 11.603 14.149 -4.854 864 2HD1 ILE 6 HD12 ILE 6 11.374 15.797 -5.470 865 3HD1 ILE 6 HD13 ILE 6 11.795 15.518 -3.760 866 H TYR 7 HN TYR 7 7.064 13.700 -3.572 867 HA TYR 7 HA TYR 7 6.240 13.907 -0.711 868 1HB TYR 7 HB2 TYR 7 4.456 13.833 -2.662 869 2HB TYR 7 HB3 TYR 7 4.892 12.142 -2.767 870 HD1 TYR 7 HD1 TYR 7 4.040 10.561 -1.052 871 HD2 TYR 7 HD2 TYR 7 3.553 14.825 -0.575 872 HE1 TYR 7 HE1 TYR 7 2.184 10.176 0.516 873 HE2 TYR 7 HE2 TYR 7 1.789 14.430 1.118 874 HH TYR 7 HH TYR 7 0.435 12.844 2.148 875 H PHE 8 HN PHE 8 6.987 12.143 0.543 876 HA PHE 8 HA PHE 8 8.539 10.058 -0.944 877 1HB PHE 8 HB2 PHE 8 9.057 10.904 1.896 878 2HB PHE 8 HB3 PHE 8 10.002 9.813 0.918 879 HD1 PHE 8 HD1 PHE 8 11.054 12.135 2.521 880 HD2 PHE 8 HD2 PHE 8 9.888 11.857 -1.624 881 HE1 PHE 8 HE1 PHE 8 12.602 13.961 1.923 882 HE2 PHE 8 HE2 PHE 8 11.443 13.682 -2.185 883 HZ PHE 8 HZ PHE 8 12.765 14.784 -0.395 884 H LEU 9 HN LEU 9 8.419 7.914 -0.174 885 HA LEU 9 HA LEU 9 6.172 7.284 1.664 886 1HB LEU 9 HB2 LEU 9 6.757 6.445 -1.190 887 2HB LEU 9 HB3 LEU 9 6.029 5.277 -0.081 888 HG LEU 9 HG LEU 9 4.891 7.966 -0.941 889 1HD1 LEU 9 HD11 LEU 9 4.074 5.079 -1.460 890 2HD1 LEU 9 HD12 LEU 9 3.199 6.509 -2.047 891 3HD1 LEU 9 HD13 LEU 9 4.836 6.159 -2.631 892 1HD2 LEU 9 HD21 LEU 9 2.782 7.208 0.216 893 2HD2 LEU 9 HD22 LEU 9 3.729 5.924 1.005 894 3HD2 LEU 9 HD23 LEU 9 4.084 7.639 1.320 895 H SER 10 HN SER 10 6.918 6.181 3.354 896 HA SER 10 HA SER 10 8.598 3.890 2.945 897 1HB SER 10 HB2 SER 10 10.280 4.417 4.639 898 2HB SER 10 HB3 SER 10 10.372 5.582 3.312 899 HG SER 10 HG SER 10 9.577 7.132 4.571 900 H THR 11 HN THR 11 8.505 2.433 4.866 901 HA THR 11 HA THR 11 5.956 2.115 5.794 902 HB THR 11 HB THR 11 8.529 1.197 7.151 903 HG1 THR 11 HG1 THR 11 8.429 -0.515 5.756 904 1HG2 THR 11 HG21 THR 11 6.434 0.754 8.471 905 2HG2 THR 11 HG22 THR 11 5.766 -0.107 7.069 906 3HG2 THR 11 HG23 THR 11 7.216 -0.713 7.913 907 H GLY 12 HN GLY 12 4.732 3.086 7.238 908 1HA GLY 12 HA2 GLY 12 4.011 4.415 8.962 909 2HA GLY 12 HA3 GLY 12 5.412 3.809 9.863 910 H ASN 13 HN ASN 13 6.128 5.518 6.937 911 HA ASN 13 HA ASN 13 7.585 7.137 6.604 912 1HB ASN 13 HB2 ASN 13 5.311 8.344 6.753 913 2HB ASN 13 HB3 ASN 13 5.881 8.978 8.312 914 1HD2 ASN 13 HD22 ASN 13 7.304 10.800 8.156 915 2HD2 ASN 13 HD21 ASN 13 7.863 11.399 6.594 916 H SER 14 HN SER 14 8.551 5.524 8.248 917 HA SER 14 HA SER 14 9.758 6.786 10.564 918 1HB SER 14 HB2 SER 14 9.075 4.412 10.364 919 2HB SER 14 HB3 SER 14 10.306 4.155 9.113 920 HG SER 14 HG SER 14 10.808 3.540 11.333 921 H ALA 15 HN ALA 15 12.227 5.611 10.065 922 HA ALA 15 HA ALA 15 13.767 7.713 9.966 923 1HB ALA 15 HB1 ALA 15 14.579 4.979 8.952 924 2HB ALA 15 HB2 ALA 15 15.709 6.266 9.456 925 3HB ALA 15 HB3 ALA 15 14.595 5.553 10.633 926 H ARG 16 HN ARG 16 13.580 5.840 6.844 927 HA ARG 16 HA ARG 16 15.418 7.583 5.595 928 1HB ARG 16 HB2 ARG 16 13.270 5.790 4.380 929 2HB ARG 16 HB3 ARG 16 14.293 6.851 3.418 930 1HG ARG 16 HG2 ARG 16 16.297 5.700 4.660 931 2HG ARG 16 HG3 ARG 16 15.102 4.433 4.992 932 1HD ARG 16 HD2 ARG 16 14.824 3.911 2.721 933 2HD ARG 16 HD3 ARG 16 15.430 5.467 2.179 934 HE ARG 16 HE ARG 16 17.143 3.262 3.274 935 1HH1 ARG 16 HH11 ARG 16 16.853 6.080 1.072 936 2HH1 ARG 16 HH12 ARG 16 18.391 5.733 0.317 937 1HH2 ARG 16 HH21 ARG 16 19.074 2.908 2.280 938 2HH2 ARG 16 HH22 ARG 16 19.617 3.907 0.940 939 H SER 17 HN SER 17 11.807 7.827 5.506 940 HA SER 17 HA SER 17 11.740 10.049 3.756 941 1HB SER 17 HB2 SER 17 9.931 9.050 5.978 942 2HB SER 17 HB3 SER 17 9.580 10.504 5.058 943 HG SER 17 HG SER 17 8.565 8.820 4.121 944 H GLN 18 HN GLN 18 11.780 9.968 7.360 945 HA GLN 18 HA GLN 18 11.561 12.734 7.833 946 1HB GLN 18 HB2 GLN 18 13.190 10.675 9.384 947 2HB GLN 18 HB3 GLN 18 12.707 12.242 9.991 948 1HG GLN 18 HG2 GLN 18 10.854 9.940 9.287 949 2HG GLN 18 HG3 GLN 18 11.379 10.411 10.897 950 1HE2 GLN 18 HE22 GLN 18 8.621 10.220 9.820 951 2HE2 GLN 18 HE21 GLN 18 7.940 11.757 10.280 952 H MET 19 HN MET 19 14.427 10.667 7.457 953 HA MET 19 HA MET 19 16.349 12.680 7.990 954 1HB MET 19 HB2 MET 19 16.568 10.108 8.111 955 2HB MET 19 HB3 MET 19 16.695 10.124 6.348 956 1HG MET 19 HG2 MET 19 18.619 11.886 6.846 957 2HG MET 19 HG3 MET 19 18.601 11.158 8.441 958 1HE MET 19 HE1 MET 19 18.837 8.480 8.794 959 2HE MET 19 HE2 MET 19 17.987 7.826 7.369 960 3HE MET 19 HE3 MET 19 19.704 7.437 7.662 961 H ALA 20 HN ALA 20 14.897 11.337 4.983 962 HA ALA 20 HA ALA 20 16.571 12.756 3.165 963 1HB ALA 20 HB1 ALA 20 15.312 10.749 2.494 964 2HB ALA 20 HB2 ALA 20 13.780 11.605 2.789 965 3HB ALA 20 HB3 ALA 20 14.871 12.153 1.497 966 H GLU 21 HN GLU 21 13.400 13.589 4.699 967 HA GLU 21 HA GLU 21 13.174 15.844 2.952 968 1HB GLU 21 HB2 GLU 21 11.179 16.363 3.947 969 2HB GLU 21 HB3 GLU 21 11.269 14.593 3.913 970 1HG GLU 21 HG2 GLU 21 11.582 14.467 6.263 971 2HG GLU 21 HG3 GLU 21 11.881 16.208 6.381 972 H GLY 22 HN GLY 22 14.701 15.443 6.127 973 1HA GLY 22 HA2 GLY 22 15.164 18.294 6.489 974 2HA GLY 22 HA3 GLY 22 15.996 16.964 7.295 975 H TRP 23 HN TRP 23 17.075 15.521 5.108 976 HA TRP 23 HA TRP 23 19.332 16.977 4.240 977 1HB TRP 23 HB2 TRP 23 17.951 14.445 3.380 978 2HB TRP 23 HB3 TRP 23 19.069 15.161 2.246 979 HD1 TRP 23 HD1 TRP 23 19.062 12.778 4.950 980 HE1 TRP 23 HE1 TRP 23 21.435 12.208 5.700 981 HE3 TRP 23 HE3 TRP 23 21.547 16.563 2.594 982 HZ2 TRP 23 HZ2 TRP 23 24.101 13.276 5.322 983 HZ3 TRP 23 HZ3 TRP 23 24.032 16.684 2.699 984 HH2 TRP 23 HH2 TRP 23 25.311 15.065 4.075 985 H ALA 24 HN ALA 24 16.170 16.494 2.629 986 HA ALA 24 HA ALA 24 16.881 17.622 0.177 987 1HB ALA 24 HB1 ALA 24 14.754 16.357 0.580 988 2HB ALA 24 HB2 ALA 24 14.143 17.724 1.545 989 3HB ALA 24 HB3 ALA 24 14.458 17.934 -0.179 990 H LYS 25 HN LYS 25 15.428 19.241 3.104 991 HA LYS 25 HA LYS 25 15.006 21.614 1.639 992 1HB LYS 25 HB2 LYS 25 14.967 20.988 4.598 993 2HB LYS 25 HB3 LYS 25 14.851 22.664 4.040 994 1HG LYS 25 HG2 LYS 25 12.954 22.044 2.541 995 2HG LYS 25 HG3 LYS 25 12.983 20.403 3.215 996 1HD LYS 25 HD2 LYS 25 12.496 21.294 5.460 997 2HD LYS 25 HD3 LYS 25 12.576 22.956 4.841 998 1HE LYS 25 HE2 LYS 25 10.634 22.491 3.338 999 2HE LYS 25 HE3 LYS 25 10.550 20.843 3.975 1000 1HZ LYS 25 HZ1 LYS 25 10.083 21.789 6.166 1001 2HZ LYS 25 HZ2 LYS 25 10.161 23.310 5.574 1002 3HZ LYS 25 HZ3 LYS 25 8.978 22.303 5.085 1003 H GLN 26 HN GLN 26 18.004 20.508 3.116 1004 HA GLN 26 HA GLN 26 19.096 23.141 3.221 1005 1HB GLN 26 HB2 GLN 26 21.190 22.253 3.640 1006 2HB GLN 26 HB3 GLN 26 20.046 21.264 4.511 1007 1HG GLN 26 HG2 GLN 26 20.595 19.377 3.387 1008 2HG GLN 26 HG3 GLN 26 20.723 20.165 1.821 1009 1HE2 GLN 26 HE22 GLN 26 22.569 18.350 3.778 1010 2HE2 GLN 26 HE21 GLN 26 24.125 19.093 3.516 1011 H TYR 27 HN TYR 27 18.374 21.244 0.430 1012 HA TYR 27 HA TYR 27 19.994 23.117 -1.238 1013 1HB TYR 27 HB2 TYR 27 20.434 20.245 -0.910 1014 2HB TYR 27 HB3 TYR 27 19.988 20.591 -2.559 1015 HD1 TYR 27 HD1 TYR 27 21.554 21.536 -4.096 1016 HD2 TYR 27 HD2 TYR 27 22.384 21.585 0.135 1017 HE1 TYR 27 HE1 TYR 27 23.868 22.258 -4.568 1018 HE2 TYR 27 HE2 TYR 27 24.705 22.322 -0.321 1019 HH TYR 27 HH TYR 27 25.939 22.840 -3.662 1020 H LEU 28 HN LEU 28 17.300 20.853 -1.084 1021 HA LEU 28 HA LEU 28 15.974 21.737 -3.524 1022 1HB LEU 28 HB2 LEU 28 16.033 19.332 -2.121 1023 2HB LEU 28 HB3 LEU 28 14.576 20.066 -1.470 1024 HG LEU 28 HG LEU 28 13.735 20.334 -3.793 1025 1HD1 LEU 28 HD11 LEU 28 16.207 18.692 -4.495 1026 2HD1 LEU 28 HD12 LEU 28 14.816 18.930 -5.586 1027 3HD1 LEU 28 HD13 LEU 28 15.796 20.309 -5.105 1028 1HD2 LEU 28 HD21 LEU 28 13.131 17.988 -4.106 1029 2HD2 LEU 28 HD22 LEU 28 14.450 17.485 -3.029 1030 3HD2 LEU 28 HD23 LEU 28 13.075 18.415 -2.390 1031 H GLY 29 HN GLY 29 16.184 23.858 -2.858 1032 1HA GLY 29 HA2 GLY 29 15.470 25.039 -0.428 1033 2HA GLY 29 HA3 GLY 29 15.695 25.873 -1.967 1034 H ASP 30 HN ASP 30 14.082 27.293 -0.897 1035 HA ASP 30 HA ASP 30 11.417 26.656 -0.349 1036 1HB ASP 30 HB2 ASP 30 12.544 28.748 0.279 1037 2HB ASP 30 HB3 ASP 30 12.618 29.236 -1.416 1038 H GLU 31 HN GLU 31 12.950 26.938 -3.436 1039 HA GLU 31 HA GLU 31 10.788 27.324 -5.234 1040 1HB GLU 31 HB2 GLU 31 13.076 27.450 -5.940 1041 2HB GLU 31 HB3 GLU 31 13.463 25.864 -5.275 1042 1HG GLU 31 HG2 GLU 31 12.119 24.764 -6.982 1043 2HG GLU 31 HG3 GLU 31 11.684 26.330 -7.692 1044 H TRP 32 HN TRP 32 11.433 24.660 -3.098 1045 HA TRP 32 HA TRP 32 9.562 22.866 -4.556 1046 1HB TRP 32 HB2 TRP 32 11.910 22.174 -2.779 1047 2HB TRP 32 HB3 TRP 32 10.804 21.028 -3.517 1048 HD1 TRP 32 HD1 TRP 32 13.435 23.633 -4.576 1049 HE1 TRP 32 HE1 TRP 32 14.373 23.017 -6.877 1050 HE3 TRP 32 HE3 TRP 32 10.586 19.484 -5.532 1051 HZ2 TRP 32 HZ2 TRP 32 14.117 20.876 -8.759 1052 HZ3 TRP 32 HZ3 TRP 32 10.988 18.145 -7.582 1053 HH2 TRP 32 HH2 TRP 32 12.740 18.825 -9.208 1054 H LYS 33 HN LYS 33 8.552 21.231 -2.941 1055 HA LYS 33 HA LYS 33 8.451 22.161 -0.193 1056 1HB LYS 33 HB2 LYS 33 6.376 23.040 -1.857 1057 2HB LYS 33 HB3 LYS 33 5.683 21.585 -1.157 1058 1HG LYS 33 HG2 LYS 33 6.958 23.897 0.386 1059 2HG LYS 33 HG3 LYS 33 5.226 23.693 0.126 1060 1HD LYS 33 HD2 LYS 33 7.039 21.820 1.724 1061 2HD LYS 33 HD3 LYS 33 5.939 23.024 2.390 1062 1HE LYS 33 HE2 LYS 33 3.996 21.848 1.461 1063 2HE LYS 33 HE3 LYS 33 5.046 20.652 0.687 1064 1HZ LYS 33 HZ1 LYS 33 4.877 21.073 3.614 1065 2HZ LYS 33 HZ2 LYS 33 4.128 19.878 2.800 1066 3HZ LYS 33 HZ3 LYS 33 5.772 19.918 2.853 1067 H VAL 34 HN VAL 34 8.945 20.349 0.870 1068 HA VAL 34 HA VAL 34 8.316 17.747 -0.367 1069 HB VAL 34 HB VAL 34 10.632 18.264 0.006 1070 1HG1 VAL 34 HG11 VAL 34 11.626 18.516 2.251 1071 2HG1 VAL 34 HG12 VAL 34 10.569 19.866 1.831 1072 3HG1 VAL 34 HG13 VAL 34 10.001 18.609 2.961 1073 1HG2 VAL 34 HG21 VAL 34 9.753 16.172 2.034 1074 2HG2 VAL 34 HG22 VAL 34 9.891 15.912 0.285 1075 3HG2 VAL 34 HG23 VAL 34 11.331 16.308 1.237 1076 H TYR 35 HN TYR 35 7.324 16.122 0.800 1077 HA TYR 35 HA TYR 35 6.634 16.452 3.586 1078 1HB TYR 35 HB2 TYR 35 4.651 17.464 2.241 1079 2HB TYR 35 HB3 TYR 35 4.356 15.831 1.664 1080 HD1 TYR 35 HD1 TYR 35 4.728 17.909 4.770 1081 HD2 TYR 35 HD2 TYR 35 3.167 14.251 3.095 1082 HE1 TYR 35 HE1 TYR 35 3.552 17.447 6.892 1083 HE2 TYR 35 HE2 TYR 35 1.994 13.775 5.219 1084 HH TYR 35 HH TYR 35 2.150 15.998 8.045 1085 H SER 36 HN SER 36 5.667 14.191 4.314 1086 HA SER 36 HA SER 36 6.320 12.032 2.473 1087 1HB SER 36 HB2 SER 36 8.017 11.084 3.910 1088 2HB SER 36 HB3 SER 36 8.521 12.637 3.264 1089 HG SER 36 HG SER 36 8.391 13.590 5.193 1090 H ALA 37 HN ALA 37 5.547 10.002 3.150 1091 HA ALA 37 HA ALA 37 3.658 9.947 5.412 1092 1HB ALA 37 HB1 ALA 37 2.498 11.082 3.528 1093 2HB ALA 37 HB2 ALA 37 2.860 9.674 2.492 1094 3HB ALA 37 HB3 ALA 37 1.787 9.510 3.900 1095 H GLY 38 HN GLY 38 2.355 7.739 5.152 1096 1HA GLY 38 HA2 GLY 38 3.456 5.589 3.669 1097 2HA GLY 38 HA3 GLY 38 4.112 5.551 5.311 1098 H ILE 39 HN ILE 39 2.790 3.438 4.902 1099 HA ILE 39 HA ILE 39 0.125 3.190 4.706 1100 HB ILE 39 HB ILE 39 1.442 1.300 4.664 1101 1HG1 ILE 39 HG12 ILE 39 0.030 0.695 7.258 1102 2HG1 ILE 39 HG13 ILE 39 -0.944 1.245 5.902 1103 1HG2 ILE 39 HG21 ILE 39 2.290 1.671 7.559 1104 2HG2 ILE 39 HG22 ILE 39 2.647 0.275 6.554 1105 3HG2 ILE 39 HG23 ILE 39 3.308 1.850 6.124 1106 1HD1 ILE 39 HD11 ILE 39 -0.791 -1.241 6.120 1107 2HD1 ILE 39 HD12 ILE 39 -0.372 -0.599 4.537 1108 3HD1 ILE 39 HD13 ILE 39 0.921 -1.128 5.650 1109 H GLU 40 HN GLU 40 1.564 3.413 7.995 1110 HA GLU 40 HA GLU 40 -1.029 4.449 9.032 1111 1HB GLU 40 HB2 GLU 40 -0.746 3.088 11.038 1112 2HB GLU 40 HB3 GLU 40 -0.964 2.120 9.589 1113 1HG GLU 40 HG2 GLU 40 1.375 1.485 9.547 1114 2HG GLU 40 HG3 GLU 40 1.778 2.629 10.822 1115 H ALA 41 HN ALA 41 1.149 5.862 8.064 1116 HA ALA 41 HA ALA 41 3.229 6.434 9.880 1117 1HB ALA 41 HB1 ALA 41 3.552 8.324 8.157 1118 2HB ALA 41 HB2 ALA 41 3.487 6.662 7.496 1119 3HB ALA 41 HB3 ALA 41 2.077 7.720 7.386 1120 H HIS 42 HN HIS 42 3.785 8.136 10.956 1121 HA HIS 42 HA HIS 42 3.220 10.681 11.029 1122 1HB HIS 42 HB2 HIS 42 1.744 11.142 13.004 1123 2HB HIS 42 HB3 HIS 42 0.893 10.554 11.604 1124 HD1 HIS 42 HD1 HIS 42 2.346 8.913 14.825 1125 HD2 HIS 42 HD2 HIS 42 -0.910 8.763 12.169 1126 HE1 HIS 42 HE1 HIS 42 0.725 7.171 15.775 1127 H GLY 43 HN GLY 43 5.423 9.390 11.216 1128 1HA GLY 43 HA2 GLY 43 6.117 8.738 14.051 1129 2HA GLY 43 HA3 GLY 43 6.898 8.099 12.603 1130 H LEU 44 HN LEU 44 8.529 8.990 14.398 1131 HA LEU 44 HA LEU 44 10.068 10.852 12.915 1132 1HB LEU 44 HB2 LEU 44 8.897 12.587 14.181 1133 2HB LEU 44 HB3 LEU 44 9.243 11.765 15.706 1134 HG LEU 44 HG LEU 44 11.661 12.162 15.424 1135 1HD1 LEU 44 HD11 LEU 44 12.459 13.628 13.527 1136 2HD1 LEU 44 HD12 LEU 44 11.999 11.994 13.037 1137 3HD1 LEU 44 HD13 LEU 44 10.894 13.355 12.734 1138 1HD2 LEU 44 HD21 LEU 44 11.723 14.571 15.628 1139 2HD2 LEU 44 HD22 LEU 44 10.125 14.718 14.876 1140 3HD2 LEU 44 HD23 LEU 44 10.294 13.937 16.464 1141 H ASN 45 HN ASN 45 11.236 8.897 12.778 1142 HA ASN 45 HA ASN 45 11.841 7.229 14.995 1143 1HB ASN 45 HB2 ASN 45 11.819 6.567 12.593 1144 2HB ASN 45 HB3 ASN 45 13.313 7.475 12.337 1145 1HD2 ASN 45 HD22 ASN 45 12.556 4.468 12.219 1146 2HD2 ASN 45 HD21 ASN 45 13.829 3.721 13.162 1147 HA PRO 46 HA PRO 46 14.971 9.929 16.750 1148 1HB PRO 46 HB2 PRO 46 16.170 8.236 18.569 1149 2HB PRO 46 HB3 PRO 46 14.606 9.072 18.812 1150 1HG PRO 46 HG2 PRO 46 15.079 6.240 17.837 1151 2HG PRO 46 HG3 PRO 46 13.925 6.801 19.090 1152 1HD PRO 46 HD2 PRO 46 13.123 6.322 16.552 1153 2HD PRO 46 HD3 PRO 46 12.467 7.718 17.458 1154 H ASN 47 HN ASN 47 15.789 6.815 15.193 1155 HA ASN 47 HA ASN 47 18.626 7.323 14.915 1156 1HB ASN 47 HB2 ASN 47 17.968 5.142 14.193 1157 2HB ASN 47 HB3 ASN 47 16.642 5.777 13.210 1158 1HD2 ASN 47 HD22 ASN 47 17.286 5.074 11.086 1159 2HD2 ASN 47 HD21 ASN 47 18.657 5.900 10.347 1160 H ALA 48 HN ALA 48 15.735 8.333 12.894 1161 HA ALA 48 HA ALA 48 17.378 9.519 10.925 1162 1HB ALA 48 HB1 ALA 48 14.503 10.189 11.738 1163 2HB ALA 48 HB2 ALA 48 15.350 10.899 10.349 1164 3HB ALA 48 HB3 ALA 48 15.086 9.160 10.400 1165 H VAL 49 HN VAL 49 16.080 10.747 13.985 1166 HA VAL 49 HA VAL 49 16.858 13.487 13.673 1167 HB VAL 49 HB VAL 49 16.771 11.925 16.287 1168 1HG1 VAL 49 HG11 VAL 49 17.835 14.147 16.479 1169 2HG1 VAL 49 HG12 VAL 49 16.430 14.898 15.693 1170 3HG1 VAL 49 HG13 VAL 49 16.264 14.129 17.284 1171 1HG2 VAL 49 HG21 VAL 49 14.494 13.436 14.932 1172 2HG2 VAL 49 HG22 VAL 49 14.591 11.675 15.106 1173 3HG2 VAL 49 HG23 VAL 49 14.454 12.685 16.540 1174 H LYS 50 HN LYS 50 18.645 10.702 15.147 1175 HA LYS 50 HA LYS 50 21.050 12.143 15.656 1176 1HB LYS 50 HB2 LYS 50 20.673 10.020 16.717 1177 2HB LYS 50 HB3 LYS 50 20.488 9.188 15.170 1178 1HG LYS 50 HG2 LYS 50 22.842 9.521 14.627 1179 2HG LYS 50 HG3 LYS 50 23.081 10.495 16.092 1180 1HD LYS 50 HD2 LYS 50 22.633 8.555 17.501 1181 2HD LYS 50 HD3 LYS 50 22.210 7.569 16.079 1182 1HE LYS 50 HE2 LYS 50 24.478 7.768 15.199 1183 2HE LYS 50 HE3 LYS 50 24.931 8.879 16.501 1184 1HZ LYS 50 HZ1 LYS 50 24.603 7.070 18.081 1185 2HZ LYS 50 HZ2 LYS 50 24.187 6.035 16.887 1186 3HZ LYS 50 HZ3 LYS 50 25.701 6.642 16.958 1187 H ALA 51 HN ALA 51 20.062 10.204 12.834 1188 HA ALA 51 HA ALA 51 22.353 10.316 11.291 1189 1HB ALA 51 HB1 ALA 51 19.445 10.292 10.423 1190 2HB ALA 51 HB2 ALA 51 20.842 9.835 9.419 1191 3HB ALA 51 HB3 ALA 51 20.427 8.877 10.856 1192 H MET 52 HN MET 52 19.868 12.856 11.786 1193 HA MET 52 HA MET 52 20.895 14.520 9.616 1194 1HB MET 52 HB2 MET 52 18.771 14.897 11.779 1195 2HB MET 52 HB3 MET 52 19.166 16.134 10.592 1196 1HG MET 52 HG2 MET 52 18.493 13.421 9.506 1197 2HG MET 52 HG3 MET 52 17.208 14.327 10.280 1198 1HE MET 52 HE1 MET 52 19.408 15.753 6.470 1199 2HE MET 52 HE2 MET 52 20.253 15.761 8.032 1200 3HE MET 52 HE3 MET 52 19.731 14.216 7.308 1201 H LYS 53 HN LYS 53 20.899 14.479 13.230 1202 HA LYS 53 HA LYS 53 22.364 16.889 13.538 1203 1HB LYS 53 HB2 LYS 53 22.346 14.358 15.257 1204 2HB LYS 53 HB3 LYS 53 23.018 15.895 15.784 1205 1HG LYS 53 HG2 LYS 53 20.102 15.620 14.954 1206 2HG LYS 53 HG3 LYS 53 20.658 15.266 16.587 1207 1HD LYS 53 HD2 LYS 53 21.423 17.554 16.886 1208 2HD LYS 53 HD3 LYS 53 21.039 17.947 15.188 1209 1HE LYS 53 HE2 LYS 53 18.676 17.493 15.551 1210 2HE LYS 53 HE3 LYS 53 18.972 16.911 17.189 1211 1HZ LYS 53 HZ1 LYS 53 18.117 19.232 16.911 1212 2HZ LYS 53 HZ2 LYS 53 19.416 19.082 17.914 1213 3HZ LYS 53 HZ3 LYS 53 19.604 19.685 16.401 1214 H GLU 54 HN GLU 54 23.449 13.599 12.782 1215 HA GLU 54 HA GLU 54 26.213 13.853 13.122 1216 1HB GLU 54 HB2 GLU 54 24.523 12.335 11.110 1217 2HB GLU 54 HB3 GLU 54 26.265 12.156 11.176 1218 1HG GLU 54 HG2 GLU 54 24.855 11.805 13.797 1219 2HG GLU 54 HG3 GLU 54 24.494 10.608 12.557 1220 H VAL 55 HN VAL 55 24.191 15.230 10.553 1221 HA VAL 55 HA VAL 55 26.612 16.440 9.320 1222 HB VAL 55 HB VAL 55 25.290 16.554 7.251 1223 1HG1 VAL 55 HG11 VAL 55 26.844 14.650 7.806 1224 2HG1 VAL 55 HG12 VAL 55 25.429 13.700 8.311 1225 3HG1 VAL 55 HG13 VAL 55 25.592 14.258 6.634 1226 1HG2 VAL 55 HG21 VAL 55 23.203 15.368 6.959 1227 2HG2 VAL 55 HG22 VAL 55 23.224 14.774 8.626 1228 3HG2 VAL 55 HG23 VAL 55 22.989 16.504 8.286 1229 H GLY 56 HN GLY 56 24.725 17.268 11.660 1230 1HA GLY 56 HA2 GLY 56 24.209 19.268 12.570 1231 2HA GLY 56 HA3 GLY 56 25.065 20.047 11.232 1232 H ILE 57 HN ILE 57 22.118 17.934 10.879 1233 HA ILE 57 HA ILE 57 20.539 20.400 10.245 1234 HB ILE 57 HB ILE 57 20.367 17.613 9.067 1235 1HG1 ILE 57 HG12 ILE 57 20.951 20.352 7.849 1236 2HG1 ILE 57 HG13 ILE 57 22.107 19.043 8.069 1237 1HG2 ILE 57 HG21 ILE 57 18.421 18.408 7.765 1238 2HG2 ILE 57 HG22 ILE 57 18.073 18.455 9.477 1239 3HG2 ILE 57 HG23 ILE 57 18.470 19.964 8.618 1240 1HD1 ILE 57 HD11 ILE 57 21.521 19.122 5.771 1241 2HD1 ILE 57 HD12 ILE 57 20.800 17.653 6.442 1242 3HD1 ILE 57 HD13 ILE 57 19.791 19.088 6.102 1243 H ASP 58 HN ASP 58 18.419 20.378 11.216 1244 HA ASP 58 HA ASP 58 18.149 18.508 13.536 1245 1HB ASP 58 HB2 ASP 58 18.661 20.711 14.393 1246 2HB ASP 58 HB3 ASP 58 17.461 21.460 13.329 1247 H ILE 59 HN ILE 59 16.263 17.483 13.700 1248 HA ILE 59 HA ILE 59 13.913 18.404 12.169 1249 HB ILE 59 HB ILE 59 13.392 16.214 11.379 1250 1HG1 ILE 59 HG12 ILE 59 16.130 15.153 12.206 1251 2HG1 ILE 59 HG13 ILE 59 14.700 14.936 13.208 1252 1HG2 ILE 59 HG21 ILE 59 14.814 17.747 9.974 1253 2HG2 ILE 59 HG22 ILE 59 16.251 16.856 10.510 1254 3HG2 ILE 59 HG23 ILE 59 14.997 16.040 9.554 1255 1HD1 ILE 59 HD11 ILE 59 15.009 13.897 10.365 1256 2HD1 ILE 59 HD12 ILE 59 14.960 12.960 11.871 1257 3HD1 ILE 59 HD13 ILE 59 13.521 13.834 11.331 1258 H SER 60 HN SER 60 14.898 18.246 15.115 1259 HA SER 60 HA SER 60 13.556 16.106 16.345 1260 1HB SER 60 HB2 SER 60 14.398 18.739 17.622 1261 2HB SER 60 HB3 SER 60 14.227 17.164 18.418 1262 HG SER 60 HG SER 60 16.169 18.078 16.575 1263 H ASN 61 HN ASN 61 11.827 18.091 14.718 1264 HA ASN 61 HA ASN 61 9.530 18.283 16.519 1265 1HB ASN 61 HB2 ASN 61 10.632 20.485 16.575 1266 2HB ASN 61 HB3 ASN 61 10.697 20.530 14.816 1267 1HD2 ASN 61 HD22 ASN 61 8.969 21.456 13.732 1268 2HD2 ASN 61 HD21 ASN 61 7.472 21.931 14.490 1269 H GLN 62 HN GLN 62 10.808 17.130 13.587 1270 HA GLN 62 HA GLN 62 8.839 17.805 11.700 1271 1HB GLN 62 HB2 GLN 62 10.881 15.608 11.893 1272 2HB GLN 62 HB3 GLN 62 9.574 15.502 10.698 1273 1HG GLN 62 HG2 GLN 62 10.121 17.739 9.834 1274 2HG GLN 62 HG3 GLN 62 11.462 17.858 10.977 1275 1HE2 GLN 62 HE22 GLN 62 11.195 14.592 9.682 1276 2HE2 GLN 62 HE21 GLN 62 12.494 14.815 8.506 1277 H THR 63 HN THR 63 7.053 16.820 11.009 1278 HA THR 63 HA THR 63 5.803 14.617 12.566 1279 HB THR 63 HB THR 63 3.651 15.813 12.058 1280 HG1 THR 63 HG1 THR 63 3.730 17.883 11.261 1281 1HG2 THR 63 HG21 THR 63 4.873 16.157 14.235 1282 2HG2 THR 63 HG22 THR 63 5.658 17.582 13.514 1283 3HG2 THR 63 HG23 THR 63 3.894 17.555 13.748 1284 H SER 64 HN SER 64 3.975 13.588 11.194 1285 HA SER 64 HA SER 64 4.131 13.804 8.350 1286 1HB SER 64 HB2 SER 64 4.675 11.326 8.018 1287 2HB SER 64 HB3 SER 64 6.001 12.427 8.391 1288 HG SER 64 HG SER 64 5.715 11.728 10.644 1289 H ASP 65 HN ASP 65 2.693 11.583 7.619 1290 HA ASP 65 HA ASP 65 0.391 11.186 9.337 1291 1HB ASP 65 HB2 ASP 65 0.074 13.524 8.378 1292 2HB ASP 65 HB3 ASP 65 0.156 12.802 6.763 1293 H ILE 66 HN ILE 66 -1.273 9.848 7.948 1294 HA ILE 66 HA ILE 66 0.044 7.779 6.521 1295 HB ILE 66 HB ILE 66 -2.300 7.126 5.922 1296 1HG1 ILE 66 HG12 ILE 66 -3.105 9.520 7.617 1297 2HG1 ILE 66 HG13 ILE 66 -3.273 9.417 5.861 1298 1HG2 ILE 66 HG21 ILE 66 -1.788 7.677 8.869 1299 2HG2 ILE 66 HG22 ILE 66 -2.818 6.394 8.175 1300 3HG2 ILE 66 HG23 ILE 66 -1.078 6.370 7.893 1301 1HD1 ILE 66 HD11 ILE 66 -4.689 7.719 7.944 1302 2HD1 ILE 66 HD12 ILE 66 -5.399 8.950 6.891 1303 3HD1 ILE 66 HD13 ILE 66 -4.787 7.437 6.184 1304 H ILE 67 HN ILE 67 -0.502 7.143 4.241 1305 HA ILE 67 HA ILE 67 0.189 9.038 2.370 1306 HB ILE 67 HB ILE 67 -0.176 7.528 0.725 1307 1HG1 ILE 67 HG12 ILE 67 -2.541 6.223 2.121 1308 2HG1 ILE 67 HG13 ILE 67 -2.648 7.463 0.871 1309 1HG2 ILE 67 HG21 ILE 67 0.435 5.321 1.429 1310 2HG2 ILE 67 HG22 ILE 67 1.220 6.480 2.499 1311 3HG2 ILE 67 HG23 ILE 67 -0.213 5.577 3.053 1312 1HD1 ILE 67 HD11 ILE 67 -1.328 5.879 -0.655 1313 2HD1 ILE 67 HD12 ILE 67 -1.840 4.597 0.491 1314 3HD1 ILE 67 HD13 ILE 67 -3.039 5.635 -0.357 1315 H ASP 68 HN ASP 68 -0.789 10.787 1.500 1316 HA ASP 68 HA ASP 68 -3.745 11.086 1.791 1317 1HB ASP 68 HB2 ASP 68 -2.603 12.221 3.645 1318 2HB ASP 68 HB3 ASP 68 -1.710 13.212 2.487 1319 H SER 69 HN SER 69 -4.225 10.740 -0.212 1320 HA SER 69 HA SER 69 -3.272 11.465 -2.584 1321 1HB SER 69 HB2 SER 69 -6.171 11.814 -1.801 1322 2HB SER 69 HB3 SER 69 -5.521 11.150 -3.319 1323 HG SER 69 HG SER 69 -6.343 9.553 -1.765 1324 H ASP 70 HN ASP 70 -4.607 13.838 -0.283 1325 HA ASP 70 HA ASP 70 -5.268 15.843 -2.232 1326 1HB ASP 70 HB2 ASP 70 -6.112 15.775 0.131 1327 2HB ASP 70 HB3 ASP 70 -4.475 16.188 0.675 1328 H ILE 71 HN ILE 71 -2.246 14.719 -1.006 1329 HA ILE 71 HA ILE 71 -0.853 17.079 -2.196 1330 HB ILE 71 HB ILE 71 0.150 15.405 0.073 1331 1HG1 ILE 71 HG12 ILE 71 -0.377 17.976 1.158 1332 2HG1 ILE 71 HG13 ILE 71 -1.823 17.614 0.222 1333 1HG2 ILE 71 HG21 ILE 71 1.904 16.587 -1.172 1334 2HG2 ILE 71 HG22 ILE 71 1.072 18.133 -0.885 1335 3HG2 ILE 71 HG23 ILE 71 1.729 17.197 0.483 1336 1HD1 ILE 71 HD11 ILE 71 -1.993 15.419 1.368 1337 2HD1 ILE 71 HD12 ILE 71 -0.518 15.830 2.296 1338 3HD1 ILE 71 HD13 ILE 71 -2.009 16.784 2.518 1339 H LEU 72 HN LEU 72 -0.787 13.483 -1.548 1340 HA LEU 72 HA LEU 72 1.566 13.026 -3.052 1341 1HB LEU 72 HB2 LEU 72 0.480 11.378 -1.547 1342 2HB LEU 72 HB3 LEU 72 -0.791 11.123 -2.735 1343 HG LEU 72 HG LEU 72 2.164 10.740 -3.398 1344 1HD1 LEU 72 HD11 LEU 72 1.488 9.261 -1.460 1345 2HD1 LEU 72 HD12 LEU 72 0.337 8.475 -2.556 1346 3HD1 LEU 72 HD13 LEU 72 2.066 8.427 -2.900 1347 1HD2 LEU 72 HD21 LEU 72 -0.427 9.918 -4.754 1348 2HD2 LEU 72 HD22 LEU 72 1.012 10.671 -5.458 1349 3HD2 LEU 72 HD23 LEU 72 1.041 8.974 -5.016 1350 H ASN 73 HN ASN 73 -1.897 12.749 -4.167 1351 HA ASN 73 HA ASN 73 -1.183 12.334 -6.885 1352 1HB ASN 73 HB2 ASN 73 -3.324 11.971 -7.170 1353 2HB ASN 73 HB3 ASN 73 -3.585 12.278 -5.468 1354 1HD2 ASN 73 HD22 ASN 73 -4.107 14.630 -4.884 1355 2HD2 ASN 73 HD21 ASN 73 -4.986 15.586 -6.067 1356 H ASN 74 HN ASN 74 -1.249 15.176 -4.935 1357 HA ASN 74 HA ASN 74 -1.508 17.127 -7.037 1358 1HB ASN 74 HB2 ASN 74 -1.889 17.040 -4.290 1359 2HB ASN 74 HB3 ASN 74 -0.409 17.974 -4.400 1360 1HD2 ASN 74 HD22 ASN 74 -3.328 18.570 -3.677 1361 2HD2 ASN 74 HD21 ASN 74 -3.736 19.971 -4.656 1362 H ALA 75 HN ALA 75 1.152 15.452 -5.435 1363 HA ALA 75 HA ALA 75 3.227 17.272 -5.817 1364 1HB ALA 75 HB1 ALA 75 3.387 14.220 -5.720 1365 2HB ALA 75 HB2 ALA 75 4.680 15.368 -5.330 1366 3HB ALA 75 HB3 ALA 75 3.244 15.282 -4.303 1367 H ASP 76 HN ASP 76 5.204 16.787 -7.108 1368 HA ASP 76 HA ASP 76 4.589 16.259 -9.974 1369 1HB ASP 76 HB2 ASP 76 6.035 18.190 -9.367 1370 2HB ASP 76 HB3 ASP 76 7.186 17.075 -8.613 1371 H LEU 77 HN LEU 77 6.357 14.864 -7.199 1372 HA LEU 77 HA LEU 77 6.905 12.404 -8.693 1373 1HB LEU 77 HB2 LEU 77 8.923 13.571 -9.078 1374 2HB LEU 77 HB3 LEU 77 8.914 14.299 -7.481 1375 HG LEU 77 HG LEU 77 9.563 12.160 -6.436 1376 1HD1 LEU 77 HD11 LEU 77 8.585 10.717 -8.477 1377 2HD1 LEU 77 HD12 LEU 77 10.257 10.883 -9.043 1378 3HD1 LEU 77 HD13 LEU 77 9.942 10.168 -7.474 1379 1HD2 LEU 77 HD21 LEU 77 11.346 13.010 -8.743 1380 2HD2 LEU 77 HD22 LEU 77 11.265 13.768 -7.150 1381 3HD2 LEU 77 HD23 LEU 77 11.859 12.106 -7.298 1382 H VAL 78 HN VAL 78 6.535 10.643 -7.470 1383 HA VAL 78 HA VAL 78 6.468 10.887 -4.510 1384 HB VAL 78 HB VAL 78 5.367 8.585 -6.106 1385 1HG1 VAL 78 HG11 VAL 78 4.185 8.113 -3.992 1386 2HG1 VAL 78 HG12 VAL 78 5.921 8.158 -3.677 1387 3HG1 VAL 78 HG13 VAL 78 4.907 9.544 -3.237 1388 1HG2 VAL 78 HG21 VAL 78 3.912 11.091 -5.176 1389 2HG2 VAL 78 HG22 VAL 78 4.083 10.450 -6.828 1390 3HG2 VAL 78 HG23 VAL 78 3.138 9.552 -5.663 1391 H VAL 79 HN VAL 79 8.324 10.348 -3.604 1392 HA VAL 79 HA VAL 79 10.166 8.517 -5.037 1393 HB VAL 79 HB VAL 79 10.714 10.010 -2.449 1394 1HG1 VAL 79 HG11 VAL 79 12.231 8.152 -3.096 1395 2HG1 VAL 79 HG12 VAL 79 12.494 8.935 -4.662 1396 3HG1 VAL 79 HG13 VAL 79 13.036 9.727 -3.163 1397 1HG2 VAL 79 HG21 VAL 79 10.122 11.758 -4.108 1398 2HG2 VAL 79 HG22 VAL 79 11.843 11.754 -3.733 1399 3HG2 VAL 79 HG23 VAL 79 11.276 11.032 -5.257 1400 H THR 80 HN THR 80 9.607 6.402 -4.621 1401 HA THR 80 HA THR 80 8.747 5.587 -1.906 1402 HB THR 80 HB THR 80 9.551 3.992 -4.350 1403 HG1 THR 80 HG1 THR 80 7.531 5.466 -4.059 1404 1HG2 THR 80 HG21 THR 80 8.197 3.209 -1.741 1405 2HG2 THR 80 HG22 THR 80 8.334 2.148 -3.185 1406 3HG2 THR 80 HG23 THR 80 9.790 2.661 -2.316 1407 H LEU 81 HN LEU 81 10.278 6.418 -0.666 1408 HA LEU 81 HA LEU 81 13.136 6.159 -1.330 1409 1HB LEU 81 HB2 LEU 81 11.630 8.307 -0.621 1410 2HB LEU 81 HB3 LEU 81 12.123 7.817 0.986 1411 HG LEU 81 HG LEU 81 14.003 8.318 -1.376 1412 1HD1 LEU 81 HD11 LEU 81 14.506 10.464 -0.238 1413 2HD1 LEU 81 HD12 LEU 81 12.827 10.366 -0.777 1414 3HD1 LEU 81 HD13 LEU 81 13.207 10.124 0.934 1415 1HD2 LEU 81 HD21 LEU 81 14.649 8.062 1.582 1416 2HD2 LEU 81 HD22 LEU 81 15.033 6.864 0.312 1417 3HD2 LEU 81 HD23 LEU 81 15.796 8.462 0.288 1418 H SER 82 HN SER 82 12.120 3.750 -0.763 1419 HA SER 82 HA SER 82 13.002 3.091 1.932 1420 1HB SER 82 HB2 SER 82 10.751 1.743 2.093 1421 2HB SER 82 HB3 SER 82 10.782 3.464 2.464 1422 HG SER 82 HG SER 82 9.611 3.912 0.764 1423 H GLY 83 HN GLY 83 12.854 0.638 2.206 1424 1HA GLY 83 HA2 GLY 83 13.052 -0.980 -0.238 1425 2HA GLY 83 HA3 GLY 83 14.513 -0.854 0.778 1426 H ASP 84 HN ASP 84 11.031 -0.913 1.607 1427 HA ASP 84 HA ASP 84 11.332 -3.315 3.300 1428 1HB ASP 84 HB2 ASP 84 12.062 -1.363 4.665 1429 2HB ASP 84 HB3 ASP 84 10.540 -0.545 4.310 1430 H ALA 85 HN ALA 85 9.576 -4.507 2.786 1431 HA ALA 85 HA ALA 85 7.614 -3.472 1.001 1432 1HB ALA 85 HB1 ALA 85 8.529 -5.770 0.915 1433 2HB ALA 85 HB2 ALA 85 7.719 -6.148 2.458 1434 3HB ALA 85 HB3 ALA 85 6.760 -5.774 1.011 1435 H ALA 86 HN ALA 86 7.591 -3.181 4.384 1436 HA ALA 86 HA ALA 86 4.860 -3.931 4.900 1437 1HB ALA 86 HB1 ALA 86 6.515 -4.077 6.653 1438 2HB ALA 86 HB2 ALA 86 6.917 -2.365 6.485 1439 3HB ALA 86 HB3 ALA 86 5.326 -2.839 7.120 1440 H ASP 87 HN ASP 87 6.164 -1.077 3.441 1441 HA ASP 87 HA ASP 87 4.308 0.845 4.481 1442 1HB ASP 87 HB2 ASP 87 6.580 1.353 3.549 1443 2HB ASP 87 HB3 ASP 87 5.950 1.048 1.942 1444 H LYS 88 HN LYS 88 2.624 -1.143 3.748 1445 HA LYS 88 HA LYS 88 0.881 -1.826 2.454 1446 1HB LYS 88 HB2 LYS 88 0.310 0.722 2.940 1447 2HB LYS 88 HB3 LYS 88 0.587 0.951 1.246 1448 1HG LYS 88 HG2 LYS 88 -1.195 -0.632 0.694 1449 2HG LYS 88 HG3 LYS 88 -1.370 -1.105 2.376 1450 1HD LYS 88 HD2 LYS 88 -1.911 1.738 1.345 1451 2HD LYS 88 HD3 LYS 88 -3.118 0.443 1.467 1452 1HE LYS 88 HE2 LYS 88 -1.601 1.454 3.882 1453 2HE LYS 88 HE3 LYS 88 -3.116 2.153 3.326 1454 1HZ LYS 88 HZ1 LYS 88 -2.852 -0.701 4.104 1455 2HZ LYS 88 HZ2 LYS 88 -3.461 0.479 5.052 1456 3HZ LYS 88 HZ3 LYS 88 -4.244 0.063 3.702 1457 H CYS 89 HN CYS 89 0.333 -0.661 -0.302 1458 HA CYS 89 HA CYS 89 2.703 -1.214 -1.922 1459 1HB CYS 89 HB2 CYS 89 1.217 -2.860 -3.323 1460 2HB CYS 89 HB3 CYS 89 1.996 -3.453 -1.880 1461 HA PRO 90 HA PRO 90 -0.777 1.834 -2.709 1462 1HB PRO 90 HB2 PRO 90 0.604 4.230 -2.930 1463 2HB PRO 90 HB3 PRO 90 -0.053 3.558 -1.404 1464 1HG PRO 90 HG2 PRO 90 2.766 3.417 -2.458 1465 2HG PRO 90 HG3 PRO 90 2.201 3.716 -0.774 1466 1HD PRO 90 HD2 PRO 90 3.084 1.253 -1.662 1467 2HD PRO 90 HD3 PRO 90 1.822 1.450 -0.416 1468 H MET 91 HN MET 91 -1.582 2.193 -4.754 1469 HA MET 91 HA MET 91 0.245 1.738 -6.947 1470 1HB MET 91 HB2 MET 91 -1.859 1.770 -8.359 1471 2HB MET 91 HB3 MET 91 -1.564 0.504 -7.213 1472 1HG MET 91 HG2 MET 91 -3.810 1.033 -6.914 1473 2HG MET 91 HG3 MET 91 -3.089 1.871 -5.593 1474 1HE MET 91 HE1 MET 91 -5.796 2.318 -6.988 1475 2HE MET 91 HE2 MET 91 -5.225 3.155 -5.542 1476 3HE MET 91 HE3 MET 91 -5.985 4.112 -6.899 1477 H THR 92 HN THR 92 -0.198 4.606 -5.417 1478 HA THR 92 HA THR 92 0.125 6.772 -6.054 1479 HB THR 92 HB THR 92 2.239 6.973 -7.451 1480 HG1 THR 92 HG1 THR 92 1.876 4.957 -8.535 1481 1HG2 THR 92 HG21 THR 92 2.347 5.081 -5.061 1482 2HG2 THR 92 HG22 THR 92 3.685 6.081 -5.698 1483 3HG2 THR 92 HG23 THR 92 2.268 6.849 -4.966 1484 HA PRO 93 HA PRO 93 -2.634 6.548 -9.640 1485 1HB PRO 93 HB2 PRO 93 -3.973 8.947 -9.338 1486 2HB PRO 93 HB3 PRO 93 -4.290 7.472 -8.353 1487 1HG PRO 93 HG2 PRO 93 -2.496 9.782 -7.583 1488 2HG PRO 93 HG3 PRO 93 -3.855 9.030 -6.661 1489 1HD PRO 93 HD2 PRO 93 -1.312 8.256 -6.235 1490 2HD PRO 93 HD3 PRO 93 -2.602 7.015 -6.325 1491 HA PRO 94 HA PRO 94 0.233 8.150 -12.448 1492 1HB PRO 94 HB2 PRO 94 -1.180 8.220 -14.854 1493 2HB PRO 94 HB3 PRO 94 -0.598 6.753 -14.021 1494 1HG PRO 94 HG2 PRO 94 -3.338 8.042 -13.824 1495 2HG PRO 94 HG3 PRO 94 -2.943 6.320 -14.155 1496 1HD PRO 94 HD2 PRO 94 -3.568 7.078 -11.663 1497 2HD PRO 94 HD3 PRO 94 -2.168 5.987 -11.928 1498 H HIS 95 HN HIS 95 -1.756 10.381 -11.251 1499 HA HIS 95 HA HIS 95 -1.390 12.574 -13.131 1500 1HB HIS 95 HB2 HIS 95 -1.937 12.608 -10.134 1501 2HB HIS 95 HB3 HIS 95 -2.116 13.963 -11.241 1502 HD1 HIS 95 HD1 HIS 95 -4.590 13.182 -9.553 1503 HD2 HIS 95 HD2 HIS 95 -3.716 11.674 -13.393 1504 HE1 HIS 95 HE1 HIS 95 -6.791 12.343 -10.518 1505 H VAL 96 HN VAL 96 0.804 10.752 -11.275 1506 HA VAL 96 HA VAL 96 2.683 13.029 -10.890 1507 HB VAL 96 HB VAL 96 2.428 10.710 -8.947 1508 1HG1 VAL 96 HG11 VAL 96 4.360 12.137 -8.629 1509 2HG1 VAL 96 HG12 VAL 96 3.371 13.587 -8.748 1510 3HG1 VAL 96 HG13 VAL 96 3.211 12.523 -7.344 1511 1HG2 VAL 96 HG21 VAL 96 0.969 11.960 -7.490 1512 2HG2 VAL 96 HG22 VAL 96 0.764 13.237 -8.714 1513 3HG2 VAL 96 HG23 VAL 96 0.129 11.586 -8.971 1514 H LYS 97 HN LYS 97 4.924 12.464 -10.950 1515 HA LYS 97 HA LYS 97 5.649 10.015 -12.431 1516 1HB LYS 97 HB2 LYS 97 6.674 12.271 -12.843 1517 2HB LYS 97 HB3 LYS 97 7.374 12.230 -11.226 1518 1HG LYS 97 HG2 LYS 97 7.951 9.850 -12.923 1519 2HG LYS 97 HG3 LYS 97 8.610 11.370 -13.542 1520 1HD LYS 97 HD2 LYS 97 8.987 10.497 -10.711 1521 2HD LYS 97 HD3 LYS 97 10.031 9.878 -11.973 1522 1HE LYS 97 HE2 LYS 97 9.697 12.894 -11.751 1523 2HE LYS 97 HE3 LYS 97 10.755 12.088 -10.597 1524 1HZ LYS 97 HZ1 LYS 97 12.035 11.160 -12.328 1525 2HZ LYS 97 HZ2 LYS 97 11.085 11.823 -13.512 1526 3HZ LYS 97 HZ3 LYS 97 11.980 12.791 -12.533 1527 H ARG 98 HN ARG 98 7.143 8.405 -11.387 1528 HA ARG 98 HA ARG 98 7.389 8.627 -8.465 1529 1HB ARG 98 HB2 ARG 98 5.274 7.333 -8.862 1530 2HB ARG 98 HB3 ARG 98 6.215 6.152 -9.786 1531 1HG ARG 98 HG2 ARG 98 7.603 5.818 -7.593 1532 2HG ARG 98 HG3 ARG 98 6.327 6.762 -6.798 1533 1HD ARG 98 HD2 ARG 98 4.677 5.133 -7.699 1534 2HD ARG 98 HD3 ARG 98 5.990 4.165 -8.373 1535 HE ARG 98 HE ARG 98 6.755 4.332 -5.790 1536 1HH1 ARG 98 HH11 ARG 98 3.509 3.600 -7.027 1537 2HH1 ARG 98 HH12 ARG 98 3.133 2.499 -5.760 1538 1HH2 ARG 98 HH21 ARG 98 6.197 3.106 -4.059 1539 2HH2 ARG 98 HH22 ARG 98 4.746 2.136 -4.034 1540 H GLU 99 HN GLU 99 9.190 7.513 -7.678 1541 HA GLU 99 HA GLU 99 10.686 5.746 -9.471 1542 1HB GLU 99 HB2 GLU 99 11.989 8.146 -8.091 1543 2HB GLU 99 HB3 GLU 99 12.835 6.798 -8.875 1544 1HG GLU 99 HG2 GLU 99 11.718 7.395 -11.039 1545 2HG GLU 99 HG3 GLU 99 10.998 8.797 -10.233 1546 H HIS 100 HN HIS 100 11.927 4.246 -8.179 1547 HA HIS 100 HA HIS 100 11.478 4.290 -5.263 1548 1HB HIS 100 HB2 HIS 100 10.956 1.857 -5.385 1549 2HB HIS 100 HB3 HIS 100 9.727 2.870 -6.130 1550 HD1 HIS 100 HD1 HIS 100 12.202 0.132 -7.095 1551 HD2 HIS 100 HD2 HIS 100 9.347 2.728 -8.779 1552 HE1 HIS 100 HE1 HIS 100 11.723 -0.753 -9.431 1553 H TRP 101 HN TRP 101 13.451 4.294 -4.363 1554 HA TRP 101 HA TRP 101 15.609 2.658 -5.553 1555 1HB TRP 101 HB2 TRP 101 17.111 4.644 -5.797 1556 2HB TRP 101 HB3 TRP 101 15.807 4.540 -6.941 1557 HD1 TRP 101 HD1 TRP 101 14.390 6.582 -7.295 1558 HE1 TRP 101 HE1 TRP 101 14.171 8.910 -6.283 1559 HE3 TRP 101 HE3 TRP 101 17.387 5.922 -3.185 1560 HZ2 TRP 101 HZ2 TRP 101 15.193 10.322 -3.937 1561 HZ3 TRP 101 HZ3 TRP 101 17.744 7.770 -1.593 1562 HH2 TRP 101 HH2 TRP 101 16.651 9.973 -1.952 1563 H GLY 102 HN GLY 102 14.146 3.554 -2.712 1564 1HA GLY 102 HA2 GLY 102 16.343 4.326 -1.076 1565 2HA GLY 102 HA3 GLY 102 14.861 3.541 -0.512 1566 H PHE 103 HN PHE 103 14.841 1.102 -1.497 1567 HA PHE 103 HA PHE 103 15.541 -0.990 -1.487 1568 1HB PHE 103 HB2 PHE 103 16.781 0.022 -3.401 1569 2HB PHE 103 HB3 PHE 103 18.199 0.155 -2.374 1570 HD1 PHE 103 HD1 PHE 103 15.738 -2.336 -3.752 1571 HD2 PHE 103 HD2 PHE 103 19.734 -1.668 -2.260 1572 HE1 PHE 103 HE1 PHE 103 16.377 -4.639 -4.419 1573 HE2 PHE 103 HE2 PHE 103 20.366 -3.971 -2.934 1574 HZ PHE 103 HZ PHE 103 18.691 -5.462 -4.012 1575 H ASP 104 HN ASP 104 17.193 0.976 0.778 1576 HA ASP 104 HA ASP 104 18.080 -1.358 2.405 1577 1HB ASP 104 HB2 ASP 104 19.966 -0.774 1.000 1578 2HB ASP 104 HB3 ASP 104 19.746 0.946 1.319 1579 H ASP 105 HN ASP 105 16.286 -0.763 3.798 1580 HA ASP 105 HA ASP 105 16.019 1.973 4.731 1581 1HB ASP 105 HB2 ASP 105 14.096 0.497 4.345 1582 2HB ASP 105 HB3 ASP 105 14.624 -0.547 5.659 1583 HA PRO 106 HA PRO 106 19.061 1.331 7.928 1584 1HB PRO 106 HB2 PRO 106 18.911 3.678 9.293 1585 2HB PRO 106 HB3 PRO 106 19.537 3.583 7.622 1586 1HG PRO 106 HG2 PRO 106 16.767 4.323 8.575 1587 2HG PRO 106 HG3 PRO 106 17.766 5.186 7.369 1588 1HD PRO 106 HD2 PRO 106 15.790 3.367 6.721 1589 2HD PRO 106 HD3 PRO 106 17.261 3.575 5.707 1590 H ALA 107 HN ALA 107 15.648 1.968 8.834 1591 HA ALA 107 HA ALA 107 16.025 1.357 11.615 1592 1HB ALA 107 HB1 ALA 107 13.597 1.494 11.726 1593 2HB ALA 107 HB2 ALA 107 14.217 2.855 10.769 1594 3HB ALA 107 HB3 ALA 107 13.473 1.460 9.958 1595 H ARG 108 HN ARG 108 16.691 -0.512 9.197 1596 HA ARG 108 HA ARG 108 15.656 -3.050 10.397 1597 1HB ARG 108 HB2 ARG 108 16.506 -2.687 7.518 1598 2HB ARG 108 HB3 ARG 108 15.708 -4.080 8.241 1599 1HG ARG 108 HG2 ARG 108 14.468 -1.321 7.788 1600 2HG ARG 108 HG3 ARG 108 14.166 -2.764 6.802 1601 1HD ARG 108 HD2 ARG 108 13.177 -3.926 8.727 1602 2HD ARG 108 HD3 ARG 108 13.593 -2.569 9.776 1603 HE ARG 108 HE ARG 108 11.542 -2.608 7.608 1604 1HH1 ARG 108 HH11 ARG 108 12.725 -1.159 10.670 1605 2HH1 ARG 108 HH12 ARG 108 11.285 -0.237 10.919 1606 1HH2 ARG 108 HH21 ARG 108 9.746 -1.271 7.875 1607 2HH2 ARG 108 HH22 ARG 108 9.557 -0.292 9.304 1608 H ALA 109 HN ALA 109 18.222 -1.215 10.568 1609 HA ALA 109 HA ALA 109 20.443 -2.623 9.757 1610 1HB ALA 109 HB1 ALA 109 20.377 -0.451 11.148 1611 2HB ALA 109 HB2 ALA 109 20.070 -1.493 12.569 1612 3HB ALA 109 HB3 ALA 109 21.572 -1.668 11.662 1613 H GLN 110 HN GLN 110 21.794 -4.107 11.003 1614 HA GLN 110 HA GLN 110 20.189 -6.249 12.164 1615 1HB GLN 110 HB2 GLN 110 22.302 -6.853 10.905 1616 2HB GLN 110 HB3 GLN 110 23.238 -5.917 12.098 1617 1HG GLN 110 HG2 GLN 110 23.327 -8.386 12.464 1618 2HG GLN 110 HG3 GLN 110 22.788 -7.448 13.846 1619 1HE2 GLN 110 HE22 GLN 110 21.152 -8.506 14.950 1620 2HE2 GLN 110 HE21 GLN 110 19.862 -9.397 14.193 1621 H GLY 111 HN GLY 111 20.182 -6.471 14.463 1622 1HA GLY 111 HA2 GLY 111 20.376 -3.862 15.659 1623 2HA GLY 111 HA3 GLY 111 19.628 -5.305 16.405 1624 H THR 112 HN THR 112 22.911 -4.182 15.420 1625 HA THR 112 HA THR 112 23.875 -4.612 18.163 1626 HB THR 112 HB THR 112 24.791 -6.522 17.031 1627 HG1 THR 112 HG1 THR 112 26.240 -5.786 18.396 1628 1HG2 THR 112 HG21 THR 112 24.715 -5.923 14.698 1629 2HG2 THR 112 HG22 THR 112 25.983 -4.697 14.966 1630 3HG2 THR 112 HG23 THR 112 26.345 -6.420 15.164 1631 H GLU 113 HN GLU 113 25.463 -3.052 18.696 1632 HA GLU 113 HA GLU 113 24.786 -0.470 18.079 1633 1HB GLU 113 HB2 GLU 113 27.470 -1.617 18.953 1634 2HB GLU 113 HB3 GLU 113 27.028 0.092 19.112 1635 1HG GLU 113 HG2 GLU 113 25.472 -2.198 20.367 1636 2HG GLU 113 HG3 GLU 113 26.752 -1.319 21.199 1637 H GLU 114 HN GLU 114 27.221 -2.521 16.504 1638 HA GLU 114 HA GLU 114 28.446 -0.300 15.098 1639 1HB GLU 114 HB2 GLU 114 29.659 -2.237 13.913 1640 2HB GLU 114 HB3 GLU 114 29.985 -2.003 15.646 1641 1HG GLU 114 HG2 GLU 114 28.372 -3.850 16.140 1642 2HG GLU 114 HG3 GLU 114 28.165 -4.066 14.385 1643 H GLU 115 HN GLU 115 26.015 -2.884 14.454 1644 HA GLU 115 HA GLU 115 26.155 -2.299 11.583 1645 1HB GLU 115 HB2 GLU 115 24.464 -4.124 13.275 1646 2HB GLU 115 HB3 GLU 115 24.185 -3.902 11.542 1647 1HG GLU 115 HG2 GLU 115 26.931 -4.677 12.628 1648 2HG GLU 115 HG3 GLU 115 25.695 -5.882 12.277 1649 H LYS 116 HN LYS 116 24.134 -1.443 14.387 1650 HA LYS 116 HA LYS 116 22.144 -0.012 12.956 1651 1HB LYS 116 HB2 LYS 116 23.310 0.636 15.699 1652 2HB LYS 116 HB3 LYS 116 21.807 1.255 15.048 1653 1HG LYS 116 HG2 LYS 116 21.623 -1.619 14.945 1654 2HG LYS 116 HG3 LYS 116 22.331 -1.186 16.499 1655 1HD LYS 116 HD2 LYS 116 20.070 -1.279 16.951 1656 2HD LYS 116 HD3 LYS 116 20.384 0.455 16.802 1657 1HE LYS 116 HE2 LYS 116 19.531 0.362 14.431 1658 2HE LYS 116 HE3 LYS 116 19.261 -1.383 14.634 1659 1HZ LYS 116 HZ1 LYS 116 17.886 0.732 16.202 1660 2HZ LYS 116 HZ2 LYS 116 17.221 -0.118 14.979 1661 3HZ LYS 116 HZ3 LYS 116 17.636 -0.874 16.357 1662 H TRP 117 HN TRP 117 25.197 1.241 14.409 1663 HA TRP 117 HA TRP 117 24.729 3.791 13.222 1664 1HB TRP 117 HB2 TRP 117 26.337 3.185 15.145 1665 2HB TRP 117 HB3 TRP 117 27.503 2.765 13.895 1666 HD1 TRP 117 HD1 TRP 117 26.061 5.553 12.292 1667 HE1 TRP 117 HE1 TRP 117 27.052 7.832 12.924 1668 HE3 TRP 117 HE3 TRP 117 28.513 4.180 16.575 1669 HZ2 TRP 117 HZ2 TRP 117 28.711 8.879 14.964 1670 HZ3 TRP 117 HZ3 TRP 117 29.795 5.871 17.864 1671 HH2 TRP 117 HH2 TRP 117 29.909 8.231 17.078 1672 H ALA 118 HN ALA 118 26.554 0.941 12.063 1673 HA ALA 118 HA ALA 118 27.605 2.051 9.731 1674 1HB ALA 118 HB1 ALA 118 26.598 -0.784 10.237 1675 2HB ALA 118 HB2 ALA 118 27.691 -0.318 8.917 1676 3HB ALA 118 HB3 ALA 118 28.218 -0.200 10.612 1677 H PHE 119 HN PHE 119 24.337 0.585 10.150 1678 HA PHE 119 HA PHE 119 23.601 0.960 7.398 1679 1HB PHE 119 HB2 PHE 119 22.120 0.396 9.954 1680 2HB PHE 119 HB3 PHE 119 21.204 1.025 8.608 1681 HD1 PHE 119 HD1 PHE 119 23.931 -1.604 8.950 1682 HD2 PHE 119 HD2 PHE 119 20.026 -0.576 7.414 1683 HE1 PHE 119 HE1 PHE 119 23.710 -3.866 7.979 1684 HE2 PHE 119 HE2 PHE 119 19.818 -2.835 6.448 1685 HZ PHE 119 HZ PHE 119 21.653 -4.493 6.726 1686 H PHE 120 HN PHE 120 23.120 2.976 10.370 1687 HA PHE 120 HA PHE 120 21.610 4.973 9.034 1688 1HB PHE 120 HB2 PHE 120 23.482 5.593 11.324 1689 2HB PHE 120 HB3 PHE 120 21.965 6.371 10.881 1690 HD1 PHE 120 HD1 PHE 120 20.542 3.400 10.649 1691 HD2 PHE 120 HD2 PHE 120 22.762 5.562 13.648 1692 HE1 PHE 120 HE1 PHE 120 19.284 2.229 12.413 1693 HE2 PHE 120 HE2 PHE 120 21.503 4.372 15.421 1694 HZ PHE 120 HZ PHE 120 19.737 2.735 14.814 1695 H GLN 121 HN GLN 121 25.139 4.624 9.498 1696 HA GLN 121 HA GLN 121 25.917 7.135 8.469 1697 1HB GLN 121 HB2 GLN 121 27.279 5.663 9.885 1698 2HB GLN 121 HB3 GLN 121 27.421 4.490 8.565 1699 1HG GLN 121 HG2 GLN 121 28.578 6.146 7.177 1700 2HG GLN 121 HG3 GLN 121 28.344 7.390 8.435 1701 1HE2 GLN 121 HE22 GLN 121 29.189 6.659 10.748 1702 2HE2 GLN 121 HE21 GLN 121 30.771 5.928 10.742 1703 H ARG 122 HN ARG 122 25.738 3.876 6.934 1704 HA ARG 122 HA ARG 122 26.589 4.709 4.398 1705 1HB ARG 122 HB2 ARG 122 26.456 2.359 5.149 1706 2HB ARG 122 HB3 ARG 122 24.695 2.459 5.257 1707 1HG ARG 122 HG2 ARG 122 24.556 2.736 2.787 1708 2HG ARG 122 HG3 ARG 122 26.324 2.688 2.690 1709 1HD ARG 122 HD2 ARG 122 25.426 0.514 2.111 1710 2HD ARG 122 HD3 ARG 122 26.308 0.384 3.628 1711 HE ARG 122 HE ARG 122 23.311 0.494 3.312 1712 1HH1 ARG 122 HH11 ARG 122 26.069 -0.535 5.327 1713 2HH1 ARG 122 HH12 ARG 122 25.097 -1.526 6.349 1714 1HH2 ARG 122 HH21 ARG 122 22.071 -0.808 4.589 1715 2HH2 ARG 122 HH22 ARG 122 22.727 -1.616 5.977 1716 H VAL 123 HN VAL 123 23.260 4.453 5.760 1717 HA VAL 123 HA VAL 123 21.985 5.233 3.344 1718 HB VAL 123 HB VAL 123 21.038 5.109 6.227 1719 1HG1 VAL 123 HG11 VAL 123 18.719 5.192 5.223 1720 2HG1 VAL 123 HG12 VAL 123 19.590 6.723 5.162 1721 3HG1 VAL 123 HG13 VAL 123 19.456 5.725 3.701 1722 1HG2 VAL 123 HG21 VAL 123 19.846 3.078 5.351 1723 2HG2 VAL 123 HG22 VAL 123 20.589 3.345 3.765 1724 3HG2 VAL 123 HG23 VAL 123 21.591 2.925 5.146 1725 H ARG 124 HN ARG 124 22.945 7.321 6.234 1726 HA ARG 124 HA ARG 124 21.554 9.500 5.058 1727 1HB ARG 124 HB2 ARG 124 22.081 10.741 6.786 1728 2HB ARG 124 HB3 ARG 124 22.551 9.218 7.499 1729 1HG ARG 124 HG2 ARG 124 24.434 11.320 6.313 1730 2HG ARG 124 HG3 ARG 124 24.048 11.093 8.017 1731 1HD ARG 124 HD2 ARG 124 24.873 8.646 7.614 1732 2HD ARG 124 HD3 ARG 124 25.672 9.322 6.199 1733 HE ARG 124 HE ARG 124 27.162 10.488 7.492 1734 1HH1 ARG 124 HH11 ARG 124 24.704 9.045 9.658 1735 2HH1 ARG 124 HH12 ARG 124 25.763 9.161 11.053 1736 1HH2 ARG 124 HH21 ARG 124 28.482 10.569 9.438 1737 2HH2 ARG 124 HH22 ARG 124 27.781 9.992 10.934 1738 H ASP 125 HN ASP 125 24.843 8.372 4.529 1739 HA ASP 125 HA ASP 125 25.748 10.640 3.029 1740 1HB ASP 125 HB2 ASP 125 27.300 8.946 3.841 1741 2HB ASP 125 HB3 ASP 125 26.519 7.701 2.862 1742 H GLU 126 HN GLU 126 24.126 7.596 2.038 1743 HA GLU 126 HA GLU 126 24.048 8.133 -0.753 1744 1HB GLU 126 HB2 GLU 126 23.757 5.912 0.279 1745 2HB GLU 126 HB3 GLU 126 22.272 6.446 1.052 1746 1HG GLU 126 HG2 GLU 126 21.885 6.961 -1.728 1747 2HG GLU 126 HG3 GLU 126 22.716 5.417 -1.652 1748 H ILE 127 HN ILE 127 21.507 8.585 1.788 1749 HA ILE 127 HA ILE 127 19.548 9.658 0.077 1750 HB ILE 127 HB ILE 127 20.041 9.808 3.073 1751 1HG1 ILE 127 HG12 ILE 127 18.021 8.428 1.247 1752 2HG1 ILE 127 HG13 ILE 127 19.321 7.664 2.150 1753 1HG2 ILE 127 HG21 ILE 127 17.623 11.002 1.669 1754 2HG2 ILE 127 HG22 ILE 127 17.878 10.850 3.432 1755 3HG2 ILE 127 HG23 ILE 127 18.890 11.930 2.501 1756 1HD1 ILE 127 HD11 ILE 127 16.755 8.866 3.270 1757 2HD1 ILE 127 HD12 ILE 127 17.255 7.180 3.255 1758 3HD1 ILE 127 HD13 ILE 127 18.116 8.340 4.292 1759 H GLY 128 HN GLY 128 22.057 11.406 2.031 1760 1HA GLY 128 HA2 GLY 128 21.199 14.003 1.296 1761 2HA GLY 128 HA3 GLY 128 22.850 13.534 1.792 1762 H ASN 129 HN ASN 129 23.586 11.789 -0.307 1763 HA ASN 129 HA ASN 129 24.267 13.636 -2.341 1764 1HB ASN 129 HB2 ASN 129 25.639 11.648 -1.901 1765 2HB ASN 129 HB3 ASN 129 24.298 10.590 -2.348 1766 1HD2 ASN 129 HD22 ASN 129 24.620 9.714 -4.392 1767 2HD2 ASN 129 HD21 ASN 129 25.307 10.577 -5.740 1768 H ARG 130 HN ARG 130 21.671 11.159 -2.243 1769 HA ARG 130 HA ARG 130 20.875 11.672 -4.974 1770 1HB ARG 130 HB2 ARG 130 19.112 10.619 -2.720 1771 2HB ARG 130 HB3 ARG 130 18.755 10.583 -4.439 1772 1HG ARG 130 HG2 ARG 130 20.575 8.831 -2.850 1773 2HG ARG 130 HG3 ARG 130 19.375 8.416 -4.039 1774 1HD ARG 130 HD2 ARG 130 22.192 9.426 -4.500 1775 2HD ARG 130 HD3 ARG 130 21.534 7.851 -4.926 1776 HE ARG 130 HE ARG 130 21.593 10.184 -6.545 1777 1HH1 ARG 130 HH11 ARG 130 19.284 7.541 -5.883 1778 2HH1 ARG 130 HH12 ARG 130 18.536 7.679 -7.433 1779 1HH2 ARG 130 HH21 ARG 130 20.703 10.354 -8.422 1780 2HH2 ARG 130 HH22 ARG 130 19.380 9.343 -8.982 1781 H LEU 131 HN LEU 131 19.656 13.045 -1.843 1782 HA LEU 131 HA LEU 131 17.730 14.616 -3.278 1783 1HB LEU 131 HB2 LEU 131 18.733 14.547 -0.435 1784 2HB LEU 131 HB3 LEU 131 17.902 15.990 -0.977 1785 HG LEU 131 HG LEU 131 16.359 14.438 0.110 1786 1HD1 LEU 131 HD11 LEU 131 14.581 14.482 -1.522 1787 2HD1 LEU 131 HD12 LEU 131 15.545 15.960 -1.692 1788 3HD1 LEU 131 HD13 LEU 131 15.697 14.636 -2.864 1789 1HD2 LEU 131 HD21 LEU 131 16.857 12.503 -2.187 1790 2HD2 LEU 131 HD22 LEU 131 17.392 12.282 -0.505 1791 3HD2 LEU 131 HD23 LEU 131 15.666 12.340 -0.888 1792 H LYS 132 HN LYS 132 21.139 15.283 -2.388 1793 HA LYS 132 HA LYS 132 21.020 18.011 -3.265 1794 1HB LYS 132 HB2 LYS 132 22.789 16.998 -1.847 1795 2HB LYS 132 HB3 LYS 132 23.343 16.025 -3.219 1796 1HG LYS 132 HG2 LYS 132 23.991 18.015 -4.450 1797 2HG LYS 132 HG3 LYS 132 23.253 19.077 -3.241 1798 1HD LYS 132 HD2 LYS 132 25.509 17.139 -2.597 1799 2HD LYS 132 HD3 LYS 132 25.785 18.814 -3.125 1800 1HE LYS 132 HE2 LYS 132 24.413 19.615 -1.191 1801 2HE LYS 132 HE3 LYS 132 24.260 17.946 -0.630 1802 1HZ LYS 132 HZ1 LYS 132 26.821 19.416 -0.911 1803 2HZ LYS 132 HZ2 LYS 132 26.064 19.099 0.495 1804 3HZ LYS 132 HZ3 LYS 132 26.677 17.875 -0.388 1805 H GLU 133 HN GLU 133 21.641 14.885 -5.053 1806 HA GLU 133 HA GLU 133 21.989 16.171 -7.572 1807 1HB GLU 133 HB2 GLU 133 21.051 13.410 -6.725 1808 2HB GLU 133 HB3 GLU 133 20.749 13.930 -8.392 1809 1HG GLU 133 HG2 GLU 133 23.052 14.336 -8.796 1810 2HG GLU 133 HG3 GLU 133 23.492 13.958 -7.113 1811 H PHE 134 HN PHE 134 18.907 15.330 -5.843 1812 HA PHE 134 HA PHE 134 17.277 15.759 -8.104 1813 1HB PHE 134 HB2 PHE 134 16.741 16.277 -5.149 1814 2HB PHE 134 HB3 PHE 134 15.538 16.569 -6.391 1815 HD1 PHE 134 HD1 PHE 134 17.764 13.724 -6.942 1816 HD2 PHE 134 HD2 PHE 134 14.081 15.057 -5.211 1817 HE1 PHE 134 HE1 PHE 134 16.970 11.363 -6.872 1818 HE2 PHE 134 HE2 PHE 134 13.227 12.701 -5.230 1819 HZ PHE 134 HZ PHE 134 14.655 10.878 -6.098 1820 H ALA 135 HN ALA 135 18.619 17.968 -5.828 1821 HA ALA 135 HA ALA 135 17.393 20.354 -6.746 1822 1HB ALA 135 HB1 ALA 135 20.115 20.080 -5.409 1823 2HB ALA 135 HB2 ALA 135 19.134 21.556 -5.504 1824 3HB ALA 135 HB3 ALA 135 18.556 20.164 -4.562 1825 H GLU 136 HN GLU 136 20.305 18.676 -7.912 1826 HA GLU 136 HA GLU 136 21.066 20.795 -9.723 1827 1HB GLU 136 HB2 GLU 136 22.057 17.925 -9.561 1828 2HB GLU 136 HB3 GLU 136 22.765 19.227 -10.518 1829 1HG GLU 136 HG2 GLU 136 23.110 20.487 -8.312 1830 2HG GLU 136 HG3 GLU 136 22.674 18.975 -7.502 1831 H THR 137 HN THR 137 19.702 17.575 -9.964 1832 HA THR 137 HA THR 137 19.564 17.472 -12.834 1833 HB THR 137 HB THR 137 18.696 15.213 -12.392 1834 HG1 THR 137 HG1 THR 137 18.902 15.811 -9.658 1835 1HG2 THR 137 HG21 THR 137 20.613 14.328 -11.115 1836 2HG2 THR 137 HG22 THR 137 21.102 15.505 -12.350 1837 3HG2 THR 137 HG23 THR 137 21.080 15.977 -10.649 1838 H GLY 138 HN GLY 138 17.277 18.423 -10.336 1839 1HA GLY 138 HA2 GLY 138 15.074 18.959 -10.376 1840 2HA GLY 138 HA3 GLY 138 15.154 19.159 -12.153 1841 H LYS 139 HN LYS 139 16.242 16.264 -10.591 1842 HA LYS 139 HA LYS 139 15.977 14.203 -11.204 1843 1HB LYS 139 HB2 LYS 139 14.719 14.615 -9.067 1844 2HB LYS 139 HB3 LYS 139 13.215 14.487 -10.009 1845 1HG LYS 139 HG2 LYS 139 13.766 12.387 -8.963 1846 2HG LYS 139 HG3 LYS 139 13.830 12.246 -10.720 1847 1HD LYS 139 HD2 LYS 139 16.409 12.824 -9.287 1848 2HD LYS 139 HD3 LYS 139 15.703 11.216 -9.042 1849 1HE LYS 139 HE2 LYS 139 16.396 12.421 -11.757 1850 2HE LYS 139 HE3 LYS 139 17.426 11.334 -10.831 1851 1HZ LYS 139 HZ1 LYS 139 15.597 9.673 -10.950 1852 2HZ LYS 139 HZ2 LYS 139 14.725 10.632 -11.854 1853 3HZ LYS 139 HZ3 LYS 139 16.164 10.081 -12.448 Start of MODEL 13 1 1H MET 1 H1 MET 1 -25.137 -11.062 -7.361 2 2H MET 1 H2 MET 1 -23.744 -10.288 -7.734 3 3H MET 1 H3 MET 1 -23.735 -11.908 -7.629 4 HA MET 1 HA MET 1 -25.450 -11.945 -9.439 5 1HB MET 1 HB2 MET 1 -24.313 -9.146 -9.873 6 2HB MET 1 HB3 MET 1 -25.278 -10.052 -11.037 7 1HG MET 1 HG2 MET 1 -26.164 -9.071 -8.298 8 2HG MET 1 HG3 MET 1 -26.670 -8.445 -9.858 9 1HE MET 1 HE1 MET 1 -29.110 -11.152 -11.224 10 2HE MET 1 HE2 MET 1 -28.418 -9.531 -11.443 11 3HE MET 1 HE3 MET 1 -27.395 -10.973 -11.645 12 H ALA 2 HN ALA 2 -22.302 -10.159 -9.931 13 HA ALA 2 HA ALA 2 -20.849 -12.593 -10.434 14 1HB ALA 2 HB1 ALA 2 -21.905 -12.249 -12.690 15 2HB ALA 2 HB2 ALA 2 -21.295 -10.579 -12.705 16 3HB ALA 2 HB3 ALA 2 -20.164 -11.946 -12.735 17 H ILE 3 HN ILE 3 -18.550 -11.917 -10.954 18 HA ILE 3 HA ILE 3 -17.808 -9.461 -9.525 19 HB ILE 3 HB ILE 3 -16.280 -11.944 -10.422 20 1HG1 ILE 3 HG12 ILE 3 -15.398 -11.784 -8.070 21 2HG1 ILE 3 HG13 ILE 3 -16.527 -10.466 -7.778 22 1HG2 ILE 3 HG21 ILE 3 -14.880 -10.059 -11.155 23 2HG2 ILE 3 HG22 ILE 3 -15.118 -9.246 -9.594 24 3HG2 ILE 3 HG23 ILE 3 -14.190 -10.766 -9.701 25 1HD1 ILE 3 HD11 ILE 3 -17.243 -13.340 -8.436 26 2HD1 ILE 3 HD12 ILE 3 -17.291 -12.521 -6.858 27 3HD1 ILE 3 HD13 ILE 3 -18.414 -12.019 -8.120 28 H VAL 4 HN VAL 4 -18.456 -7.847 -10.830 29 HA VAL 4 HA VAL 4 -18.127 -7.860 -13.717 30 HB VAL 4 HB VAL 4 -18.942 -5.701 -11.773 31 1HG1 VAL 4 HG11 VAL 4 -20.140 -4.639 -13.662 32 2HG1 VAL 4 HG12 VAL 4 -18.411 -4.636 -13.914 33 3HG1 VAL 4 HG13 VAL 4 -19.423 -5.826 -14.774 34 1HG2 VAL 4 HG21 VAL 4 -20.525 -7.551 -11.577 35 2HG2 VAL 4 HG22 VAL 4 -21.295 -6.274 -12.504 36 3HG2 VAL 4 HG23 VAL 4 -20.638 -7.688 -13.346 37 H LYS 5 HN LYS 5 -16.919 -5.931 -14.687 38 HA LYS 5 HA LYS 5 -14.389 -5.389 -13.272 39 1HB LYS 5 HB2 LYS 5 -14.040 -7.213 -14.869 40 2HB LYS 5 HB3 LYS 5 -14.697 -6.223 -16.182 41 1HG LYS 5 HG2 LYS 5 -12.847 -4.641 -15.984 42 2HG LYS 5 HG3 LYS 5 -12.233 -5.472 -14.539 43 1HD LYS 5 HD2 LYS 5 -11.778 -7.497 -15.827 44 2HD LYS 5 HD3 LYS 5 -12.486 -6.798 -17.286 45 1HE LYS 5 HE2 LYS 5 -10.059 -5.644 -15.835 46 2HE LYS 5 HE3 LYS 5 -9.949 -6.798 -17.165 47 1HZ LYS 5 HZ1 LYS 5 -11.050 -5.206 -18.596 48 2HZ LYS 5 HZ2 LYS 5 -11.182 -4.116 -17.378 49 3HZ LYS 5 HZ3 LYS 5 -9.705 -4.542 -17.948 50 H ALA 6 HN ALA 6 -14.186 -3.287 -13.009 51 HA ALA 6 HA ALA 6 -15.957 -1.397 -14.391 52 1HB ALA 6 HB1 ALA 6 -14.685 0.179 -12.733 53 2HB ALA 6 HB2 ALA 6 -15.882 -0.918 -12.105 54 3HB ALA 6 HB3 ALA 6 -14.159 -1.322 -11.967 55 H THR 7 HN THR 7 -14.859 0.784 -14.820 56 HA THR 7 HA THR 7 -12.141 1.005 -15.490 57 HB THR 7 HB THR 7 -12.697 -0.100 -17.554 58 HG1 THR 7 HG1 THR 7 -11.353 1.673 -17.765 59 1HG2 THR 7 HG21 THR 7 -14.970 1.881 -17.909 60 2HG2 THR 7 HG22 THR 7 -14.341 0.815 -19.183 61 3HG2 THR 7 HG23 THR 7 -15.073 0.106 -17.746 62 H ASP 8 HN ASP 8 -12.106 3.436 -16.600 63 HA ASP 8 HA ASP 8 -12.466 5.109 -14.485 64 1HB ASP 8 HB2 ASP 8 -11.026 5.580 -16.362 65 2HB ASP 8 HB3 ASP 8 -12.421 5.816 -17.422 66 H GLN 9 HN GLN 9 -15.010 4.450 -16.858 67 HA GLN 9 HA GLN 9 -16.748 6.407 -15.476 68 1HB GLN 9 HB2 GLN 9 -16.857 5.632 -18.396 69 2HB GLN 9 HB3 GLN 9 -17.857 6.840 -17.558 70 1HG GLN 9 HG2 GLN 9 -15.761 8.163 -17.067 71 2HG GLN 9 HG3 GLN 9 -14.831 7.014 -18.025 72 1HE2 GLN 9 HE22 GLN 9 -15.065 7.015 -20.355 73 2HE2 GLN 9 HE21 GLN 9 -15.884 8.311 -21.187 74 H SER 10 HN SER 10 -16.529 3.132 -16.891 75 HA SER 10 HA SER 10 -19.210 2.394 -16.372 76 1HB SER 10 HB2 SER 10 -16.739 0.643 -16.155 77 2HB SER 10 HB3 SER 10 -18.421 0.095 -16.296 78 HG SER 10 HG SER 10 -17.483 0.125 -18.346 79 H PHE 11 HN PHE 11 -16.341 2.680 -14.127 80 HA PHE 11 HA PHE 11 -18.006 1.882 -11.872 81 1HB PHE 11 HB2 PHE 11 -15.592 1.740 -11.660 82 2HB PHE 11 HB3 PHE 11 -15.447 3.477 -11.938 83 HD1 PHE 11 HD1 PHE 11 -16.653 5.040 -10.219 84 HD2 PHE 11 HD2 PHE 11 -15.745 0.867 -9.438 85 HE1 PHE 11 HE1 PHE 11 -16.683 5.490 -7.795 86 HE2 PHE 11 HE2 PHE 11 -15.709 1.386 -7.014 87 HZ PHE 11 HZ PHE 11 -16.178 3.667 -6.189 88 H SER 12 HN SER 12 -19.391 3.093 -11.106 89 HA SER 12 HA SER 12 -20.458 5.086 -10.329 90 1HB SER 12 HB2 SER 12 -19.923 6.181 -13.152 91 2HB SER 12 HB3 SER 12 -20.965 6.926 -11.938 92 HG SER 12 HG SER 12 -18.182 6.494 -11.876 93 H ALA 13 HN ALA 13 -20.643 4.148 -13.818 94 HA ALA 13 HA ALA 13 -23.453 4.152 -13.817 95 1HB ALA 13 HB1 ALA 13 -22.074 4.316 -15.871 96 2HB ALA 13 HB2 ALA 13 -21.500 2.648 -15.627 97 3HB ALA 13 HB3 ALA 13 -23.211 2.956 -15.996 98 H GLU 14 HN GLU 14 -21.052 1.601 -13.307 99 HA GLU 14 HA GLU 14 -22.903 -0.543 -13.022 100 1HB GLU 14 HB2 GLU 14 -19.963 -0.286 -12.313 101 2HB GLU 14 HB3 GLU 14 -20.848 -1.803 -12.223 102 1HG GLU 14 HG2 GLU 14 -20.541 -0.172 -14.757 103 2HG GLU 14 HG3 GLU 14 -19.474 -1.502 -14.272 104 H THR 15 HN THR 15 -21.897 1.970 -10.797 105 HA THR 15 HA THR 15 -22.363 0.237 -8.442 106 HB THR 15 HB THR 15 -20.760 1.780 -7.350 107 HG1 THR 15 HG1 THR 15 -19.827 3.391 -8.534 108 1HG2 THR 15 HG21 THR 15 -19.827 -0.211 -8.644 109 2HG2 THR 15 HG22 THR 15 -19.568 0.906 -10.016 110 3HG2 THR 15 HG23 THR 15 -18.728 1.176 -8.485 111 H SER 16 HN SER 16 -23.857 2.881 -10.032 112 HA SER 16 HA SER 16 -24.529 4.354 -7.645 113 1HB SER 16 HB2 SER 16 -25.559 4.546 -10.501 114 2HB SER 16 HB3 SER 16 -25.924 5.708 -9.211 115 HG SER 16 HG SER 16 -23.400 5.071 -10.329 116 H GLU 17 HN GLU 17 -25.746 1.404 -8.511 117 HA GLU 17 HA GLU 17 -28.341 1.977 -7.243 118 1HB GLU 17 HB2 GLU 17 -28.004 0.447 -9.854 119 2HB GLU 17 HB3 GLU 17 -29.479 0.479 -8.880 120 1HG GLU 17 HG2 GLU 17 -29.594 2.962 -9.172 121 2HG GLU 17 HG3 GLU 17 -28.195 2.880 -10.248 122 H GLY 18 HN GLY 18 -29.260 0.182 -6.132 123 1HA GLY 18 HA2 GLY 18 -29.234 -1.700 -4.874 124 2HA GLY 18 HA3 GLY 18 -28.046 -2.409 -5.985 125 H VAL 19 HN VAL 19 -26.863 -3.227 -4.259 126 HA VAL 19 HA VAL 19 -25.044 -1.261 -2.975 127 HB VAL 19 HB VAL 19 -25.869 -3.925 -1.733 128 1HG1 VAL 19 HG11 VAL 19 -24.058 -1.673 -0.733 129 2HG1 VAL 19 HG12 VAL 19 -24.562 -3.086 0.214 130 3HG1 VAL 19 HG13 VAL 19 -23.540 -3.303 -1.209 131 1HG2 VAL 19 HG21 VAL 19 -27.717 -2.369 -1.505 132 2HG2 VAL 19 HG22 VAL 19 -26.871 -2.411 0.046 133 3HG2 VAL 19 HG23 VAL 19 -26.614 -1.052 -1.057 134 H VAL 20 HN VAL 20 -22.999 -1.496 -3.501 135 HA VAL 20 HA VAL 20 -22.281 -3.801 -5.203 136 HB VAL 20 HB VAL 20 -21.771 -0.910 -6.003 137 1HG1 VAL 20 HG11 VAL 20 -20.155 -2.511 -6.856 138 2HG1 VAL 20 HG12 VAL 20 -21.450 -3.606 -7.380 139 3HG1 VAL 20 HG13 VAL 20 -21.244 -2.030 -8.176 140 1HG2 VAL 20 HG21 VAL 20 -23.508 -1.431 -7.822 141 2HG2 VAL 20 HG22 VAL 20 -24.011 -2.804 -6.838 142 3HG2 VAL 20 HG23 VAL 20 -24.147 -1.154 -6.202 143 H LEU 21 HN LEU 21 -20.638 -4.665 -4.414 144 HA LEU 21 HA LEU 21 -18.679 -3.365 -2.624 145 1HB LEU 21 HB2 LEU 21 -19.528 -5.599 -2.095 146 2HB LEU 21 HB3 LEU 21 -19.152 -6.165 -3.721 147 HG LEU 21 HG LEU 21 -16.738 -6.027 -3.261 148 1HD1 LEU 21 HD11 LEU 21 -15.973 -5.673 -0.932 149 2HD1 LEU 21 HD12 LEU 21 -16.646 -4.194 -1.631 150 3HD1 LEU 21 HD13 LEU 21 -17.599 -5.155 -0.466 151 1HD2 LEU 21 HD21 LEU 21 -18.068 -8.094 -2.731 152 2HD2 LEU 21 HD22 LEU 21 -16.625 -7.908 -1.757 153 3HD2 LEU 21 HD23 LEU 21 -18.216 -7.530 -1.058 154 H ALA 22 HN ALA 22 -17.412 -1.928 -3.954 155 HA ALA 22 HA ALA 22 -16.273 -3.094 -6.410 156 1HB ALA 22 HB1 ALA 22 -17.085 -0.705 -6.457 157 2HB ALA 22 HB2 ALA 22 -15.769 -0.317 -5.310 158 3HB ALA 22 HB3 ALA 22 -15.399 -0.936 -6.934 159 H ASP 23 HN ASP 23 -14.093 -3.542 -6.569 160 HA ASP 23 HA ASP 23 -12.422 -3.426 -4.118 161 1HB ASP 23 HB2 ASP 23 -13.322 -5.622 -4.095 162 2HB ASP 23 HB3 ASP 23 -13.157 -5.802 -5.836 163 H PHE 24 HN PHE 24 -10.212 -3.369 -4.523 164 HA PHE 24 HA PHE 24 -9.370 -2.660 -7.301 165 1HB PHE 24 HB2 PHE 24 -8.805 -1.283 -4.652 166 2HB PHE 24 HB3 PHE 24 -7.941 -0.942 -6.140 167 HD1 PHE 24 HD1 PHE 24 -8.742 0.666 -7.627 168 HD2 PHE 24 HD2 PHE 24 -11.461 -0.970 -4.722 169 HE1 PHE 24 HE1 PHE 24 -10.531 2.254 -8.370 170 HE2 PHE 24 HE2 PHE 24 -13.234 0.558 -5.499 171 HZ PHE 24 HZ PHE 24 -12.767 2.196 -7.310 172 H TRP 25 HN TRP 25 -7.940 -4.151 -7.909 173 HA TRP 25 HA TRP 25 -6.256 -5.501 -5.861 174 1HB TRP 25 HB2 TRP 25 -6.618 -7.578 -6.783 175 2HB TRP 25 HB3 TRP 25 -8.221 -6.881 -6.742 176 HD1 TRP 25 HD1 TRP 25 -8.889 -5.654 -9.210 177 HE1 TRP 25 HE1 TRP 25 -8.516 -6.439 -11.582 178 HE3 TRP 25 HE3 TRP 25 -5.224 -9.091 -8.284 179 HZ2 TRP 25 HZ2 TRP 25 -6.446 -8.046 -12.986 180 HZ3 TRP 25 HZ3 TRP 25 -4.003 -10.158 -10.152 181 HH2 TRP 25 HH2 TRP 25 -4.603 -9.627 -12.505 182 H ALA 26 HN ALA 26 -4.079 -6.009 -6.707 183 HA ALA 26 HA ALA 26 -3.421 -5.170 -9.441 184 1HB ALA 26 HB1 ALA 26 -3.520 -3.078 -8.064 185 2HB ALA 26 HB2 ALA 26 -2.240 -3.753 -7.045 186 3HB ALA 26 HB3 ALA 26 -1.932 -3.408 -8.781 187 HA PRO 27 HA PRO 27 -0.244 -8.195 -8.864 188 1HB PRO 27 HB2 PRO 27 1.594 -6.259 -10.273 189 2HB PRO 27 HB3 PRO 27 1.372 -8.015 -10.559 190 1HG PRO 27 HG2 PRO 27 0.158 -6.235 -12.199 191 2HG PRO 27 HG3 PRO 27 -0.787 -7.637 -11.593 192 1HD PRO 27 HD2 PRO 27 -0.780 -4.800 -10.554 193 2HD PRO 27 HD3 PRO 27 -2.154 -5.896 -10.902 194 H TRP 28 HN TRP 28 0.340 -4.952 -7.655 195 HA TRP 28 HA TRP 28 2.816 -4.987 -6.496 196 1HB TRP 28 HB2 TRP 28 0.327 -3.714 -5.398 197 2HB TRP 28 HB3 TRP 28 1.989 -3.314 -4.960 198 HD1 TRP 28 HD1 TRP 28 -0.643 -2.364 -7.320 199 HE1 TRP 28 HE1 TRP 28 0.178 -0.911 -9.230 200 HE3 TRP 28 HE3 TRP 28 4.371 -2.725 -6.432 201 HZ2 TRP 28 HZ2 TRP 28 2.713 0.217 -10.098 202 HZ3 TRP 28 HZ3 TRP 28 5.970 -1.378 -7.765 203 HH2 TRP 28 HH2 TRP 28 5.156 0.097 -9.595 204 H CYS 29 HN CYS 29 0.057 -6.841 -5.104 205 HA CYS 29 HA CYS 29 2.023 -8.005 -3.244 206 1HB CYS 29 HB2 CYS 29 0.575 -7.405 -1.242 207 2HB CYS 29 HB3 CYS 29 1.489 -6.112 -1.976 208 H GLY 30 HN GLY 30 1.024 -9.594 -1.753 209 1HA GLY 30 HA2 GLY 30 -0.182 -11.668 -3.194 210 2HA GLY 30 HA3 GLY 30 0.027 -11.586 -1.443 211 HA PRO 31 HA PRO 31 -4.226 -10.821 -0.571 212 1HB PRO 31 HB2 PRO 31 -4.081 -7.808 -0.653 213 2HB PRO 31 HB3 PRO 31 -4.969 -8.865 0.497 214 1HG PRO 31 HG2 PRO 31 -2.549 -7.844 1.195 215 2HG PRO 31 HG3 PRO 31 -2.893 -9.577 1.516 216 1HD PRO 31 HD2 PRO 31 -1.328 -8.354 -0.757 217 2HD PRO 31 HD3 PRO 31 -0.936 -9.802 0.221 218 H SER 32 HN SER 32 -3.240 -8.680 -3.323 219 HA SER 32 HA SER 32 -5.772 -8.492 -4.534 220 1HB SER 32 HB2 SER 32 -3.052 -8.901 -5.862 221 2HB SER 32 HB3 SER 32 -4.440 -8.049 -6.550 222 HG SER 32 HG SER 32 -2.649 -6.837 -5.503 223 H LYS 33 HN LYS 33 -3.787 -11.297 -4.169 224 HA LYS 33 HA LYS 33 -5.486 -12.770 -6.121 225 1HB LYS 33 HB2 LYS 33 -2.864 -13.796 -5.046 226 2HB LYS 33 HB3 LYS 33 -3.865 -14.402 -6.365 227 1HG LYS 33 HG2 LYS 33 -2.215 -13.392 -7.571 228 2HG LYS 33 HG3 LYS 33 -3.391 -12.073 -7.503 229 1HD LYS 33 HD2 LYS 33 -2.124 -11.085 -5.597 230 2HD LYS 33 HD3 LYS 33 -0.999 -12.449 -5.637 231 1HE LYS 33 HE2 LYS 33 -0.369 -11.799 -7.988 232 2HE LYS 33 HE3 LYS 33 -1.426 -10.387 -7.848 233 1HZ LYS 33 HZ1 LYS 33 -0.051 -9.684 -5.935 234 2HZ LYS 33 HZ2 LYS 33 0.968 -10.945 -6.189 235 3HZ LYS 33 HZ3 LYS 33 0.848 -9.768 -7.306 236 H MET 34 HN MET 34 -5.737 -12.037 -3.017 237 HA MET 34 HA MET 34 -6.706 -14.757 -2.222 238 1HB MET 34 HB2 MET 34 -5.601 -12.607 -0.380 239 2HB MET 34 HB3 MET 34 -6.291 -14.162 0.101 240 1HG MET 34 HG2 MET 34 -4.505 -15.300 -1.270 241 2HG MET 34 HG3 MET 34 -3.738 -13.729 -1.493 242 1HE MET 34 HE1 MET 34 -4.087 -12.321 1.412 243 2HE MET 34 HE2 MET 34 -2.557 -12.828 2.154 244 3HE MET 34 HE3 MET 34 -2.585 -12.331 0.451 245 H ILE 35 HN ILE 35 -7.171 -11.182 -1.879 246 HA ILE 35 HA ILE 35 -9.854 -11.314 -1.016 247 HB ILE 35 HB ILE 35 -8.055 -9.347 -1.210 248 1HG1 ILE 35 HG12 ILE 35 -10.076 -7.701 -1.102 249 2HG1 ILE 35 HG13 ILE 35 -11.073 -9.164 -1.163 250 1HG2 ILE 35 HG21 ILE 35 -8.528 -7.712 -2.904 251 2HG2 ILE 35 HG22 ILE 35 -7.993 -9.218 -3.656 252 3HG2 ILE 35 HG23 ILE 35 -9.718 -8.772 -3.681 253 1HD1 ILE 35 HD11 ILE 35 -8.805 -8.647 0.826 254 2HD1 ILE 35 HD12 ILE 35 -10.529 -8.395 1.171 255 3HD1 ILE 35 HD13 ILE 35 -9.923 -10.034 0.851 256 H ALA 36 HN ALA 36 -8.335 -11.494 -4.225 257 HA ALA 36 HA ALA 36 -10.623 -11.234 -5.803 258 1HB ALA 36 HB1 ALA 36 -7.978 -12.672 -6.309 259 2HB ALA 36 HB2 ALA 36 -9.266 -12.541 -7.525 260 3HB ALA 36 HB3 ALA 36 -8.508 -11.082 -6.849 261 HA PRO 37 HA PRO 37 -11.428 -15.981 -5.664 262 1HB PRO 37 HB2 PRO 37 -10.248 -17.244 -3.380 263 2HB PRO 37 HB3 PRO 37 -9.847 -17.506 -5.112 264 1HG PRO 37 HG2 PRO 37 -8.473 -15.868 -3.049 265 2HG PRO 37 HG3 PRO 37 -7.776 -16.632 -4.503 266 1HD PRO 37 HD2 PRO 37 -8.244 -13.914 -4.321 267 2HD PRO 37 HD3 PRO 37 -8.320 -14.817 -5.849 268 H VAL 38 HN VAL 38 -10.784 -14.302 -2.527 269 HA VAL 38 HA VAL 38 -12.981 -15.373 -1.127 270 HB VAL 38 HB VAL 38 -11.270 -12.917 -0.917 271 1HG1 VAL 38 HG11 VAL 38 -13.784 -13.324 0.709 272 2HG1 VAL 38 HG12 VAL 38 -12.413 -12.288 1.217 273 3HG1 VAL 38 HG13 VAL 38 -13.310 -11.920 -0.263 274 1HG2 VAL 38 HG21 VAL 38 -10.537 -15.187 -0.152 275 2HG2 VAL 38 HG22 VAL 38 -10.572 -13.973 1.148 276 3HG2 VAL 38 HG23 VAL 38 -11.871 -15.184 1.020 277 H LEU 39 HN LEU 39 -12.841 -12.557 -3.381 278 HA LEU 39 HA LEU 39 -15.578 -11.843 -2.914 279 1HB LEU 39 HB2 LEU 39 -13.467 -11.100 -4.881 280 2HB LEU 39 HB3 LEU 39 -15.118 -11.022 -5.505 281 HG LEU 39 HG LEU 39 -15.823 -9.456 -3.886 282 1HD1 LEU 39 HD11 LEU 39 -14.850 -10.174 -1.809 283 2HD1 LEU 39 HD12 LEU 39 -13.200 -9.880 -2.409 284 3HD1 LEU 39 HD13 LEU 39 -14.301 -8.523 -2.108 285 1HD2 LEU 39 HD21 LEU 39 -14.467 -7.571 -4.395 286 2HD2 LEU 39 HD22 LEU 39 -13.003 -8.569 -4.611 287 3HD2 LEU 39 HD23 LEU 39 -14.324 -8.649 -5.788 288 H GLU 40 HN GLU 40 -14.092 -14.093 -5.317 289 HA GLU 40 HA GLU 40 -16.576 -14.567 -6.632 290 1HB GLU 40 HB2 GLU 40 -14.130 -16.348 -6.463 291 2HB GLU 40 HB3 GLU 40 -15.522 -16.538 -7.560 292 1HG GLU 40 HG2 GLU 40 -15.043 -14.350 -8.584 293 2HG GLU 40 HG3 GLU 40 -13.638 -14.149 -7.541 294 H GLU 41 HN GLU 41 -15.011 -16.038 -3.758 295 HA GLU 41 HA GLU 41 -16.983 -18.057 -3.344 296 1HB GLU 41 HB2 GLU 41 -14.864 -16.794 -1.588 297 2HB GLU 41 HB3 GLU 41 -15.939 -18.043 -0.989 298 1HG GLU 41 HG2 GLU 41 -14.092 -18.349 -3.393 299 2HG GLU 41 HG3 GLU 41 -13.729 -18.906 -1.762 300 H LEU 42 HN LEU 42 -16.854 -14.670 -2.612 301 HA LEU 42 HA LEU 42 -18.985 -14.736 -0.617 302 1HB LEU 42 HB2 LEU 42 -17.002 -13.136 -0.667 303 2HB LEU 42 HB3 LEU 42 -17.605 -12.448 -2.155 304 HG LEU 42 HG LEU 42 -17.911 -11.085 -0.157 305 1HD1 LEU 42 HD11 LEU 42 -20.198 -10.369 -0.513 306 2HD1 LEU 42 HD12 LEU 42 -19.367 -10.665 -2.056 307 3HD1 LEU 42 HD13 LEU 42 -20.557 -11.828 -1.438 308 1HD2 LEU 42 HD21 LEU 42 -19.922 -13.179 0.751 309 2HD2 LEU 42 HD22 LEU 42 -18.326 -12.843 1.481 310 3HD2 LEU 42 HD23 LEU 42 -19.587 -11.608 1.481 311 H ASP 43 HN ASP 43 -18.642 -13.847 -4.075 312 HA ASP 43 HA ASP 43 -21.334 -12.980 -4.338 313 1HB ASP 43 HB2 ASP 43 -19.573 -12.398 -5.994 314 2HB ASP 43 HB3 ASP 43 -19.331 -14.098 -6.357 315 H GLN 44 HN GLN 44 -19.797 -16.160 -4.813 316 HA GLN 44 HA GLN 44 -22.224 -17.319 -5.767 317 1HB GLN 44 HB2 GLN 44 -21.088 -19.361 -5.839 318 2HB GLN 44 HB3 GLN 44 -19.915 -18.096 -6.224 319 1HG GLN 44 HG2 GLN 44 -19.141 -18.225 -3.810 320 2HG GLN 44 HG3 GLN 44 -20.178 -19.636 -3.602 321 1HE2 GLN 44 HE22 GLN 44 -17.527 -18.339 -5.661 322 2HE2 GLN 44 HE21 GLN 44 -16.766 -19.896 -5.971 323 H GLU 45 HN GLU 45 -21.586 -16.191 -2.620 324 HA GLU 45 HA GLU 45 -23.407 -18.122 -1.457 325 1HB GLU 45 HB2 GLU 45 -21.662 -18.279 -0.089 326 2HB GLU 45 HB3 GLU 45 -21.053 -16.654 -0.435 327 1HG GLU 45 HG2 GLU 45 -22.461 -15.601 1.020 328 2HG GLU 45 HG3 GLU 45 -23.611 -16.951 1.118 329 H MET 46 HN MET 46 -22.792 -14.602 -1.683 330 HA MET 46 HA MET 46 -25.674 -14.184 -1.033 331 1HB MET 46 HB2 MET 46 -24.979 -12.228 0.213 332 2HB MET 46 HB3 MET 46 -24.370 -13.737 0.905 333 1HG MET 46 HG2 MET 46 -22.163 -13.347 -0.092 334 2HG MET 46 HG3 MET 46 -22.736 -11.884 -0.890 335 1HE MET 46 HE1 MET 46 -23.529 -9.850 0.303 336 2HE MET 46 HE2 MET 46 -24.584 -10.592 1.536 337 3HE MET 46 HE3 MET 46 -23.271 -9.456 2.041 338 H GLY 47 HN GLY 47 -23.899 -14.122 -3.657 339 1HA GLY 47 HA2 GLY 47 -24.257 -11.466 -4.667 340 2HA GLY 47 HA3 GLY 47 -24.050 -12.978 -5.608 341 H ASP 48 HN ASP 48 -26.521 -13.676 -3.727 342 HA ASP 48 HA ASP 48 -28.650 -13.228 -5.587 343 1HB ASP 48 HB2 ASP 48 -28.807 -15.106 -4.082 344 2HB ASP 48 HB3 ASP 48 -28.418 -14.090 -2.696 345 H LYS 49 HN LYS 49 -27.211 -11.379 -2.991 346 HA LYS 49 HA LYS 49 -29.378 -9.426 -3.138 347 1HB LYS 49 HB2 LYS 49 -27.296 -9.630 -0.969 348 2HB LYS 49 HB3 LYS 49 -28.868 -8.838 -0.917 349 1HG LYS 49 HG2 LYS 49 -29.447 -10.676 0.248 350 2HG LYS 49 HG3 LYS 49 -29.665 -11.402 -1.359 351 1HD LYS 49 HD2 LYS 49 -27.548 -12.550 -1.234 352 2HD LYS 49 HD3 LYS 49 -27.006 -11.489 0.083 353 1HE LYS 49 HE2 LYS 49 -27.449 -13.422 1.198 354 2HE LYS 49 HE3 LYS 49 -28.849 -12.392 1.499 355 1HZ LYS 49 HZ1 LYS 49 -29.923 -13.679 -0.462 356 2HZ LYS 49 HZ2 LYS 49 -28.724 -14.772 -0.249 357 3HZ LYS 49 HZ3 LYS 49 -29.756 -14.475 0.966 358 H LEU 50 HN LEU 50 -25.980 -9.962 -3.682 359 HA LEU 50 HA LEU 50 -25.353 -7.076 -3.608 360 1HB LEU 50 HB2 LEU 50 -24.423 -8.512 -1.782 361 2HB LEU 50 HB3 LEU 50 -23.656 -9.524 -3.000 362 HG LEU 50 HG LEU 50 -22.241 -7.580 -3.684 363 1HD1 LEU 50 HD11 LEU 50 -23.365 -6.229 -1.189 364 2HD1 LEU 50 HD12 LEU 50 -22.099 -5.598 -2.270 365 3HD1 LEU 50 HD13 LEU 50 -23.759 -5.745 -2.842 366 1HD2 LEU 50 HD21 LEU 50 -21.463 -9.276 -2.140 367 2HD2 LEU 50 HD22 LEU 50 -20.756 -7.698 -1.768 368 3HD2 LEU 50 HD23 LEU 50 -22.074 -8.339 -0.757 369 H LYS 51 HN LYS 51 -23.816 -6.250 -5.079 370 HA LYS 51 HA LYS 51 -23.114 -7.962 -7.432 371 1HB LYS 51 HB2 LYS 51 -24.721 -6.083 -7.906 372 2HB LYS 51 HB3 LYS 51 -23.519 -4.952 -7.266 373 1HG LYS 51 HG2 LYS 51 -21.941 -5.597 -9.080 374 2HG LYS 51 HG3 LYS 51 -23.157 -6.732 -9.718 375 1HD LYS 51 HD2 LYS 51 -24.744 -4.840 -10.008 376 2HD LYS 51 HD3 LYS 51 -23.528 -3.723 -9.351 377 1HE LYS 51 HE2 LYS 51 -21.992 -4.334 -11.230 378 2HE LYS 51 HE3 LYS 51 -23.256 -5.370 -11.907 379 1HZ LYS 51 HZ1 LYS 51 -24.663 -3.413 -12.130 380 2HZ LYS 51 HZ2 LYS 51 -23.514 -2.460 -11.426 381 3HZ LYS 51 HZ3 LYS 51 -23.234 -3.151 -12.896 382 H ILE 52 HN ILE 52 -20.858 -7.733 -8.124 383 HA ILE 52 HA ILE 52 -19.125 -6.282 -6.213 384 HB ILE 52 HB ILE 52 -18.660 -9.037 -7.450 385 1HG1 ILE 52 HG12 ILE 52 -18.318 -9.657 -4.946 386 2HG1 ILE 52 HG13 ILE 52 -19.240 -8.202 -4.588 387 1HG2 ILE 52 HG21 ILE 52 -16.879 -7.302 -5.689 388 2HG2 ILE 52 HG22 ILE 52 -16.563 -8.994 -6.117 389 3HG2 ILE 52 HG23 ILE 52 -16.577 -7.776 -7.381 390 1HD1 ILE 52 HD11 ILE 52 -20.352 -10.333 -6.425 391 2HD1 ILE 52 HD12 ILE 52 -20.425 -10.513 -4.659 392 3HD1 ILE 52 HD13 ILE 52 -21.239 -9.152 -5.439 393 H VAL 53 HN VAL 53 -17.402 -5.183 -7.275 394 HA VAL 53 HA VAL 53 -17.107 -5.636 -10.182 395 HB VAL 53 HB VAL 53 -17.154 -2.790 -9.107 396 1HG1 VAL 53 HG11 VAL 53 -17.502 -2.238 -11.471 397 2HG1 VAL 53 HG12 VAL 53 -15.970 -3.077 -11.160 398 3HG1 VAL 53 HG13 VAL 53 -17.333 -3.952 -11.896 399 1HG2 VAL 53 HG21 VAL 53 -19.537 -4.105 -10.476 400 2HG2 VAL 53 HG22 VAL 53 -19.454 -3.685 -8.769 401 3HG2 VAL 53 HG23 VAL 53 -19.372 -2.411 -9.980 402 H LYS 54 HN LYS 54 -14.890 -5.517 -10.799 403 HA LYS 54 HA LYS 54 -12.995 -4.713 -8.626 404 1HB LYS 54 HB2 LYS 54 -12.745 -6.874 -10.739 405 2HB LYS 54 HB3 LYS 54 -11.371 -6.235 -9.829 406 1HG LYS 54 HG2 LYS 54 -12.548 -6.830 -7.687 407 2HG LYS 54 HG3 LYS 54 -13.835 -7.570 -8.630 408 1HD LYS 54 HD2 LYS 54 -12.400 -9.344 -7.927 409 2HD LYS 54 HD3 LYS 54 -12.106 -9.096 -9.654 410 1HE LYS 54 HE2 LYS 54 -10.163 -7.468 -8.642 411 2HE LYS 54 HE3 LYS 54 -10.331 -8.512 -7.260 412 1HZ LYS 54 HZ1 LYS 54 -9.947 -10.423 -8.817 413 2HZ LYS 54 HZ2 LYS 54 -9.674 -9.366 -10.032 414 3HZ LYS 54 HZ3 LYS 54 -8.672 -9.392 -8.749 415 H ILE 55 HN ILE 55 -11.121 -3.553 -9.197 416 HA ILE 55 HA ILE 55 -11.053 -2.336 -11.904 417 HB ILE 55 HB ILE 55 -10.569 -1.215 -9.118 418 1HG1 ILE 55 HG12 ILE 55 -12.717 -0.779 -10.288 419 2HG1 ILE 55 HG13 ILE 55 -11.820 0.641 -9.794 420 1HG2 ILE 55 HG21 ILE 55 -8.461 -0.766 -10.055 421 2HG2 ILE 55 HG22 ILE 55 -9.136 -0.291 -11.625 422 3HG2 ILE 55 HG23 ILE 55 -9.375 0.737 -10.191 423 1HD1 ILE 55 HD11 ILE 55 -11.034 1.036 -12.091 424 2HD1 ILE 55 HD12 ILE 55 -11.911 -0.406 -12.651 425 3HD1 ILE 55 HD13 ILE 55 -12.784 0.996 -11.989 426 H ASP 56 HN ASP 56 -9.513 -3.317 -13.011 427 HA ASP 56 HA ASP 56 -7.182 -4.633 -11.771 428 1HB ASP 56 HB2 ASP 56 -8.212 -5.749 -13.676 429 2HB ASP 56 HB3 ASP 56 -8.048 -4.294 -14.665 430 H VAL 57 HN VAL 57 -6.608 -2.734 -10.727 431 HA VAL 57 HA VAL 57 -6.130 -0.279 -11.297 432 HB VAL 57 HB VAL 57 -4.462 -2.318 -9.864 433 1HG1 VAL 57 HG11 VAL 57 -4.045 0.612 -9.259 434 2HG1 VAL 57 HG12 VAL 57 -3.230 -0.813 -8.611 435 3HG1 VAL 57 HG13 VAL 57 -2.932 -0.340 -10.276 436 1HG2 VAL 57 HG21 VAL 57 -6.751 -1.896 -9.014 437 2HG2 VAL 57 HG22 VAL 57 -5.577 -1.331 -7.860 438 3HG2 VAL 57 HG23 VAL 57 -6.400 -0.155 -8.892 439 H ASP 58 HN ASP 58 -3.433 -2.608 -12.302 440 HA ASP 58 HA ASP 58 -1.818 -0.440 -13.171 441 1HB ASP 58 HB2 ASP 58 -1.043 -2.808 -12.794 442 2HB ASP 58 HB3 ASP 58 -1.983 -3.309 -14.213 443 H GLU 59 HN GLU 59 -4.525 -1.954 -14.804 444 HA GLU 59 HA GLU 59 -3.955 -0.541 -17.344 445 1HB GLU 59 HB2 GLU 59 -4.424 -2.721 -17.895 446 2HB GLU 59 HB3 GLU 59 -5.409 -3.007 -16.458 447 1HG GLU 59 HG2 GLU 59 -7.234 -1.750 -17.354 448 2HG GLU 59 HG3 GLU 59 -6.339 -1.403 -18.850 449 H ASN 60 HN ASN 60 -6.187 -0.631 -14.587 450 HA ASN 60 HA ASN 60 -7.679 1.658 -15.741 451 1HB ASN 60 HB2 ASN 60 -8.616 -1.127 -15.321 452 2HB ASN 60 HB3 ASN 60 -9.677 0.033 -14.563 453 1HD2 ASN 60 HD22 ASN 60 -9.272 -1.563 -17.454 454 2HD2 ASN 60 HD21 ASN 60 -10.050 -0.404 -18.496 455 H GLN 61 HN GLN 61 -5.799 1.585 -13.569 456 HA GLN 61 HA GLN 61 -7.221 2.049 -11.167 457 1HB GLN 61 HB2 GLN 61 -5.107 3.057 -10.295 458 2HB GLN 61 HB3 GLN 61 -4.898 1.500 -11.015 459 1HG GLN 61 HG2 GLN 61 -4.234 2.804 -13.202 460 2HG GLN 61 HG3 GLN 61 -4.157 4.184 -12.145 461 1HE2 GLN 61 HE22 GLN 61 -2.912 3.134 -9.786 462 2HE2 GLN 61 HE21 GLN 61 -1.316 2.594 -10.198 463 H GLU 62 HN GLU 62 -7.375 3.879 -13.907 464 HA GLU 62 HA GLU 62 -7.137 6.579 -13.176 465 1HB GLU 62 HB2 GLU 62 -8.732 4.913 -15.105 466 2HB GLU 62 HB3 GLU 62 -9.179 6.628 -14.917 467 1HG GLU 62 HG2 GLU 62 -6.822 7.269 -15.413 468 2HG GLU 62 HG3 GLU 62 -6.411 5.568 -15.636 469 H THR 63 HN THR 63 -9.992 4.345 -12.753 470 HA THR 63 HA THR 63 -11.660 6.079 -11.323 471 HB THR 63 HB THR 63 -11.145 3.097 -10.956 472 HG1 THR 63 HG1 THR 63 -12.856 2.951 -12.513 473 1HG2 THR 63 HG21 THR 63 -12.597 3.979 -9.145 474 2HG2 THR 63 HG22 THR 63 -13.684 4.672 -10.369 475 3HG2 THR 63 HG23 THR 63 -13.460 2.905 -10.234 476 H ALA 64 HN ALA 64 -8.910 4.139 -10.228 477 HA ALA 64 HA ALA 64 -9.563 4.249 -7.444 478 1HB ALA 64 HB1 ALA 64 -7.577 2.934 -7.187 479 2HB ALA 64 HB2 ALA 64 -8.217 2.471 -8.767 480 3HB ALA 64 HB3 ALA 64 -6.855 3.568 -8.684 481 H GLY 65 HN GLY 65 -6.742 5.580 -9.211 482 1HA GLY 65 HA2 GLY 65 -5.829 7.552 -7.494 483 2HA GLY 65 HA3 GLY 65 -5.834 7.672 -9.266 484 H LYS 66 HN LYS 66 -8.583 7.915 -9.856 485 HA LYS 66 HA LYS 66 -9.012 10.657 -9.313 486 1HB LYS 66 HB2 LYS 66 -9.831 9.512 -11.282 487 2HB LYS 66 HB3 LYS 66 -10.917 8.503 -10.313 488 1HG LYS 66 HG2 LYS 66 -12.264 10.430 -9.699 489 2HG LYS 66 HG3 LYS 66 -11.133 11.542 -10.490 490 1HD LYS 66 HD2 LYS 66 -12.631 9.317 -11.950 491 2HD LYS 66 HD3 LYS 66 -13.236 10.977 -11.810 492 1HE LYS 66 HE2 LYS 66 -11.321 11.871 -12.992 493 2HE LYS 66 HE3 LYS 66 -10.509 10.300 -12.990 494 1HZ LYS 66 HZ1 LYS 66 -12.090 9.431 -14.481 495 2HZ LYS 66 HZ2 LYS 66 -13.065 10.767 -14.393 496 3HZ LYS 66 HZ3 LYS 66 -11.599 10.853 -15.109 497 H TYR 67 HN TYR 67 -10.412 7.709 -7.725 498 HA TYR 67 HA TYR 67 -12.151 9.277 -6.066 499 1HB TYR 67 HB2 TYR 67 -12.595 6.909 -6.545 500 2HB TYR 67 HB3 TYR 67 -11.113 6.444 -5.720 501 HD1 TYR 67 HD1 TYR 67 -14.506 7.923 -5.263 502 HD2 TYR 67 HD2 TYR 67 -11.015 6.359 -3.261 503 HE1 TYR 67 HE1 TYR 67 -15.712 7.998 -3.107 504 HE2 TYR 67 HE2 TYR 67 -12.220 6.404 -1.109 505 HH TYR 67 HH TYR 67 -15.571 7.660 -0.796 506 H GLY 68 HN GLY 68 -8.856 8.019 -5.820 507 1HA GLY 68 HA2 GLY 68 -7.131 8.944 -4.433 508 2HA GLY 68 HA3 GLY 68 -8.358 9.507 -3.276 509 H VAL 69 HN VAL 69 -7.048 6.520 -4.834 510 HA VAL 69 HA VAL 69 -7.924 4.917 -2.441 511 HB VAL 69 HB VAL 69 -7.782 4.224 -5.379 512 1HG1 VAL 69 HG11 VAL 69 -7.997 1.813 -4.735 513 2HG1 VAL 69 HG12 VAL 69 -6.396 2.509 -4.471 514 3HG1 VAL 69 HG13 VAL 69 -7.482 2.282 -3.096 515 1HG2 VAL 69 HG21 VAL 69 -9.929 4.885 -4.566 516 2HG2 VAL 69 HG22 VAL 69 -9.941 3.161 -4.934 517 3HG2 VAL 69 HG23 VAL 69 -9.852 3.702 -3.241 518 H MET 70 HN MET 70 -5.535 4.921 -5.013 519 HA MET 70 HA MET 70 -3.405 4.694 -5.193 520 1HB MET 70 HB2 MET 70 -1.951 6.154 -4.005 521 2HB MET 70 HB3 MET 70 -3.447 7.003 -4.369 522 1HG MET 70 HG2 MET 70 -4.180 6.989 -2.146 523 2HG MET 70 HG3 MET 70 -3.170 5.626 -1.713 524 1HE MET 70 HE1 MET 70 0.311 6.969 -1.165 525 2HE MET 70 HE2 MET 70 -0.701 5.586 -1.644 526 3HE MET 70 HE3 MET 70 -0.166 6.757 -2.863 527 H SER 71 HN SER 71 -4.841 2.852 -3.062 528 HA SER 71 HA SER 71 -2.414 1.410 -2.256 529 1HB SER 71 HB2 SER 71 -3.522 1.102 -0.020 530 2HB SER 71 HB3 SER 71 -2.877 2.683 -0.434 531 HG SER 71 HG SER 71 -4.998 3.396 -0.913 532 H ILE 72 HN ILE 72 -2.935 -0.814 -1.358 533 HA ILE 72 HA ILE 72 -5.226 -2.084 -2.693 534 HB ILE 72 HB ILE 72 -2.324 -2.933 -2.885 535 1HG1 ILE 72 HG12 ILE 72 -2.746 -0.971 -4.365 536 2HG1 ILE 72 HG13 ILE 72 -2.226 -2.421 -5.175 537 1HG2 ILE 72 HG21 ILE 72 -3.682 -4.942 -2.970 538 2HG2 ILE 72 HG22 ILE 72 -4.761 -4.207 -4.172 539 3HG2 ILE 72 HG23 ILE 72 -3.081 -4.579 -4.583 540 1HD1 ILE 72 HD11 ILE 72 -3.992 -1.287 -6.404 541 2HD1 ILE 72 HD12 ILE 72 -4.523 -2.892 -5.939 542 3HD1 ILE 72 HD13 ILE 72 -5.126 -1.474 -5.049 543 HA PRO 73 HA PRO 73 -6.206 -4.016 -2.541 544 1HB PRO 73 HB2 PRO 73 -7.830 -5.711 -1.224 545 2HB PRO 73 HB3 PRO 73 -6.241 -6.261 -1.845 546 1HG PRO 73 HG2 PRO 73 -6.954 -5.400 0.967 547 2HG PRO 73 HG3 PRO 73 -6.044 -6.843 0.470 548 1HD PRO 73 HD2 PRO 73 -4.832 -4.484 1.280 549 2HD PRO 73 HD3 PRO 73 -4.081 -5.581 0.089 550 H THR 74 HN THR 74 -7.915 -2.597 -2.780 551 HA THR 74 HA THR 74 -8.982 -1.344 -0.253 552 HB THR 74 HB THR 74 -8.626 -0.041 -2.963 553 HG1 THR 74 HG1 THR 74 -6.731 0.252 -2.157 554 1HG2 THR 74 HG21 THR 74 -10.579 0.953 -1.939 555 2HG2 THR 74 HG22 THR 74 -9.783 1.002 -0.346 556 3HG2 THR 74 HG23 THR 74 -9.223 2.048 -1.653 557 H LEU 75 HN LEU 75 -11.122 -1.132 0.028 558 HA LEU 75 HA LEU 75 -12.945 -2.226 -2.076 559 1HB LEU 75 HB2 LEU 75 -13.264 -2.337 0.951 560 2HB LEU 75 HB3 LEU 75 -14.501 -2.778 -0.216 561 HG LEU 75 HG LEU 75 -11.866 -4.227 0.244 562 1HD1 LEU 75 HD11 LEU 75 -14.762 -5.026 0.794 563 2HD1 LEU 75 HD12 LEU 75 -13.320 -6.018 1.094 564 3HD1 LEU 75 HD13 LEU 75 -13.588 -4.512 1.996 565 1HD2 LEU 75 HD21 LEU 75 -12.850 -5.952 -1.326 566 2HD2 LEU 75 HD22 LEU 75 -14.072 -4.737 -1.804 567 3HD2 LEU 75 HD23 LEU 75 -12.356 -4.444 -2.088 568 H LEU 76 HN LEU 76 -14.613 -0.914 -2.571 569 HA LEU 76 HA LEU 76 -15.218 1.421 -0.891 570 1HB LEU 76 HB2 LEU 76 -15.389 1.494 -3.925 571 2HB LEU 76 HB3 LEU 76 -15.730 2.787 -2.789 572 HG LEU 76 HG LEU 76 -12.962 1.685 -3.483 573 1HD1 LEU 76 HD11 LEU 76 -14.292 4.355 -4.105 574 2HD1 LEU 76 HD12 LEU 76 -12.641 3.865 -4.539 575 3HD1 LEU 76 HD13 LEU 76 -14.021 3.031 -5.258 576 1HD2 LEU 76 HD21 LEU 76 -12.088 3.578 -2.164 577 2HD2 LEU 76 HD22 LEU 76 -13.739 4.002 -1.662 578 3HD2 LEU 76 HD23 LEU 76 -13.004 2.469 -1.143 579 H VAL 77 HN VAL 77 -17.134 0.699 -0.014 580 HA VAL 77 HA VAL 77 -18.912 -1.040 -1.665 581 HB VAL 77 HB VAL 77 -19.013 -0.319 1.294 582 1HG1 VAL 77 HG11 VAL 77 -20.815 -2.158 -0.335 583 2HG1 VAL 77 HG12 VAL 77 -20.843 -1.958 1.438 584 3HG1 VAL 77 HG13 VAL 77 -21.295 -0.615 0.394 585 1HG2 VAL 77 HG21 VAL 77 -18.370 -2.936 -0.115 586 2HG2 VAL 77 HG22 VAL 77 -17.213 -1.920 0.774 587 3HG2 VAL 77 HG23 VAL 77 -18.533 -2.714 1.640 588 H LEU 78 HN LEU 78 -20.264 0.064 -2.934 589 HA LEU 78 HA LEU 78 -21.206 2.741 -2.080 590 1HB LEU 78 HB2 LEU 78 -21.002 1.509 -4.857 591 2HB LEU 78 HB3 LEU 78 -22.034 2.883 -4.484 592 HG LEU 78 HG LEU 78 -19.858 3.928 -3.429 593 1HD1 LEU 78 HD11 LEU 78 -17.811 3.364 -4.657 594 2HD1 LEU 78 HD12 LEU 78 -18.384 1.964 -3.759 595 3HD1 LEU 78 HD13 LEU 78 -18.653 2.050 -5.510 596 1HD2 LEU 78 HD21 LEU 78 -19.363 5.038 -5.562 597 2HD2 LEU 78 HD22 LEU 78 -20.340 3.828 -6.419 598 3HD2 LEU 78 HD23 LEU 78 -21.102 4.928 -5.256 599 H LYS 79 HN LYS 79 -23.433 3.209 -2.227 600 HA LYS 79 HA LYS 79 -25.302 0.979 -2.627 601 1HB LYS 79 HB2 LYS 79 -24.850 0.613 -0.387 602 2HB LYS 79 HB3 LYS 79 -24.710 2.343 -0.024 603 1HG LYS 79 HG2 LYS 79 -27.063 2.669 -0.064 604 2HG LYS 79 HG3 LYS 79 -27.353 1.027 -0.691 605 1HD LYS 79 HD2 LYS 79 -26.225 0.163 1.462 606 2HD LYS 79 HD3 LYS 79 -26.204 1.834 2.019 607 1HE LYS 79 HE2 LYS 79 -28.107 1.048 3.032 608 2HE LYS 79 HE3 LYS 79 -28.768 1.822 1.587 609 1HZ LYS 79 HZ1 LYS 79 -28.253 -1.079 1.948 610 2HZ LYS 79 HZ2 LYS 79 -29.725 -0.369 1.992 611 3HZ LYS 79 HZ3 LYS 79 -28.903 -0.408 0.585 612 H ASP 80 HN ASP 80 -26.892 1.707 -3.632 613 HA ASP 80 HA ASP 80 -28.199 3.008 -4.926 614 1HB ASP 80 HB2 ASP 80 -29.288 2.703 -2.708 615 2HB ASP 80 HB3 ASP 80 -28.725 4.305 -2.236 616 H GLY 81 HN GLY 81 -25.401 4.253 -4.703 617 1HA GLY 81 HA2 GLY 81 -25.291 6.095 -6.509 618 2HA GLY 81 HA3 GLY 81 -26.100 7.077 -5.286 619 H GLU 82 HN GLU 82 -24.449 5.733 -3.061 620 HA GLU 82 HA GLU 82 -21.990 7.295 -3.517 621 1HB GLU 82 HB2 GLU 82 -22.423 8.528 -1.523 622 2HB GLU 82 HB3 GLU 82 -23.900 8.546 -2.509 623 1HG GLU 82 HG2 GLU 82 -24.857 6.741 -1.072 624 2HG GLU 82 HG3 GLU 82 -23.426 6.825 -0.044 625 H VAL 83 HN VAL 83 -20.293 6.952 -1.875 626 HA VAL 83 HA VAL 83 -19.960 4.159 -1.118 627 HB VAL 83 HB VAL 83 -18.352 6.649 -0.388 628 1HG1 VAL 83 HG11 VAL 83 -16.517 5.049 0.113 629 2HG1 VAL 83 HG12 VAL 83 -17.895 4.773 1.174 630 3HG1 VAL 83 HG13 VAL 83 -17.614 3.694 -0.211 631 1HG2 VAL 83 HG21 VAL 83 -18.333 6.225 -2.853 632 2HG2 VAL 83 HG22 VAL 83 -16.761 5.892 -2.124 633 3HG2 VAL 83 HG23 VAL 83 -17.822 4.549 -2.541 634 H VAL 84 HN VAL 84 -20.449 3.205 0.680 635 HA VAL 84 HA VAL 84 -21.379 4.799 3.020 636 HB VAL 84 HB VAL 84 -22.967 2.987 3.471 637 1HG1 VAL 84 HG11 VAL 84 -23.675 5.056 2.301 638 2HG1 VAL 84 HG12 VAL 84 -23.424 4.249 0.740 639 3HG1 VAL 84 HG13 VAL 84 -24.666 3.658 1.861 640 1HG2 VAL 84 HG21 VAL 84 -23.592 1.334 1.813 641 2HG2 VAL 84 HG22 VAL 84 -22.360 1.926 0.680 642 3HG2 VAL 84 HG23 VAL 84 -21.884 1.140 2.203 643 H GLU 85 HN GLU 85 -19.217 2.313 1.818 644 HA GLU 85 HA GLU 85 -17.994 2.306 4.432 645 1HB GLU 85 HB2 GLU 85 -19.295 -0.098 3.288 646 2HB GLU 85 HB3 GLU 85 -17.575 -0.355 3.630 647 1HG GLU 85 HG2 GLU 85 -19.677 0.688 5.492 648 2HG GLU 85 HG3 GLU 85 -19.132 -1.000 5.383 649 H THR 86 HN THR 86 -15.794 1.653 4.351 650 HA THR 86 HA THR 86 -14.478 1.520 1.727 651 HB THR 86 HB THR 86 -13.404 3.654 3.502 652 HG1 THR 86 HG1 THR 86 -15.524 4.294 3.671 653 1HG2 THR 86 HG21 THR 86 -13.020 4.746 1.335 654 2HG2 THR 86 HG22 THR 86 -12.510 3.043 1.267 655 3HG2 THR 86 HG23 THR 86 -14.074 3.536 0.554 656 H SER 87 HN SER 87 -12.586 0.259 2.025 657 HA SER 87 HA SER 87 -11.226 0.406 4.584 658 1HB SER 87 HB2 SER 87 -11.227 -2.014 5.022 659 2HB SER 87 HB3 SER 87 -12.834 -1.305 5.182 660 HG SER 87 HG SER 87 -13.373 -2.102 3.159 661 H VAL 88 HN VAL 88 -9.144 -0.635 4.517 662 HA VAL 88 HA VAL 88 -8.033 -0.996 1.802 663 HB VAL 88 HB VAL 88 -8.036 1.364 2.168 664 1HG1 VAL 88 HG11 VAL 88 -6.492 0.995 4.754 665 2HG1 VAL 88 HG12 VAL 88 -6.847 2.524 3.933 666 3HG1 VAL 88 HG13 VAL 88 -8.167 1.563 4.597 667 1HG2 VAL 88 HG21 VAL 88 -6.204 0.408 0.973 668 2HG2 VAL 88 HG22 VAL 88 -5.669 1.830 1.904 669 3HG2 VAL 88 HG23 VAL 88 -5.297 0.192 2.472 670 H GLY 89 HN GLY 89 -7.981 -3.193 2.554 671 1HA GLY 89 HA2 GLY 89 -5.590 -4.164 3.459 672 2HA GLY 89 HA3 GLY 89 -6.504 -3.950 4.959 673 H PHE 90 HN PHE 90 -5.610 -6.463 3.973 674 HA PHE 90 HA PHE 90 -7.562 -7.878 2.498 675 1HB PHE 90 HB2 PHE 90 -5.272 -8.709 2.789 676 2HB PHE 90 HB3 PHE 90 -5.512 -8.853 4.524 677 HD1 PHE 90 HD1 PHE 90 -6.279 -10.895 5.450 678 HD2 PHE 90 HD2 PHE 90 -6.929 -10.111 1.253 679 HE1 PHE 90 HE1 PHE 90 -7.270 -13.150 5.178 680 HE2 PHE 90 HE2 PHE 90 -7.967 -12.351 1.008 681 HZ PHE 90 HZ PHE 90 -8.120 -13.880 2.956 682 H LYS 91 HN LYS 91 -9.174 -9.358 3.163 683 HA LYS 91 HA LYS 91 -9.973 -9.473 5.989 684 1HB LYS 91 HB2 LYS 91 -11.530 -8.200 3.750 685 2HB LYS 91 HB3 LYS 91 -12.435 -9.244 4.840 686 1HG LYS 91 HG2 LYS 91 -11.902 -7.940 6.757 687 2HG LYS 91 HG3 LYS 91 -10.684 -6.996 5.902 688 1HD LYS 91 HD2 LYS 91 -13.674 -6.965 5.324 689 2HD LYS 91 HD3 LYS 91 -12.831 -5.788 6.323 690 1HE LYS 91 HE2 LYS 91 -12.404 -6.248 3.330 691 2HE LYS 91 HE3 LYS 91 -13.237 -4.896 4.098 692 1HZ LYS 91 HZ1 LYS 91 -11.238 -4.030 3.683 693 2HZ LYS 91 HZ2 LYS 91 -10.999 -4.484 5.229 694 3HZ LYS 91 HZ3 LYS 91 -10.339 -5.370 4.002 695 HA PRO 92 HA PRO 92 -10.521 -13.639 4.208 696 1HB PRO 92 HB2 PRO 92 -11.566 -14.924 6.393 697 2HB PRO 92 HB3 PRO 92 -9.829 -14.517 6.246 698 1HG PRO 92 HG2 PRO 92 -11.993 -12.951 7.683 699 2HG PRO 92 HG3 PRO 92 -10.385 -13.443 8.311 700 1HD PRO 92 HD2 PRO 92 -10.790 -10.963 7.294 701 2HD PRO 92 HD3 PRO 92 -9.266 -11.836 6.975 702 H LYS 93 HN LYS 93 -12.479 -15.077 3.955 703 HA LYS 93 HA LYS 93 -14.538 -13.806 2.665 704 1HB LYS 93 HB2 LYS 93 -14.031 -16.110 2.292 705 2HB LYS 93 HB3 LYS 93 -14.263 -16.521 3.988 706 1HG LYS 93 HG2 LYS 93 -16.036 -17.448 2.716 707 2HG LYS 93 HG3 LYS 93 -16.669 -16.216 3.797 708 1HD LYS 93 HD2 LYS 93 -16.727 -14.617 1.819 709 2HD LYS 93 HD3 LYS 93 -16.291 -15.971 0.757 710 1HE LYS 93 HE2 LYS 93 -18.617 -16.059 2.742 711 2HE LYS 93 HE3 LYS 93 -18.834 -15.454 1.109 712 1HZ LYS 93 HZ1 LYS 93 -17.776 -18.168 1.625 713 2HZ LYS 93 HZ2 LYS 93 -19.372 -17.838 1.526 714 3HZ LYS 93 HZ3 LYS 93 -18.414 -17.566 0.216 715 H GLU 94 HN GLU 94 -14.678 -14.886 6.109 716 HA GLU 94 HA GLU 94 -17.382 -14.066 6.367 717 1HB GLU 94 HB2 GLU 94 -15.226 -14.512 8.479 718 2HB GLU 94 HB3 GLU 94 -16.944 -14.249 8.832 719 1HG GLU 94 HG2 GLU 94 -17.526 -16.275 7.501 720 2HG GLU 94 HG3 GLU 94 -15.813 -16.567 7.196 721 H ALA 95 HN ALA 95 -14.302 -12.368 7.155 722 HA ALA 95 HA ALA 95 -15.567 -10.066 8.327 723 1HB ALA 95 HB1 ALA 95 -13.158 -10.676 8.648 724 2HB ALA 95 HB2 ALA 95 -12.880 -10.275 6.930 725 3HB ALA 95 HB3 ALA 95 -13.403 -9.017 8.073 726 H LEU 96 HN LEU 96 -14.709 -11.018 5.022 727 HA LEU 96 HA LEU 96 -15.233 -8.538 3.769 728 1HB LEU 96 HB2 LEU 96 -14.335 -11.004 2.916 729 2HB LEU 96 HB3 LEU 96 -15.973 -11.064 2.322 730 HG LEU 96 HG LEU 96 -14.637 -10.252 0.567 731 1HD1 LEU 96 HD11 LEU 96 -15.890 -7.733 1.748 732 2HD1 LEU 96 HD12 LEU 96 -15.394 -7.985 0.079 733 3HD1 LEU 96 HD13 LEU 96 -16.724 -8.950 0.755 734 1HD2 LEU 96 HD21 LEU 96 -12.665 -9.653 1.939 735 2HD2 LEU 96 HD22 LEU 96 -13.042 -8.430 0.717 736 3HD2 LEU 96 HD23 LEU 96 -13.471 -8.145 2.421 737 H GLN 97 HN GLN 97 -17.346 -11.402 4.227 738 HA GLN 97 HA GLN 97 -19.643 -10.146 3.116 739 1HB GLN 97 HB2 GLN 97 -20.719 -12.037 3.443 740 2HB GLN 97 HB3 GLN 97 -19.085 -12.676 3.555 741 1HG GLN 97 HG2 GLN 97 -19.288 -12.711 5.960 742 2HG GLN 97 HG3 GLN 97 -20.976 -12.128 5.822 743 1HE2 GLN 97 HE22 GLN 97 -22.187 -13.563 3.880 744 2HE2 GLN 97 HE21 GLN 97 -22.019 -15.292 4.108 745 H GLU 98 HN GLU 98 -18.422 -10.308 6.497 746 HA GLU 98 HA GLU 98 -20.673 -9.040 7.639 747 1HB GLU 98 HB2 GLU 98 -19.002 -10.178 8.963 748 2HB GLU 98 HB3 GLU 98 -17.756 -9.010 8.488 749 1HG GLU 98 HG2 GLU 98 -18.939 -7.212 9.657 750 2HG GLU 98 HG3 GLU 98 -20.290 -8.292 10.020 751 H LEU 99 HN LEU 99 -17.677 -7.610 6.269 752 HA LEU 99 HA LEU 99 -18.132 -4.982 7.035 753 1HB LEU 99 HB2 LEU 99 -16.047 -5.986 6.097 754 2HB LEU 99 HB3 LEU 99 -16.755 -5.973 4.494 755 HG LEU 99 HG LEU 99 -15.081 -4.215 4.998 756 1HD1 LEU 99 HD11 LEU 99 -17.718 -2.912 4.284 757 2HD1 LEU 99 HD12 LEU 99 -16.081 -2.407 3.852 758 3HD1 LEU 99 HD13 LEU 99 -16.740 -3.903 3.174 759 1HD2 LEU 99 HD21 LEU 99 -15.775 -3.826 7.355 760 2HD2 LEU 99 HD22 LEU 99 -15.532 -2.342 6.412 761 3HD2 LEU 99 HD23 LEU 99 -17.178 -2.905 6.750 762 H VAL 100 HN VAL 100 -19.251 -6.657 4.111 763 HA VAL 100 HA VAL 100 -20.591 -4.214 3.160 764 HB VAL 100 HB VAL 100 -19.371 -5.657 1.658 765 1HG1 VAL 100 HG11 VAL 100 -21.587 -7.731 1.977 766 2HG1 VAL 100 HG12 VAL 100 -20.205 -7.802 0.864 767 3HG1 VAL 100 HG13 VAL 100 -19.941 -7.903 2.602 768 1HG2 VAL 100 HG21 VAL 100 -22.310 -5.567 0.933 769 2HG2 VAL 100 HG22 VAL 100 -21.184 -4.205 0.826 770 3HG2 VAL 100 HG23 VAL 100 -20.927 -5.638 -0.177 771 H ASN 101 HN ASN 101 -21.501 -7.219 4.880 772 HA ASN 101 HA ASN 101 -24.269 -7.191 4.290 773 1HB ASN 101 HB2 ASN 101 -23.360 -9.164 5.123 774 2HB ASN 101 HB3 ASN 101 -22.725 -8.373 6.582 775 1HD2 ASN 101 HD22 ASN 101 -24.148 -7.925 8.320 776 2HD2 ASN 101 HD21 ASN 101 -25.787 -8.522 8.363 777 H LYS 102 HN LYS 102 -22.363 -5.336 6.581 778 HA LYS 102 HA LYS 102 -24.361 -4.357 8.325 779 1HB LYS 102 HB2 LYS 102 -21.814 -3.170 7.199 780 2HB LYS 102 HB3 LYS 102 -22.755 -2.357 8.470 781 1HG LYS 102 HG2 LYS 102 -22.384 -4.075 10.045 782 2HG LYS 102 HG3 LYS 102 -21.874 -5.219 8.830 783 1HD LYS 102 HD2 LYS 102 -20.227 -3.633 10.486 784 2HD LYS 102 HD3 LYS 102 -19.824 -4.872 9.304 785 1HE LYS 102 HE2 LYS 102 -18.505 -3.037 8.767 786 2HE LYS 102 HE3 LYS 102 -19.752 -3.176 7.522 787 1HZ LYS 102 HZ1 LYS 102 -20.784 -1.233 8.313 788 2HZ LYS 102 HZ2 LYS 102 -19.974 -1.255 9.763 789 3HZ LYS 102 HZ3 LYS 102 -19.199 -0.895 8.363 790 H HIS 103 HN HIS 103 -23.867 -3.612 4.920 791 HA HIS 103 HA HIS 103 -25.900 -1.409 5.118 792 1HB HIS 103 HB2 HIS 103 -23.498 -1.514 3.254 793 2HB HIS 103 HB3 HIS 103 -24.637 -0.179 3.467 794 HD1 HIS 103 HD1 HIS 103 -24.469 1.106 5.950 795 HD2 HIS 103 HD2 HIS 103 -21.567 -1.821 5.071 796 HE1 HIS 103 HE1 HIS 103 -22.731 1.250 7.797 797 H LEU 104 HN LEU 104 -24.900 -4.306 3.537 798 HA LEU 104 HA LEU 104 -26.457 -4.222 1.118 799 1HB LEU 104 HB2 LEU 104 -24.523 -5.461 1.269 800 2HB LEU 104 HB3 LEU 104 -25.018 -6.246 2.754 801 HG LEU 104 HG LEU 104 -24.928 -7.597 0.765 802 1HD1 LEU 104 HD11 LEU 104 -26.226 -8.290 2.759 803 2HD1 LEU 104 HD12 LEU 104 -27.702 -7.673 1.973 804 3HD1 LEU 104 HD13 LEU 104 -26.793 -9.004 1.249 805 1HD2 LEU 104 HD21 LEU 104 -26.622 -7.521 -0.935 806 2HD2 LEU 104 HD22 LEU 104 -27.462 -6.185 -0.129 807 3HD2 LEU 104 HD23 LEU 104 -25.840 -5.957 -0.827 808 1H MET 1 H1 MET 1 8.678 26.100 -11.962 809 2H MET 1 H2 MET 1 9.009 27.699 -11.953 810 3H MET 1 H3 MET 1 8.121 27.063 -13.174 811 HA MET 1 HA MET 1 6.710 28.261 -11.631 812 1HB MET 1 HB2 MET 1 6.330 25.230 -11.601 813 2HB MET 1 HB3 MET 1 5.153 26.384 -10.974 814 1HG MET 1 HG2 MET 1 6.099 26.219 -13.858 815 2HG MET 1 HG3 MET 1 4.558 25.667 -13.218 816 1HE MET 1 HE1 MET 1 3.488 28.677 -15.465 817 2HE MET 1 HE2 MET 1 4.800 27.517 -15.770 818 3HE MET 1 HE3 MET 1 3.253 26.954 -15.095 819 H GLU 2 HN GLU 2 6.533 29.016 -9.556 820 HA GLU 2 HA GLU 2 8.230 27.903 -7.461 821 1HB GLU 2 HB2 GLU 2 7.780 30.337 -7.725 822 2HB GLU 2 HB3 GLU 2 6.071 30.060 -7.364 823 1HG GLU 2 HG2 GLU 2 6.675 29.226 -5.110 824 2HG GLU 2 HG3 GLU 2 8.389 29.396 -5.492 825 H ASN 3 HN ASN 3 7.626 26.499 -5.932 826 HA ASN 3 HA ASN 3 6.657 25.050 -4.717 827 1HB ASN 3 HB2 ASN 3 3.848 25.842 -5.394 828 2HB ASN 3 HB3 ASN 3 4.463 24.866 -4.060 829 1HD2 ASN 3 HD22 ASN 3 6.453 26.439 -2.812 830 2HD2 ASN 3 HD21 ASN 3 5.758 27.951 -2.350 831 H LYS 4 HN LYS 4 6.717 23.179 -5.070 832 HA LYS 4 HA LYS 4 5.661 21.719 -7.367 833 1HB LYS 4 HB2 LYS 4 8.622 22.124 -6.665 834 2HB LYS 4 HB3 LYS 4 8.046 20.846 -7.742 835 1HG LYS 4 HG2 LYS 4 7.232 22.443 -9.358 836 2HG LYS 4 HG3 LYS 4 7.557 23.815 -8.294 837 1HD LYS 4 HD2 LYS 4 9.760 21.974 -9.216 838 2HD LYS 4 HD3 LYS 4 9.212 23.388 -10.148 839 1HE LYS 4 HE2 LYS 4 9.738 24.894 -8.317 840 2HE LYS 4 HE3 LYS 4 10.210 23.548 -7.274 841 1HZ LYS 4 HZ1 LYS 4 12.112 24.696 -8.371 842 2HZ LYS 4 HZ2 LYS 4 12.055 23.091 -8.698 843 3HZ LYS 4 HZ3 LYS 4 11.576 24.189 -9.828 844 H ILE 5 HN ILE 5 5.306 19.534 -6.613 845 HA ILE 5 HA ILE 5 5.979 19.185 -3.735 846 HB ILE 5 HB ILE 5 3.471 18.412 -5.250 847 1HG1 ILE 5 HG12 ILE 5 4.202 20.566 -3.225 848 2HG1 ILE 5 HG13 ILE 5 3.458 20.763 -4.810 849 1HG2 ILE 5 HG21 ILE 5 4.226 17.972 -2.340 850 2HG2 ILE 5 HG22 ILE 5 2.644 17.569 -3.085 851 3HG2 ILE 5 HG23 ILE 5 4.069 16.690 -3.574 852 1HD1 ILE 5 HD11 ILE 5 2.169 19.649 -2.300 853 2HD1 ILE 5 HD12 ILE 5 1.815 21.182 -3.120 854 3HD1 ILE 5 HD13 ILE 5 1.398 19.636 -3.908 855 H ILE 6 HN ILE 6 6.659 17.342 -3.007 856 HA ILE 6 HA ILE 6 7.013 15.006 -4.766 857 HB ILE 6 HB ILE 6 9.075 16.349 -4.997 858 1HG1 ILE 6 HG12 ILE 6 9.320 13.671 -3.593 859 2HG1 ILE 6 HG13 ILE 6 9.288 14.006 -5.328 860 1HG2 ILE 6 HG21 ILE 6 9.545 15.951 -2.024 861 2HG2 ILE 6 HG22 ILE 6 10.585 16.821 -3.171 862 3HG2 ILE 6 HG23 ILE 6 9.016 17.477 -2.765 863 1HD1 ILE 6 HD11 ILE 6 11.466 15.137 -5.157 864 2HD1 ILE 6 HD12 ILE 6 11.535 14.816 -3.411 865 3HD1 ILE 6 HD13 ILE 6 11.557 13.475 -4.554 866 H TYR 7 HN TYR 7 6.923 13.068 -3.535 867 HA TYR 7 HA TYR 7 6.144 13.406 -0.673 868 1HB TYR 7 HB2 TYR 7 4.251 13.520 -2.413 869 2HB TYR 7 HB3 TYR 7 4.591 11.840 -2.758 870 HD1 TYR 7 HD1 TYR 7 4.187 10.093 -0.866 871 HD2 TYR 7 HD2 TYR 7 2.970 14.227 -0.563 872 HE1 TYR 7 HE1 TYR 7 2.315 9.441 0.568 873 HE2 TYR 7 HE2 TYR 7 1.266 13.588 1.114 874 HH TYR 7 HH TYR 7 0.118 11.844 2.091 875 H PHE 8 HN PHE 8 6.680 11.615 0.591 876 HA PHE 8 HA PHE 8 8.237 9.471 -0.780 877 1HB PHE 8 HB2 PHE 8 8.460 10.428 2.084 878 2HB PHE 8 HB3 PHE 8 9.484 9.261 1.272 879 HD1 PHE 8 HD1 PHE 8 9.553 11.277 -1.372 880 HD2 PHE 8 HD2 PHE 8 10.502 11.582 2.830 881 HE1 PHE 8 HE1 PHE 8 11.191 13.040 -1.869 882 HE2 PHE 8 HE2 PHE 8 12.080 13.381 2.304 883 HZ PHE 8 HZ PHE 8 12.481 14.092 -0.019 884 H LEU 9 HN LEU 9 7.858 7.323 -0.189 885 HA LEU 9 HA LEU 9 5.659 6.747 1.736 886 1HB LEU 9 HB2 LEU 9 5.922 5.912 -1.164 887 2HB LEU 9 HB3 LEU 9 5.136 4.841 -0.019 888 HG LEU 9 HG LEU 9 4.252 7.707 -0.512 889 1HD1 LEU 9 HD11 LEU 9 2.487 6.829 -1.871 890 2HD1 LEU 9 HD12 LEU 9 3.990 6.125 -2.479 891 3HD1 LEU 9 HD13 LEU 9 2.918 5.151 -1.469 892 1HD2 LEU 9 HD21 LEU 9 3.525 6.952 1.702 893 2HD2 LEU 9 HD22 LEU 9 2.132 6.913 0.621 894 3HD2 LEU 9 HD23 LEU 9 2.971 5.403 1.045 895 H SER 10 HN SER 10 6.350 5.350 3.237 896 HA SER 10 HA SER 10 7.852 3.037 2.623 897 1HB SER 10 HB2 SER 10 9.831 3.642 4.087 898 2HB SER 10 HB3 SER 10 9.798 4.311 2.473 899 HG SER 10 HG SER 10 8.858 6.237 3.423 900 H THR 11 HN THR 11 8.045 1.644 4.567 901 HA THR 11 HA THR 11 5.736 1.528 5.901 902 HB THR 11 HB THR 11 8.380 0.379 6.854 903 HG1 THR 11 HG1 THR 11 7.958 -1.111 5.317 904 1HG2 THR 11 HG21 THR 11 5.538 -0.668 7.274 905 2HG2 THR 11 HG22 THR 11 7.057 -1.358 7.904 906 3HG2 THR 11 HG23 THR 11 6.473 0.168 8.534 907 H GLY 12 HN GLY 12 4.762 2.627 7.305 908 1HA GLY 12 HA2 GLY 12 4.210 3.897 9.126 909 2HA GLY 12 HA3 GLY 12 5.671 3.268 9.902 910 H ASN 13 HN ASN 13 6.564 4.818 7.068 911 HA ASN 13 HA ASN 13 8.161 6.294 6.817 912 1HB ASN 13 HB2 ASN 13 7.224 8.167 6.119 913 2HB ASN 13 HB3 ASN 13 5.725 7.429 6.616 914 1HD2 ASN 13 HD22 ASN 13 7.704 10.159 6.963 915 2HD2 ASN 13 HD21 ASN 13 6.843 10.889 8.300 916 H SER 14 HN SER 14 8.239 5.134 9.540 917 HA SER 14 HA SER 14 8.629 6.857 11.559 918 1HB SER 14 HB2 SER 14 10.232 4.302 11.244 919 2HB SER 14 HB3 SER 14 9.557 5.005 12.726 920 HG SER 14 HG SER 14 8.288 3.268 11.945 921 H ALA 15 HN ALA 15 11.230 5.933 9.271 922 HA ALA 15 HA ALA 15 13.056 7.766 10.759 923 1HB ALA 15 HB1 ALA 15 13.626 4.953 9.705 924 2HB ALA 15 HB2 ALA 15 14.840 6.061 10.370 925 3HB ALA 15 HB3 ALA 15 13.524 5.458 11.396 926 H ARG 16 HN ARG 16 13.453 5.780 7.791 927 HA ARG 16 HA ARG 16 15.274 7.585 6.704 928 1HB ARG 16 HB2 ARG 16 14.443 6.349 4.416 929 2HB ARG 16 HB3 ARG 16 15.601 5.723 5.568 930 1HG ARG 16 HG2 ARG 16 14.162 3.941 5.072 931 2HG ARG 16 HG3 ARG 16 13.775 4.425 6.696 932 1HD ARG 16 HD2 ARG 16 11.923 5.916 5.353 933 2HD ARG 16 HD3 ARG 16 12.132 4.614 4.194 934 HE ARG 16 HE ARG 16 10.744 4.553 6.705 935 1HH1 ARG 16 HH11 ARG 16 12.585 2.420 4.464 936 2HH1 ARG 16 HH12 ARG 16 11.730 1.000 5.063 937 1HH2 ARG 16 HH21 ARG 16 9.728 2.518 7.403 938 2HH2 ARG 16 HH22 ARG 16 10.335 1.046 6.660 939 H SER 17 HN SER 17 11.747 7.700 6.314 940 HA SER 17 HA SER 17 11.726 9.680 4.265 941 1HB SER 17 HB2 SER 17 9.462 9.753 6.077 942 2HB SER 17 HB3 SER 17 9.518 9.234 4.386 943 HG SER 17 HG SER 17 9.753 7.154 5.041 944 H GLN 18 HN GLN 18 11.668 9.843 7.837 945 HA GLN 18 HA GLN 18 11.399 12.631 8.189 946 1HB GLN 18 HB2 GLN 18 13.197 10.864 9.871 947 2HB GLN 18 HB3 GLN 18 12.400 12.331 10.335 948 1HG GLN 18 HG2 GLN 18 10.987 9.716 9.723 949 2HG GLN 18 HG3 GLN 18 11.393 10.322 11.316 950 1HE2 GLN 18 HE22 GLN 18 8.693 9.806 9.850 951 2HE2 GLN 18 HE21 GLN 18 7.800 11.283 10.204 952 H MET 19 HN MET 19 14.225 10.538 7.746 953 HA MET 19 HA MET 19 16.155 12.578 8.036 954 1HB MET 19 HB2 MET 19 16.407 10.000 8.190 955 2HB MET 19 HB3 MET 19 16.467 10.010 6.423 956 1HG MET 19 HG2 MET 19 18.345 11.860 6.858 957 2HG MET 19 HG3 MET 19 18.428 11.081 8.430 958 1HE MET 19 HE1 MET 19 18.528 8.354 8.593 959 2HE MET 19 HE2 MET 19 17.694 7.839 7.102 960 3HE MET 19 HE3 MET 19 19.383 7.366 7.384 961 H ALA 20 HN ALA 20 14.634 11.043 5.134 962 HA ALA 20 HA ALA 20 16.070 12.484 3.186 963 1HB ALA 20 HB1 ALA 20 13.287 11.281 3.018 964 2HB ALA 20 HB2 ALA 20 14.292 11.816 1.643 965 3HB ALA 20 HB3 ALA 20 14.808 10.445 2.646 966 H GLU 21 HN GLU 21 13.000 13.342 4.887 967 HA GLU 21 HA GLU 21 12.642 15.566 3.130 968 1HB GLU 21 HB2 GLU 21 10.701 16.073 4.326 969 2HB GLU 21 HB3 GLU 21 10.830 14.313 4.272 970 1HG GLU 21 HG2 GLU 21 11.704 14.341 6.590 971 2HG GLU 21 HG3 GLU 21 11.483 16.095 6.630 972 H GLY 22 HN GLY 22 14.393 15.204 6.205 973 1HA GLY 22 HA2 GLY 22 14.885 18.051 6.528 974 2HA GLY 22 HA3 GLY 22 15.768 16.717 7.273 975 H TRP 23 HN TRP 23 16.710 15.287 5.037 976 HA TRP 23 HA TRP 23 18.926 16.709 4.027 977 1HB TRP 23 HB2 TRP 23 17.425 14.222 3.211 978 2HB TRP 23 HB3 TRP 23 18.525 14.923 2.047 979 HD1 TRP 23 HD1 TRP 23 18.515 12.539 4.777 980 HE1 TRP 23 HE1 TRP 23 20.881 11.878 5.440 981 HE3 TRP 23 HE3 TRP 23 21.067 16.162 2.245 982 HZ2 TRP 23 HZ2 TRP 23 23.588 12.847 4.978 983 HZ3 TRP 23 HZ3 TRP 23 23.554 16.195 2.271 984 HH2 TRP 23 HH2 TRP 23 24.817 14.555 3.634 985 H ALA 24 HN ALA 24 15.664 16.259 2.629 986 HA ALA 24 HA ALA 24 16.178 17.445 0.159 987 1HB ALA 24 HB1 ALA 24 14.083 16.170 0.820 988 2HB ALA 24 HB2 ALA 24 13.567 17.602 1.747 989 3HB ALA 24 HB3 ALA 24 13.763 17.700 -0.000 990 H LYS 25 HN LYS 25 14.961 19.016 3.225 991 HA LYS 25 HA LYS 25 14.536 21.424 1.827 992 1HB LYS 25 HB2 LYS 25 13.931 20.460 4.448 993 2HB LYS 25 HB3 LYS 25 14.854 21.941 4.680 994 1HG LYS 25 HG2 LYS 25 12.536 22.564 4.542 995 2HG LYS 25 HG3 LYS 25 13.312 23.097 3.044 996 1HD LYS 25 HD2 LYS 25 12.467 20.907 1.986 997 2HD LYS 25 HD3 LYS 25 11.622 20.610 3.490 998 1HE LYS 25 HE2 LYS 25 10.095 21.499 1.751 999 2HE LYS 25 HE3 LYS 25 10.182 22.605 3.115 1000 1HZ LYS 25 HZ1 LYS 25 11.943 23.055 0.791 1001 2HZ LYS 25 HZ2 LYS 25 10.371 23.470 0.672 1002 3HZ LYS 25 HZ3 LYS 25 11.324 24.135 1.838 1003 H GLN 26 HN GLN 26 17.533 20.239 3.191 1004 HA GLN 26 HA GLN 26 18.699 22.833 3.318 1005 1HB GLN 26 HB2 GLN 26 20.806 21.877 3.542 1006 2HB GLN 26 HB3 GLN 26 19.699 20.888 4.462 1007 1HG GLN 26 HG2 GLN 26 20.120 19.027 3.247 1008 2HG GLN 26 HG3 GLN 26 20.143 19.861 1.700 1009 1HE2 GLN 26 HE22 GLN 26 22.097 17.947 3.456 1010 2HE2 GLN 26 HE21 GLN 26 23.643 18.665 3.088 1011 H TYR 27 HN TYR 27 17.766 20.993 0.550 1012 HA TYR 27 HA TYR 27 19.231 22.905 -1.192 1013 1HB TYR 27 HB2 TYR 27 19.453 19.986 -1.078 1014 2HB TYR 27 HB3 TYR 27 18.877 20.494 -2.641 1015 HD1 TYR 27 HD1 TYR 27 20.334 21.536 -4.244 1016 HD2 TYR 27 HD2 TYR 27 21.622 21.013 -0.164 1017 HE1 TYR 27 HE1 TYR 27 22.640 22.128 -4.907 1018 HE2 TYR 27 HE2 TYR 27 23.934 21.625 -0.808 1019 HH TYR 27 HH TYR 27 24.840 22.439 -4.193 1020 H LEU 28 HN LEU 28 16.203 21.938 -0.197 1021 HA LEU 28 HA LEU 28 14.885 22.706 -2.734 1022 1HB LEU 28 HB2 LEU 28 13.842 20.827 -0.554 1023 2HB LEU 28 HB3 LEU 28 12.929 21.450 -1.907 1024 HG LEU 28 HG LEU 28 15.121 19.382 -1.933 1025 1HD1 LEU 28 HD11 LEU 28 12.634 18.928 -1.337 1026 2HD1 LEU 28 HD12 LEU 28 12.263 19.332 -3.000 1027 3HD1 LEU 28 HD13 LEU 28 13.322 17.942 -2.631 1028 1HD2 LEU 28 HD21 LEU 28 14.963 19.247 -4.345 1029 2HD2 LEU 28 HD22 LEU 28 13.757 20.547 -4.393 1030 3HD2 LEU 28 HD23 LEU 28 15.425 20.896 -3.920 1031 H GLY 29 HN GLY 29 15.000 24.873 -2.051 1032 1HA GLY 29 HA2 GLY 29 14.183 25.931 0.477 1033 2HA GLY 29 HA3 GLY 29 14.244 26.807 -1.057 1034 H ASP 30 HN ASP 30 12.262 27.767 0.126 1035 HA ASP 30 HA ASP 30 9.799 26.423 0.409 1036 1HB ASP 30 HB2 ASP 30 10.303 28.650 1.321 1037 2HB ASP 30 HB3 ASP 30 10.357 29.321 -0.310 1038 H GLU 31 HN GLU 31 11.451 27.312 -2.449 1039 HA GLU 31 HA GLU 31 9.462 27.453 -4.432 1040 1HB GLU 31 HB2 GLU 31 11.808 28.040 -4.727 1041 2HB GLU 31 HB3 GLU 31 12.315 26.375 -4.422 1042 1HG GLU 31 HG2 GLU 31 11.194 25.616 -6.437 1043 2HG GLU 31 HG3 GLU 31 10.574 27.244 -6.766 1044 H TRP 32 HN TRP 32 10.332 24.733 -2.411 1045 HA TRP 32 HA TRP 32 8.585 22.975 -4.023 1046 1HB TRP 32 HB2 TRP 32 10.962 21.741 -2.727 1047 2HB TRP 32 HB3 TRP 32 10.040 21.192 -4.094 1048 HD1 TRP 32 HD1 TRP 32 12.571 24.025 -3.324 1049 HE1 TRP 32 HE1 TRP 32 14.274 24.190 -5.233 1050 HE3 TRP 32 HE3 TRP 32 10.616 20.490 -6.476 1051 HZ2 TRP 32 HZ2 TRP 32 14.844 22.830 -7.677 1052 HZ3 TRP 32 HZ3 TRP 32 11.806 19.900 -8.567 1053 HH2 TRP 32 HH2 TRP 32 13.936 21.037 -9.172 1054 H LYS 33 HN LYS 33 7.680 21.211 -2.738 1055 HA LYS 33 HA LYS 33 7.991 21.474 0.207 1056 1HB LYS 33 HB2 LYS 33 5.385 21.169 -1.347 1057 2HB LYS 33 HB3 LYS 33 5.533 20.834 0.363 1058 1HG LYS 33 HG2 LYS 33 6.141 23.534 -0.900 1059 2HG LYS 33 HG3 LYS 33 4.614 23.101 -0.127 1060 1HD LYS 33 HD2 LYS 33 7.326 23.333 1.225 1061 2HD LYS 33 HD3 LYS 33 6.011 24.481 1.337 1062 1HE LYS 33 HE2 LYS 33 5.864 21.596 2.325 1063 2HE LYS 33 HE3 LYS 33 6.281 22.986 3.331 1064 1HZ LYS 33 HZ1 LYS 33 4.053 23.906 2.744 1065 2HZ LYS 33 HZ2 LYS 33 3.668 22.459 2.055 1066 3HZ LYS 33 HZ3 LYS 33 4.007 22.549 3.639 1067 H VAL 34 HN VAL 34 8.334 19.627 1.180 1068 HA VAL 34 HA VAL 34 8.130 17.098 -0.323 1069 HB VAL 34 HB VAL 34 10.369 17.915 0.132 1070 1HG1 VAL 34 HG11 VAL 34 9.728 17.823 3.099 1071 2HG1 VAL 34 HG12 VAL 34 11.330 18.069 2.384 1072 3HG1 VAL 34 HG13 VAL 34 10.064 19.271 2.137 1073 1HG2 VAL 34 HG21 VAL 34 9.904 15.457 0.173 1074 2HG2 VAL 34 HG22 VAL 34 11.297 15.925 1.160 1075 3HG2 VAL 34 HG23 VAL 34 9.747 15.535 1.936 1076 H TYR 35 HN TYR 35 7.082 15.395 0.703 1077 HA TYR 35 HA TYR 35 6.098 15.753 3.478 1078 1HB TYR 35 HB2 TYR 35 4.378 14.921 1.117 1079 2HB TYR 35 HB3 TYR 35 3.861 14.963 2.793 1080 HD1 TYR 35 HD1 TYR 35 4.473 16.918 -0.243 1081 HD2 TYR 35 HD2 TYR 35 3.494 17.173 3.950 1082 HE1 TYR 35 HE1 TYR 35 3.675 19.242 -0.571 1083 HE2 TYR 35 HE2 TYR 35 2.712 19.504 3.630 1084 HH TYR 35 HH TYR 35 2.649 21.081 0.396 1085 H SER 36 HN SER 36 5.437 13.641 4.390 1086 HA SER 36 HA SER 36 6.561 11.266 3.009 1087 1HB SER 36 HB2 SER 36 7.132 12.117 5.874 1088 2HB SER 36 HB3 SER 36 7.706 10.647 5.068 1089 HG SER 36 HG SER 36 8.888 12.917 5.286 1090 H ALA 37 HN ALA 37 5.439 9.398 3.482 1091 HA ALA 37 HA ALA 37 3.387 9.343 5.588 1092 1HB ALA 37 HB1 ALA 37 1.635 8.922 3.910 1093 2HB ALA 37 HB2 ALA 37 2.358 10.513 3.648 1094 3HB ALA 37 HB3 ALA 37 2.826 9.142 2.609 1095 H GLY 38 HN GLY 38 2.128 7.132 5.193 1096 1HA GLY 38 HA2 GLY 38 3.197 5.021 3.712 1097 2HA GLY 38 HA3 GLY 38 3.972 4.973 5.302 1098 H ILE 39 HN ILE 39 2.653 2.875 4.931 1099 HA ILE 39 HA ILE 39 0.002 2.497 4.932 1100 HB ILE 39 HB ILE 39 1.413 0.687 4.808 1101 1HG1 ILE 39 HG12 ILE 39 0.220 0.085 7.515 1102 2HG1 ILE 39 HG13 ILE 39 -0.859 0.508 6.191 1103 1HG2 ILE 39 HG21 ILE 39 2.471 1.113 7.624 1104 2HG2 ILE 39 HG22 ILE 39 2.854 -0.233 6.562 1105 3HG2 ILE 39 HG23 ILE 39 3.352 1.399 6.123 1106 1HD1 ILE 39 HD11 ILE 39 1.135 -1.765 5.971 1107 2HD1 ILE 39 HD12 ILE 39 -0.558 -1.943 6.486 1108 3HD1 ILE 39 HD13 ILE 39 -0.203 -1.343 4.869 1109 H GLU 40 HN GLU 40 1.699 2.833 8.077 1110 HA GLU 40 HA GLU 40 -0.835 3.746 9.324 1111 1HB GLU 40 HB2 GLU 40 -0.305 2.398 11.308 1112 2HB GLU 40 HB3 GLU 40 -0.634 1.426 9.884 1113 1HG GLU 40 HG2 GLU 40 1.680 0.814 9.621 1114 2HG GLU 40 HG3 GLU 40 2.216 2.027 10.776 1115 H ALA 41 HN ALA 41 1.264 5.230 8.189 1116 HA ALA 41 HA ALA 41 3.419 5.864 9.898 1117 1HB ALA 41 HB1 ALA 41 3.641 7.737 8.142 1118 2HB ALA 41 HB2 ALA 41 3.560 6.077 7.502 1119 3HB ALA 41 HB3 ALA 41 2.135 7.137 7.459 1120 H HIS 42 HN HIS 42 4.006 7.728 10.864 1121 HA HIS 42 HA HIS 42 3.300 10.097 11.490 1122 1HB HIS 42 HB2 HIS 42 0.919 9.750 11.859 1123 2HB HIS 42 HB3 HIS 42 1.228 8.403 12.963 1124 HD1 HIS 42 HD1 HIS 42 1.520 12.242 12.812 1125 HD2 HIS 42 HD2 HIS 42 1.626 9.012 15.515 1126 HE1 HIS 42 HE1 HIS 42 1.493 13.263 15.156 1127 H GLY 43 HN GLY 43 5.354 10.227 12.379 1128 1HA GLY 43 HA2 GLY 43 6.033 9.031 14.882 1129 2HA GLY 43 HA3 GLY 43 6.626 8.058 13.518 1130 H LEU 44 HN LEU 44 8.529 9.014 15.076 1131 HA LEU 44 HA LEU 44 10.161 10.430 13.225 1132 1HB LEU 44 HB2 LEU 44 9.234 12.464 14.187 1133 2HB LEU 44 HB3 LEU 44 9.467 11.859 15.828 1134 HG LEU 44 HG LEU 44 11.926 11.967 15.554 1135 1HD1 LEU 44 HD11 LEU 44 12.872 13.127 13.541 1136 2HD1 LEU 44 HD12 LEU 44 12.248 11.516 13.199 1137 3HD1 LEU 44 HD13 LEU 44 11.299 12.959 12.747 1138 1HD2 LEU 44 HD21 LEU 44 10.696 13.955 16.363 1139 2HD2 LEU 44 HD22 LEU 44 12.180 14.372 15.494 1140 3HD2 LEU 44 HD23 LEU 44 10.609 14.562 14.696 1141 H ASN 45 HN ASN 45 11.398 8.497 13.365 1142 HA ASN 45 HA ASN 45 12.095 7.297 15.872 1143 1HB ASN 45 HB2 ASN 45 12.028 6.169 13.635 1144 2HB ASN 45 HB3 ASN 45 13.498 7.041 13.183 1145 1HD2 ASN 45 HD22 ASN 45 13.220 4.122 13.280 1146 2HD2 ASN 45 HD21 ASN 45 14.290 3.560 14.530 1147 HA PRO 46 HA PRO 46 15.260 10.351 16.898 1148 1HB PRO 46 HB2 PRO 46 16.595 8.978 18.909 1149 2HB PRO 46 HB3 PRO 46 15.085 9.917 19.116 1150 1HG PRO 46 HG2 PRO 46 15.386 6.937 18.670 1151 2HG PRO 46 HG3 PRO 46 14.357 7.782 19.873 1152 1HD PRO 46 HD2 PRO 46 13.317 6.862 17.567 1153 2HD PRO 46 HD3 PRO 46 12.810 8.454 18.199 1154 H ASN 47 HN ASN 47 15.913 7.034 15.784 1155 HA ASN 47 HA ASN 47 18.722 7.353 15.369 1156 1HB ASN 47 HB2 ASN 47 18.556 5.314 14.496 1157 2HB ASN 47 HB3 ASN 47 16.914 5.282 15.078 1158 1HD2 ASN 47 HD22 ASN 47 18.948 5.195 12.318 1159 2HD2 ASN 47 HD21 ASN 47 17.691 5.318 11.090 1160 H ALA 48 HN ALA 48 15.844 8.370 13.478 1161 HA ALA 48 HA ALA 48 17.382 9.116 11.153 1162 1HB ALA 48 HB1 ALA 48 14.558 9.938 12.031 1163 2HB ALA 48 HB2 ALA 48 15.260 10.157 10.419 1164 3HB ALA 48 HB3 ALA 48 15.012 8.518 11.062 1165 H VAL 49 HN VAL 49 16.195 10.678 14.096 1166 HA VAL 49 HA VAL 49 17.013 13.366 13.461 1167 HB VAL 49 HB VAL 49 16.990 12.095 16.232 1168 1HG1 VAL 49 HG11 VAL 49 16.613 14.414 17.004 1169 2HG1 VAL 49 HG12 VAL 49 18.150 14.268 16.147 1170 3HG1 VAL 49 HG13 VAL 49 16.749 15.001 15.334 1171 1HG2 VAL 49 HG21 VAL 49 14.720 13.586 14.859 1172 2HG2 VAL 49 HG22 VAL 49 14.744 11.835 15.130 1173 3HG2 VAL 49 HG23 VAL 49 14.721 12.942 16.505 1174 H LYS 50 HN LYS 50 18.765 10.677 15.165 1175 HA LYS 50 HA LYS 50 21.243 12.009 15.409 1176 1HB LYS 50 HB2 LYS 50 20.747 9.920 16.568 1177 2HB LYS 50 HB3 LYS 50 20.641 9.041 15.037 1178 1HG LYS 50 HG2 LYS 50 23.022 9.455 14.585 1179 2HG LYS 50 HG3 LYS 50 23.152 10.416 16.074 1180 1HD LYS 50 HD2 LYS 50 22.626 8.396 17.416 1181 2HD LYS 50 HD3 LYS 50 22.376 7.471 15.932 1182 1HE LYS 50 HE2 LYS 50 24.552 6.908 16.754 1183 2HE LYS 50 HE3 LYS 50 24.757 7.863 15.284 1184 1HZ LYS 50 HZ1 LYS 50 25.233 9.793 16.709 1185 2HZ LYS 50 HZ2 LYS 50 25.047 8.883 18.058 1186 3HZ LYS 50 HZ3 LYS 50 26.269 8.571 17.019 1187 H ALA 51 HN ALA 51 20.061 9.955 12.722 1188 HA ALA 51 HA ALA 51 22.287 10.036 11.075 1189 1HB ALA 51 HB1 ALA 51 20.258 8.646 10.747 1190 2HB ALA 51 HB2 ALA 51 19.347 10.087 10.282 1191 3HB ALA 51 HB3 ALA 51 20.705 9.532 9.272 1192 H MET 52 HN MET 52 19.821 12.613 11.584 1193 HA MET 52 HA MET 52 20.809 14.227 9.365 1194 1HB MET 52 HB2 MET 52 18.811 14.721 11.628 1195 2HB MET 52 HB3 MET 52 19.176 15.901 10.381 1196 1HG MET 52 HG2 MET 52 18.364 13.191 9.413 1197 2HG MET 52 HG3 MET 52 17.152 14.147 10.245 1198 1HE MET 52 HE1 MET 52 20.088 15.529 7.820 1199 2HE MET 52 HE2 MET 52 19.562 13.949 7.184 1200 3HE MET 52 HE3 MET 52 19.185 15.440 6.294 1201 H LYS 53 HN LYS 53 21.097 14.143 12.949 1202 HA LYS 53 HA LYS 53 22.529 16.597 13.139 1203 1HB LYS 53 HB2 LYS 53 22.666 14.115 14.920 1204 2HB LYS 53 HB3 LYS 53 23.327 15.684 15.357 1205 1HG LYS 53 HG2 LYS 53 20.377 15.248 14.760 1206 2HG LYS 53 HG3 LYS 53 21.074 15.069 16.363 1207 1HD LYS 53 HD2 LYS 53 21.680 17.414 16.434 1208 2HD LYS 53 HD3 LYS 53 21.201 17.642 14.731 1209 1HE LYS 53 HE2 LYS 53 18.892 17.093 15.223 1210 2HE LYS 53 HE3 LYS 53 19.280 16.645 16.886 1211 1HZ LYS 53 HZ1 LYS 53 18.279 18.897 16.500 1212 2HZ LYS 53 HZ2 LYS 53 19.629 18.881 17.443 1213 3HZ LYS 53 HZ3 LYS 53 19.716 19.387 15.889 1214 H GLU 54 HN GLU 54 23.645 13.320 12.234 1215 HA GLU 54 HA GLU 54 26.415 13.714 12.397 1216 1HB GLU 54 HB2 GLU 54 24.814 12.306 10.223 1217 2HB GLU 54 HB3 GLU 54 26.567 12.284 10.334 1218 1HG GLU 54 HG2 GLU 54 26.364 11.237 12.624 1219 2HG GLU 54 HG3 GLU 54 24.626 11.060 12.310 1220 H VAL 55 HN VAL 55 24.141 15.082 10.037 1221 HA VAL 55 HA VAL 55 26.376 16.537 8.715 1222 HB VAL 55 HB VAL 55 24.874 16.690 6.765 1223 1HG1 VAL 55 HG11 VAL 55 26.593 14.914 6.991 1224 2HG1 VAL 55 HG12 VAL 55 25.376 13.831 7.695 1225 3HG1 VAL 55 HG13 VAL 55 25.209 14.400 6.023 1226 1HG2 VAL 55 HG21 VAL 55 22.671 16.394 7.942 1227 2HG2 VAL 55 HG22 VAL 55 22.881 15.336 6.546 1228 3HG2 VAL 55 HG23 VAL 55 23.064 14.676 8.181 1229 H GLY 56 HN GLY 56 24.634 17.108 11.235 1230 1HA GLY 56 HA2 GLY 56 23.970 18.974 12.312 1231 2HA GLY 56 HA3 GLY 56 24.812 19.901 11.062 1232 H ILE 57 HN ILE 57 21.910 17.742 10.564 1233 HA ILE 57 HA ILE 57 20.325 20.225 9.989 1234 HB ILE 57 HB ILE 57 20.021 17.434 8.840 1235 1HG1 ILE 57 HG12 ILE 57 20.669 20.107 7.510 1236 2HG1 ILE 57 HG13 ILE 57 21.836 18.830 7.833 1237 1HG2 ILE 57 HG21 ILE 57 18.095 18.307 7.547 1238 2HG2 ILE 57 HG22 ILE 57 17.772 18.454 9.259 1239 3HG2 ILE 57 HG23 ILE 57 18.254 19.886 8.323 1240 1HD1 ILE 57 HD11 ILE 57 20.621 17.309 6.295 1241 2HD1 ILE 57 HD12 ILE 57 19.530 18.656 5.868 1242 3HD1 ILE 57 HD13 ILE 57 21.259 18.767 5.526 1243 H ASP 58 HN ASP 58 18.324 20.326 11.085 1244 HA ASP 58 HA ASP 58 18.049 18.428 13.380 1245 1HB ASP 58 HB2 ASP 58 18.654 20.620 14.232 1246 2HB ASP 58 HB3 ASP 58 17.409 21.396 13.241 1247 H ILE 59 HN ILE 59 16.147 17.490 13.612 1248 HA ILE 59 HA ILE 59 13.770 18.449 12.151 1249 HB ILE 59 HB ILE 59 13.200 16.207 11.454 1250 1HG1 ILE 59 HG12 ILE 59 16.069 15.314 12.084 1251 2HG1 ILE 59 HG13 ILE 59 14.707 15.002 13.154 1252 1HG2 ILE 59 HG21 ILE 59 15.947 16.956 10.321 1253 2HG2 ILE 59 HG22 ILE 59 14.642 16.091 9.483 1254 3HG2 ILE 59 HG23 ILE 59 14.432 17.790 9.917 1255 1HD1 ILE 59 HD11 ILE 59 15.075 13.042 11.793 1256 2HD1 ILE 59 HD12 ILE 59 13.534 13.807 11.362 1257 3HD1 ILE 59 HD13 ILE 59 14.939 13.987 10.297 1258 H SER 60 HN SER 60 14.876 18.236 15.079 1259 HA SER 60 HA SER 60 13.583 16.108 16.325 1260 1HB SER 60 HB2 SER 60 14.243 18.827 17.535 1261 2HB SER 60 HB3 SER 60 14.055 17.295 18.407 1262 HG SER 60 HG SER 60 16.088 18.109 16.595 1263 H ASN 61 HN ASN 61 12.065 18.853 14.980 1264 HA ASN 61 HA ASN 61 9.708 18.807 16.711 1265 1HB ASN 61 HB2 ASN 61 10.678 20.958 15.977 1266 2HB ASN 61 HB3 ASN 61 10.456 20.495 14.290 1267 1HD2 ASN 61 HD22 ASN 61 8.578 21.250 13.336 1268 2HD2 ASN 61 HD21 ASN 61 7.148 21.742 14.206 1269 H GLN 62 HN GLN 62 10.752 17.124 13.831 1270 HA GLN 62 HA GLN 62 8.520 17.401 12.211 1271 1HB GLN 62 HB2 GLN 62 10.753 15.402 12.311 1272 2HB GLN 62 HB3 GLN 62 9.338 15.097 11.292 1273 1HG GLN 62 HG2 GLN 62 9.549 17.271 10.204 1274 2HG GLN 62 HG3 GLN 62 10.946 17.667 11.214 1275 1HE2 GLN 62 HE22 GLN 62 10.844 14.304 10.045 1276 2HE2 GLN 62 HE21 GLN 62 12.104 14.582 8.835 1277 H THR 63 HN THR 63 6.888 16.035 11.648 1278 HA THR 63 HA THR 63 6.181 13.668 13.093 1279 HB THR 63 HB THR 63 5.268 15.472 14.592 1280 HG1 THR 63 HG1 THR 63 4.245 13.600 14.741 1281 1HG2 THR 63 HG21 THR 63 3.363 16.093 12.295 1282 2HG2 THR 63 HG22 THR 63 3.287 16.731 13.949 1283 3HG2 THR 63 HG23 THR 63 4.641 17.171 12.901 1284 H SER 64 HN SER 64 3.908 12.933 11.988 1285 HA SER 64 HA SER 64 3.832 13.617 9.132 1286 1HB SER 64 HB2 SER 64 4.782 10.873 10.016 1287 2HB SER 64 HB3 SER 64 4.633 11.480 8.357 1288 HG SER 64 HG SER 64 6.207 13.178 9.282 1289 H ASP 65 HN ASP 65 2.616 11.236 8.199 1290 HA ASP 65 HA ASP 65 0.206 10.703 9.747 1291 1HB ASP 65 HB2 ASP 65 -0.072 13.056 8.778 1292 2HB ASP 65 HB3 ASP 65 0.136 12.336 7.173 1293 H ILE 66 HN ILE 66 -1.331 9.363 8.256 1294 HA ILE 66 HA ILE 66 0.106 7.303 6.884 1295 HB ILE 66 HB ILE 66 -2.207 6.509 6.360 1296 1HG1 ILE 66 HG12 ILE 66 -3.128 8.888 8.013 1297 2HG1 ILE 66 HG13 ILE 66 -3.264 8.786 6.256 1298 1HG2 ILE 66 HG21 ILE 66 -0.951 5.865 8.347 1299 2HG2 ILE 66 HG22 ILE 66 -1.677 7.196 9.274 1300 3HG2 ILE 66 HG23 ILE 66 -2.685 5.861 8.655 1301 1HD1 ILE 66 HD11 ILE 66 -4.632 7.011 8.306 1302 2HD1 ILE 66 HD12 ILE 66 -5.380 8.218 7.251 1303 3HD1 ILE 66 HD13 ILE 66 -4.691 6.739 6.542 1304 H ILE 67 HN ILE 67 -0.693 6.556 4.635 1305 HA ILE 67 HA ILE 67 -0.075 8.348 2.633 1306 HB ILE 67 HB ILE 67 -0.629 6.784 1.103 1307 1HG1 ILE 67 HG12 ILE 67 -2.959 5.745 2.748 1308 2HG1 ILE 67 HG13 ILE 67 -3.053 6.831 1.359 1309 1HG2 ILE 67 HG21 ILE 67 -0.037 4.591 1.844 1310 2HG2 ILE 67 HG22 ILE 67 0.861 5.760 2.807 1311 3HG2 ILE 67 HG23 ILE 67 -0.558 4.928 3.500 1312 1HD1 ILE 67 HD11 ILE 67 -3.641 4.855 0.393 1313 2HD1 ILE 67 HD12 ILE 67 -1.939 4.929 -0.012 1314 3HD1 ILE 67 HD13 ILE 67 -2.454 3.886 1.325 1315 H ASP 68 HN ASP 68 -1.116 9.967 1.587 1316 HA ASP 68 HA ASP 68 -4.041 10.329 1.940 1317 1HB ASP 68 HB2 ASP 68 -2.951 11.566 3.780 1318 2HB ASP 68 HB3 ASP 68 -2.057 12.524 2.597 1319 H SER 69 HN SER 69 -4.488 9.948 -0.073 1320 HA SER 69 HA SER 69 -3.400 10.553 -2.440 1321 1HB SER 69 HB2 SER 69 -6.324 10.934 -1.752 1322 2HB SER 69 HB3 SER 69 -5.640 10.322 -3.275 1323 HG SER 69 HG SER 69 -6.527 8.812 -1.487 1324 H ASP 70 HN ASP 70 -4.887 12.982 -0.277 1325 HA ASP 70 HA ASP 70 -5.551 14.891 -2.315 1326 1HB ASP 70 HB2 ASP 70 -6.496 14.838 0.014 1327 2HB ASP 70 HB3 ASP 70 -4.914 15.377 0.610 1328 H ILE 71 HN ILE 71 -2.537 13.985 -0.920 1329 HA ILE 71 HA ILE 71 -1.236 16.366 -2.167 1330 HB ILE 71 HB ILE 71 -0.162 14.875 0.187 1331 1HG1 ILE 71 HG12 ILE 71 -0.940 17.396 1.211 1332 2HG1 ILE 71 HG13 ILE 71 -2.332 16.902 0.256 1333 1HG2 ILE 71 HG21 ILE 71 1.489 16.180 -1.061 1334 2HG2 ILE 71 HG22 ILE 71 0.507 17.648 -0.834 1335 3HG2 ILE 71 HG23 ILE 71 1.219 16.815 0.572 1336 1HD1 ILE 71 HD11 ILE 71 -2.335 14.712 1.440 1337 2HD1 ILE 71 HD12 ILE 71 -0.917 15.264 2.381 1338 3HD1 ILE 71 HD13 ILE 71 -2.488 16.087 2.565 1339 H LEU 72 HN LEU 72 -1.066 12.816 -1.390 1340 HA LEU 72 HA LEU 72 1.338 12.345 -2.813 1341 1HB LEU 72 HB2 LEU 72 0.356 10.699 -1.321 1342 2HB LEU 72 HB3 LEU 72 -1.056 10.519 -2.328 1343 HG LEU 72 HG LEU 72 0.804 8.763 -2.381 1344 1HD1 LEU 72 HD11 LEU 72 -1.096 8.869 -4.073 1345 2HD1 LEU 72 HD12 LEU 72 0.024 9.702 -5.172 1346 3HD1 LEU 72 HD13 LEU 72 0.388 8.073 -4.626 1347 1HD2 LEU 72 HD21 LEU 72 2.643 8.906 -3.781 1348 2HD2 LEU 72 HD22 LEU 72 2.172 10.493 -4.426 1349 3HD2 LEU 72 HD23 LEU 72 2.701 10.332 -2.753 1350 H ASN 73 HN ASN 73 -2.106 11.965 -3.971 1351 HA ASN 73 HA ASN 73 -1.225 11.327 -6.586 1352 1HB ASN 73 HB2 ASN 73 -3.347 10.879 -7.012 1353 2HB ASN 73 HB3 ASN 73 -3.694 11.228 -5.334 1354 1HD2 ASN 73 HD22 ASN 73 -4.359 13.564 -4.843 1355 2HD2 ASN 73 HD21 ASN 73 -5.246 14.433 -6.083 1356 H ASN 74 HN ASN 74 -1.554 14.277 -4.863 1357 HA ASN 74 HA ASN 74 -1.758 16.154 -7.027 1358 1HB ASN 74 HB2 ASN 74 -2.235 16.135 -4.297 1359 2HB ASN 74 HB3 ASN 74 -0.761 17.083 -4.378 1360 1HD2 ASN 74 HD22 ASN 74 -3.681 17.682 -3.747 1361 2HD2 ASN 74 HD21 ASN 74 -4.076 19.054 -4.774 1362 H ALA 75 HN ALA 75 0.899 14.586 -5.305 1363 HA ALA 75 HA ALA 75 2.956 16.407 -5.761 1364 1HB ALA 75 HB1 ALA 75 4.448 14.555 -5.285 1365 2HB ALA 75 HB2 ALA 75 3.029 14.415 -4.239 1366 3HB ALA 75 HB3 ALA 75 3.199 13.354 -5.660 1367 H ASP 76 HN ASP 76 4.846 16.057 -7.149 1368 HA ASP 76 HA ASP 76 4.117 15.349 -9.954 1369 1HB ASP 76 HB2 ASP 76 5.289 17.479 -9.528 1370 2HB ASP 76 HB3 ASP 76 6.634 16.597 -8.796 1371 H LEU 77 HN LEU 77 6.064 14.170 -7.203 1372 HA LEU 77 HA LEU 77 6.793 11.788 -8.707 1373 1HB LEU 77 HB2 LEU 77 8.508 13.389 -9.268 1374 2HB LEU 77 HB3 LEU 77 8.792 13.793 -7.596 1375 HG LEU 77 HG LEU 77 10.449 12.324 -8.936 1376 1HD1 LEU 77 HD11 LEU 77 11.121 11.052 -6.926 1377 2HD1 LEU 77 HD12 LEU 77 10.848 12.777 -6.661 1378 3HD1 LEU 77 HD13 LEU 77 9.637 11.590 -6.116 1379 1HD2 LEU 77 HD21 LEU 77 10.240 10.051 -9.110 1380 2HD2 LEU 77 HD22 LEU 77 8.953 9.924 -7.929 1381 3HD2 LEU 77 HD23 LEU 77 8.597 10.600 -9.529 1382 H VAL 78 HN VAL 78 6.849 10.040 -7.488 1383 HA VAL 78 HA VAL 78 6.615 10.149 -4.520 1384 HB VAL 78 HB VAL 78 5.854 7.881 -6.344 1385 1HG1 VAL 78 HG11 VAL 78 4.515 7.221 -4.384 1386 2HG1 VAL 78 HG12 VAL 78 6.222 7.344 -3.952 1387 3HG1 VAL 78 HG13 VAL 78 5.098 8.638 -3.482 1388 1HG2 VAL 78 HG21 VAL 78 3.468 8.709 -5.941 1389 2HG2 VAL 78 HG22 VAL 78 4.199 10.292 -5.516 1390 3HG2 VAL 78 HG23 VAL 78 4.437 9.563 -7.119 1391 H VAL 79 HN VAL 79 8.525 9.963 -3.588 1392 HA VAL 79 HA VAL 79 10.580 8.198 -4.785 1393 HB VAL 79 HB VAL 79 10.715 9.630 -2.110 1394 1HG1 VAL 79 HG11 VAL 79 12.801 8.369 -3.913 1395 2HG1 VAL 79 HG12 VAL 79 13.150 9.274 -2.417 1396 3HG1 VAL 79 HG13 VAL 79 12.255 7.752 -2.345 1397 1HG2 VAL 79 HG21 VAL 79 10.489 11.358 -3.850 1398 2HG2 VAL 79 HG22 VAL 79 12.139 11.308 -3.222 1399 3HG2 VAL 79 HG23 VAL 79 11.781 10.570 -4.792 1400 H THR 80 HN THR 80 10.009 6.050 -4.527 1401 HA THR 80 HA THR 80 8.721 5.216 -2.006 1402 HB THR 80 HB THR 80 10.158 3.536 -4.096 1403 HG1 THR 80 HG1 THR 80 8.128 4.912 -4.580 1404 1HG2 THR 80 HG21 THR 80 9.810 2.362 -1.960 1405 2HG2 THR 80 HG22 THR 80 8.083 2.788 -1.989 1406 3HG2 THR 80 HG23 THR 80 8.758 1.690 -3.219 1407 H LEU 81 HN LEU 81 9.943 4.999 -0.127 1408 HA LEU 81 HA LEU 81 12.914 5.117 -0.455 1409 1HB LEU 81 HB2 LEU 81 11.119 5.853 1.857 1410 2HB LEU 81 HB3 LEU 81 12.851 5.592 2.048 1411 HG LEU 81 HG LEU 81 11.609 7.636 0.151 1412 1HD1 LEU 81 HD11 LEU 81 12.949 8.059 2.851 1413 2HD1 LEU 81 HD12 LEU 81 12.251 9.307 1.792 1414 3HD1 LEU 81 HD13 LEU 81 11.195 8.108 2.560 1415 1HD2 LEU 81 HD21 LEU 81 13.874 7.022 -0.609 1416 2HD2 LEU 81 HD22 LEU 81 13.918 8.617 0.134 1417 3HD2 LEU 81 HD23 LEU 81 14.507 7.209 1.041 1418 H SER 82 HN SER 82 14.034 3.499 -0.090 1419 HA SER 82 HA SER 82 14.951 1.615 0.754 1420 1HB SER 82 HB2 SER 82 12.493 1.196 2.451 1421 2HB SER 82 HB3 SER 82 14.063 0.413 2.629 1422 HG SER 82 HG SER 82 14.975 2.356 3.136 1423 H GLY 83 HN GLY 83 11.772 1.624 -0.664 1424 1HA GLY 83 HA2 GLY 83 10.686 0.147 -2.090 1425 2HA GLY 83 HA3 GLY 83 12.122 -0.911 -2.092 1426 H ASP 84 HN ASP 84 10.442 0.457 0.752 1427 HA ASP 84 HA ASP 84 10.822 -1.902 2.182 1428 1HB ASP 84 HB2 ASP 84 10.592 0.498 3.031 1429 2HB ASP 84 HB3 ASP 84 8.851 0.255 2.990 1430 H ALA 85 HN ALA 85 9.708 -3.777 2.177 1431 HA ALA 85 HA ALA 85 7.356 -4.114 0.587 1432 1HB ALA 85 HB1 ALA 85 8.673 -6.001 2.592 1433 2HB ALA 85 HB2 ALA 85 7.493 -6.454 1.345 1434 3HB ALA 85 HB3 ALA 85 9.092 -5.855 0.866 1435 H ALA 86 HN ALA 86 7.729 -3.214 3.963 1436 HA ALA 86 HA ALA 86 5.177 -4.433 4.761 1437 1HB ALA 86 HB1 ALA 86 6.910 -4.550 6.387 1438 2HB ALA 86 HB2 ALA 86 7.302 -2.845 6.242 1439 3HB ALA 86 HB3 ALA 86 5.760 -3.332 6.979 1440 H ASP 87 HN ASP 87 5.999 -1.535 3.170 1441 HA ASP 87 HA ASP 87 4.288 0.327 4.524 1442 1HB ASP 87 HB2 ASP 87 6.361 0.864 3.233 1443 2HB ASP 87 HB3 ASP 87 5.480 0.543 1.751 1444 H LYS 88 HN LYS 88 2.609 -1.916 3.829 1445 HA LYS 88 HA LYS 88 0.708 -2.544 2.712 1446 1HB LYS 88 HB2 LYS 88 0.127 0.030 3.234 1447 2HB LYS 88 HB3 LYS 88 0.281 0.214 1.511 1448 1HG LYS 88 HG2 LYS 88 -1.455 -1.448 1.133 1449 2HG LYS 88 HG3 LYS 88 -1.542 -1.846 2.842 1450 1HD LYS 88 HD2 LYS 88 -2.115 0.966 1.787 1451 2HD LYS 88 HD3 LYS 88 -3.324 -0.311 1.800 1452 1HE LYS 88 HE2 LYS 88 -1.943 0.885 4.253 1453 2HE LYS 88 HE3 LYS 88 -3.589 1.217 3.704 1454 1HZ LYS 88 HZ1 LYS 88 -3.477 -0.401 5.529 1455 2HZ LYS 88 HZ2 LYS 88 -4.249 -1.000 4.242 1456 3HZ LYS 88 HZ3 LYS 88 -2.716 -1.483 4.572 1457 H CYS 89 HN CYS 89 -0.047 -1.436 -0.004 1458 HA CYS 89 HA CYS 89 2.350 -1.821 -1.670 1459 1HB CYS 89 HB2 CYS 89 0.535 -3.200 -3.173 1460 2HB CYS 89 HB3 CYS 89 1.760 -3.927 -2.190 1461 HA PRO 90 HA PRO 90 -0.487 1.736 -2.541 1462 1HB PRO 90 HB2 PRO 90 2.075 3.183 -3.012 1463 2HB PRO 90 HB3 PRO 90 0.611 3.707 -2.129 1464 1HG PRO 90 HG2 PRO 90 2.884 2.939 -0.782 1465 2HG PRO 90 HG3 PRO 90 1.253 2.510 -0.175 1466 1HD PRO 90 HD2 PRO 90 3.142 0.815 -1.864 1467 2HD PRO 90 HD3 PRO 90 2.289 0.361 -0.370 1468 H MET 91 HN MET 91 -1.232 1.865 -4.649 1469 HA MET 91 HA MET 91 0.494 0.624 -6.680 1470 1HB MET 91 HB2 MET 91 -1.557 0.576 -8.048 1471 2HB MET 91 HB3 MET 91 -1.600 -0.323 -6.528 1472 1HG MET 91 HG2 MET 91 -3.663 0.732 -6.805 1473 2HG MET 91 HG3 MET 91 -2.846 1.519 -5.479 1474 1HE MET 91 HE1 MET 91 -5.216 4.008 -7.206 1475 2HE MET 91 HE2 MET 91 -5.293 2.206 -7.290 1476 3HE MET 91 HE3 MET 91 -4.735 2.958 -5.789 1477 H THR 92 HN THR 92 0.467 3.638 -5.675 1478 HA THR 92 HA THR 92 0.710 5.717 -6.474 1479 HB THR 92 HB THR 92 2.705 5.882 -8.045 1480 HG1 THR 92 HG1 THR 92 2.477 3.755 -8.898 1481 1HG2 THR 92 HG21 THR 92 2.770 6.083 -5.575 1482 2HG2 THR 92 HG22 THR 92 2.920 4.325 -5.427 1483 3HG2 THR 92 HG23 THR 92 4.214 5.284 -6.194 1484 HA PRO 93 HA PRO 93 -2.267 5.480 -9.869 1485 1HB PRO 93 HB2 PRO 93 -3.535 7.886 -9.476 1486 2HB PRO 93 HB3 PRO 93 -3.839 6.466 -8.420 1487 1HG PRO 93 HG2 PRO 93 -1.930 8.755 -7.888 1488 2HG PRO 93 HG3 PRO 93 -3.191 8.063 -6.813 1489 1HD PRO 93 HD2 PRO 93 -0.617 7.290 -6.630 1490 2HD PRO 93 HD3 PRO 93 -1.925 6.078 -6.459 1491 HA PRO 94 HA PRO 94 0.590 7.159 -12.712 1492 1HB PRO 94 HB2 PRO 94 -0.881 7.384 -15.073 1493 2HB PRO 94 HB3 PRO 94 -0.284 5.859 -14.357 1494 1HG PRO 94 HG2 PRO 94 -3.017 7.138 -14.005 1495 2HG PRO 94 HG3 PRO 94 -2.636 5.438 -14.449 1496 1HD PRO 94 HD2 PRO 94 -3.189 6.052 -11.900 1497 2HD PRO 94 HD3 PRO 94 -1.802 4.964 -12.275 1498 H HIS 95 HN HIS 95 -1.735 9.226 -11.548 1499 HA HIS 95 HA HIS 95 -1.330 11.593 -13.104 1500 1HB HIS 95 HB2 HIS 95 -1.859 11.415 -10.117 1501 2HB HIS 95 HB3 HIS 95 -2.298 12.721 -11.210 1502 HD1 HIS 95 HD1 HIS 95 -3.906 11.043 -13.430 1503 HD2 HIS 95 HD2 HIS 95 -4.137 10.524 -9.260 1504 HE1 HIS 95 HE1 HIS 95 -6.115 9.863 -12.971 1505 H VAL 96 HN VAL 96 0.833 9.738 -11.141 1506 HA VAL 96 HA VAL 96 2.712 12.014 -10.814 1507 HB VAL 96 HB VAL 96 2.481 9.792 -8.766 1508 1HG1 VAL 96 HG11 VAL 96 4.380 11.320 -8.611 1509 2HG1 VAL 96 HG12 VAL 96 3.308 12.715 -8.702 1510 3HG1 VAL 96 HG13 VAL 96 3.271 11.669 -7.277 1511 1HG2 VAL 96 HG21 VAL 96 0.731 12.277 -8.685 1512 2HG2 VAL 96 HG22 VAL 96 0.167 10.584 -8.794 1513 3HG2 VAL 96 HG23 VAL 96 1.002 11.131 -7.352 1514 H LYS 97 HN LYS 97 4.966 11.400 -10.891 1515 HA LYS 97 HA LYS 97 5.588 8.845 -12.249 1516 1HB LYS 97 HB2 LYS 97 6.460 11.126 -12.925 1517 2HB LYS 97 HB3 LYS 97 7.368 11.187 -11.427 1518 1HG LYS 97 HG2 LYS 97 7.738 8.771 -13.194 1519 2HG LYS 97 HG3 LYS 97 8.303 10.303 -13.833 1520 1HD LYS 97 HD2 LYS 97 9.159 9.155 -11.176 1521 2HD LYS 97 HD3 LYS 97 10.059 8.964 -12.673 1522 1HE LYS 97 HE2 LYS 97 9.514 11.604 -11.221 1523 2HE LYS 97 HE3 LYS 97 11.065 10.772 -11.327 1524 1HZ LYS 97 HZ1 LYS 97 11.102 11.193 -13.698 1525 2HZ LYS 97 HZ2 LYS 97 9.614 11.878 -13.669 1526 3HZ LYS 97 HZ3 LYS 97 10.847 12.616 -12.906 1527 H ARG 98 HN ARG 98 7.199 7.376 -11.192 1528 HA ARG 98 HA ARG 98 7.686 7.864 -8.320 1529 1HB ARG 98 HB2 ARG 98 5.632 6.426 -8.407 1530 2HB ARG 98 HB3 ARG 98 6.509 5.269 -9.398 1531 1HG ARG 98 HG2 ARG 98 8.150 5.545 -7.098 1532 2HG ARG 98 HG3 ARG 98 6.546 5.672 -6.447 1533 1HD ARG 98 HD2 ARG 98 7.393 3.449 -8.378 1534 2HD ARG 98 HD3 ARG 98 7.716 3.337 -6.668 1535 HE ARG 98 HE ARG 98 4.993 3.482 -7.899 1536 1HH1 ARG 98 HH21 ARG 98 6.880 2.721 -4.966 1537 2HH1 ARG 98 HH22 ARG 98 5.711 1.582 -4.386 1538 1HH2 ARG 98 HH11 ARG 98 3.441 2.274 -7.033 1539 2HH2 ARG 98 HH12 ARG 98 3.581 1.412 -5.542 1540 H GLU 99 HN GLU 99 9.654 7.006 -7.638 1541 HA GLU 99 HA GLU 99 10.995 4.972 -9.194 1542 1HB GLU 99 HB2 GLU 99 11.710 7.109 -10.318 1543 2HB GLU 99 HB3 GLU 99 12.364 7.670 -8.776 1544 1HG GLU 99 HG2 GLU 99 13.958 5.788 -8.753 1545 2HG GLU 99 HG3 GLU 99 13.201 5.089 -10.188 1546 H HIS 100 HN HIS 100 12.488 3.867 -7.784 1547 HA HIS 100 HA HIS 100 12.206 4.518 -4.923 1548 1HB HIS 100 HB2 HIS 100 13.558 2.158 -6.329 1549 2HB HIS 100 HB3 HIS 100 13.411 2.352 -4.591 1550 HD1 HIS 100 HD1 HIS 100 10.306 2.837 -6.861 1551 HD2 HIS 100 HD2 HIS 100 12.159 0.057 -4.314 1552 HE1 HIS 100 HE1 HIS 100 8.611 0.971 -6.483 1553 H TRP 101 HN TRP 101 13.826 5.468 -3.758 1554 HA TRP 101 HA TRP 101 16.491 5.807 -5.096 1555 1HB TRP 101 HB2 TRP 101 15.032 7.738 -3.275 1556 2HB TRP 101 HB3 TRP 101 16.663 7.955 -3.854 1557 HD1 TRP 101 HD1 TRP 101 15.349 6.758 -6.879 1558 HE1 TRP 101 HE1 TRP 101 14.322 8.452 -8.384 1559 HE3 TRP 101 HE3 TRP 101 15.120 10.634 -3.557 1560 HZ2 TRP 101 HZ2 TRP 101 13.444 11.256 -8.206 1561 HZ3 TRP 101 HZ3 TRP 101 14.266 12.850 -4.296 1562 HH2 TRP 101 HH2 TRP 101 13.392 13.151 -6.600 1563 H GLY 102 HN GLY 102 15.435 3.705 -3.086 1564 1HA GLY 102 HA2 GLY 102 17.997 3.398 -1.892 1565 2HA GLY 102 HA3 GLY 102 16.789 3.782 -0.648 1566 H PHE 103 HN PHE 103 18.103 1.294 -0.777 1567 HA PHE 103 HA PHE 103 15.853 -0.554 -1.338 1568 1HB PHE 103 HB2 PHE 103 17.598 -0.440 -3.205 1569 2HB PHE 103 HB3 PHE 103 18.739 -1.141 -2.067 1570 HD1 PHE 103 HD1 PHE 103 15.263 -1.705 -3.444 1571 HD2 PHE 103 HD2 PHE 103 18.951 -3.513 -2.111 1572 HE1 PHE 103 HE1 PHE 103 14.412 -3.939 -4.109 1573 HE2 PHE 103 HE2 PHE 103 18.095 -5.743 -2.784 1574 HZ PHE 103 HZ PHE 103 15.825 -5.962 -3.780 1575 H ASP 104 HN ASP 104 17.100 0.793 1.112 1576 HA ASP 104 HA ASP 104 17.365 -1.544 2.840 1577 1HB ASP 104 HB2 ASP 104 19.700 -1.110 2.093 1578 2HB ASP 104 HB3 ASP 104 19.536 0.586 2.562 1579 H ASP 105 HN ASP 105 17.246 -0.746 5.144 1580 HA ASP 105 HA ASP 105 15.831 1.852 5.400 1581 1HB ASP 105 HB2 ASP 105 14.036 0.365 5.092 1582 2HB ASP 105 HB3 ASP 105 14.747 -0.858 6.111 1583 HA PRO 106 HA PRO 106 18.994 1.670 8.515 1584 1HB PRO 106 HB2 PRO 106 18.588 4.094 9.744 1585 2HB PRO 106 HB3 PRO 106 19.351 3.894 8.139 1586 1HG PRO 106 HG2 PRO 106 16.478 4.606 8.785 1587 2HG PRO 106 HG3 PRO 106 17.558 5.354 7.568 1588 1HD PRO 106 HD2 PRO 106 15.708 3.416 6.948 1589 2HD PRO 106 HD3 PRO 106 17.233 3.515 6.063 1590 H ALA 107 HN ALA 107 15.539 2.121 9.412 1591 HA ALA 107 HA ALA 107 15.893 1.696 12.201 1592 1HB ALA 107 HB1 ALA 107 13.487 1.130 10.418 1593 2HB ALA 107 HB2 ALA 107 13.470 1.295 12.184 1594 3HB ALA 107 HB3 ALA 107 13.864 2.697 11.173 1595 H ARG 108 HN ARG 108 16.640 -0.400 9.703 1596 HA ARG 108 HA ARG 108 15.777 -2.878 11.139 1597 1HB ARG 108 HB2 ARG 108 17.032 -2.693 8.392 1598 2HB ARG 108 HB3 ARG 108 16.184 -4.062 9.092 1599 1HG ARG 108 HG2 ARG 108 14.930 -1.416 8.273 1600 2HG ARG 108 HG3 ARG 108 14.885 -2.910 7.337 1601 1HD ARG 108 HD2 ARG 108 13.569 -3.993 9.167 1602 2HD ARG 108 HD3 ARG 108 13.578 -2.441 10.045 1603 HE ARG 108 HE ARG 108 12.503 -1.475 7.976 1604 1HH1 ARG 108 HH21 ARG 108 11.803 -4.816 9.010 1605 2HH1 ARG 108 HH22 ARG 108 10.364 -4.936 8.069 1606 1HH2 ARG 108 HH11 ARG 108 10.718 -1.702 6.609 1607 2HH2 ARG 108 HH12 ARG 108 9.759 -3.104 6.628 1608 H ALA 109 HN ALA 109 18.314 -0.846 11.358 1609 HA ALA 109 HA ALA 109 20.649 -2.157 10.915 1610 1HB ALA 109 HB1 ALA 109 20.443 0.128 11.895 1611 2HB ALA 109 HB2 ALA 109 19.943 -0.594 13.440 1612 3HB ALA 109 HB3 ALA 109 21.571 -0.902 12.803 1613 H GLN 110 HN GLN 110 21.931 -3.630 11.953 1614 HA GLN 110 HA GLN 110 20.682 -5.897 12.951 1615 1HB GLN 110 HB2 GLN 110 22.903 -6.001 11.949 1616 2HB GLN 110 HB3 GLN 110 23.574 -5.000 13.242 1617 1HG GLN 110 HG2 GLN 110 24.230 -7.326 13.502 1618 2HG GLN 110 HG3 GLN 110 23.313 -6.746 14.877 1619 1HE2 GLN 110 HE22 GLN 110 21.068 -7.511 15.166 1620 2HE2 GLN 110 HE21 GLN 110 20.608 -9.052 14.463 1621 H GLY 111 HN GLY 111 22.320 -3.300 14.781 1622 1HA GLY 111 HA2 GLY 111 20.814 -2.690 16.667 1623 2HA GLY 111 HA3 GLY 111 21.030 -4.394 17.212 1624 H THR 112 HN THR 112 23.940 -3.955 16.224 1625 HA THR 112 HA THR 112 25.021 -3.300 18.855 1626 HB THR 112 HB THR 112 27.193 -3.658 17.837 1627 HG1 THR 112 HG1 THR 112 27.284 -4.131 15.592 1628 1HG2 THR 112 HG21 THR 112 25.326 -5.684 16.565 1629 2HG2 THR 112 HG22 THR 112 27.000 -5.925 17.114 1630 3HG2 THR 112 HG23 THR 112 25.707 -5.660 18.314 1631 H GLU 113 HN GLU 113 26.589 -1.465 19.080 1632 HA GLU 113 HA GLU 113 25.285 0.889 18.312 1633 1HB GLU 113 HB2 GLU 113 28.183 0.371 19.197 1634 2HB GLU 113 HB3 GLU 113 27.431 1.986 19.206 1635 1HG GLU 113 HG2 GLU 113 25.685 1.118 20.792 1636 2HG GLU 113 HG3 GLU 113 26.550 -0.420 20.861 1637 H GLU 114 HN GLU 114 28.019 -0.837 16.916 1638 HA GLU 114 HA GLU 114 28.793 1.162 15.021 1639 1HB GLU 114 HB2 GLU 114 29.965 -0.879 13.972 1640 2HB GLU 114 HB3 GLU 114 30.522 -0.317 15.565 1641 1HG GLU 114 HG2 GLU 114 29.118 -2.138 16.603 1642 2HG GLU 114 HG3 GLU 114 28.748 -2.680 14.938 1643 H GLU 115 HN GLU 115 26.534 -1.766 14.973 1644 HA GLU 115 HA GLU 115 26.309 -1.454 12.114 1645 1HB GLU 115 HB2 GLU 115 24.787 -3.110 14.112 1646 2HB GLU 115 HB3 GLU 115 24.433 -3.092 12.381 1647 1HG GLU 115 HG2 GLU 115 27.288 -3.600 13.317 1648 2HG GLU 115 HG3 GLU 115 26.095 -4.901 13.341 1649 H LYS 116 HN LYS 116 24.525 -0.263 14.957 1650 HA LYS 116 HA LYS 116 22.377 0.980 13.555 1651 1HB LYS 116 HB2 LYS 116 23.864 1.638 16.146 1652 2HB LYS 116 HB3 LYS 116 22.634 2.711 15.501 1653 1HG LYS 116 HG2 LYS 116 21.062 0.693 15.449 1654 2HG LYS 116 HG3 LYS 116 22.282 -0.150 16.435 1655 1HD LYS 116 HD2 LYS 116 21.977 1.269 18.277 1656 2HD LYS 116 HD3 LYS 116 21.240 2.561 17.308 1657 1HE LYS 116 HE2 LYS 116 19.247 1.234 16.899 1658 2HE LYS 116 HE3 LYS 116 19.945 -0.157 17.747 1659 1HZ LYS 116 HZ1 LYS 116 18.419 1.071 19.161 1660 2HZ LYS 116 HZ2 LYS 116 19.918 1.155 19.790 1661 3HZ LYS 116 HZ3 LYS 116 19.281 2.443 19.010 1662 H TRP 117 HN TRP 117 25.469 2.467 14.594 1663 HA TRP 117 HA TRP 117 24.935 4.832 13.154 1664 1HB TRP 117 HB2 TRP 117 26.743 4.290 14.969 1665 2HB TRP 117 HB3 TRP 117 27.773 3.863 13.607 1666 HD1 TRP 117 HD1 TRP 117 26.957 6.298 11.678 1667 HE1 TRP 117 HE1 TRP 117 27.559 8.682 12.210 1668 HE3 TRP 117 HE3 TRP 117 27.882 5.747 16.695 1669 HZ2 TRP 117 HZ2 TRP 117 28.344 10.192 14.518 1670 HZ3 TRP 117 HZ3 TRP 117 28.623 7.701 18.033 1671 HH2 TRP 117 HH2 TRP 117 28.857 9.942 16.965 1672 H ALA 118 HN ALA 118 26.576 1.821 12.113 1673 HA ALA 118 HA ALA 118 27.419 2.769 9.603 1674 1HB ALA 118 HB1 ALA 118 28.261 0.678 10.705 1675 2HB ALA 118 HB2 ALA 118 26.664 -0.043 10.568 1676 3HB ALA 118 HB3 ALA 118 27.604 0.296 9.093 1677 H PHE 119 HN PHE 119 24.292 1.218 10.500 1678 HA PHE 119 HA PHE 119 23.354 1.125 7.779 1679 1HB PHE 119 HB2 PHE 119 22.122 0.827 10.501 1680 2HB PHE 119 HB3 PHE 119 21.054 1.254 9.191 1681 HD1 PHE 119 HD1 PHE 119 19.916 -0.475 8.154 1682 HD2 PHE 119 HD2 PHE 119 23.877 -1.237 9.697 1683 HE1 PHE 119 HE1 PHE 119 19.734 -2.838 7.471 1684 HE2 PHE 119 HE2 PHE 119 23.668 -3.616 9.042 1685 HZ PHE 119 HZ PHE 119 21.601 -4.423 7.917 1686 H PHE 120 HN PHE 120 22.992 3.496 10.462 1687 HA PHE 120 HA PHE 120 21.216 5.212 9.045 1688 1HB PHE 120 HB2 PHE 120 23.206 6.093 11.153 1689 2HB PHE 120 HB3 PHE 120 21.676 6.841 10.742 1690 HD1 PHE 120 HD1 PHE 120 22.388 6.447 13.483 1691 HD2 PHE 120 HD2 PHE 120 20.493 3.613 10.829 1692 HE1 PHE 120 HE1 PHE 120 21.473 5.207 15.428 1693 HE2 PHE 120 HE2 PHE 120 19.600 2.395 12.765 1694 HZ PHE 120 HZ PHE 120 20.092 3.170 15.071 1695 H GLN 121 HN GLN 121 24.802 5.210 9.363 1696 HA GLN 121 HA GLN 121 25.228 7.588 7.927 1697 1HB GLN 121 HB2 GLN 121 26.798 6.602 9.470 1698 2HB GLN 121 HB3 GLN 121 27.058 5.208 8.402 1699 1HG GLN 121 HG2 GLN 121 28.055 6.574 6.707 1700 2HG GLN 121 HG3 GLN 121 27.529 8.073 7.510 1701 1HE2 GLN 121 HE22 GLN 121 28.301 8.291 9.952 1702 2HE2 GLN 121 HE21 GLN 121 29.991 7.903 10.192 1703 H ARG 122 HN ARG 122 25.169 4.141 6.875 1704 HA ARG 122 HA ARG 122 25.990 4.579 4.233 1705 1HB ARG 122 HB2 ARG 122 25.803 2.343 5.281 1706 2HB ARG 122 HB3 ARG 122 24.073 2.557 5.516 1707 1HG ARG 122 HG2 ARG 122 23.959 2.617 2.881 1708 2HG ARG 122 HG3 ARG 122 25.558 1.872 2.978 1709 1HD ARG 122 HD2 ARG 122 22.954 0.880 4.216 1710 2HD ARG 122 HD3 ARG 122 23.773 0.170 2.823 1711 HE ARG 122 HE ARG 122 25.714 -0.207 4.479 1712 1HH1 ARG 122 HH11 ARG 122 22.241 -0.588 5.359 1713 2HH1 ARG 122 HH12 ARG 122 22.596 -1.584 6.721 1714 1HH2 ARG 122 HH21 ARG 122 26.111 -1.590 6.250 1715 2HH2 ARG 122 HH22 ARG 122 24.809 -2.223 7.182 1716 H VAL 123 HN VAL 123 22.675 4.423 5.648 1717 HA VAL 123 HA VAL 123 21.332 4.932 3.201 1718 HB VAL 123 HB VAL 123 20.489 5.153 6.114 1719 1HG1 VAL 123 HG11 VAL 123 19.038 6.647 4.860 1720 2HG1 VAL 123 HG12 VAL 123 18.775 5.413 3.603 1721 3HG1 VAL 123 HG13 VAL 123 18.140 5.193 5.242 1722 1HG2 VAL 123 HG21 VAL 123 19.357 3.024 5.651 1723 2HG2 VAL 123 HG22 VAL 123 19.817 3.103 3.939 1724 3HG2 VAL 123 HG23 VAL 123 21.044 2.859 5.193 1725 H ARG 124 HN ARG 124 22.389 7.262 5.820 1726 HA ARG 124 HA ARG 124 21.018 9.410 4.612 1727 1HB ARG 124 HB2 ARG 124 22.201 10.886 5.997 1728 2HB ARG 124 HB3 ARG 124 22.023 9.402 6.928 1729 1HG ARG 124 HG2 ARG 124 24.328 8.837 6.519 1730 2HG ARG 124 HG3 ARG 124 24.573 10.252 5.479 1731 1HD ARG 124 HD2 ARG 124 24.215 11.767 7.326 1732 2HD ARG 124 HD3 ARG 124 23.647 10.447 8.353 1733 HE ARG 124 HE ARG 124 25.703 9.883 8.914 1734 1HH1 ARG 124 HH11 ARG 124 26.133 11.741 5.890 1735 2HH1 ARG 124 HH12 ARG 124 27.818 11.986 6.136 1736 1HH2 ARG 124 HH21 ARG 124 27.856 10.328 9.290 1737 2HH2 ARG 124 HH22 ARG 124 28.857 11.109 8.094 1738 H ASP 125 HN ASP 125 24.250 8.128 3.887 1739 HA ASP 125 HA ASP 125 25.034 10.267 2.167 1740 1HB ASP 125 HB2 ASP 125 26.645 8.627 2.989 1741 2HB ASP 125 HB3 ASP 125 25.811 7.324 2.138 1742 H GLU 126 HN GLU 126 23.292 7.185 1.506 1743 HA GLU 126 HA GLU 126 23.023 7.580 -1.311 1744 1HB GLU 126 HB2 GLU 126 22.683 5.415 -0.106 1745 2HB GLU 126 HB3 GLU 126 21.242 6.070 0.657 1746 1HG GLU 126 HG2 GLU 126 20.432 4.757 -1.107 1747 2HG GLU 126 HG3 GLU 126 20.272 6.410 -1.690 1748 H ILE 127 HN ILE 127 20.666 8.176 1.350 1749 HA ILE 127 HA ILE 127 18.625 9.253 -0.262 1750 HB ILE 127 HB ILE 127 19.310 9.340 2.688 1751 1HG1 ILE 127 HG12 ILE 127 17.010 8.199 1.031 1752 2HG1 ILE 127 HG13 ILE 127 18.373 7.289 1.692 1753 1HG2 ILE 127 HG21 ILE 127 16.924 10.782 1.492 1754 2HG2 ILE 127 HG22 ILE 127 17.232 10.488 3.229 1755 3HG2 ILE 127 HG23 ILE 127 18.297 11.543 2.328 1756 1HD1 ILE 127 HD11 ILE 127 16.014 8.493 3.163 1757 2HD1 ILE 127 HD12 ILE 127 16.554 6.810 3.106 1758 3HD1 ILE 127 HD13 ILE 127 17.490 8.019 4.025 1759 H GLY 128 HN GLY 128 21.252 10.968 1.528 1760 1HA GLY 128 HA2 GLY 128 20.341 13.575 0.961 1761 2HA GLY 128 HA3 GLY 128 22.012 13.097 1.359 1762 H ASN 129 HN ASN 129 22.685 11.472 -0.888 1763 HA ASN 129 HA ASN 129 23.272 13.539 -2.734 1764 1HB ASN 129 HB2 ASN 129 24.525 11.287 -2.339 1765 2HB ASN 129 HB3 ASN 129 23.410 10.625 -3.536 1766 1HD2 ASN 129 HD22 ASN 129 23.255 12.334 -5.679 1767 2HD2 ASN 129 HD21 ASN 129 24.833 12.897 -6.155 1768 H ARG 130 HN ARG 130 20.837 10.909 -2.838 1769 HA ARG 130 HA ARG 130 19.903 11.623 -5.480 1770 1HB ARG 130 HB2 ARG 130 18.820 9.914 -3.232 1771 2HB ARG 130 HB3 ARG 130 17.738 10.420 -4.521 1772 1HG ARG 130 HG2 ARG 130 18.574 8.262 -5.055 1773 2HG ARG 130 HG3 ARG 130 19.170 9.406 -6.238 1774 1HD ARG 130 HD2 ARG 130 20.887 8.567 -3.874 1775 2HD ARG 130 HD3 ARG 130 20.695 7.519 -5.277 1776 HE ARG 130 HE ARG 130 21.458 10.168 -6.122 1777 1HH1 ARG 130 HH21 ARG 130 22.848 7.218 -4.644 1778 2HH1 ARG 130 HH22 ARG 130 24.359 7.396 -5.480 1779 1HH2 ARG 130 HH11 ARG 130 23.353 10.410 -7.103 1780 2HH2 ARG 130 HH12 ARG 130 24.691 9.286 -6.929 1781 H LEU 131 HN LEU 131 18.828 12.740 -2.194 1782 HA LEU 131 HA LEU 131 16.713 14.285 -3.362 1783 1HB LEU 131 HB2 LEU 131 17.853 13.955 -0.644 1784 2HB LEU 131 HB3 LEU 131 17.382 15.603 -0.969 1785 HG LEU 131 HG LEU 131 15.548 14.409 0.072 1786 1HD1 LEU 131 HD11 LEU 131 14.768 14.867 -2.852 1787 2HD1 LEU 131 HD12 LEU 131 13.775 15.070 -1.419 1788 3HD1 LEU 131 HD13 LEU 131 15.111 16.184 -1.718 1789 1HD2 LEU 131 HD21 LEU 131 14.385 12.546 -1.007 1790 2HD2 LEU 131 HD22 LEU 131 15.598 12.520 -2.304 1791 3HD2 LEU 131 HD23 LEU 131 16.070 12.136 -0.641 1792 H LYS 132 HN LYS 132 20.132 15.095 -2.613 1793 HA LYS 132 HA LYS 132 19.909 17.848 -3.358 1794 1HB LYS 132 HB2 LYS 132 21.772 16.797 -2.087 1795 2HB LYS 132 HB3 LYS 132 22.256 15.894 -3.531 1796 1HG LYS 132 HG2 LYS 132 22.743 18.008 -4.709 1797 2HG LYS 132 HG3 LYS 132 22.218 18.936 -3.297 1798 1HD LYS 132 HD2 LYS 132 24.484 16.903 -3.269 1799 2HD LYS 132 HD3 LYS 132 24.714 18.645 -3.537 1800 1HE LYS 132 HE2 LYS 132 23.663 19.094 -1.310 1801 2HE LYS 132 HE3 LYS 132 23.552 17.353 -1.028 1802 1HZ LYS 132 HZ1 LYS 132 25.530 18.293 -0.003 1803 2HZ LYS 132 HZ2 LYS 132 25.974 17.240 -1.165 1804 3HZ LYS 132 HZ3 LYS 132 26.080 18.849 -1.431 1805 H GLU 133 HN GLU 133 20.592 14.850 -5.313 1806 HA GLU 133 HA GLU 133 20.810 16.252 -7.772 1807 1HB GLU 133 HB2 GLU 133 19.974 13.419 -7.042 1808 2HB GLU 133 HB3 GLU 133 19.755 13.993 -8.705 1809 1HG GLU 133 HG2 GLU 133 22.003 14.359 -9.068 1810 2HG GLU 133 HG3 GLU 133 22.429 14.310 -7.341 1811 H PHE 134 HN PHE 134 17.789 15.118 -6.059 1812 HA PHE 134 HA PHE 134 16.153 15.718 -8.272 1813 1HB PHE 134 HB2 PHE 134 15.244 14.519 -6.447 1814 2HB PHE 134 HB3 PHE 134 15.636 15.785 -5.296 1815 HD1 PHE 134 HD1 PHE 134 13.961 17.203 -4.585 1816 HD2 PHE 134 HD2 PHE 134 13.580 15.356 -8.451 1817 HE1 PHE 134 HE1 PHE 134 11.723 18.259 -4.875 1818 HE2 PHE 134 HE2 PHE 134 11.359 16.429 -8.737 1819 HZ PHE 134 HZ PHE 134 10.430 17.881 -6.956 1820 H ALA 135 HN ALA 135 17.454 17.900 -5.789 1821 HA ALA 135 HA ALA 135 16.051 20.234 -6.565 1822 1HB ALA 135 HB1 ALA 135 18.871 20.063 -5.433 1823 2HB ALA 135 HB2 ALA 135 17.727 21.421 -5.301 1824 3HB ALA 135 HB3 ALA 135 17.406 19.899 -4.449 1825 H GLU 136 HN GLU 136 18.876 18.640 -7.950 1826 HA GLU 136 HA GLU 136 19.713 20.915 -9.530 1827 1HB GLU 136 HB2 GLU 136 20.723 18.064 -9.276 1828 2HB GLU 136 HB3 GLU 136 21.485 19.271 -10.297 1829 1HG GLU 136 HG2 GLU 136 21.114 19.721 -7.311 1830 2HG GLU 136 HG3 GLU 136 22.464 18.806 -7.960 1831 H THR 137 HN THR 137 18.368 17.708 -9.988 1832 HA THR 137 HA THR 137 18.421 17.814 -12.897 1833 HB THR 137 HB THR 137 17.676 15.433 -12.639 1834 HG1 THR 137 HG1 THR 137 17.793 15.865 -9.867 1835 1HG2 THR 137 HG21 THR 137 19.629 14.577 -11.393 1836 2HG2 THR 137 HG22 THR 137 20.072 15.878 -12.514 1837 3HG2 THR 137 HG23 THR 137 19.979 16.202 -10.779 1838 H GLY 138 HN GLY 138 16.064 18.372 -10.344 1839 1HA GLY 138 HA2 GLY 138 13.835 18.719 -10.296 1840 2HA GLY 138 HA3 GLY 138 13.923 19.259 -11.991 1841 H LYS 139 HN LYS 139 14.898 16.048 -10.797 1842 HA LYS 139 HA LYS 139 13.723 14.675 -12.910 1843 1HB LYS 139 HB2 LYS 139 15.520 13.731 -11.671 1844 2HB LYS 139 HB3 LYS 139 14.578 13.716 -10.160 1845 1HG LYS 139 HG2 LYS 139 13.163 11.993 -10.904 1846 2HG LYS 139 HG3 LYS 139 13.578 12.244 -12.606 1847 1HD LYS 139 HD2 LYS 139 14.475 10.167 -11.619 1848 2HD LYS 139 HD3 LYS 139 15.698 11.221 -12.373 1849 1HE LYS 139 HE2 LYS 139 16.452 12.022 -10.190 1850 2HE LYS 139 HE3 LYS 139 15.164 11.122 -9.376 1851 1HZ LYS 139 HZ1 LYS 139 17.246 9.923 -9.272 1852 2HZ LYS 139 HZ2 LYS 139 16.145 9.077 -10.150 1853 3HZ LYS 139 HZ3 LYS 139 17.372 9.879 -10.904 Start of MODEL 14 1 1H MET 1 H1 MET 1 -24.854 -11.000 -7.128 2 2H MET 1 H2 MET 1 -23.814 -10.209 -8.112 3 3H MET 1 H3 MET 1 -23.292 -11.505 -7.249 4 HA MET 1 HA MET 1 -24.866 -12.918 -8.399 5 1HB MET 1 HB2 MET 1 -25.848 -12.241 -10.479 6 2HB MET 1 HB3 MET 1 -26.423 -11.224 -9.174 7 1HG MET 1 HG2 MET 1 -24.336 -10.469 -11.259 8 2HG MET 1 HG3 MET 1 -26.016 -9.973 -11.255 9 1HE MET 1 HE1 MET 1 -26.677 -9.060 -8.274 10 2HE MET 1 HE2 MET 1 -26.256 -7.343 -8.404 11 3HE MET 1 HE3 MET 1 -27.081 -8.153 -9.751 12 H ALA 2 HN ALA 2 -22.249 -10.699 -9.598 13 HA ALA 2 HA ALA 2 -20.619 -13.026 -10.098 14 1HB ALA 2 HB1 ALA 2 -21.745 -12.778 -12.323 15 2HB ALA 2 HB2 ALA 2 -21.273 -11.063 -12.362 16 3HB ALA 2 HB3 ALA 2 -20.034 -12.335 -12.415 17 H ILE 3 HN ILE 3 -18.379 -12.250 -10.552 18 HA ILE 3 HA ILE 3 -17.768 -9.700 -9.238 19 HB ILE 3 HB ILE 3 -16.161 -12.162 -9.990 20 1HG1 ILE 3 HG12 ILE 3 -15.229 -11.802 -7.695 21 2HG1 ILE 3 HG13 ILE 3 -16.313 -10.428 -7.487 22 1HG2 ILE 3 HG21 ILE 3 -14.073 -10.882 -9.450 23 2HG2 ILE 3 HG22 ILE 3 -14.814 -10.362 -10.957 24 3HG2 ILE 3 HG23 ILE 3 -15.026 -9.376 -9.496 25 1HD1 ILE 3 HD11 ILE 3 -17.158 -13.315 -7.877 26 2HD1 ILE 3 HD12 ILE 3 -17.067 -12.395 -6.355 27 3HD1 ILE 3 HD13 ILE 3 -18.244 -11.919 -7.587 28 H VAL 4 HN VAL 4 -18.294 -8.086 -10.536 29 HA VAL 4 HA VAL 4 -18.037 -8.183 -13.451 30 HB VAL 4 HB VAL 4 -18.932 -5.994 -11.540 31 1HG1 VAL 4 HG11 VAL 4 -19.436 -6.277 -14.530 32 2HG1 VAL 4 HG12 VAL 4 -20.243 -5.102 -13.472 33 3HG1 VAL 4 HG13 VAL 4 -18.516 -4.983 -13.713 34 1HG2 VAL 4 HG21 VAL 4 -21.280 -6.642 -12.138 35 2HG2 VAL 4 HG22 VAL 4 -20.635 -8.072 -12.973 36 3HG2 VAL 4 HG23 VAL 4 -20.443 -7.878 -11.216 37 H LYS 5 HN LYS 5 -16.914 -6.105 -14.393 38 HA LYS 5 HA LYS 5 -14.651 -5.282 -12.758 39 1HB LYS 5 HB2 LYS 5 -13.072 -5.296 -14.539 40 2HB LYS 5 HB3 LYS 5 -13.629 -6.918 -14.211 41 1HG LYS 5 HG2 LYS 5 -14.538 -5.174 -16.555 42 2HG LYS 5 HG3 LYS 5 -13.255 -6.364 -16.622 43 1HD LYS 5 HD2 LYS 5 -16.209 -6.958 -16.199 44 2HD LYS 5 HD3 LYS 5 -15.244 -7.249 -17.643 45 1HE LYS 5 HE2 LYS 5 -13.784 -8.813 -16.329 46 2HE LYS 5 HE3 LYS 5 -14.848 -8.598 -14.933 47 1HZ LYS 5 HZ1 LYS 5 -15.658 -9.740 -17.548 48 2HZ LYS 5 HZ2 LYS 5 -15.414 -10.583 -16.179 49 3HZ LYS 5 HZ3 LYS 5 -16.661 -9.539 -16.272 50 H ALA 6 HN ALA 6 -14.188 -3.186 -12.869 51 HA ALA 6 HA ALA 6 -16.218 -1.406 -14.110 52 1HB ALA 6 HB1 ALA 6 -14.917 0.213 -12.520 53 2HB ALA 6 HB2 ALA 6 -16.093 -0.902 -11.865 54 3HB ALA 6 HB3 ALA 6 -14.366 -1.284 -11.748 55 H THR 7 HN THR 7 -15.249 0.753 -14.834 56 HA THR 7 HA THR 7 -12.424 0.761 -15.652 57 HB THR 7 HB THR 7 -12.933 1.700 -17.802 58 HG1 THR 7 HG1 THR 7 -14.882 2.283 -18.449 59 1HG2 THR 7 HG21 THR 7 -13.042 -0.757 -17.679 60 2HG2 THR 7 HG22 THR 7 -14.814 -0.651 -17.468 61 3HG2 THR 7 HG23 THR 7 -14.046 -0.072 -18.974 62 H ASP 8 HN ASP 8 -12.310 3.134 -16.675 63 HA ASP 8 HA ASP 8 -12.179 5.152 -14.746 64 1HB ASP 8 HB2 ASP 8 -11.064 5.322 -16.857 65 2HB ASP 8 HB3 ASP 8 -12.575 5.172 -17.749 66 H GLN 9 HN GLN 9 -15.046 4.054 -16.510 67 HA GLN 9 HA GLN 9 -16.704 6.060 -15.116 68 1HB GLN 9 HB2 GLN 9 -16.632 5.424 -18.082 69 2HB GLN 9 HB3 GLN 9 -18.044 6.172 -17.326 70 1HG GLN 9 HG2 GLN 9 -16.850 8.143 -16.714 71 2HG GLN 9 HG3 GLN 9 -15.290 7.401 -17.012 72 1HE2 GLN 9 HE22 GLN 9 -14.291 8.023 -18.843 73 2HE2 GLN 9 HE21 GLN 9 -15.101 8.559 -20.315 74 H SER 10 HN SER 10 -16.483 2.838 -16.694 75 HA SER 10 HA SER 10 -19.155 2.099 -16.181 76 1HB SER 10 HB2 SER 10 -16.814 0.173 -16.168 77 2HB SER 10 HB3 SER 10 -18.506 -0.161 -16.556 78 HG SER 10 HG SER 10 -16.538 1.221 -18.005 79 H PHE 11 HN PHE 11 -16.498 2.491 -13.896 80 HA PHE 11 HA PHE 11 -17.418 0.881 -11.747 81 1HB PHE 11 HB2 PHE 11 -15.298 2.094 -11.616 82 2HB PHE 11 HB3 PHE 11 -16.100 3.620 -11.854 83 HD1 PHE 11 HD1 PHE 11 -17.086 4.835 -10.055 84 HD2 PHE 11 HD2 PHE 11 -15.591 0.821 -9.355 85 HE1 PHE 11 HE1 PHE 11 -17.131 5.228 -7.615 86 HE2 PHE 11 HE2 PHE 11 -15.516 1.315 -6.938 87 HZ PHE 11 HZ PHE 11 -16.298 3.488 -6.056 88 H SER 12 HN SER 12 -18.242 4.354 -12.507 89 HA SER 12 HA SER 12 -20.151 4.553 -10.478 90 1HB SER 12 HB2 SER 12 -20.295 5.949 -13.187 91 2HB SER 12 HB3 SER 12 -20.817 6.584 -11.617 92 HG SER 12 HG SER 12 -18.790 7.459 -12.249 93 H ALA 13 HN ALA 13 -20.496 3.610 -13.917 94 HA ALA 13 HA ALA 13 -23.283 3.605 -13.933 95 1HB ALA 13 HB1 ALA 13 -21.408 1.861 -15.592 96 2HB ALA 13 HB2 ALA 13 -23.078 2.297 -16.008 97 3HB ALA 13 HB3 ALA 13 -21.823 3.558 -15.945 98 H GLU 14 HN GLU 14 -21.006 1.044 -12.971 99 HA GLU 14 HA GLU 14 -23.066 -0.921 -12.588 100 1HB GLU 14 HB2 GLU 14 -20.091 -0.859 -12.016 101 2HB GLU 14 HB3 GLU 14 -21.097 -2.232 -11.582 102 1HG GLU 14 HG2 GLU 14 -20.793 -1.136 -14.404 103 2HG GLU 14 HG3 GLU 14 -19.946 -2.537 -13.755 104 H THR 15 HN THR 15 -21.848 1.650 -10.584 105 HA THR 15 HA THR 15 -22.524 0.176 -8.092 106 HB THR 15 HB THR 15 -20.982 1.795 -7.030 107 HG1 THR 15 HG1 THR 15 -20.170 2.499 -9.607 108 1HG2 THR 15 HG21 THR 15 -19.798 -0.179 -7.548 109 2HG2 THR 15 HG22 THR 15 -19.834 0.115 -9.301 110 3HG2 THR 15 HG23 THR 15 -18.822 1.117 -8.264 111 H SER 16 HN SER 16 -23.876 2.603 -10.046 112 HA SER 16 HA SER 16 -24.585 4.467 -7.986 113 1HB SER 16 HB2 SER 16 -25.634 4.089 -10.819 114 2HB SER 16 HB3 SER 16 -26.044 5.454 -9.768 115 HG SER 16 HG SER 16 -23.458 4.717 -10.697 116 H GLU 17 HN GLU 17 -25.812 1.376 -8.402 117 HA GLU 17 HA GLU 17 -28.290 2.061 -7.007 118 1HB GLU 17 HB2 GLU 17 -28.130 0.401 -9.563 119 2HB GLU 17 HB3 GLU 17 -29.521 0.399 -8.470 120 1HG GLU 17 HG2 GLU 17 -29.789 2.859 -8.846 121 2HG GLU 17 HG3 GLU 17 -28.478 2.800 -10.030 122 H GLY 18 HN GLY 18 -29.096 0.265 -5.740 123 1HA GLY 18 HA2 GLY 18 -28.967 -1.608 -4.482 124 2HA GLY 18 HA3 GLY 18 -27.829 -2.299 -5.652 125 H VAL 19 HN VAL 19 -26.759 -3.125 -3.758 126 HA VAL 19 HA VAL 19 -24.749 -1.197 -2.728 127 HB VAL 19 HB VAL 19 -25.763 -3.621 -1.179 128 1HG1 VAL 19 HG11 VAL 19 -23.720 -1.443 -0.507 129 2HG1 VAL 19 HG12 VAL 19 -24.320 -2.671 0.623 130 3HG1 VAL 19 HG13 VAL 19 -23.369 -3.163 -0.782 131 1HG2 VAL 19 HG21 VAL 19 -26.518 -1.739 0.413 132 2HG2 VAL 19 HG22 VAL 19 -26.271 -0.636 -0.944 133 3HG2 VAL 19 HG23 VAL 19 -27.461 -1.942 -1.068 134 H VAL 20 HN VAL 20 -22.795 -1.508 -3.240 135 HA VAL 20 HA VAL 20 -22.126 -3.919 -4.811 136 HB VAL 20 HB VAL 20 -21.700 -1.031 -5.703 137 1HG1 VAL 20 HG11 VAL 20 -21.133 -2.160 -7.867 138 2HG1 VAL 20 HG12 VAL 20 -20.005 -2.550 -6.557 139 3HG1 VAL 20 HG13 VAL 20 -21.237 -3.729 -7.033 140 1HG2 VAL 20 HG21 VAL 20 -23.882 -3.016 -6.447 141 2HG2 VAL 20 HG22 VAL 20 -24.044 -1.336 -5.914 142 3HG2 VAL 20 HG23 VAL 20 -23.410 -1.696 -7.517 143 H LEU 21 HN LEU 21 -20.350 -4.714 -4.096 144 HA LEU 21 HA LEU 21 -18.455 -3.137 -2.438 145 1HB LEU 21 HB2 LEU 21 -19.222 -5.383 -1.659 146 2HB LEU 21 HB3 LEU 21 -18.568 -6.103 -3.132 147 HG LEU 21 HG LEU 21 -16.274 -5.400 -2.451 148 1HD1 LEU 21 HD11 LEU 21 -16.003 -4.625 -0.045 149 2HD1 LEU 21 HD12 LEU 21 -16.718 -3.422 -1.110 150 3HD1 LEU 21 HD13 LEU 21 -17.748 -4.359 0.012 151 1HD2 LEU 21 HD21 LEU 21 -17.163 -7.619 -1.814 152 2HD2 LEU 21 HD22 LEU 21 -16.032 -6.998 -0.602 153 3HD2 LEU 21 HD23 LEU 21 -17.783 -6.943 -0.291 154 H ALA 22 HN ALA 22 -17.206 -1.861 -3.879 155 HA ALA 22 HA ALA 22 -16.185 -3.175 -6.303 156 1HB ALA 22 HB1 ALA 22 -16.882 -0.782 -6.427 157 2HB ALA 22 HB2 ALA 22 -15.575 -0.385 -5.271 158 3HB ALA 22 HB3 ALA 22 -15.198 -1.048 -6.880 159 H ASP 23 HN ASP 23 -13.912 -3.473 -6.606 160 HA ASP 23 HA ASP 23 -12.210 -3.574 -4.180 161 1HB ASP 23 HB2 ASP 23 -13.176 -5.783 -4.257 162 2HB ASP 23 HB3 ASP 23 -12.956 -5.881 -5.999 163 H PHE 24 HN PHE 24 -9.967 -3.645 -4.687 164 HA PHE 24 HA PHE 24 -9.237 -2.751 -7.440 165 1HB PHE 24 HB2 PHE 24 -8.623 -1.543 -4.732 166 2HB PHE 24 HB3 PHE 24 -7.772 -1.099 -6.193 167 HD1 PHE 24 HD1 PHE 24 -11.279 -1.227 -4.754 168 HD2 PHE 24 HD2 PHE 24 -8.589 0.658 -7.534 169 HE1 PHE 24 HE1 PHE 24 -13.075 0.318 -5.427 170 HE2 PHE 24 HE2 PHE 24 -10.409 2.231 -8.190 171 HZ PHE 24 HZ PHE 24 -12.640 2.072 -7.139 172 H TRP 25 HN TRP 25 -7.736 -4.104 -8.195 173 HA TRP 25 HA TRP 25 -5.922 -5.591 -6.373 174 1HB TRP 25 HB2 TRP 25 -6.528 -7.636 -7.233 175 2HB TRP 25 HB3 TRP 25 -8.082 -6.850 -7.087 176 HD1 TRP 25 HD1 TRP 25 -8.955 -5.692 -9.502 177 HE1 TRP 25 HE1 TRP 25 -8.693 -6.431 -11.910 178 HE3 TRP 25 HE3 TRP 25 -5.230 -9.136 -8.839 179 HZ2 TRP 25 HZ2 TRP 25 -6.833 -8.143 -13.436 180 HZ3 TRP 25 HZ3 TRP 25 -4.200 -10.262 -10.781 181 HH2 TRP 25 HH2 TRP 25 -4.991 -9.764 -13.085 182 H ALA 26 HN ALA 26 -3.888 -6.198 -7.542 183 HA ALA 26 HA ALA 26 -3.688 -6.037 -10.368 184 1HB ALA 26 HB1 ALA 26 -2.516 -3.760 -8.767 185 2HB ALA 26 HB2 ALA 26 -1.844 -4.191 -10.350 186 3HB ALA 26 HB3 ALA 26 -3.514 -3.656 -10.239 187 HA PRO 27 HA PRO 27 -0.273 -8.697 -9.629 188 1HB PRO 27 HB2 PRO 27 1.388 -7.005 -11.499 189 2HB PRO 27 HB3 PRO 27 1.183 -8.784 -11.476 190 1HG PRO 27 HG2 PRO 27 -0.196 -7.281 -13.263 191 2HG PRO 27 HG3 PRO 27 -1.045 -8.603 -12.387 192 1HD PRO 27 HD2 PRO 27 -1.061 -5.650 -11.818 193 2HD PRO 27 HD3 PRO 27 -2.416 -6.818 -11.840 194 H TRP 28 HN TRP 28 0.234 -5.352 -8.759 195 HA TRP 28 HA TRP 28 2.885 -5.396 -7.772 196 1HB TRP 28 HB2 TRP 28 0.635 -3.828 -6.589 197 2HB TRP 28 HB3 TRP 28 2.343 -3.429 -6.643 198 HD1 TRP 28 HD1 TRP 28 -0.785 -2.730 -8.264 199 HE1 TRP 28 HE1 TRP 28 -0.573 -1.514 -10.510 200 HE3 TRP 28 HE3 TRP 28 4.195 -3.479 -9.024 201 HZ2 TRP 28 HZ2 TRP 28 1.523 -1.057 -12.461 202 HZ3 TRP 28 HZ3 TRP 28 5.285 -2.657 -11.096 203 HH2 TRP 28 HH2 TRP 28 3.962 -1.448 -12.820 204 H CYS 29 HN CYS 29 0.151 -7.188 -6.490 205 HA CYS 29 HA CYS 29 1.720 -7.650 -4.028 206 1HB CYS 29 HB2 CYS 29 -0.387 -5.760 -4.202 207 2HB CYS 29 HB3 CYS 29 -1.100 -7.148 -3.416 208 H GLY 30 HN GLY 30 1.104 -9.353 -2.740 209 1HA GLY 30 HA2 GLY 30 0.031 -11.704 -3.958 210 2HA GLY 30 HA3 GLY 30 0.409 -11.455 -2.248 211 HA PRO 31 HA PRO 31 -3.855 -10.686 -1.070 212 1HB PRO 31 HB2 PRO 31 -3.640 -7.696 -1.461 213 2HB PRO 31 HB3 PRO 31 -4.525 -8.607 -0.183 214 1HG PRO 31 HG2 PRO 31 -2.037 -7.632 0.336 215 2HG PRO 31 HG3 PRO 31 -2.459 -9.301 0.841 216 1HD PRO 31 HD2 PRO 31 -0.841 -8.402 -1.528 217 2HD PRO 31 HD3 PRO 31 -0.581 -9.808 -0.460 218 H SER 32 HN SER 32 -2.984 -8.785 -4.037 219 HA SER 32 HA SER 32 -5.566 -8.660 -5.136 220 1HB SER 32 HB2 SER 32 -2.982 -9.150 -6.678 221 2HB SER 32 HB3 SER 32 -4.350 -8.141 -7.156 222 HG SER 32 HG SER 32 -2.386 -7.094 -6.344 223 H LYS 33 HN LYS 33 -3.674 -11.444 -4.611 224 HA LYS 33 HA LYS 33 -5.447 -13.029 -6.407 225 1HB LYS 33 HB2 LYS 33 -2.738 -13.958 -5.444 226 2HB LYS 33 HB3 LYS 33 -3.820 -14.682 -6.631 227 1HG LYS 33 HG2 LYS 33 -2.245 -13.780 -8.003 228 2HG LYS 33 HG3 LYS 33 -3.459 -12.496 -8.017 229 1HD LYS 33 HD2 LYS 33 -2.131 -11.251 -6.322 230 2HD LYS 33 HD3 LYS 33 -0.951 -12.546 -6.248 231 1HE LYS 33 HE2 LYS 33 -1.603 -10.901 -8.740 232 2HE LYS 33 HE3 LYS 33 -0.282 -10.551 -7.620 233 1HZ LYS 33 HZ1 LYS 33 0.511 -11.811 -9.516 234 2HZ LYS 33 HZ2 LYS 33 0.686 -12.711 -8.173 235 3HZ LYS 33 HZ3 LYS 33 -0.523 -13.034 -9.228 236 H MET 34 HN MET 34 -5.407 -12.109 -3.315 237 HA MET 34 HA MET 34 -6.305 -14.776 -2.287 238 1HB MET 34 HB2 MET 34 -5.053 -12.527 -0.668 239 2HB MET 34 HB3 MET 34 -5.693 -14.051 -0.046 240 1HG MET 34 HG2 MET 34 -4.021 -15.266 -1.492 241 2HG MET 34 HG3 MET 34 -3.285 -13.711 -1.872 242 1HE MET 34 HE1 MET 34 -1.830 -12.596 1.627 243 2HE MET 34 HE2 MET 34 -2.002 -12.182 -0.090 244 3HE MET 34 HE3 MET 34 -3.422 -12.145 0.988 245 H ILE 35 HN ILE 35 -6.764 -11.175 -2.093 246 HA ILE 35 HA ILE 35 -9.363 -11.314 -0.984 247 HB ILE 35 HB ILE 35 -7.674 -9.295 -1.408 248 1HG1 ILE 35 HG12 ILE 35 -9.836 -7.757 -1.283 249 2HG1 ILE 35 HG13 ILE 35 -10.685 -9.300 -1.108 250 1HG2 ILE 35 HG21 ILE 35 -8.368 -7.760 -3.131 251 2HG2 ILE 35 HG22 ILE 35 -7.787 -9.263 -3.854 252 3HG2 ILE 35 HG23 ILE 35 -9.533 -8.926 -3.786 253 1HD1 ILE 35 HD11 ILE 35 -9.259 -9.865 0.834 254 2HD1 ILE 35 HD12 ILE 35 -8.307 -8.383 0.583 255 3HD1 ILE 35 HD13 ILE 35 -10.015 -8.275 1.077 256 H ALA 36 HN ALA 36 -8.101 -11.585 -4.302 257 HA ALA 36 HA ALA 36 -10.462 -11.340 -5.710 258 1HB ALA 36 HB1 ALA 36 -7.917 -12.901 -6.350 259 2HB ALA 36 HB2 ALA 36 -9.270 -12.724 -7.487 260 3HB ALA 36 HB3 ALA 36 -8.405 -11.294 -6.882 261 HA PRO 37 HA PRO 37 -11.421 -16.043 -5.353 262 1HB PRO 37 HB2 PRO 37 -10.143 -17.352 -3.188 263 2HB PRO 37 HB3 PRO 37 -9.814 -17.568 -4.936 264 1HG PRO 37 HG2 PRO 37 -8.334 -15.946 -2.909 265 2HG PRO 37 HG3 PRO 37 -7.696 -16.767 -4.359 266 1HD PRO 37 HD2 PRO 37 -8.086 -14.044 -4.270 267 2HD PRO 37 HD3 PRO 37 -8.268 -14.997 -5.755 268 H VAL 38 HN VAL 38 -10.476 -14.346 -2.310 269 HA VAL 38 HA VAL 38 -12.610 -15.222 -0.690 270 HB VAL 38 HB VAL 38 -10.651 -12.972 -0.764 271 1HG1 VAL 38 HG11 VAL 38 -11.383 -12.213 1.504 272 2HG1 VAL 38 HG12 VAL 38 -12.313 -11.671 0.111 273 3HG1 VAL 38 HG13 VAL 38 -12.952 -12.984 1.149 274 1HG2 VAL 38 HG21 VAL 38 -10.058 -15.274 -0.002 275 2HG2 VAL 38 HG22 VAL 38 -9.829 -14.047 1.254 276 3HG2 VAL 38 HG23 VAL 38 -11.249 -15.119 1.307 277 H LEU 39 HN LEU 39 -12.559 -12.644 -3.162 278 HA LEU 39 HA LEU 39 -15.206 -11.687 -2.476 279 1HB LEU 39 HB2 LEU 39 -13.451 -11.392 -4.942 280 2HB LEU 39 HB3 LEU 39 -15.064 -10.705 -4.856 281 HG LEU 39 HG LEU 39 -13.017 -10.137 -2.668 282 1HD1 LEU 39 HD11 LEU 39 -11.933 -9.575 -4.795 283 2HD1 LEU 39 HD12 LEU 39 -13.308 -8.527 -5.226 284 3HD1 LEU 39 HD13 LEU 39 -12.292 -8.164 -3.801 285 1HD2 LEU 39 HD21 LEU 39 -15.241 -8.340 -3.684 286 2HD2 LEU 39 HD22 LEU 39 -15.452 -9.486 -2.353 287 3HD2 LEU 39 HD23 LEU 39 -14.274 -8.168 -2.218 288 H GLU 40 HN GLU 40 -13.938 -14.066 -4.910 289 HA GLU 40 HA GLU 40 -16.512 -14.510 -6.059 290 1HB GLU 40 HB2 GLU 40 -14.119 -16.367 -5.969 291 2HB GLU 40 HB3 GLU 40 -15.576 -16.550 -6.971 292 1HG GLU 40 HG2 GLU 40 -15.087 -14.431 -8.122 293 2HG GLU 40 HG3 GLU 40 -13.622 -14.228 -7.169 294 H GLU 41 HN GLU 41 -14.821 -15.858 -3.226 295 HA GLU 41 HA GLU 41 -16.791 -17.803 -2.551 296 1HB GLU 41 HB2 GLU 41 -14.584 -16.448 -0.978 297 2HB GLU 41 HB3 GLU 41 -15.676 -17.639 -0.269 298 1HG GLU 41 HG2 GLU 41 -15.012 -19.298 -1.983 299 2HG GLU 41 HG3 GLU 41 -13.871 -18.153 -2.672 300 H LEU 42 HN LEU 42 -16.614 -14.310 -2.059 301 HA LEU 42 HA LEU 42 -18.761 -14.281 -0.078 302 1HB LEU 42 HB2 LEU 42 -17.033 -12.467 -0.200 303 2HB LEU 42 HB3 LEU 42 -17.568 -12.061 -1.826 304 HG LEU 42 HG LEU 42 -19.836 -11.477 -0.946 305 1HD1 LEU 42 HD11 LEU 42 -18.454 -11.996 1.717 306 2HD1 LEU 42 HD12 LEU 42 -19.972 -11.092 1.524 307 3HD1 LEU 42 HD13 LEU 42 -19.921 -12.805 1.108 308 1HD2 LEU 42 HD21 LEU 42 -18.028 -9.745 -1.202 309 2HD2 LEU 42 HD22 LEU 42 -19.242 -9.376 0.034 310 3HD2 LEU 42 HD23 LEU 42 -17.656 -9.960 0.530 311 H ASP 43 HN ASP 43 -18.447 -13.731 -3.615 312 HA ASP 43 HA ASP 43 -21.161 -12.901 -3.867 313 1HB ASP 43 HB2 ASP 43 -19.482 -12.234 -5.525 314 2HB ASP 43 HB3 ASP 43 -19.115 -13.918 -5.890 315 H GLN 44 HN GLN 44 -19.585 -16.086 -4.236 316 HA GLN 44 HA GLN 44 -21.988 -17.352 -5.140 317 1HB GLN 44 HB2 GLN 44 -20.857 -19.401 -4.915 318 2HB GLN 44 HB3 GLN 44 -19.684 -18.195 -5.454 319 1HG GLN 44 HG2 GLN 44 -18.965 -17.994 -3.007 320 2HG GLN 44 HG3 GLN 44 -19.969 -19.403 -2.668 321 1HE2 GLN 44 HE22 GLN 44 -17.341 -18.274 -4.856 322 2HE2 GLN 44 HE21 GLN 44 -16.530 -19.831 -4.987 323 H GLU 45 HN GLU 45 -21.272 -16.012 -2.065 324 HA GLU 45 HA GLU 45 -22.949 -17.882 -0.628 325 1HB GLU 45 HB2 GLU 45 -21.036 -17.655 0.616 326 2HB GLU 45 HB3 GLU 45 -20.685 -16.080 -0.041 327 1HG GLU 45 HG2 GLU 45 -20.971 -15.670 2.175 328 2HG GLU 45 HG3 GLU 45 -22.414 -15.060 1.413 329 H MET 46 HN MET 46 -22.701 -14.420 -1.377 330 HA MET 46 HA MET 46 -25.597 -14.124 -0.738 331 1HB MET 46 HB2 MET 46 -24.973 -11.998 0.409 332 2HB MET 46 HB3 MET 46 -24.495 -13.483 1.236 333 1HG MET 46 HG2 MET 46 -22.177 -13.209 0.375 334 2HG MET 46 HG3 MET 46 -22.640 -11.736 -0.456 335 1HE MET 46 HE1 MET 46 -23.162 -9.204 2.249 336 2HE MET 46 HE2 MET 46 -23.058 -9.660 0.526 337 3HE MET 46 HE3 MET 46 -24.495 -10.148 1.452 338 H GLY 47 HN GLY 47 -23.780 -14.117 -3.272 339 1HA GLY 47 HA2 GLY 47 -24.064 -11.514 -4.408 340 2HA GLY 47 HA3 GLY 47 -23.897 -13.060 -5.296 341 H ASP 48 HN ASP 48 -26.486 -13.517 -3.451 342 HA ASP 48 HA ASP 48 -28.468 -12.995 -5.480 343 1HB ASP 48 HB2 ASP 48 -28.722 -14.878 -3.920 344 2HB ASP 48 HB3 ASP 48 -28.737 -13.761 -2.552 345 H LYS 49 HN LYS 49 -27.062 -11.211 -2.807 346 HA LYS 49 HA LYS 49 -29.093 -9.117 -3.109 347 1HB LYS 49 HB2 LYS 49 -27.343 -9.333 -0.686 348 2HB LYS 49 HB3 LYS 49 -28.972 -8.692 -0.845 349 1HG LYS 49 HG2 LYS 49 -29.470 -10.535 0.342 350 2HG LYS 49 HG3 LYS 49 -29.543 -11.295 -1.263 351 1HD LYS 49 HD2 LYS 49 -27.525 -12.443 -0.951 352 2HD LYS 49 HD3 LYS 49 -26.903 -11.217 0.162 353 1HE LYS 49 HE2 LYS 49 -27.244 -13.213 1.397 354 2HE LYS 49 HE3 LYS 49 -28.338 -11.955 1.951 355 1HZ LYS 49 HZ1 LYS 49 -30.125 -13.038 0.672 356 2HZ LYS 49 HZ2 LYS 49 -29.104 -14.223 0.184 357 3HZ LYS 49 HZ3 LYS 49 -29.485 -14.067 1.757 358 H LEU 50 HN LEU 50 -25.813 -9.830 -3.695 359 HA LEU 50 HA LEU 50 -24.946 -7.020 -3.412 360 1HB LEU 50 HB2 LEU 50 -24.075 -8.495 -1.646 361 2HB LEU 50 HB3 LEU 50 -23.553 -9.666 -2.855 362 HG LEU 50 HG LEU 50 -21.869 -8.051 -3.707 363 1HD1 LEU 50 HD11 LEU 50 -22.930 -5.920 -3.022 364 2HD1 LEU 50 HD12 LEU 50 -22.769 -6.373 -1.318 365 3HD1 LEU 50 HD13 LEU 50 -21.328 -6.066 -2.319 366 1HD2 LEU 50 HD21 LEU 50 -21.291 -9.756 -2.032 367 2HD2 LEU 50 HD22 LEU 50 -20.313 -8.285 -1.886 368 3HD2 LEU 50 HD23 LEU 50 -21.635 -8.586 -0.737 369 H LYS 51 HN LYS 51 -23.499 -6.232 -4.915 370 HA LYS 51 HA LYS 51 -22.782 -7.976 -7.253 371 1HB LYS 51 HB2 LYS 51 -24.301 -6.105 -7.909 372 2HB LYS 51 HB3 LYS 51 -23.183 -4.960 -7.173 373 1HG LYS 51 HG2 LYS 51 -21.396 -5.761 -8.805 374 2HG LYS 51 HG3 LYS 51 -22.632 -6.732 -9.599 375 1HD LYS 51 HD2 LYS 51 -22.570 -3.703 -9.284 376 2HD LYS 51 HD3 LYS 51 -22.189 -4.610 -10.750 377 1HE LYS 51 HE2 LYS 51 -24.533 -5.457 -10.831 378 2HE LYS 51 HE3 LYS 51 -24.915 -4.510 -9.381 379 1HZ LYS 51 HZ1 LYS 51 -25.525 -3.299 -11.373 380 2HZ LYS 51 HZ2 LYS 51 -24.277 -2.514 -10.626 381 3HZ LYS 51 HZ3 LYS 51 -23.991 -3.410 -11.971 382 H ILE 52 HN ILE 52 -20.507 -7.803 -7.852 383 HA ILE 52 HA ILE 52 -18.824 -6.248 -5.975 384 HB ILE 52 HB ILE 52 -18.313 -9.089 -6.959 385 1HG1 ILE 52 HG12 ILE 52 -18.980 -7.994 -4.197 386 2HG1 ILE 52 HG13 ILE 52 -19.929 -9.123 -5.162 387 1HG2 ILE 52 HG21 ILE 52 -16.229 -7.749 -6.899 388 2HG2 ILE 52 HG22 ILE 52 -16.582 -7.274 -5.222 389 3HG2 ILE 52 HG23 ILE 52 -16.227 -8.964 -5.647 390 1HD1 ILE 52 HD11 ILE 52 -18.935 -10.450 -3.511 391 2HD1 ILE 52 HD12 ILE 52 -17.939 -10.737 -4.955 392 3HD1 ILE 52 HD13 ILE 52 -17.361 -9.657 -3.675 393 H VAL 53 HN VAL 53 -17.145 -5.135 -7.088 394 HA VAL 53 HA VAL 53 -16.982 -5.623 -10.023 395 HB VAL 53 HB VAL 53 -17.287 -2.833 -8.843 396 1HG1 VAL 53 HG11 VAL 53 -16.106 -2.980 -10.959 397 2HG1 VAL 53 HG12 VAL 53 -17.444 -3.906 -11.688 398 3HG1 VAL 53 HG13 VAL 53 -17.698 -2.221 -11.181 399 1HG2 VAL 53 HG21 VAL 53 -19.451 -4.023 -8.532 400 2HG2 VAL 53 HG22 VAL 53 -19.540 -2.698 -9.692 401 3HG2 VAL 53 HG23 VAL 53 -19.498 -4.375 -10.260 402 H LYS 54 HN LYS 54 -14.815 -6.027 -10.426 403 HA LYS 54 HA LYS 54 -12.834 -4.942 -8.520 404 1HB LYS 54 HB2 LYS 54 -12.614 -6.966 -10.775 405 2HB LYS 54 HB3 LYS 54 -11.226 -6.341 -9.871 406 1HG LYS 54 HG2 LYS 54 -12.320 -7.093 -7.730 407 2HG LYS 54 HG3 LYS 54 -13.616 -7.805 -8.673 408 1HD LYS 54 HD2 LYS 54 -12.158 -9.587 -8.107 409 2HD LYS 54 HD3 LYS 54 -11.872 -9.240 -9.821 410 1HE LYS 54 HE2 LYS 54 -9.930 -7.676 -8.768 411 2HE LYS 54 HE3 LYS 54 -10.116 -8.724 -7.390 412 1HZ LYS 54 HZ1 LYS 54 -9.735 -10.632 -8.953 413 2HZ LYS 54 HZ2 LYS 54 -9.434 -9.570 -10.155 414 3HZ LYS 54 HZ3 LYS 54 -8.449 -9.618 -8.858 415 H ILE 55 HN ILE 55 -11.056 -3.681 -9.167 416 HA ILE 55 HA ILE 55 -11.082 -2.373 -11.837 417 HB ILE 55 HB ILE 55 -10.606 -1.328 -9.011 418 1HG1 ILE 55 HG12 ILE 55 -12.866 -1.019 -10.117 419 2HG1 ILE 55 HG13 ILE 55 -12.085 0.389 -9.435 420 1HG2 ILE 55 HG21 ILE 55 -9.432 -0.181 -11.557 421 2HG2 ILE 55 HG22 ILE 55 -9.602 0.741 -10.039 422 3HG2 ILE 55 HG23 ILE 55 -8.606 -0.713 -10.095 423 1HD1 ILE 55 HD11 ILE 55 -12.167 -0.254 -12.403 424 2HD1 ILE 55 HD12 ILE 55 -13.078 1.013 -11.531 425 3HD1 ILE 55 HD13 ILE 55 -11.338 1.138 -11.672 426 H ASP 56 HN ASP 56 -9.252 -3.001 -12.910 427 HA ASP 56 HA ASP 56 -6.992 -4.298 -11.518 428 1HB ASP 56 HB2 ASP 56 -7.682 -5.119 -13.731 429 2HB ASP 56 HB3 ASP 56 -7.418 -3.522 -14.434 430 H VAL 57 HN VAL 57 -5.800 -2.819 -10.324 431 HA VAL 57 HA VAL 57 -5.692 -0.088 -11.156 432 HB VAL 57 HB VAL 57 -4.476 0.407 -9.178 433 1HG1 VAL 57 HG11 VAL 57 -6.918 -1.308 -8.658 434 2HG1 VAL 57 HG12 VAL 57 -6.271 -0.021 -7.613 435 3HG1 VAL 57 HG13 VAL 57 -6.901 0.390 -9.214 436 1HG2 VAL 57 HG21 VAL 57 -3.195 -1.605 -8.743 437 2HG2 VAL 57 HG22 VAL 57 -4.249 -1.241 -7.358 438 3HG2 VAL 57 HG23 VAL 57 -4.694 -2.532 -8.466 439 H ASP 58 HN ASP 58 -4.641 -1.402 -13.182 440 HA ASP 58 HA ASP 58 -2.266 0.275 -13.469 441 1HB ASP 58 HB2 ASP 58 -1.152 -1.832 -12.872 442 2HB ASP 58 HB3 ASP 58 -2.152 -2.732 -14.018 443 H GLU 59 HN GLU 59 -4.553 -2.134 -14.971 444 HA GLU 59 HA GLU 59 -4.353 -0.849 -17.583 445 1HB GLU 59 HB2 GLU 59 -4.691 -3.067 -17.889 446 2HB GLU 59 HB3 GLU 59 -5.529 -3.290 -16.357 447 1HG GLU 59 HG2 GLU 59 -7.551 -2.375 -17.194 448 2HG GLU 59 HG3 GLU 59 -6.811 -2.018 -18.769 449 H ASN 60 HN ASN 60 -6.505 -0.735 -14.779 450 HA ASN 60 HA ASN 60 -8.192 1.301 -16.110 451 1HB ASN 60 HB2 ASN 60 -8.980 -1.421 -15.169 452 2HB ASN 60 HB3 ASN 60 -10.049 -0.145 -14.635 453 1HD2 ASN 60 HD22 ASN 60 -9.817 -2.326 -17.076 454 2HD2 ASN 60 HD21 ASN 60 -10.607 -1.418 -18.337 455 H GLN 61 HN GLN 61 -6.057 1.660 -14.308 456 HA GLN 61 HA GLN 61 -7.001 1.707 -11.638 457 1HB GLN 61 HB2 GLN 61 -4.831 2.376 -11.028 458 2HB GLN 61 HB3 GLN 61 -4.630 1.398 -12.484 459 1HG GLN 61 HG2 GLN 61 -4.428 3.465 -13.846 460 2HG GLN 61 HG3 GLN 61 -4.437 4.391 -12.337 461 1HE2 GLN 61 HE22 GLN 61 -2.768 3.312 -10.574 462 2HE2 GLN 61 HE21 GLN 61 -1.174 3.156 -11.245 463 H GLU 62 HN GLU 62 -7.608 3.822 -14.163 464 HA GLU 62 HA GLU 62 -7.274 6.430 -13.359 465 1HB GLU 62 HB2 GLU 62 -9.395 4.932 -14.947 466 2HB GLU 62 HB3 GLU 62 -9.511 6.680 -14.713 467 1HG GLU 62 HG2 GLU 62 -8.485 6.280 -16.837 468 2HG GLU 62 HG3 GLU 62 -7.303 7.005 -15.750 469 H THR 63 HN THR 63 -10.183 4.384 -12.690 470 HA THR 63 HA THR 63 -11.526 6.246 -11.096 471 HB THR 63 HB THR 63 -11.544 3.217 -11.145 472 HG1 THR 63 HG1 THR 63 -13.195 3.605 -12.669 473 1HG2 THR 63 HG21 THR 63 -13.757 3.253 -10.222 474 2HG2 THR 63 HG22 THR 63 -12.708 4.048 -9.074 475 3HG2 THR 63 HG23 THR 63 -13.766 5.033 -10.114 476 H ALA 64 HN ALA 64 -8.830 4.121 -10.251 477 HA ALA 64 HA ALA 64 -9.376 4.059 -7.411 478 1HB ALA 64 HB1 ALA 64 -7.274 2.901 -7.277 479 2HB ALA 64 HB2 ALA 64 -8.004 2.386 -8.809 480 3HB ALA 64 HB3 ALA 64 -6.710 3.570 -8.821 481 H GLY 65 HN GLY 65 -6.632 5.549 -9.140 482 1HA GLY 65 HA2 GLY 65 -5.892 7.604 -7.523 483 2HA GLY 65 HA3 GLY 65 -6.024 7.786 -9.288 484 H LYS 66 HN LYS 66 -8.760 7.808 -9.733 485 HA LYS 66 HA LYS 66 -9.446 10.485 -9.183 486 1HB LYS 66 HB2 LYS 66 -10.220 9.093 -11.071 487 2HB LYS 66 HB3 LYS 66 -11.222 8.142 -9.965 488 1HG LYS 66 HG2 LYS 66 -12.532 10.223 -9.447 489 2HG LYS 66 HG3 LYS 66 -11.571 11.080 -10.663 490 1HD LYS 66 HD2 LYS 66 -13.414 8.687 -11.124 491 2HD LYS 66 HD3 LYS 66 -13.721 10.363 -11.597 492 1HE LYS 66 HE2 LYS 66 -11.721 10.267 -13.115 493 2HE LYS 66 HE3 LYS 66 -11.495 8.570 -12.681 494 1HZ LYS 66 HZ1 LYS 66 -12.646 8.716 -14.725 495 2HZ LYS 66 HZ2 LYS 66 -13.682 8.097 -13.660 496 3HZ LYS 66 HZ3 LYS 66 -13.835 9.678 -14.107 497 H TYR 67 HN TYR 67 -10.441 7.462 -7.479 498 HA TYR 67 HA TYR 67 -12.124 9.019 -5.698 499 1HB TYR 67 HB2 TYR 67 -11.818 6.094 -6.284 500 2HB TYR 67 HB3 TYR 67 -12.478 6.578 -4.740 501 HD1 TYR 67 HD1 TYR 67 -13.004 7.065 -8.432 502 HD2 TYR 67 HD2 TYR 67 -14.703 7.327 -4.477 503 HE1 TYR 67 HE1 TYR 67 -15.203 7.585 -9.426 504 HE2 TYR 67 HE2 TYR 67 -16.914 7.847 -5.460 505 HH TYR 67 HH TYR 67 -17.441 8.106 -9.007 506 H GLY 68 HN GLY 68 -8.857 8.445 -5.751 507 1HA GLY 68 HA2 GLY 68 -7.318 9.042 -4.142 508 2HA GLY 68 HA3 GLY 68 -8.593 9.164 -2.914 509 H VAL 69 HN VAL 69 -6.761 6.791 -4.937 510 HA VAL 69 HA VAL 69 -6.601 4.843 -2.798 511 HB VAL 69 HB VAL 69 -7.858 4.203 -5.516 512 1HG1 VAL 69 HG11 VAL 69 -7.068 2.354 -3.262 513 2HG1 VAL 69 HG12 VAL 69 -8.033 1.881 -4.686 514 3HG1 VAL 69 HG13 VAL 69 -6.369 2.424 -4.888 515 1HG2 VAL 69 HG21 VAL 69 -9.832 3.373 -4.301 516 2HG2 VAL 69 HG22 VAL 69 -9.170 4.060 -2.795 517 3HG2 VAL 69 HG23 VAL 69 -9.614 5.114 -4.156 518 H MET 70 HN MET 70 -4.460 4.213 -3.010 519 HA MET 70 HA MET 70 -3.231 4.239 -5.676 520 1HB MET 70 HB2 MET 70 -1.441 5.641 -5.155 521 2HB MET 70 HB3 MET 70 -2.946 6.488 -4.905 522 1HG MET 70 HG2 MET 70 -1.672 7.240 -3.181 523 2HG MET 70 HG3 MET 70 -2.678 6.033 -2.418 524 1HE MET 70 HE1 MET 70 0.681 6.623 -4.248 525 2HE MET 70 HE2 MET 70 1.801 5.436 -3.536 526 3HE MET 70 HE3 MET 70 0.534 4.903 -4.635 527 H SER 71 HN SER 71 -4.080 2.363 -3.422 528 HA SER 71 HA SER 71 -1.575 0.963 -2.832 529 1HB SER 71 HB2 SER 71 -3.045 0.438 -0.699 530 2HB SER 71 HB3 SER 71 -2.165 1.957 -0.867 531 HG SER 71 HG SER 71 -4.952 1.483 -1.189 532 H ILE 72 HN ILE 72 -2.043 -1.386 -2.068 533 HA ILE 72 HA ILE 72 -4.526 -2.471 -3.201 534 HB ILE 72 HB ILE 72 -2.329 -4.392 -3.278 535 1HG1 ILE 72 HG12 ILE 72 -1.003 -2.438 -3.997 536 2HG1 ILE 72 HG13 ILE 72 -1.067 -3.792 -5.096 537 1HG2 ILE 72 HG21 ILE 72 -4.548 -3.699 -5.172 538 2HG2 ILE 72 HG22 ILE 72 -3.250 -4.836 -5.587 539 3HG2 ILE 72 HG23 ILE 72 -4.265 -5.184 -4.203 540 1HD1 ILE 72 HD11 ILE 72 -2.514 -2.662 -6.608 541 2HD1 ILE 72 HD12 ILE 72 -2.766 -1.299 -5.499 542 3HD1 ILE 72 HD13 ILE 72 -1.165 -1.581 -6.200 543 HA PRO 73 HA PRO 73 -5.786 -4.135 -2.922 544 1HB PRO 73 HB2 PRO 73 -7.576 -5.565 -1.543 545 2HB PRO 73 HB3 PRO 73 -6.074 -6.344 -2.143 546 1HG PRO 73 HG2 PRO 73 -6.668 -5.284 0.621 547 2HG PRO 73 HG3 PRO 73 -5.936 -6.853 0.191 548 1HD PRO 73 HD2 PRO 73 -4.475 -4.584 0.908 549 2HD PRO 73 HD3 PRO 73 -3.827 -5.853 -0.160 550 H THR 74 HN THR 74 -7.762 -2.944 -3.020 551 HA THR 74 HA THR 74 -8.564 -1.524 -0.507 552 HB THR 74 HB THR 74 -8.187 -0.227 -3.221 553 HG1 THR 74 HG1 THR 74 -6.346 -0.299 -2.083 554 1HG2 THR 74 HG21 THR 74 -8.925 1.873 -1.985 555 2HG2 THR 74 HG22 THR 74 -10.215 0.749 -2.430 556 3HG2 THR 74 HG23 THR 74 -9.625 0.815 -0.758 557 H LEU 75 HN LEU 75 -10.740 -1.157 -0.229 558 HA LEU 75 HA LEU 75 -12.654 -2.359 -2.162 559 1HB LEU 75 HB2 LEU 75 -12.742 -2.451 0.883 560 2HB LEU 75 HB3 LEU 75 -14.092 -2.859 -0.157 561 HG LEU 75 HG LEU 75 -11.462 -4.387 -0.059 562 1HD1 LEU 75 HD11 LEU 75 -14.208 -5.104 1.096 563 2HD1 LEU 75 HD12 LEU 75 -12.745 -6.106 1.131 564 3HD1 LEU 75 HD13 LEU 75 -12.788 -4.590 2.030 565 1HD2 LEU 75 HD21 LEU 75 -14.093 -5.045 -1.470 566 2HD2 LEU 75 HD22 LEU 75 -12.565 -4.607 -2.245 567 3HD2 LEU 75 HD23 LEU 75 -12.674 -6.119 -1.346 568 H LEU 76 HN LEU 76 -14.371 -1.027 -2.551 569 HA LEU 76 HA LEU 76 -14.803 1.320 -0.831 570 1HB LEU 76 HB2 LEU 76 -15.202 1.394 -3.844 571 2HB LEU 76 HB3 LEU 76 -15.484 2.687 -2.689 572 HG LEU 76 HG LEU 76 -12.779 1.586 -3.526 573 1HD1 LEU 76 HD11 LEU 76 -12.503 3.757 -4.631 574 2HD1 LEU 76 HD12 LEU 76 -13.940 2.933 -5.250 575 3HD1 LEU 76 HD13 LEU 76 -14.120 4.267 -4.094 576 1HD2 LEU 76 HD21 LEU 76 -11.809 3.483 -2.273 577 2HD2 LEU 76 HD22 LEU 76 -13.425 3.930 -1.682 578 3HD2 LEU 76 HD23 LEU 76 -12.680 2.394 -1.197 579 H VAL 77 HN VAL 77 -16.646 0.704 0.186 580 HA VAL 77 HA VAL 77 -18.576 -1.075 -1.178 581 HB VAL 77 HB VAL 77 -18.933 0.174 1.564 582 1HG1 VAL 77 HG11 VAL 77 -20.311 -1.804 1.945 583 2HG1 VAL 77 HG12 VAL 77 -20.855 -0.952 0.496 584 3HG1 VAL 77 HG13 VAL 77 -19.883 -2.431 0.331 585 1HG2 VAL 77 HG21 VAL 77 -17.347 -2.349 0.987 586 2HG2 VAL 77 HG22 VAL 77 -16.756 -0.887 1.784 587 3HG2 VAL 77 HG23 VAL 77 -17.979 -1.883 2.575 588 H LEU 78 HN LEU 78 -19.907 -0.031 -2.589 589 HA LEU 78 HA LEU 78 -20.729 2.775 -1.998 590 1HB LEU 78 HB2 LEU 78 -20.149 1.331 -4.586 591 2HB LEU 78 HB3 LEU 78 -21.450 2.519 -4.540 592 HG LEU 78 HG LEU 78 -19.887 4.222 -3.635 593 1HD1 LEU 78 HD11 LEU 78 -17.734 2.168 -4.274 594 2HD1 LEU 78 HD12 LEU 78 -17.447 3.890 -3.909 595 3HD1 LEU 78 HD13 LEU 78 -18.120 2.831 -2.673 596 1HD2 LEU 78 HD21 LEU 78 -19.063 3.063 -6.308 597 2HD2 LEU 78 HD22 LEU 78 -20.462 4.120 -6.023 598 3HD2 LEU 78 HD23 LEU 78 -18.827 4.735 -5.750 599 H LYS 79 HN LYS 79 -22.898 3.302 -2.205 600 HA LYS 79 HA LYS 79 -24.855 1.120 -2.480 601 1HB LYS 79 HB2 LYS 79 -24.474 0.891 -0.227 602 2HB LYS 79 HB3 LYS 79 -24.182 2.619 0.029 603 1HG LYS 79 HG2 LYS 79 -26.474 3.162 -0.007 604 2HG LYS 79 HG3 LYS 79 -26.937 1.568 -0.649 605 1HD LYS 79 HD2 LYS 79 -26.166 0.504 1.453 606 2HD LYS 79 HD3 LYS 79 -25.694 2.090 2.097 607 1HE LYS 79 HE2 LYS 79 -28.008 2.875 1.974 608 2HE LYS 79 HE3 LYS 79 -28.516 1.358 1.209 609 1HZ LYS 79 HZ1 LYS 79 -27.798 0.211 3.269 610 2HZ LYS 79 HZ2 LYS 79 -27.530 1.667 3.981 611 3HZ LYS 79 HZ3 LYS 79 -29.038 1.258 3.518 612 H ASP 80 HN ASP 80 -26.385 1.808 -3.564 613 HA ASP 80 HA ASP 80 -27.604 3.057 -5.004 614 1HB ASP 80 HB2 ASP 80 -28.801 2.796 -2.841 615 2HB ASP 80 HB3 ASP 80 -28.272 4.412 -2.374 616 H GLY 81 HN GLY 81 -24.891 4.217 -4.960 617 1HA GLY 81 HA2 GLY 81 -24.691 6.102 -6.658 618 2HA GLY 81 HA3 GLY 81 -25.518 7.087 -5.453 619 H GLU 82 HN GLU 82 -23.919 5.766 -3.180 620 HA GLU 82 HA GLU 82 -21.443 7.301 -3.634 621 1HB GLU 82 HB2 GLU 82 -21.899 8.631 -1.729 622 2HB GLU 82 HB3 GLU 82 -23.380 8.593 -2.711 623 1HG GLU 82 HG2 GLU 82 -24.317 6.857 -1.174 624 2HG GLU 82 HG3 GLU 82 -22.882 7.016 -0.157 625 H VAL 83 HN VAL 83 -19.754 6.993 -2.028 626 HA VAL 83 HA VAL 83 -19.496 4.247 -1.115 627 HB VAL 83 HB VAL 83 -17.616 5.572 -1.984 628 1HG1 VAL 83 HG11 VAL 83 -17.730 7.193 0.587 629 2HG1 VAL 83 HG12 VAL 83 -16.481 7.268 -0.670 630 3HG1 VAL 83 HG13 VAL 83 -18.126 7.802 -1.035 631 1HG2 VAL 83 HG21 VAL 83 -17.205 3.630 -0.545 632 2HG2 VAL 83 HG22 VAL 83 -15.949 4.859 -0.361 633 3HG2 VAL 83 HG23 VAL 83 -17.192 4.678 0.890 634 H VAL 84 HN VAL 84 -19.876 3.405 0.754 635 HA VAL 84 HA VAL 84 -20.815 5.121 2.997 636 HB VAL 84 HB VAL 84 -22.347 3.254 3.570 637 1HG1 VAL 84 HG11 VAL 84 -24.099 3.883 1.992 638 2HG1 VAL 84 HG12 VAL 84 -23.129 5.299 2.411 639 3HG1 VAL 84 HG13 VAL 84 -22.891 4.500 0.846 640 1HG2 VAL 84 HG21 VAL 84 -23.001 1.589 1.929 641 2HG2 VAL 84 HG22 VAL 84 -21.814 2.192 0.762 642 3HG2 VAL 84 HG23 VAL 84 -21.278 1.415 2.271 643 H GLU 85 HN GLU 85 -18.687 2.515 1.942 644 HA GLU 85 HA GLU 85 -17.332 2.772 4.471 645 1HB GLU 85 HB2 GLU 85 -18.778 0.269 3.743 646 2HB GLU 85 HB3 GLU 85 -17.079 0.006 4.125 647 1HG GLU 85 HG2 GLU 85 -19.020 1.503 5.867 648 2HG GLU 85 HG3 GLU 85 -18.650 -0.229 6.012 649 H THR 86 HN THR 86 -15.201 1.704 4.397 650 HA THR 86 HA THR 86 -14.020 1.435 1.706 651 HB THR 86 HB THR 86 -12.440 3.294 3.294 652 HG1 THR 86 HG1 THR 86 -14.345 4.133 4.113 653 1HG2 THR 86 HG21 THR 86 -12.144 2.973 0.931 654 2HG2 THR 86 HG22 THR 86 -13.800 3.569 0.612 655 3HG2 THR 86 HG23 THR 86 -12.550 4.664 1.257 656 H SER 87 HN SER 87 -11.978 0.326 1.824 657 HA SER 87 HA SER 87 -10.672 -0.006 4.406 658 1HB SER 87 HB2 SER 87 -12.015 -2.331 2.978 659 2HB SER 87 HB3 SER 87 -10.562 -2.574 3.963 660 HG SER 87 HG SER 87 -12.723 -1.075 4.972 661 H VAL 88 HN VAL 88 -8.504 -0.377 4.123 662 HA VAL 88 HA VAL 88 -7.445 -0.611 1.356 663 HB VAL 88 HB VAL 88 -6.825 1.577 3.392 664 1HG1 VAL 88 HG11 VAL 88 -5.480 0.753 0.801 665 2HG1 VAL 88 HG12 VAL 88 -5.350 2.417 1.432 666 3HG1 VAL 88 HG13 VAL 88 -4.749 1.073 2.391 667 1HG2 VAL 88 HG21 VAL 88 -8.875 2.034 2.087 668 2HG2 VAL 88 HG22 VAL 88 -7.567 3.108 1.600 669 3HG2 VAL 88 HG23 VAL 88 -7.982 1.714 0.583 670 H GLY 89 HN GLY 89 -7.232 -2.786 2.077 671 1HA GLY 89 HA2 GLY 89 -4.913 -3.801 3.040 672 2HA GLY 89 HA3 GLY 89 -5.809 -3.477 4.536 673 H PHE 90 HN PHE 90 -5.087 -6.106 3.624 674 HA PHE 90 HA PHE 90 -7.220 -7.414 2.256 675 1HB PHE 90 HB2 PHE 90 -4.972 -8.361 2.339 676 2HB PHE 90 HB3 PHE 90 -5.020 -8.432 4.096 677 HD1 PHE 90 HD1 PHE 90 -6.416 -9.940 0.975 678 HD2 PHE 90 HD2 PHE 90 -6.098 -10.249 5.270 679 HE1 PHE 90 HE1 PHE 90 -7.449 -12.198 0.902 680 HE2 PHE 90 HE2 PHE 90 -7.104 -12.513 5.178 681 HZ PHE 90 HZ PHE 90 -7.786 -13.489 2.994 682 H LYS 91 HN LYS 91 -8.899 -8.760 3.084 683 HA LYS 91 HA LYS 91 -9.279 -8.936 5.987 684 1HB LYS 91 HB2 LYS 91 -10.942 -7.185 4.337 685 2HB LYS 91 HB3 LYS 91 -11.883 -8.593 4.791 686 1HG LYS 91 HG2 LYS 91 -12.368 -7.225 6.534 687 2HG LYS 91 HG3 LYS 91 -11.045 -8.163 7.211 688 1HD LYS 91 HD2 LYS 91 -10.676 -5.989 7.921 689 2HD LYS 91 HD3 LYS 91 -9.512 -6.188 6.605 690 1HE LYS 91 HE2 LYS 91 -10.915 -4.921 5.080 691 2HE LYS 91 HE3 LYS 91 -12.286 -4.994 6.193 692 1HZ LYS 91 HZ1 LYS 91 -11.053 -3.588 7.732 693 2HZ LYS 91 HZ2 LYS 91 -9.795 -3.477 6.690 694 3HZ LYS 91 HZ3 LYS 91 -11.266 -2.855 6.290 695 HA PRO 92 HA PRO 92 -10.254 -13.034 4.332 696 1HB PRO 92 HB2 PRO 92 -11.318 -14.282 6.516 697 2HB PRO 92 HB3 PRO 92 -9.580 -13.872 6.397 698 1HG PRO 92 HG2 PRO 92 -11.778 -12.285 7.764 699 2HG PRO 92 HG3 PRO 92 -10.189 -12.777 8.441 700 1HD PRO 92 HD2 PRO 92 -10.549 -10.309 7.369 701 2HD PRO 92 HD3 PRO 92 -9.021 -11.196 7.119 702 H LYS 93 HN LYS 93 -12.207 -14.454 4.070 703 HA LYS 93 HA LYS 93 -14.326 -13.225 2.810 704 1HB LYS 93 HB2 LYS 93 -13.880 -15.482 2.351 705 2HB LYS 93 HB3 LYS 93 -13.845 -15.932 4.049 706 1HG LYS 93 HG2 LYS 93 -15.721 -16.943 3.030 707 2HG LYS 93 HG3 LYS 93 -16.268 -15.774 4.218 708 1HD LYS 93 HD2 LYS 93 -16.732 -14.156 2.311 709 2HD LYS 93 HD3 LYS 93 -16.320 -15.444 1.175 710 1HE LYS 93 HE2 LYS 93 -18.427 -15.679 3.388 711 2HE LYS 93 HE3 LYS 93 -18.817 -15.171 1.746 712 1HZ LYS 93 HZ1 LYS 93 -17.548 -17.788 2.331 713 2HZ LYS 93 HZ2 LYS 93 -19.156 -17.588 2.210 714 3HZ LYS 93 HZ3 LYS 93 -18.216 -17.281 0.907 715 H GLU 94 HN GLU 94 -14.406 -14.350 6.257 716 HA GLU 94 HA GLU 94 -17.133 -13.628 6.510 717 1HB GLU 94 HB2 GLU 94 -14.961 -13.934 8.631 718 2HB GLU 94 HB3 GLU 94 -16.692 -13.736 8.978 719 1HG GLU 94 HG2 GLU 94 -17.187 -15.812 7.691 720 2HG GLU 94 HG3 GLU 94 -15.462 -16.038 7.389 721 H ALA 95 HN ALA 95 -14.126 -11.813 7.247 722 HA ALA 95 HA ALA 95 -15.491 -9.580 8.417 723 1HB ALA 95 HB1 ALA 95 -12.744 -9.755 7.140 724 2HB ALA 95 HB2 ALA 95 -13.326 -8.477 8.243 725 3HB ALA 95 HB3 ALA 95 -13.104 -10.128 8.845 726 H LEU 96 HN LEU 96 -14.531 -10.516 5.145 727 HA LEU 96 HA LEU 96 -15.121 -8.137 3.742 728 1HB LEU 96 HB2 LEU 96 -14.379 -10.787 3.060 729 2HB LEU 96 HB3 LEU 96 -15.983 -10.636 2.397 730 HG LEU 96 HG LEU 96 -15.126 -8.397 1.337 731 1HD1 LEU 96 HD11 LEU 96 -12.663 -8.403 0.930 732 2HD1 LEU 96 HD12 LEU 96 -13.043 -8.211 2.649 733 3HD1 LEU 96 HD13 LEU 96 -12.489 -9.780 2.032 734 1HD2 LEU 96 HD21 LEU 96 -15.596 -10.111 -0.165 735 2HD2 LEU 96 HD22 LEU 96 -13.871 -9.874 -0.450 736 3HD2 LEU 96 HD23 LEU 96 -14.447 -11.230 0.546 737 H GLN 97 HN GLN 97 -17.210 -10.968 4.467 738 HA GLN 97 HA GLN 97 -19.487 -9.783 3.255 739 1HB GLN 97 HB2 GLN 97 -20.568 -11.661 3.645 740 2HB GLN 97 HB3 GLN 97 -18.937 -12.292 3.794 741 1HG GLN 97 HG2 GLN 97 -19.167 -12.317 6.191 742 2HG GLN 97 HG3 GLN 97 -20.825 -11.668 6.058 743 1HE2 GLN 97 HE22 GLN 97 -22.163 -13.053 4.208 744 2HE2 GLN 97 HE21 GLN 97 -22.088 -14.785 4.440 745 H GLU 98 HN GLU 98 -18.335 -9.828 6.648 746 HA GLU 98 HA GLU 98 -20.558 -8.469 7.738 747 1HB GLU 98 HB2 GLU 98 -18.891 -9.566 9.099 748 2HB GLU 98 HB3 GLU 98 -17.630 -8.449 8.549 749 1HG GLU 98 HG2 GLU 98 -18.755 -6.571 9.643 750 2HG GLU 98 HG3 GLU 98 -20.121 -7.603 10.085 751 H LEU 99 HN LEU 99 -17.585 -7.157 6.245 752 HA LEU 99 HA LEU 99 -17.958 -4.467 6.902 753 1HB LEU 99 HB2 LEU 99 -15.847 -5.332 6.051 754 2HB LEU 99 HB3 LEU 99 -16.593 -5.718 4.500 755 HG LEU 99 HG LEU 99 -16.967 -3.300 4.064 756 1HD1 LEU 99 HD11 LEU 99 -15.456 -2.893 6.680 757 2HD1 LEU 99 HD12 LEU 99 -15.740 -1.627 5.467 758 3HD1 LEU 99 HD13 LEU 99 -17.114 -2.361 6.294 759 1HD2 LEU 99 HD21 LEU 99 -14.092 -4.010 4.734 760 2HD2 LEU 99 HD22 LEU 99 -14.968 -4.462 3.255 761 3HD2 LEU 99 HD23 LEU 99 -14.640 -2.756 3.598 762 H VAL 100 HN VAL 100 -19.179 -6.275 4.086 763 HA VAL 100 HA VAL 100 -20.495 -3.817 3.125 764 HB VAL 100 HB VAL 100 -19.403 -5.124 1.524 765 1HG1 VAL 100 HG11 VAL 100 -20.208 -7.315 0.746 766 2HG1 VAL 100 HG12 VAL 100 -19.666 -7.429 2.418 767 3HG1 VAL 100 HG13 VAL 100 -21.400 -7.385 2.061 768 1HG2 VAL 100 HG21 VAL 100 -21.569 -3.846 1.009 769 2HG2 VAL 100 HG22 VAL 100 -21.086 -5.077 -0.163 770 3HG2 VAL 100 HG23 VAL 100 -22.393 -5.405 0.998 771 H ASN 101 HN ASN 101 -21.504 -6.891 4.707 772 HA ASN 101 HA ASN 101 -24.298 -6.552 4.546 773 1HB ASN 101 HB2 ASN 101 -23.293 -8.618 5.281 774 2HB ASN 101 HB3 ASN 101 -22.586 -7.824 6.695 775 1HD2 ASN 101 HD22 ASN 101 -23.914 -7.334 8.498 776 2HD2 ASN 101 HD21 ASN 101 -25.559 -7.898 8.625 777 H LYS 102 HN LYS 102 -21.963 -4.870 6.595 778 HA LYS 102 HA LYS 102 -23.641 -3.704 8.541 779 1HB LYS 102 HB2 LYS 102 -21.144 -2.882 7.072 780 2HB LYS 102 HB3 LYS 102 -21.955 -1.690 8.084 781 1HG LYS 102 HG2 LYS 102 -21.484 -2.693 10.042 782 2HG LYS 102 HG3 LYS 102 -21.417 -4.325 9.367 783 1HD LYS 102 HD2 LYS 102 -19.236 -3.304 10.244 784 2HD LYS 102 HD3 LYS 102 -19.235 -4.124 8.698 785 1HE LYS 102 HE2 LYS 102 -17.893 -2.205 8.437 786 2HE LYS 102 HE3 LYS 102 -19.384 -1.951 7.519 787 1HZ LYS 102 HZ1 LYS 102 -20.113 -0.401 9.139 788 2HZ LYS 102 HZ2 LYS 102 -18.915 -0.793 10.201 789 3HZ LYS 102 HZ3 LYS 102 -18.550 -0.028 8.800 790 H HIS 103 HN HIS 103 -23.539 -3.045 5.071 791 HA HIS 103 HA HIS 103 -25.430 -0.753 5.460 792 1HB HIS 103 HB2 HIS 103 -23.211 -1.011 3.391 793 2HB HIS 103 HB3 HIS 103 -24.323 0.350 3.584 794 HD1 HIS 103 HD1 HIS 103 -24.008 1.795 5.953 795 HD2 HIS 103 HD2 HIS 103 -21.159 -1.193 5.090 796 HE1 HIS 103 HE1 HIS 103 -22.148 2.069 7.663 797 H LEU 104 HN LEU 104 -24.736 -3.707 3.741 798 HA LEU 104 HA LEU 104 -26.703 -3.439 1.631 799 1HB LEU 104 HB2 LEU 104 -24.922 -4.939 1.242 800 2HB LEU 104 HB3 LEU 104 -25.031 -5.612 2.859 801 HG LEU 104 HG LEU 104 -27.127 -6.740 2.345 802 1HD1 LEU 104 HD11 LEU 104 -26.727 -5.689 -0.505 803 2HD1 LEU 104 HD12 LEU 104 -27.977 -6.828 0.027 804 3HD1 LEU 104 HD13 LEU 104 -28.017 -5.162 0.592 805 1HD2 LEU 104 HD21 LEU 104 -24.942 -7.273 0.304 806 2HD2 LEU 104 HD22 LEU 104 -24.940 -7.779 2.011 807 3HD2 LEU 104 HD23 LEU 104 -26.159 -8.424 0.915 808 1H MET 1 H1 MET 1 6.626 26.556 -11.307 809 2H MET 1 H2 MET 1 7.318 28.005 -11.597 810 3H MET 1 H3 MET 1 5.891 27.634 -12.309 811 HA MET 1 HA MET 1 5.563 29.171 -10.479 812 1HB MET 1 HB2 MET 1 4.473 26.354 -10.004 813 2HB MET 1 HB3 MET 1 3.968 27.771 -9.087 814 1HG MET 1 HG2 MET 1 3.624 27.397 -12.083 815 2HG MET 1 HG3 MET 1 2.377 27.268 -10.850 816 1HE MET 1 HE1 MET 1 2.048 29.024 -13.461 817 2HE MET 1 HE2 MET 1 0.806 28.883 -12.196 818 3HE MET 1 HE3 MET 1 1.299 30.486 -12.784 819 H GLU 2 HN GLU 2 5.759 29.582 -8.157 820 HA GLU 2 HA GLU 2 8.220 28.440 -7.014 821 1HB GLU 2 HB2 GLU 2 6.370 30.690 -6.104 822 2HB GLU 2 HB3 GLU 2 7.891 30.233 -5.314 823 1HG GLU 2 HG2 GLU 2 9.135 30.722 -7.403 824 2HG GLU 2 HG3 GLU 2 7.639 31.252 -8.174 825 H ASN 3 HN ASN 3 6.192 26.494 -7.246 826 HA ASN 3 HA ASN 3 6.150 25.504 -4.645 827 1HB ASN 3 HB2 ASN 3 3.424 25.877 -5.952 828 2HB ASN 3 HB3 ASN 3 3.833 24.729 -4.666 829 1HD2 ASN 3 HD22 ASN 3 4.938 25.821 -2.639 830 2HD2 ASN 3 HD21 ASN 3 4.187 27.297 -2.104 831 H LYS 4 HN LYS 4 6.650 23.623 -5.034 832 HA LYS 4 HA LYS 4 5.653 21.893 -7.201 833 1HB LYS 4 HB2 LYS 4 8.524 22.088 -6.142 834 2HB LYS 4 HB3 LYS 4 7.920 20.808 -7.192 835 1HG LYS 4 HG2 LYS 4 8.720 22.047 -8.850 836 2HG LYS 4 HG3 LYS 4 7.215 22.963 -8.677 837 1HD LYS 4 HD2 LYS 4 8.314 24.732 -7.491 838 2HD LYS 4 HD3 LYS 4 9.787 23.770 -7.241 839 1HE LYS 4 HE2 LYS 4 10.356 23.807 -9.559 840 2HE LYS 4 HE3 LYS 4 8.740 24.346 -10.028 841 1HZ LYS 4 HZ1 LYS 4 10.734 26.044 -8.606 842 2HZ LYS 4 HZ2 LYS 4 10.295 26.144 -10.166 843 3HZ LYS 4 HZ3 LYS 4 9.189 26.474 -9.012 844 H ILE 5 HN ILE 5 4.631 20.146 -6.247 845 HA ILE 5 HA ILE 5 5.074 19.692 -3.336 846 HB ILE 5 HB ILE 5 2.954 18.728 -5.277 847 1HG1 ILE 5 HG12 ILE 5 2.869 21.205 -4.372 848 2HG1 ILE 5 HG13 ILE 5 1.437 20.214 -4.555 849 1HG2 ILE 5 HG21 ILE 5 1.812 17.750 -3.285 850 2HG2 ILE 5 HG22 ILE 5 3.391 17.008 -3.555 851 3HG2 ILE 5 HG23 ILE 5 3.226 18.219 -2.280 852 1HD1 ILE 5 HD11 ILE 5 1.277 19.794 -2.192 853 2HD1 ILE 5 HD12 ILE 5 2.870 20.517 -1.901 854 3HD1 ILE 5 HD13 ILE 5 1.512 21.533 -2.432 855 H ILE 6 HN ILE 6 6.244 17.835 -2.767 856 HA ILE 6 HA ILE 6 6.631 15.721 -4.799 857 HB ILE 6 HB ILE 6 8.561 17.287 -4.941 858 1HG1 ILE 6 HG12 ILE 6 9.105 14.438 -4.055 859 2HG1 ILE 6 HG13 ILE 6 8.812 15.057 -5.682 860 1HG2 ILE 6 HG21 ILE 6 8.650 18.001 -2.559 861 2HG2 ILE 6 HG22 ILE 6 9.318 16.405 -2.137 862 3HG2 ILE 6 HG23 ILE 6 10.211 17.511 -3.200 863 1HD1 ILE 6 HD11 ILE 6 11.294 15.603 -4.003 864 2HD1 ILE 6 HD12 ILE 6 11.165 14.591 -5.447 865 3HD1 ILE 6 HD13 ILE 6 10.940 16.345 -5.582 866 H TYR 7 HN TYR 7 6.424 13.682 -3.843 867 HA TYR 7 HA TYR 7 5.752 13.757 -0.932 868 1HB TYR 7 HB2 TYR 7 3.999 13.503 -2.975 869 2HB TYR 7 HB3 TYR 7 4.464 11.824 -2.823 870 HD1 TYR 7 HD1 TYR 7 3.471 10.504 -1.051 871 HD2 TYR 7 HD2 TYR 7 3.254 14.807 -0.923 872 HE1 TYR 7 HE1 TYR 7 1.736 10.369 0.717 873 HE2 TYR 7 HE2 TYR 7 1.623 14.667 0.941 874 HH TYR 7 HH TYR 7 0.343 11.563 2.173 875 H PHE 8 HN PHE 8 6.533 12.102 0.324 876 HA PHE 8 HA PHE 8 8.407 10.182 -1.010 877 1HB PHE 8 HB2 PHE 8 8.518 11.532 1.703 878 2HB PHE 8 HB3 PHE 8 9.585 10.240 1.194 879 HD1 PHE 8 HD1 PHE 8 9.280 12.255 -1.731 880 HD2 PHE 8 HD2 PHE 8 11.077 12.215 2.188 881 HE1 PHE 8 HE1 PHE 8 10.856 13.962 -2.455 882 HE2 PHE 8 HE2 PHE 8 12.737 13.873 1.383 883 HZ PHE 8 HZ PHE 8 12.566 14.836 -0.883 884 H LEU 9 HN LEU 9 8.368 8.034 -0.299 885 HA LEU 9 HA LEU 9 6.067 7.227 1.425 886 1HB LEU 9 HB2 LEU 9 6.748 6.484 -1.419 887 2HB LEU 9 HB3 LEU 9 6.099 5.246 -0.373 888 HG LEU 9 HG LEU 9 4.737 7.840 -1.154 889 1HD1 LEU 9 HD11 LEU 9 3.897 4.959 -1.643 890 2HD1 LEU 9 HD12 LEU 9 3.244 6.425 -2.384 891 3HD1 LEU 9 HD13 LEU 9 4.868 5.872 -2.809 892 1HD2 LEU 9 HD21 LEU 9 2.683 6.863 -0.032 893 2HD2 LEU 9 HD22 LEU 9 3.729 5.654 0.727 894 3HD2 LEU 9 HD23 LEU 9 3.941 7.379 1.101 895 H SER 10 HN SER 10 6.597 5.724 2.955 896 HA SER 10 HA SER 10 8.901 3.961 2.586 897 1HB SER 10 HB2 SER 10 8.713 5.906 4.942 898 2HB SER 10 HB3 SER 10 9.810 4.537 4.818 899 HG SER 10 HG SER 10 9.836 7.008 3.499 900 H THR 11 HN THR 11 8.576 2.038 3.778 901 HA THR 11 HA THR 11 6.087 1.287 4.643 902 HB THR 11 HB THR 11 8.756 0.228 5.616 903 HG1 THR 11 HG1 THR 11 8.639 -1.021 3.732 904 1HG2 THR 11 HG21 THR 11 7.616 -1.894 5.866 905 2HG2 THR 11 HG22 THR 11 6.762 -0.696 6.824 906 3HG2 THR 11 HG23 THR 11 6.086 -1.198 5.261 907 H GLY 12 HN GLY 12 4.899 1.847 6.299 908 1HA GLY 12 HA2 GLY 12 4.157 2.781 8.254 909 2HA GLY 12 HA3 GLY 12 5.503 1.906 9.012 910 H ASN 13 HN ASN 13 5.859 4.456 6.584 911 HA ASN 13 HA ASN 13 7.961 5.637 7.337 912 1HB ASN 13 HB2 ASN 13 6.784 6.596 5.468 913 2HB ASN 13 HB3 ASN 13 5.623 7.369 6.548 914 1HD2 ASN 13 HD22 ASN 13 6.117 9.569 6.525 915 2HD2 ASN 13 HD21 ASN 13 7.704 10.195 6.948 916 H SER 14 HN SER 14 8.691 5.708 9.267 917 HA SER 14 HA SER 14 7.938 8.088 10.864 918 1HB SER 14 HB2 SER 14 8.822 5.386 11.977 919 2HB SER 14 HB3 SER 14 8.380 6.823 12.910 920 HG SER 14 HG SER 14 6.690 5.281 11.205 921 H ALA 15 HN ALA 15 10.210 6.755 8.800 922 HA ALA 15 HA ALA 15 12.477 7.902 10.307 923 1HB ALA 15 HB1 ALA 15 12.420 5.509 10.870 924 2HB ALA 15 HB2 ALA 15 12.487 5.071 9.163 925 3HB ALA 15 HB3 ALA 15 13.862 5.914 9.911 926 H ARG 16 HN ARG 16 12.413 5.919 7.326 927 HA ARG 16 HA ARG 16 14.478 7.303 6.141 928 1HB ARG 16 HB2 ARG 16 12.737 6.350 4.032 929 2HB ARG 16 HB3 ARG 16 14.336 5.827 4.501 930 1HG ARG 16 HG2 ARG 16 13.397 4.252 6.120 931 2HG ARG 16 HG3 ARG 16 11.752 4.865 5.821 932 1HD ARG 16 HD2 ARG 16 11.874 4.182 3.471 933 2HD ARG 16 HD3 ARG 16 13.553 3.679 3.717 934 HE ARG 16 HE ARG 16 12.608 2.111 5.477 935 1HH1 ARG 16 HH11 ARG 16 11.038 2.734 2.314 936 2HH1 ARG 16 HH12 ARG 16 10.127 1.272 2.351 937 1HH2 ARG 16 HH22 ARG 16 11.632 0.123 5.369 938 2HH2 ARG 16 HH21 ARG 16 10.545 -0.321 4.090 939 H SER 17 HN SER 17 10.939 7.978 5.444 940 HA SER 17 HA SER 17 11.649 10.031 3.604 941 1HB SER 17 HB2 SER 17 9.123 9.880 5.216 942 2HB SER 17 HB3 SER 17 9.375 10.682 3.663 943 HG SER 17 HG SER 17 8.340 8.644 3.420 944 H GLN 18 HN GLN 18 11.422 10.037 7.164 945 HA GLN 18 HA GLN 18 11.082 12.854 7.508 946 1HB GLN 18 HB2 GLN 18 12.590 11.262 9.533 947 2HB GLN 18 HB3 GLN 18 11.459 12.573 9.758 948 1HG GLN 18 HG2 GLN 18 10.789 9.694 9.090 949 2HG GLN 18 HG3 GLN 18 10.580 10.499 10.624 950 1HE2 GLN 18 HE22 GLN 18 8.267 10.833 10.965 951 2HE2 GLN 18 HE21 GLN 18 7.267 11.516 9.719 952 H MET 19 HN MET 19 13.891 10.690 7.563 953 HA MET 19 HA MET 19 15.778 12.805 7.920 954 1HB MET 19 HB2 MET 19 17.484 11.010 7.322 955 2HB MET 19 HB3 MET 19 16.445 10.716 8.705 956 1HG MET 19 HG2 MET 19 14.988 9.466 6.824 957 2HG MET 19 HG3 MET 19 16.558 9.281 6.083 958 1HE MET 19 HE1 MET 19 18.427 7.052 8.588 959 2HE MET 19 HE2 MET 19 18.278 7.607 6.881 960 3HE MET 19 HE3 MET 19 18.509 8.787 8.225 961 H ALA 20 HN ALA 20 14.520 11.047 5.022 962 HA ALA 20 HA ALA 20 16.197 12.308 3.129 963 1HB ALA 20 HB1 ALA 20 14.508 11.642 1.475 964 2HB ALA 20 HB2 ALA 20 14.815 10.311 2.608 965 3HB ALA 20 HB3 ALA 20 13.344 11.295 2.768 966 H GLU 21 HN GLU 21 13.001 13.349 4.458 967 HA GLU 21 HA GLU 21 12.934 15.573 2.664 968 1HB GLU 21 HB2 GLU 21 10.997 16.311 3.687 969 2HB GLU 21 HB3 GLU 21 10.908 14.550 3.633 970 1HG GLU 21 HG2 GLU 21 11.462 14.474 6.044 971 2HG GLU 21 HG3 GLU 21 11.591 16.237 6.060 972 H GLY 22 HN GLY 22 14.335 15.188 5.894 973 1HA GLY 22 HA2 GLY 22 15.000 17.957 6.308 974 2HA GLY 22 HA3 GLY 22 15.840 16.542 6.982 975 H TRP 23 HN TRP 23 16.800 15.186 4.831 976 HA TRP 23 HA TRP 23 19.068 16.594 3.919 977 1HB TRP 23 HB2 TRP 23 17.643 14.036 3.193 978 2HB TRP 23 HB3 TRP 23 18.829 14.665 2.067 979 HD1 TRP 23 HD1 TRP 23 18.621 12.478 4.972 980 HE1 TRP 23 HE1 TRP 23 20.895 12.014 6.004 981 HE3 TRP 23 HE3 TRP 23 21.338 15.971 2.458 982 HZ2 TRP 23 HZ2 TRP 23 23.616 13.051 5.770 983 HZ3 TRP 23 HZ3 TRP 23 23.793 16.175 2.813 984 HH2 TRP 23 HH2 TRP 23 24.938 14.706 4.452 985 H ALA 24 HN ALA 24 15.851 16.246 2.454 986 HA ALA 24 HA ALA 24 16.626 17.307 -0.088 987 1HB ALA 24 HB1 ALA 24 14.236 17.283 -0.554 988 2HB ALA 24 HB2 ALA 24 14.666 15.787 0.288 989 3HB ALA 24 HB3 ALA 24 13.835 17.102 1.152 990 H LYS 25 HN LYS 25 14.731 18.752 2.695 991 HA LYS 25 HA LYS 25 14.251 21.033 1.108 992 1HB LYS 25 HB2 LYS 25 13.039 20.034 3.365 993 2HB LYS 25 HB3 LYS 25 13.843 21.479 4.016 994 1HG LYS 25 HG2 LYS 25 12.875 22.784 2.087 995 2HG LYS 25 HG3 LYS 25 12.041 21.307 1.559 996 1HD LYS 25 HD2 LYS 25 10.855 21.351 3.832 997 2HD LYS 25 HD3 LYS 25 11.511 22.984 4.033 998 1HE LYS 25 HE2 LYS 25 9.675 21.966 1.807 999 2HE LYS 25 HE3 LYS 25 9.238 23.097 3.082 1000 1HZ LYS 25 HZ1 LYS 25 10.675 24.732 2.068 1001 2HZ LYS 25 HZ2 LYS 25 11.222 23.664 0.934 1002 3HZ LYS 25 HZ3 LYS 25 9.676 24.119 0.909 1003 H GLN 26 HN GLN 26 17.040 20.371 3.053 1004 HA GLN 26 HA GLN 26 17.891 23.068 3.364 1005 1HB GLN 26 HB2 GLN 26 20.211 22.106 3.363 1006 2HB GLN 26 HB3 GLN 26 19.113 21.432 4.569 1007 1HG GLN 26 HG2 GLN 26 18.973 19.372 3.547 1008 2HG GLN 26 HG3 GLN 26 19.210 20.015 1.936 1009 1HE2 GLN 26 HE22 GLN 26 20.502 18.057 1.792 1010 2HE2 GLN 26 HE21 GLN 26 22.211 18.150 2.231 1011 H TYR 27 HN TYR 27 17.487 21.252 0.418 1012 HA TYR 27 HA TYR 27 18.850 23.462 -1.071 1013 1HB TYR 27 HB2 TYR 27 18.895 20.467 -1.580 1014 2HB TYR 27 HB3 TYR 27 19.086 21.628 -2.875 1015 HD1 TYR 27 HD1 TYR 27 21.123 22.614 -3.423 1016 HD2 TYR 27 HD2 TYR 27 20.660 20.550 0.325 1017 HE1 TYR 27 HE1 TYR 27 23.565 22.763 -3.049 1018 HE2 TYR 27 HE2 TYR 27 23.097 20.720 0.739 1019 HH TYR 27 HH TYR 27 25.338 22.262 -1.615 1020 H LEU 28 HN LEU 28 16.162 21.114 -0.988 1021 HA LEU 28 HA LEU 28 14.753 22.327 -3.238 1022 1HB LEU 28 HB2 LEU 28 13.853 20.232 -1.200 1023 2HB LEU 28 HB3 LEU 28 12.917 20.797 -2.568 1024 HG LEU 28 HG LEU 28 15.420 19.102 -2.610 1025 1HD1 LEU 28 HD11 LEU 28 12.677 18.645 -3.865 1026 2HD1 LEU 28 HD12 LEU 28 13.996 17.469 -3.681 1027 3HD1 LEU 28 HD13 LEU 28 13.115 18.060 -2.260 1028 1HD2 LEU 28 HD21 LEU 28 15.300 19.099 -5.067 1029 2HD2 LEU 28 HD22 LEU 28 14.019 20.326 -5.027 1030 3HD2 LEU 28 HD23 LEU 28 15.654 20.719 -4.466 1031 H GLY 29 HN GLY 29 15.103 24.393 -2.187 1032 1HA GLY 29 HA2 GLY 29 14.235 25.177 0.351 1033 2HA GLY 29 HA3 GLY 29 14.602 26.251 -0.995 1034 H ASP 30 HN ASP 30 13.009 27.747 -0.547 1035 HA ASP 30 HA ASP 30 10.415 27.239 0.370 1036 1HB ASP 30 HB2 ASP 30 11.575 29.392 0.544 1037 2HB ASP 30 HB3 ASP 30 11.486 29.604 -1.207 1038 H GLU 31 HN GLU 31 11.622 27.099 -2.902 1039 HA GLU 31 HA GLU 31 9.153 27.326 -4.343 1040 1HB GLU 31 HB2 GLU 31 11.783 25.909 -4.959 1041 2HB GLU 31 HB3 GLU 31 10.441 26.029 -6.102 1042 1HG GLU 31 HG2 GLU 31 10.582 28.482 -6.037 1043 2HG GLU 31 HG3 GLU 31 11.946 28.374 -4.899 1044 H TRP 32 HN TRP 32 10.191 24.822 -2.192 1045 HA TRP 32 HA TRP 32 8.550 22.798 -3.649 1046 1HB TRP 32 HB2 TRP 32 11.051 22.411 -1.989 1047 2HB TRP 32 HB3 TRP 32 10.105 21.131 -2.730 1048 HD1 TRP 32 HD1 TRP 32 12.424 24.031 -3.685 1049 HE1 TRP 32 HE1 TRP 32 13.364 23.653 -6.042 1050 HE3 TRP 32 HE3 TRP 32 9.821 19.798 -4.929 1051 HZ2 TRP 32 HZ2 TRP 32 12.994 21.813 -8.200 1052 HZ3 TRP 32 HZ3 TRP 32 10.151 18.743 -7.150 1053 HH2 TRP 32 HH2 TRP 32 11.716 19.744 -8.799 1054 H LYS 33 HN LYS 33 7.397 21.338 -2.500 1055 HA LYS 33 HA LYS 33 6.988 21.695 0.432 1056 1HB LYS 33 HB2 LYS 33 4.927 21.494 -1.811 1057 2HB LYS 33 HB3 LYS 33 4.525 21.144 -0.140 1058 1HG LYS 33 HG2 LYS 33 5.774 23.777 -1.027 1059 2HG LYS 33 HG3 LYS 33 4.029 23.526 -1.007 1060 1HD LYS 33 HD2 LYS 33 5.868 23.379 1.426 1061 2HD LYS 33 HD3 LYS 33 4.862 24.755 0.968 1062 1HE LYS 33 HE2 LYS 33 2.823 23.326 1.167 1063 2HE LYS 33 HE3 LYS 33 3.831 21.976 1.702 1064 1HZ LYS 33 HZ1 LYS 33 2.864 23.151 3.570 1065 2HZ LYS 33 HZ2 LYS 33 4.483 23.312 3.623 1066 3HZ LYS 33 HZ3 LYS 33 3.547 24.559 3.127 1067 H VAL 34 HN VAL 34 8.401 20.089 0.640 1068 HA VAL 34 HA VAL 34 7.903 17.420 -0.425 1069 HB VAL 34 HB VAL 34 10.187 18.089 -0.031 1070 1HG1 VAL 34 HG11 VAL 34 11.135 18.511 2.168 1071 2HG1 VAL 34 HG12 VAL 34 9.885 19.712 1.811 1072 3HG1 VAL 34 HG13 VAL 34 9.535 18.377 2.927 1073 1HG2 VAL 34 HG21 VAL 34 9.359 15.966 1.976 1074 2HG2 VAL 34 HG22 VAL 34 9.555 15.722 0.231 1075 3HG2 VAL 34 HG23 VAL 34 10.953 16.178 1.216 1076 H TYR 35 HN TYR 35 6.768 15.835 0.649 1077 HA TYR 35 HA TYR 35 6.057 16.157 3.457 1078 1HB TYR 35 HB2 TYR 35 4.142 17.166 2.054 1079 2HB TYR 35 HB3 TYR 35 3.829 15.526 1.514 1080 HD1 TYR 35 HD1 TYR 35 3.978 17.800 4.462 1081 HD2 TYR 35 HD2 TYR 35 2.753 13.907 3.063 1082 HE1 TYR 35 HE1 TYR 35 2.758 17.424 6.580 1083 HE2 TYR 35 HE2 TYR 35 1.532 13.523 5.165 1084 HH TYR 35 HH TYR 35 1.444 15.947 7.823 1085 H SER 36 HN SER 36 5.086 13.940 4.222 1086 HA SER 36 HA SER 36 6.316 11.717 2.688 1087 1HB SER 36 HB2 SER 36 7.459 11.124 4.834 1088 2HB SER 36 HB3 SER 36 8.062 12.607 4.077 1089 HG SER 36 HG SER 36 7.745 13.447 5.929 1090 H ALA 37 HN ALA 37 5.463 9.676 3.101 1091 HA ALA 37 HA ALA 37 3.408 9.330 5.157 1092 1HB ALA 37 HB1 ALA 37 2.851 9.182 2.168 1093 2HB ALA 37 HB2 ALA 37 1.704 8.788 3.456 1094 3HB ALA 37 HB3 ALA 37 2.244 10.456 3.268 1095 H GLY 38 HN GLY 38 2.283 7.062 4.716 1096 1HA GLY 38 HA2 GLY 38 3.590 5.078 3.196 1097 2HA GLY 38 HA3 GLY 38 4.214 5.014 4.845 1098 H ILE 39 HN ILE 39 3.072 2.848 4.136 1099 HA ILE 39 HA ILE 39 0.441 2.219 4.228 1100 HB ILE 39 HB ILE 39 1.911 0.544 3.841 1101 1HG1 ILE 39 HG12 ILE 39 1.064 -0.212 6.663 1102 2HG1 ILE 39 HG13 ILE 39 -0.122 0.024 5.391 1103 1HG2 ILE 39 HG21 ILE 39 3.278 0.859 6.525 1104 2HG2 ILE 39 HG22 ILE 39 3.650 -0.345 5.292 1105 3HG2 ILE 39 HG23 ILE 39 3.930 1.357 4.948 1106 1HD1 ILE 39 HD11 ILE 39 2.106 -2.030 5.369 1107 2HD1 ILE 39 HD12 ILE 39 0.364 -2.317 5.546 1108 3HD1 ILE 39 HD13 ILE 39 0.999 -1.696 4.013 1109 H GLU 40 HN GLU 40 2.366 2.513 7.228 1110 HA GLU 40 HA GLU 40 -0.098 3.003 8.811 1111 1HB GLU 40 HB2 GLU 40 0.716 1.448 10.527 1112 2HB GLU 40 HB3 GLU 40 0.295 0.659 9.021 1113 1HG GLU 40 HG2 GLU 40 2.617 0.222 8.470 1114 2HG GLU 40 HG3 GLU 40 3.182 1.288 9.752 1115 H ALA 41 HN ALA 41 1.703 4.801 7.720 1116 HA ALA 41 HA ALA 41 3.845 5.663 9.433 1117 1HB ALA 41 HB1 ALA 41 2.215 6.886 7.172 1118 2HB ALA 41 HB2 ALA 41 3.688 7.628 7.840 1119 3HB ALA 41 HB3 ALA 41 3.761 6.043 7.018 1120 H HIS 42 HN HIS 42 3.958 7.522 10.609 1121 HA HIS 42 HA HIS 42 2.929 9.704 11.129 1122 1HB HIS 42 HB2 HIS 42 0.561 9.151 11.149 1123 2HB HIS 42 HB3 HIS 42 0.801 7.936 12.412 1124 HD1 HIS 42 HD1 HIS 42 1.089 11.784 11.983 1125 HD2 HIS 42 HD2 HIS 42 0.521 8.781 14.881 1126 HE1 HIS 42 HE1 HIS 42 0.586 12.991 14.182 1127 H GLY 43 HN GLY 43 5.103 9.515 11.924 1128 1HA GLY 43 HA2 GLY 43 5.421 8.972 14.743 1129 2HA GLY 43 HA3 GLY 43 6.014 7.645 13.728 1130 H LEU 44 HN LEU 44 7.885 8.779 15.224 1131 HA LEU 44 HA LEU 44 9.623 10.028 13.246 1132 1HB LEU 44 HB2 LEU 44 8.505 11.980 14.270 1133 2HB LEU 44 HB3 LEU 44 8.989 11.433 15.876 1134 HG LEU 44 HG LEU 44 11.364 11.735 15.302 1135 1HD1 LEU 44 HD11 LEU 44 10.315 12.519 12.548 1136 2HD1 LEU 44 HD12 LEU 44 11.931 12.958 13.129 1137 3HD1 LEU 44 HD13 LEU 44 11.506 11.258 12.945 1138 1HD2 LEU 44 HD21 LEU 44 10.086 13.629 16.217 1139 2HD2 LEU 44 HD22 LEU 44 11.358 14.169 15.114 1140 3HD2 LEU 44 HD23 LEU 44 9.668 14.157 14.572 1141 H ASN 45 HN ASN 45 10.725 8.164 13.325 1142 HA ASN 45 HA ASN 45 11.556 6.698 15.610 1143 1HB ASN 45 HB2 ASN 45 11.405 5.794 13.313 1144 2HB ASN 45 HB3 ASN 45 12.693 6.885 12.787 1145 1HD2 ASN 45 HD22 ASN 45 13.025 4.176 12.264 1146 2HD2 ASN 45 HD21 ASN 45 14.228 3.529 13.338 1147 HA PRO 46 HA PRO 46 14.627 9.767 16.807 1148 1HB PRO 46 HB2 PRO 46 16.055 8.335 18.689 1149 2HB PRO 46 HB3 PRO 46 14.487 9.150 18.976 1150 1HG PRO 46 HG2 PRO 46 14.983 6.238 18.294 1151 2HG PRO 46 HG3 PRO 46 13.917 6.909 19.570 1152 1HD PRO 46 HD2 PRO 46 12.927 6.110 17.185 1153 2HD PRO 46 HD3 PRO 46 12.293 7.584 17.978 1154 H ASN 47 HN ASN 47 15.357 6.623 15.330 1155 HA ASN 47 HA ASN 47 18.156 7.105 14.859 1156 1HB ASN 47 HB2 ASN 47 17.440 4.920 14.225 1157 2HB ASN 47 HB3 ASN 47 16.064 5.554 13.310 1158 1HD2 ASN 47 HD22 ASN 47 16.638 4.725 11.174 1159 2HD2 ASN 47 HD21 ASN 47 17.937 5.588 10.347 1160 H ALA 48 HN ALA 48 15.181 7.973 12.879 1161 HA ALA 48 HA ALA 48 16.736 9.189 10.844 1162 1HB ALA 48 HB1 ALA 48 14.413 8.675 10.445 1163 2HB ALA 48 HB2 ALA 48 13.846 9.788 11.720 1164 3HB ALA 48 HB3 ALA 48 14.601 10.417 10.247 1165 H VAL 49 HN VAL 49 15.365 10.442 13.897 1166 HA VAL 49 HA VAL 49 16.051 13.191 13.523 1167 HB VAL 49 HB VAL 49 15.983 11.674 16.163 1168 1HG1 VAL 49 HG11 VAL 49 15.626 14.642 15.533 1169 2HG1 VAL 49 HG12 VAL 49 15.426 13.886 17.128 1170 3HG1 VAL 49 HG13 VAL 49 17.018 13.907 16.362 1171 1HG2 VAL 49 HG21 VAL 49 13.645 12.458 16.339 1172 2HG2 VAL 49 HG22 VAL 49 13.744 13.133 14.695 1173 3HG2 VAL 49 HG23 VAL 49 13.840 11.381 14.960 1174 H LYS 50 HN LYS 50 17.943 10.581 15.148 1175 HA LYS 50 HA LYS 50 20.273 12.121 15.634 1176 1HB LYS 50 HB2 LYS 50 19.844 10.059 16.756 1177 2HB LYS 50 HB3 LYS 50 19.777 9.137 15.270 1178 1HG LYS 50 HG2 LYS 50 22.354 10.551 16.006 1179 2HG LYS 50 HG3 LYS 50 21.865 9.096 16.877 1180 1HD LYS 50 HD2 LYS 50 21.598 7.977 14.556 1181 2HD LYS 50 HD3 LYS 50 22.556 9.322 13.925 1182 1HE LYS 50 HE2 LYS 50 23.389 7.480 16.222 1183 2HE LYS 50 HE3 LYS 50 23.852 7.227 14.537 1184 1HZ LYS 50 HZ1 LYS 50 25.555 8.364 15.849 1185 2HZ LYS 50 HZ2 LYS 50 25.090 9.222 14.541 1186 3HZ LYS 50 HZ3 LYS 50 24.581 9.659 16.057 1187 H ALA 51 HN ALA 51 19.365 10.119 12.842 1188 HA ALA 51 HA ALA 51 21.643 10.120 11.326 1189 1HB ALA 51 HB1 ALA 51 19.639 8.818 10.839 1190 2HB ALA 51 HB2 ALA 51 18.790 10.290 10.315 1191 3HB ALA 51 HB3 ALA 51 20.215 9.728 9.428 1192 H MET 52 HN MET 52 19.172 12.746 11.673 1193 HA MET 52 HA MET 52 20.473 14.374 9.604 1194 1HB MET 52 HB2 MET 52 17.984 14.833 11.315 1195 2HB MET 52 HB3 MET 52 18.545 15.860 9.992 1196 1HG MET 52 HG2 MET 52 17.433 13.076 9.801 1197 2HG MET 52 HG3 MET 52 16.839 14.553 9.066 1198 1HE MET 52 HE1 MET 52 19.716 15.735 7.921 1199 2HE MET 52 HE2 MET 52 19.423 15.226 6.252 1200 3HE MET 52 HE3 MET 52 18.067 15.821 7.237 1201 H LYS 53 HN LYS 53 20.131 14.297 13.170 1202 HA LYS 53 HA LYS 53 21.347 16.854 13.591 1203 1HB LYS 53 HB2 LYS 53 21.425 14.327 15.304 1204 2HB LYS 53 HB3 LYS 53 21.970 15.914 15.848 1205 1HG LYS 53 HG2 LYS 53 19.124 15.400 14.954 1206 2HG LYS 53 HG3 LYS 53 19.684 15.167 16.611 1207 1HD LYS 53 HD2 LYS 53 20.286 17.557 16.780 1208 2HD LYS 53 HD3 LYS 53 19.881 17.788 15.068 1209 1HE LYS 53 HE2 LYS 53 17.964 18.530 16.220 1210 2HE LYS 53 HE3 LYS 53 17.575 16.937 15.555 1211 1HZ LYS 53 HZ1 LYS 53 16.762 17.062 17.761 1212 2HZ LYS 53 HZ2 LYS 53 18.026 16.032 17.816 1213 3HZ LYS 53 HZ3 LYS 53 18.196 17.561 18.380 1214 H GLU 54 HN GLU 54 22.756 13.718 12.646 1215 HA GLU 54 HA GLU 54 25.464 14.280 13.206 1216 1HB GLU 54 HB2 GLU 54 24.235 12.738 10.880 1217 2HB GLU 54 HB3 GLU 54 25.969 12.824 11.205 1218 1HG GLU 54 HG2 GLU 54 25.523 11.922 13.519 1219 2HG GLU 54 HG3 GLU 54 23.866 11.601 13.007 1220 H VAL 55 HN VAL 55 23.388 15.591 10.676 1221 HA VAL 55 HA VAL 55 25.691 17.099 9.546 1222 HB VAL 55 HB VAL 55 24.421 17.109 7.433 1223 1HG1 VAL 55 HG11 VAL 55 24.935 14.288 8.482 1224 2HG1 VAL 55 HG12 VAL 55 24.995 14.845 6.804 1225 3HG1 VAL 55 HG13 VAL 55 26.196 15.424 7.955 1226 1HG2 VAL 55 HG21 VAL 55 22.544 15.636 7.031 1227 2HG2 VAL 55 HG22 VAL 55 22.577 15.025 8.693 1228 3HG2 VAL 55 HG23 VAL 55 22.113 16.710 8.366 1229 H GLY 56 HN GLY 56 23.701 17.618 11.858 1230 1HA GLY 56 HA2 GLY 56 22.868 19.482 12.826 1231 2HA GLY 56 HA3 GLY 56 23.751 20.418 11.610 1232 H ILE 57 HN ILE 57 21.006 18.078 11.041 1233 HA ILE 57 HA ILE 57 19.328 20.435 10.241 1234 HB ILE 57 HB ILE 57 19.371 17.672 8.995 1235 1HG1 ILE 57 HG12 ILE 57 20.111 20.425 7.917 1236 2HG1 ILE 57 HG13 ILE 57 21.196 19.062 8.180 1237 1HG2 ILE 57 HG21 ILE 57 17.051 18.586 9.252 1238 2HG2 ILE 57 HG22 ILE 57 17.555 20.055 8.393 1239 3HG2 ILE 57 HG23 ILE 57 17.535 18.485 7.568 1240 1HD1 ILE 57 HD11 ILE 57 20.811 19.193 5.849 1241 2HD1 ILE 57 HD12 ILE 57 19.908 17.781 6.410 1242 3HD1 ILE 57 HD13 ILE 57 19.059 19.306 6.035 1243 H ASP 58 HN ASP 58 18.004 20.741 11.950 1244 HA ASP 58 HA ASP 58 17.323 18.554 13.772 1245 1HB ASP 58 HB2 ASP 58 17.513 20.784 14.701 1246 2HB ASP 58 HB3 ASP 58 16.327 21.418 13.545 1247 H ILE 59 HN ILE 59 15.564 17.274 13.637 1248 HA ILE 59 HA ILE 59 13.253 18.078 11.990 1249 HB ILE 59 HB ILE 59 12.984 15.920 11.020 1250 1HG1 ILE 59 HG12 ILE 59 15.702 14.968 12.000 1251 2HG1 ILE 59 HG13 ILE 59 14.225 14.629 12.895 1252 1HG2 ILE 59 HG21 ILE 59 14.376 17.608 9.809 1253 2HG2 ILE 59 HG22 ILE 59 15.835 16.808 10.432 1254 3HG2 ILE 59 HG23 ILE 59 14.737 15.939 9.338 1255 1HD1 ILE 59 HD11 ILE 59 14.822 13.722 10.063 1256 2HD1 ILE 59 HD12 ILE 59 14.613 12.738 11.526 1257 3HD1 ILE 59 HD13 ILE 59 13.230 13.591 10.849 1258 H SER 60 HN SER 60 14.025 17.849 14.979 1259 HA SER 60 HA SER 60 12.878 15.525 16.030 1260 1HB SER 60 HB2 SER 60 13.240 18.169 17.483 1261 2HB SER 60 HB3 SER 60 13.252 16.540 18.181 1262 HG SER 60 HG SER 60 15.140 17.825 16.506 1263 H ASN 61 HN ASN 61 10.985 17.302 14.347 1264 HA ASN 61 HA ASN 61 8.585 17.162 16.018 1265 1HB ASN 61 HB2 ASN 61 9.462 19.458 16.239 1266 2HB ASN 61 HB3 ASN 61 9.596 19.603 14.491 1267 1HD2 ASN 61 HD22 ASN 61 7.840 20.438 13.385 1268 2HD2 ASN 61 HD21 ASN 61 6.270 20.719 14.093 1269 H GLN 62 HN GLN 62 10.123 16.335 13.107 1270 HA GLN 62 HA GLN 62 8.587 17.111 11.058 1271 1HB GLN 62 HB2 GLN 62 10.697 15.518 11.220 1272 2HB GLN 62 HB3 GLN 62 9.517 14.224 11.148 1273 1HG GLN 62 HG2 GLN 62 10.066 14.508 8.913 1274 2HG GLN 62 HG3 GLN 62 8.610 15.493 9.017 1275 1HE2 GLN 62 HE22 GLN 62 12.121 15.480 8.670 1276 2HE2 GLN 62 HE21 GLN 62 12.313 17.192 8.377 1277 H THR 63 HN THR 63 7.980 14.011 12.632 1278 HA THR 63 HA THR 63 6.272 12.549 12.643 1279 HB THR 63 HB THR 63 4.012 13.325 13.072 1280 HG1 THR 63 HG1 THR 63 5.018 15.690 12.050 1281 1HG2 THR 63 HG21 THR 63 4.437 14.551 15.128 1282 2HG2 THR 63 HG22 THR 63 5.681 13.309 14.907 1283 3HG2 THR 63 HG23 THR 63 6.061 15.013 14.571 1284 H SER 64 HN SER 64 3.800 12.285 11.326 1285 HA SER 64 HA SER 64 4.096 12.698 8.499 1286 1HB SER 64 HB2 SER 64 4.331 10.129 8.094 1287 2HB SER 64 HB3 SER 64 5.765 11.089 8.442 1288 HG SER 64 HG SER 64 5.590 9.082 9.640 1289 H ASP 65 HN ASP 65 2.523 10.567 7.639 1290 HA ASP 65 HA ASP 65 0.144 10.134 9.149 1291 1HB ASP 65 HB2 ASP 65 -0.241 12.516 8.453 1292 2HB ASP 65 HB3 ASP 65 0.011 12.043 6.769 1293 H ILE 66 HN ILE 66 -1.422 8.857 7.478 1294 HA ILE 66 HA ILE 66 0.262 7.014 6.067 1295 HB ILE 66 HB ILE 66 -1.909 5.927 5.487 1296 1HG1 ILE 66 HG12 ILE 66 -3.915 6.504 6.776 1297 2HG1 ILE 66 HG13 ILE 66 -3.170 8.004 7.312 1298 1HG2 ILE 66 HG21 ILE 66 -2.242 5.073 7.738 1299 2HG2 ILE 66 HG22 ILE 66 -0.525 5.321 7.410 1300 3HG2 ILE 66 HG23 ILE 66 -1.406 6.482 8.430 1301 1HD1 ILE 66 HD11 ILE 66 -3.220 8.890 5.036 1302 2HD1 ILE 66 HD12 ILE 66 -3.718 7.304 4.388 1303 3HD1 ILE 66 HD13 ILE 66 -4.816 8.242 5.420 1304 H ILE 67 HN ILE 67 -0.494 6.269 3.808 1305 HA ILE 67 HA ILE 67 0.360 7.975 1.878 1306 HB ILE 67 HB ILE 67 -0.313 6.298 0.269 1307 1HG1 ILE 67 HG12 ILE 67 -1.706 4.588 2.331 1308 2HG1 ILE 67 HG13 ILE 67 -2.649 5.876 1.616 1309 1HG2 ILE 67 HG21 ILE 67 1.572 5.909 1.950 1310 2HG2 ILE 67 HG22 ILE 67 0.478 4.707 2.675 1311 3HG2 ILE 67 HG23 ILE 67 0.975 4.544 0.993 1312 1HD1 ILE 67 HD11 ILE 67 -1.113 3.929 -0.155 1313 2HD1 ILE 67 HD12 ILE 67 -2.767 3.625 0.445 1314 3HD1 ILE 67 HD13 ILE 67 -2.462 5.019 -0.579 1315 H ASP 68 HN ASP 68 -1.671 9.660 2.968 1316 HA ASP 68 HA ASP 68 -4.138 9.757 1.739 1317 1HB ASP 68 HB2 ASP 68 -3.462 11.039 3.703 1318 2HB ASP 68 HB3 ASP 68 -2.468 12.093 2.694 1319 H SER 69 HN SER 69 -4.472 9.534 -0.330 1320 HA SER 69 HA SER 69 -3.181 10.434 -2.541 1321 1HB SER 69 HB2 SER 69 -6.170 10.345 -2.123 1322 2HB SER 69 HB3 SER 69 -5.302 10.130 -3.658 1323 HG SER 69 HG SER 69 -4.360 8.224 -2.737 1324 H ASP 70 HN ASP 70 -5.026 12.524 -0.331 1325 HA ASP 70 HA ASP 70 -5.936 14.404 -2.259 1326 1HB ASP 70 HB2 ASP 70 -6.788 14.262 0.058 1327 2HB ASP 70 HB3 ASP 70 -5.229 14.863 0.654 1328 H ILE 71 HN ILE 71 -2.801 13.911 -0.842 1329 HA ILE 71 HA ILE 71 -1.776 16.426 -2.106 1330 HB ILE 71 HB ILE 71 -0.432 14.832 0.049 1331 1HG1 ILE 71 HG12 ILE 71 -1.384 17.150 1.361 1332 2HG1 ILE 71 HG13 ILE 71 -2.781 16.598 0.439 1333 1HG2 ILE 71 HG21 ILE 71 0.793 16.872 0.544 1334 2HG2 ILE 71 HG22 ILE 71 1.017 16.392 -1.146 1335 3HG2 ILE 71 HG23 ILE 71 -0.079 17.739 -0.747 1336 1HD1 ILE 71 HD11 ILE 71 -2.468 14.312 1.383 1337 2HD1 ILE 71 HD12 ILE 71 -1.054 14.930 2.291 1338 3HD1 ILE 71 HD13 ILE 71 -2.688 15.545 2.656 1339 H LEU 72 HN LEU 72 -1.219 12.905 -1.468 1340 HA LEU 72 HA LEU 72 1.145 12.640 -2.920 1341 1HB LEU 72 HB2 LEU 72 0.100 10.998 -1.386 1342 2HB LEU 72 HB3 LEU 72 -1.097 10.599 -2.598 1343 HG LEU 72 HG LEU 72 1.873 10.322 -3.167 1344 1HD1 LEU 72 HD11 LEU 72 1.652 7.954 -2.478 1345 2HD1 LEU 72 HD12 LEU 72 1.406 9.047 -1.125 1346 3HD1 LEU 72 HD13 LEU 72 0.007 8.282 -1.886 1347 1HD2 LEU 72 HD21 LEU 72 0.434 10.086 -5.179 1348 2HD2 LEU 72 HD22 LEU 72 1.097 8.555 -4.734 1349 3HD2 LEU 72 HD23 LEU 72 -0.596 8.922 -4.329 1350 H ASN 73 HN ASN 73 -2.254 12.213 -4.163 1351 HA ASN 73 HA ASN 73 -1.287 11.588 -6.781 1352 1HB ASN 73 HB2 ASN 73 -3.392 11.111 -7.319 1353 2HB ASN 73 HB3 ASN 73 -3.718 11.215 -5.601 1354 1HD2 ASN 73 HD21 ASN 73 -4.551 13.447 -4.826 1355 2HD2 ASN 73 HD22 ASN 73 -5.510 14.381 -5.958 1356 H ASN 74 HN ASN 74 -1.903 14.594 -5.104 1357 HA ASN 74 HA ASN 74 -1.985 16.256 -7.483 1358 1HB ASN 74 HB2 ASN 74 -2.084 16.739 -4.499 1359 2HB ASN 74 HB3 ASN 74 -1.586 18.057 -5.534 1360 1HD2 ASN 74 HD22 ASN 74 -4.302 16.955 -4.039 1361 2HD2 ASN 74 HD21 ASN 74 -5.492 17.529 -5.185 1362 H ALA 75 HN ALA 75 0.520 14.885 -5.445 1363 HA ALA 75 HA ALA 75 2.509 16.782 -5.748 1364 1HB ALA 75 HB1 ALA 75 2.911 13.764 -5.665 1365 2HB ALA 75 HB2 ALA 75 4.063 15.017 -5.184 1366 3HB ALA 75 HB3 ALA 75 2.574 14.781 -4.250 1367 H ASP 76 HN ASP 76 4.415 16.765 -7.027 1368 HA ASP 76 HA ASP 76 3.953 16.165 -9.886 1369 1HB ASP 76 HB2 ASP 76 5.075 18.269 -9.150 1370 2HB ASP 76 HB3 ASP 76 6.402 17.305 -8.490 1371 H LEU 77 HN LEU 77 5.463 14.689 -7.080 1372 HA LEU 77 HA LEU 77 6.304 12.397 -8.678 1373 1HB LEU 77 HB2 LEU 77 8.167 14.415 -8.037 1374 2HB LEU 77 HB3 LEU 77 8.386 13.236 -6.750 1375 HG LEU 77 HG LEU 77 8.606 12.682 -9.714 1376 1HD1 LEU 77 HD11 LEU 77 10.389 14.097 -8.889 1377 2HD1 LEU 77 HD12 LEU 77 10.638 13.033 -7.498 1378 3HD1 LEU 77 HD13 LEU 77 11.045 12.469 -9.142 1379 1HD2 LEU 77 HD21 LEU 77 9.102 10.857 -7.330 1380 2HD2 LEU 77 HD22 LEU 77 7.993 10.587 -8.708 1381 3HD2 LEU 77 HD23 LEU 77 9.730 10.535 -8.950 1382 H VAL 78 HN VAL 78 6.525 10.522 -7.466 1383 HA VAL 78 HA VAL 78 6.183 10.566 -4.507 1384 HB VAL 78 HB VAL 78 5.164 8.515 -6.488 1385 1HG1 VAL 78 HG11 VAL 78 5.891 7.517 -4.327 1386 2HG1 VAL 78 HG12 VAL 78 4.933 8.719 -3.442 1387 3HG1 VAL 78 HG13 VAL 78 4.126 7.511 -4.464 1388 1HG2 VAL 78 HG21 VAL 78 3.637 10.481 -4.713 1389 2HG2 VAL 78 HG22 VAL 78 3.777 10.581 -6.465 1390 3HG2 VAL 78 HG23 VAL 78 2.936 9.216 -5.761 1391 H VAL 79 HN VAL 79 8.230 10.527 -3.896 1392 HA VAL 79 HA VAL 79 10.238 8.840 -5.264 1393 HB VAL 79 HB VAL 79 10.420 10.689 -2.844 1394 1HG1 VAL 79 HG11 VAL 79 12.201 8.937 -2.879 1395 2HG1 VAL 79 HG12 VAL 79 12.665 9.495 -4.499 1396 3HG1 VAL 79 HG13 VAL 79 12.834 10.574 -3.103 1397 1HG2 VAL 79 HG21 VAL 79 9.921 12.014 -4.838 1398 2HG2 VAL 79 HG22 VAL 79 11.615 12.238 -4.397 1399 3HG2 VAL 79 HG23 VAL 79 11.192 11.165 -5.752 1400 H THR 80 HN THR 80 9.596 6.675 -4.815 1401 HA THR 80 HA THR 80 8.935 5.881 -2.116 1402 HB THR 80 HB THR 80 10.113 4.161 -4.323 1403 HG1 THR 80 HG1 THR 80 7.422 4.981 -3.981 1404 1HG2 THR 80 HG21 THR 80 9.853 3.020 -2.168 1405 2HG2 THR 80 HG22 THR 80 8.140 3.491 -2.104 1406 3HG2 THR 80 HG23 THR 80 8.720 2.381 -3.372 1407 H LEU 81 HN LEU 81 10.326 5.606 -0.416 1408 HA LEU 81 HA LEU 81 13.254 5.583 -0.931 1409 1HB LEU 81 HB2 LEU 81 11.600 5.755 1.602 1410 2HB LEU 81 HB3 LEU 81 13.322 5.457 1.611 1411 HG LEU 81 HG LEU 81 13.014 7.724 2.142 1412 1HD1 LEU 81 HD11 LEU 81 13.908 7.715 -0.768 1413 2HD1 LEU 81 HD12 LEU 81 14.342 8.876 0.496 1414 3HD1 LEU 81 HD13 LEU 81 14.914 7.205 0.610 1415 1HD2 LEU 81 HD21 LEU 81 11.467 8.194 -0.424 1416 2HD2 LEU 81 HD22 LEU 81 10.751 8.050 1.198 1417 3HD2 LEU 81 HD23 LEU 81 11.867 9.378 0.831 1418 H SER 82 HN SER 82 14.334 3.831 -0.803 1419 HA SER 82 HA SER 82 15.160 1.829 -0.307 1420 1HB SER 82 HB2 SER 82 12.683 1.135 1.253 1421 2HB SER 82 HB3 SER 82 14.239 0.291 1.264 1422 HG SER 82 HG SER 82 15.225 2.087 2.097 1423 H GLY 83 HN GLY 83 11.827 1.934 -1.483 1424 1HA GLY 83 HA2 GLY 83 10.880 0.977 -3.390 1425 2HA GLY 83 HA3 GLY 83 12.380 0.068 -3.689 1426 H ASP 84 HN ASP 84 10.622 0.312 -0.596 1427 HA ASP 84 HA ASP 84 10.876 -2.566 -0.354 1428 1HB ASP 84 HB2 ASP 84 11.744 -1.175 1.409 1429 2HB ASP 84 HB3 ASP 84 10.178 -0.381 1.604 1430 H ALA 85 HN ALA 85 9.178 -3.863 -0.903 1431 HA ALA 85 HA ALA 85 6.680 -2.868 -1.703 1432 1HB ALA 85 HB1 ALA 85 7.448 -5.726 -0.966 1433 2HB ALA 85 HB2 ALA 85 6.050 -5.236 -1.944 1434 3HB ALA 85 HB3 ALA 85 7.691 -4.953 -2.553 1435 H ALA 86 HN ALA 86 7.687 -3.754 1.531 1436 HA ALA 86 HA ALA 86 5.214 -4.504 2.669 1437 1HB ALA 86 HB1 ALA 86 7.589 -3.045 3.899 1438 2HB ALA 86 HB2 ALA 86 6.227 -3.701 4.826 1439 3HB ALA 86 HB3 ALA 86 7.295 -4.793 3.909 1440 H ASP 87 HN ASP 87 6.217 -1.353 1.514 1441 HA ASP 87 HA ASP 87 4.536 0.231 3.171 1442 1HB ASP 87 HB2 ASP 87 6.576 0.975 1.930 1443 2HB ASP 87 HB3 ASP 87 5.635 0.917 0.439 1444 H LYS 88 HN LYS 88 2.932 -1.926 2.144 1445 HA LYS 88 HA LYS 88 0.964 -2.447 1.223 1446 1HB LYS 88 HB2 LYS 88 0.412 -0.208 2.486 1447 2HB LYS 88 HB3 LYS 88 0.190 0.456 0.878 1448 1HG LYS 88 HG2 LYS 88 -1.499 -1.310 0.414 1449 2HG LYS 88 HG3 LYS 88 -1.248 -1.995 2.021 1450 1HD LYS 88 HD2 LYS 88 -2.221 0.835 1.439 1451 2HD LYS 88 HD3 LYS 88 -3.282 -0.534 1.764 1452 1HE LYS 88 HE2 LYS 88 -1.159 0.423 3.727 1453 2HE LYS 88 HE3 LYS 88 -2.776 1.115 3.684 1454 1HZ LYS 88 HZ1 LYS 88 -2.258 -1.766 4.179 1455 2HZ LYS 88 HZ2 LYS 88 -2.611 -0.655 5.328 1456 3HZ LYS 88 HZ3 LYS 88 -3.720 -1.008 4.199 1457 H CYS 89 HN CYS 89 3.167 -2.327 -0.541 1458 HA CYS 89 HA CYS 89 3.768 -2.151 -2.776 1459 1HB CYS 89 HB2 CYS 89 2.280 -3.843 -4.031 1460 2HB CYS 89 HB3 CYS 89 3.021 -4.357 -2.519 1461 HA PRO 90 HA PRO 90 0.369 1.022 -3.610 1462 1HB PRO 90 HB2 PRO 90 2.596 2.968 -4.084 1463 2HB PRO 90 HB3 PRO 90 1.055 3.143 -3.172 1464 1HG PRO 90 HG2 PRO 90 3.383 2.860 -1.837 1465 2HG PRO 90 HG3 PRO 90 1.866 2.087 -1.291 1466 1HD PRO 90 HD2 PRO 90 4.108 0.893 -2.991 1467 2HD PRO 90 HD3 PRO 90 3.399 0.222 -1.513 1468 H MET 91 HN MET 91 -0.587 1.324 -5.599 1469 HA MET 91 HA MET 91 0.972 0.558 -7.947 1470 1HB MET 91 HB2 MET 91 -1.140 0.960 -9.196 1471 2HB MET 91 HB3 MET 91 -1.130 -0.297 -7.974 1472 1HG MET 91 HG2 MET 91 -3.099 0.666 -7.580 1473 2HG MET 91 HG3 MET 91 -2.147 1.472 -6.380 1474 1HE MET 91 HE1 MET 91 -4.977 3.727 -7.470 1475 2HE MET 91 HE2 MET 91 -4.962 1.969 -7.805 1476 3HE MET 91 HE3 MET 91 -4.213 2.519 -6.310 1477 H THR 92 HN THR 92 0.161 3.551 -6.426 1478 HA THR 92 HA THR 92 0.260 5.694 -6.889 1479 HB THR 92 HB THR 92 2.130 6.507 -8.495 1480 HG1 THR 92 HG1 THR 92 2.297 4.071 -9.065 1481 1HG2 THR 92 HG21 THR 92 2.827 5.032 -5.910 1482 2HG2 THR 92 HG22 THR 92 3.778 6.309 -6.687 1483 3HG2 THR 92 HG23 THR 92 2.204 6.695 -6.031 1484 HA PRO 93 HA PRO 93 -2.535 5.871 -10.317 1485 1HB PRO 93 HB2 PRO 93 -3.724 8.288 -9.905 1486 2HB PRO 93 HB3 PRO 93 -3.959 6.910 -8.772 1487 1HG PRO 93 HG2 PRO 93 -2.002 9.204 -8.463 1488 2HG PRO 93 HG3 PRO 93 -3.204 8.574 -7.279 1489 1HD PRO 93 HD2 PRO 93 -0.608 7.742 -7.243 1490 2HD PRO 93 HD3 PRO 93 -1.976 6.630 -6.909 1491 HA PRO 94 HA PRO 94 0.028 7.735 -13.364 1492 1HB PRO 94 HB2 PRO 94 -1.706 8.283 -15.467 1493 2HB PRO 94 HB3 PRO 94 -1.145 6.652 -14.999 1494 1HG PRO 94 HG2 PRO 94 -3.716 8.042 -14.172 1495 2HG PRO 94 HG3 PRO 94 -3.515 6.385 -14.836 1496 1HD PRO 94 HD2 PRO 94 -3.724 6.735 -12.183 1497 2HD PRO 94 HD3 PRO 94 -2.482 5.619 -12.839 1498 H HIS 95 HN HIS 95 -2.237 9.683 -11.767 1499 HA HIS 95 HA HIS 95 -1.889 12.202 -13.073 1500 1HB HIS 95 HB2 HIS 95 -2.367 11.593 -10.128 1501 2HB HIS 95 HB3 HIS 95 -2.638 13.133 -10.931 1502 HD1 HIS 95 HD1 HIS 95 -5.077 12.179 -9.497 1503 HD2 HIS 95 HD2 HIS 95 -4.128 10.984 -13.424 1504 HE1 HIS 95 HE1 HIS 95 -7.244 11.333 -10.541 1505 H VAL 96 HN VAL 96 0.375 10.228 -11.247 1506 HA VAL 96 HA VAL 96 2.247 12.513 -11.087 1507 HB VAL 96 HB VAL 96 0.996 12.449 -8.997 1508 1HG1 VAL 96 HG11 VAL 96 0.325 10.097 -8.832 1509 2HG1 VAL 96 HG12 VAL 96 2.016 9.607 -8.591 1510 3HG1 VAL 96 HG13 VAL 96 1.192 10.613 -7.382 1511 1HG2 VAL 96 HG21 VAL 96 2.832 12.488 -7.484 1512 2HG2 VAL 96 HG22 VAL 96 3.808 11.434 -8.521 1513 3HG2 VAL 96 HG23 VAL 96 3.402 13.070 -9.056 1514 H LYS 97 HN LYS 97 4.464 11.926 -10.967 1515 HA LYS 97 HA LYS 97 5.189 9.412 -12.281 1516 1HB LYS 97 HB2 LYS 97 6.154 11.735 -12.714 1517 2HB LYS 97 HB3 LYS 97 6.958 11.615 -11.151 1518 1HG LYS 97 HG2 LYS 97 7.386 9.234 -12.851 1519 2HG LYS 97 HG3 LYS 97 7.878 10.710 -13.672 1520 1HD LYS 97 HD2 LYS 97 8.743 9.923 -10.902 1521 2HD LYS 97 HD3 LYS 97 9.633 9.447 -12.336 1522 1HE LYS 97 HE2 LYS 97 9.161 12.369 -11.538 1523 2HE LYS 97 HE3 LYS 97 10.652 11.497 -11.211 1524 1HZ LYS 97 HZ1 LYS 97 10.828 12.798 -13.226 1525 2HZ LYS 97 HZ2 LYS 97 10.949 11.220 -13.611 1526 3HZ LYS 97 HZ3 LYS 97 9.570 12.041 -13.921 1527 H ARG 98 HN ARG 98 6.623 7.830 -11.278 1528 HA ARG 98 HA ARG 98 7.160 8.136 -8.419 1529 1HB ARG 98 HB2 ARG 98 5.051 6.690 -8.574 1530 2HB ARG 98 HB3 ARG 98 6.019 5.504 -9.456 1531 1HG ARG 98 HG2 ARG 98 7.642 5.568 -7.382 1532 2HG ARG 98 HG3 ARG 98 6.360 6.465 -6.590 1533 1HD ARG 98 HD2 ARG 98 5.990 4.339 -5.832 1534 2HD ARG 98 HD3 ARG 98 4.859 4.399 -7.160 1535 HE ARG 98 HE ARG 98 7.409 2.918 -6.976 1536 1HH1 ARG 98 HH11 ARG 98 4.460 3.550 -8.880 1537 2HH1 ARG 98 HH12 ARG 98 4.754 2.249 -9.984 1538 1HH2 ARG 98 HH21 ARG 98 7.773 1.247 -8.360 1539 2HH2 ARG 98 HH22 ARG 98 6.699 0.871 -9.675 1540 H GLU 99 HN GLU 99 9.166 7.343 -7.946 1541 HA GLU 99 HA GLU 99 10.384 5.282 -9.555 1542 1HB GLU 99 HB2 GLU 99 11.471 8.115 -9.490 1543 2HB GLU 99 HB3 GLU 99 12.587 6.749 -9.533 1544 1HG GLU 99 HG2 GLU 99 10.510 7.445 -11.629 1545 2HG GLU 99 HG3 GLU 99 12.245 7.667 -11.747 1546 H HIS 100 HN HIS 100 12.017 4.283 -8.308 1547 HA HIS 100 HA HIS 100 11.833 4.814 -5.402 1548 1HB HIS 100 HB2 HIS 100 13.166 2.489 -6.847 1549 2HB HIS 100 HB3 HIS 100 12.829 2.618 -5.129 1550 HD1 HIS 100 HD1 HIS 100 11.802 0.069 -6.372 1551 HD2 HIS 100 HD2 HIS 100 9.604 3.655 -6.490 1552 HE1 HIS 100 HE1 HIS 100 9.379 -0.584 -6.765 1553 H TRP 101 HN TRP 101 13.586 5.690 -4.351 1554 HA TRP 101 HA TRP 101 16.070 6.119 -5.968 1555 1HB TRP 101 HB2 TRP 101 14.486 8.086 -4.319 1556 2HB TRP 101 HB3 TRP 101 16.158 8.364 -4.783 1557 HD1 TRP 101 HD1 TRP 101 12.673 8.275 -6.307 1558 HE1 TRP 101 HE1 TRP 101 12.743 9.154 -8.687 1559 HE3 TRP 101 HE3 TRP 101 17.753 8.498 -6.922 1560 HZ2 TRP 101 HZ2 TRP 101 14.750 9.470 -10.775 1561 HZ3 TRP 101 HZ3 TRP 101 18.714 9.019 -9.147 1562 HH2 TRP 101 HH2 TRP 101 17.224 9.474 -11.086 1563 H GLY 102 HN GLY 102 15.214 4.247 -3.554 1564 1HA GLY 102 HA2 GLY 102 17.942 4.295 -2.491 1565 2HA GLY 102 HA3 GLY 102 16.640 4.359 -1.285 1566 H PHE 103 HN PHE 103 18.423 2.117 -1.611 1567 HA PHE 103 HA PHE 103 16.577 0.003 -2.631 1568 1HB PHE 103 HB2 PHE 103 19.593 0.020 -2.922 1569 2HB PHE 103 HB3 PHE 103 18.464 -1.139 -3.608 1570 HD1 PHE 103 HD1 PHE 103 16.402 0.503 -4.927 1571 HD2 PHE 103 HD2 PHE 103 20.677 1.057 -4.721 1572 HE1 PHE 103 HE1 PHE 103 16.332 1.833 -7.015 1573 HE2 PHE 103 HE2 PHE 103 20.604 2.348 -6.846 1574 HZ PHE 103 HZ PHE 103 18.430 2.762 -7.978 1575 H ASP 104 HN ASP 104 17.581 1.189 0.160 1576 HA ASP 104 HA ASP 104 17.608 -1.348 1.568 1577 1HB ASP 104 HB2 ASP 104 20.030 -0.957 1.091 1578 2HB ASP 104 HB3 ASP 104 19.906 0.641 1.828 1579 H ASP 105 HN ASP 105 17.429 -0.760 3.997 1580 HA ASP 105 HA ASP 105 15.856 1.755 4.343 1581 1HB ASP 105 HB2 ASP 105 14.177 0.212 3.841 1582 2HB ASP 105 HB3 ASP 105 14.960 -1.092 4.687 1583 HA PRO 106 HA PRO 106 18.722 1.573 7.754 1584 1HB PRO 106 HB2 PRO 106 18.057 3.860 9.085 1585 2HB PRO 106 HB3 PRO 106 18.946 3.838 7.540 1586 1HG PRO 106 HG2 PRO 106 15.989 4.329 7.985 1587 2HG PRO 106 HG3 PRO 106 17.112 5.212 6.902 1588 1HD PRO 106 HD2 PRO 106 15.440 3.204 6.009 1589 2HD PRO 106 HD3 PRO 106 17.016 3.503 5.276 1590 H ALA 107 HN ALA 107 15.172 1.899 8.362 1591 HA ALA 107 HA ALA 107 15.245 1.189 11.100 1592 1HB ALA 107 HB1 ALA 107 13.070 0.704 9.022 1593 2HB ALA 107 HB2 ALA 107 12.861 0.703 10.784 1594 3HB ALA 107 HB3 ALA 107 13.295 2.207 9.949 1595 H ARG 108 HN ARG 108 16.290 -0.665 8.511 1596 HA ARG 108 HA ARG 108 15.375 -3.299 9.564 1597 1HB ARG 108 HB2 ARG 108 17.390 -2.755 7.351 1598 2HB ARG 108 HB3 ARG 108 16.657 -4.299 7.741 1599 1HG ARG 108 HG2 ARG 108 15.183 -1.875 6.690 1600 2HG ARG 108 HG3 ARG 108 15.701 -3.247 5.715 1601 1HD ARG 108 HD2 ARG 108 14.201 -4.378 7.836 1602 2HD ARG 108 HD3 ARG 108 13.328 -2.912 7.423 1603 HE ARG 108 HE ARG 108 13.884 -5.279 5.692 1604 1HH1 ARG 108 HH11 ARG 108 12.304 -2.101 5.919 1605 2HH1 ARG 108 HH12 ARG 108 11.070 -2.512 4.742 1606 1HH2 ARG 108 HH21 ARG 108 12.389 -5.653 3.937 1607 2HH2 ARG 108 HH22 ARG 108 11.275 -4.402 3.469 1608 H ALA 109 HN ALA 109 17.703 -1.080 10.435 1609 HA ALA 109 HA ALA 109 20.125 -2.004 10.617 1610 1HB ALA 109 HB1 ALA 109 20.096 -1.192 13.085 1611 2HB ALA 109 HB2 ALA 109 19.651 -0.020 11.811 1612 3HB ALA 109 HB3 ALA 109 18.399 -0.815 12.810 1613 H GLN 110 HN GLN 110 21.324 -3.652 11.418 1614 HA GLN 110 HA GLN 110 19.970 -5.854 12.781 1615 1HB GLN 110 HB2 GLN 110 21.889 -6.384 11.252 1616 2HB GLN 110 HB3 GLN 110 22.942 -5.412 12.311 1617 1HG GLN 110 HG2 GLN 110 23.185 -7.838 12.713 1618 2HG GLN 110 HG3 GLN 110 22.714 -6.908 14.126 1619 1HE2 GLN 110 HE22 GLN 110 21.256 -8.043 15.388 1620 2HE2 GLN 110 HE21 GLN 110 19.954 -9.014 14.763 1621 H GLY 111 HN GLY 111 20.134 -6.003 15.006 1622 1HA GLY 111 HA2 GLY 111 20.397 -3.434 16.196 1623 2HA GLY 111 HA3 GLY 111 19.814 -4.902 17.016 1624 H THR 112 HN THR 112 23.103 -4.400 15.590 1625 HA THR 112 HA THR 112 24.243 -4.705 18.337 1626 HB THR 112 HB THR 112 26.360 -5.154 17.403 1627 HG1 THR 112 HG1 THR 112 26.694 -5.216 15.161 1628 1HG2 THR 112 HG21 THR 112 24.685 -7.023 17.414 1629 2HG2 THR 112 HG22 THR 112 24.428 -6.710 15.673 1630 3HG2 THR 112 HG23 THR 112 26.029 -7.220 16.258 1631 H GLU 113 HN GLU 113 25.912 -3.068 18.887 1632 HA GLU 113 HA GLU 113 24.809 -0.545 18.503 1633 1HB GLU 113 HB2 GLU 113 27.678 -1.302 19.287 1634 2HB GLU 113 HB3 GLU 113 26.926 0.277 19.610 1635 1HG GLU 113 HG2 GLU 113 25.162 -0.911 20.968 1636 2HG GLU 113 HG3 GLU 113 26.059 -2.415 20.745 1637 H GLU 114 HN GLU 114 27.380 -2.177 16.736 1638 HA GLU 114 HA GLU 114 28.211 0.171 15.273 1639 1HB GLU 114 HB2 GLU 114 29.522 -1.634 13.978 1640 2HB GLU 114 HB3 GLU 114 29.985 -1.311 15.661 1641 1HG GLU 114 HG2 GLU 114 28.685 -3.330 16.363 1642 2HG GLU 114 HG3 GLU 114 28.321 -3.631 14.650 1643 H GLU 115 HN GLU 115 26.087 -2.779 14.702 1644 HA GLU 115 HA GLU 115 26.019 -2.073 11.908 1645 1HB GLU 115 HB2 GLU 115 24.483 -4.119 13.488 1646 2HB GLU 115 HB3 GLU 115 24.312 -3.850 11.748 1647 1HG GLU 115 HG2 GLU 115 27.050 -4.402 12.951 1648 2HG GLU 115 HG3 GLU 115 25.940 -5.712 12.547 1649 H LYS 116 HN LYS 116 24.029 -1.338 14.758 1650 HA LYS 116 HA LYS 116 21.866 -0.199 13.291 1651 1HB LYS 116 HB2 LYS 116 22.978 0.549 16.050 1652 2HB LYS 116 HB3 LYS 116 21.533 1.262 15.329 1653 1HG LYS 116 HG2 LYS 116 20.955 -1.441 15.142 1654 2HG LYS 116 HG3 LYS 116 21.913 -1.380 16.609 1655 1HD LYS 116 HD2 LYS 116 19.878 -1.083 17.529 1656 2HD LYS 116 HD3 LYS 116 20.274 0.619 17.247 1657 1HE LYS 116 HE2 LYS 116 19.001 0.503 15.068 1658 2HE LYS 116 HE3 LYS 116 18.676 -1.211 15.387 1659 1HZ LYS 116 HZ1 LYS 116 17.710 1.025 17.086 1660 2HZ LYS 116 HZ2 LYS 116 16.799 0.187 16.025 1661 3HZ LYS 116 HZ3 LYS 116 17.402 -0.558 17.338 1662 H TRP 117 HN TRP 117 24.824 1.332 14.605 1663 HA TRP 117 HA TRP 117 24.202 3.832 13.419 1664 1HB TRP 117 HB2 TRP 117 25.922 3.332 15.248 1665 2HB TRP 117 HB3 TRP 117 27.019 2.810 13.973 1666 HD1 TRP 117 HD1 TRP 117 25.367 5.625 12.469 1667 HE1 TRP 117 HE1 TRP 117 26.455 7.882 12.934 1668 HE3 TRP 117 HE3 TRP 117 28.510 4.212 16.263 1669 HZ2 TRP 117 HZ2 TRP 117 28.489 8.918 14.643 1670 HZ3 TRP 117 HZ3 TRP 117 30.020 5.885 17.306 1671 HH2 TRP 117 HH2 TRP 117 30.021 8.245 16.517 1672 H ALA 118 HN ALA 118 26.063 1.054 12.209 1673 HA ALA 118 HA ALA 118 26.960 2.197 9.822 1674 1HB ALA 118 HB1 ALA 118 27.733 -0.005 10.832 1675 2HB ALA 118 HB2 ALA 118 26.188 -0.714 10.357 1676 3HB ALA 118 HB3 ALA 118 27.317 -0.152 9.107 1677 H PHE 119 HN PHE 119 23.853 0.464 10.398 1678 HA PHE 119 HA PHE 119 23.015 0.624 7.656 1679 1HB PHE 119 HB2 PHE 119 21.703 0.007 10.276 1680 2HB PHE 119 HB3 PHE 119 20.656 0.625 9.025 1681 HD1 PHE 119 HD1 PHE 119 19.713 -0.805 7.433 1682 HD2 PHE 119 HD2 PHE 119 23.286 -2.042 9.517 1683 HE1 PHE 119 HE1 PHE 119 19.561 -3.039 6.383 1684 HE2 PHE 119 HE2 PHE 119 23.099 -4.292 8.497 1685 HZ PHE 119 HZ PHE 119 21.241 -4.795 6.920 1686 H PHE 120 HN PHE 120 22.487 2.748 10.509 1687 HA PHE 120 HA PHE 120 20.793 4.597 9.197 1688 1HB PHE 120 HB2 PHE 120 22.792 5.277 11.377 1689 2HB PHE 120 HB3 PHE 120 21.296 6.104 10.980 1690 HD1 PHE 120 HD1 PHE 120 19.761 3.164 10.810 1691 HD2 PHE 120 HD2 PHE 120 22.122 5.322 13.716 1692 HE1 PHE 120 HE1 PHE 120 18.539 2.050 12.635 1693 HE2 PHE 120 HE2 PHE 120 20.892 4.190 15.544 1694 HZ PHE 120 HZ PHE 120 19.077 2.585 15.012 1695 H GLN 121 HN GLN 121 24.363 4.641 9.656 1696 HA GLN 121 HA GLN 121 24.855 7.126 8.430 1697 1HB GLN 121 HB2 GLN 121 26.387 5.939 9.938 1698 2HB GLN 121 HB3 GLN 121 26.622 4.658 8.740 1699 1HG GLN 121 HG2 GLN 121 27.615 6.295 7.169 1700 2HG GLN 121 HG3 GLN 121 27.363 7.590 8.364 1701 1HE2 GLN 121 HE22 GLN 121 28.326 6.922 10.694 1702 2HE2 GLN 121 HE21 GLN 121 29.950 6.286 10.631 1703 H ARG 122 HN ARG 122 24.913 3.780 7.114 1704 HA ARG 122 HA ARG 122 25.917 4.366 4.566 1705 1HB ARG 122 HB2 ARG 122 25.694 2.090 5.520 1706 2HB ARG 122 HB3 ARG 122 23.939 2.245 5.548 1707 1HG ARG 122 HG2 ARG 122 24.166 2.471 2.925 1708 2HG ARG 122 HG3 ARG 122 25.769 1.774 3.187 1709 1HD ARG 122 HD2 ARG 122 23.063 0.620 3.963 1710 2HD ARG 122 HD3 ARG 122 24.129 0.010 2.693 1711 HE ARG 122 HE ARG 122 25.785 -0.372 4.646 1712 1HH1 ARG 122 HH11 ARG 122 22.248 -0.973 4.833 1713 2HH1 ARG 122 HH12 ARG 122 22.386 -1.970 6.238 1714 1HH2 ARG 122 HH21 ARG 122 25.921 -1.779 6.447 1715 2HH2 ARG 122 HH22 ARG 122 24.505 -2.509 7.101 1716 H VAL 123 HN VAL 123 22.480 4.019 5.650 1717 HA VAL 123 HA VAL 123 21.591 4.720 3.001 1718 HB VAL 123 HB VAL 123 19.961 4.434 5.550 1719 1HG1 VAL 123 HG11 VAL 123 18.177 3.908 3.650 1720 2HG1 VAL 123 HG12 VAL 123 18.563 5.589 4.066 1721 3HG1 VAL 123 HG13 VAL 123 19.260 4.819 2.618 1722 1HG2 VAL 123 HG21 VAL 123 21.144 2.329 4.975 1723 2HG2 VAL 123 HG22 VAL 123 19.422 2.182 4.645 1724 3HG2 VAL 123 HG23 VAL 123 20.558 2.449 3.304 1725 H ARG 124 HN ARG 124 21.839 6.652 6.091 1726 HA ARG 124 HA ARG 124 20.360 8.810 4.974 1727 1HB ARG 124 HB2 ARG 124 20.968 10.101 6.827 1728 2HB ARG 124 HB3 ARG 124 20.812 8.448 7.379 1729 1HG ARG 124 HG2 ARG 124 22.645 9.039 8.550 1730 2HG ARG 124 HG3 ARG 124 23.443 8.397 7.118 1731 1HD ARG 124 HD2 ARG 124 23.753 10.700 6.259 1732 2HD ARG 124 HD3 ARG 124 22.856 11.345 7.641 1733 HE ARG 124 HE ARG 124 24.624 10.366 9.118 1734 1HH1 ARG 124 HH21 ARG 124 25.561 11.303 5.792 1735 2HH1 ARG 124 HH22 ARG 124 27.220 11.485 6.214 1736 1HH2 ARG 124 HH11 ARG 124 26.648 10.570 9.617 1737 2HH2 ARG 124 HH12 ARG 124 27.902 11.062 8.488 1738 H ASP 125 HN ASP 125 23.858 8.096 4.824 1739 HA ASP 125 HA ASP 125 24.579 10.567 3.542 1740 1HB ASP 125 HB2 ASP 125 26.245 9.072 4.556 1741 2HB ASP 125 HB3 ASP 125 25.856 7.809 3.384 1742 H GLU 126 HN GLU 126 23.539 7.385 2.239 1743 HA GLU 126 HA GLU 126 23.919 8.092 -0.496 1744 1HB GLU 126 HB2 GLU 126 23.723 5.762 0.532 1745 2HB GLU 126 HB3 GLU 126 21.993 6.040 0.679 1746 1HG GLU 126 HG2 GLU 126 22.397 4.756 -1.312 1747 2HG GLU 126 HG3 GLU 126 21.840 6.359 -1.772 1748 H ILE 127 HN ILE 127 21.013 8.132 1.621 1749 HA ILE 127 HA ILE 127 19.124 9.187 -0.193 1750 HB ILE 127 HB ILE 127 19.473 9.228 2.817 1751 1HG1 ILE 127 HG12 ILE 127 17.397 8.051 0.914 1752 2HG1 ILE 127 HG13 ILE 127 18.674 7.167 1.736 1753 1HG2 ILE 127 HG21 ILE 127 17.390 10.348 3.206 1754 2HG2 ILE 127 HG22 ILE 127 18.427 11.430 2.312 1755 3HG2 ILE 127 HG23 ILE 127 17.119 10.570 1.461 1756 1HD1 ILE 127 HD11 ILE 127 17.546 7.738 3.953 1757 2HD1 ILE 127 HD12 ILE 127 16.198 8.425 3.014 1758 3HD1 ILE 127 HD13 ILE 127 16.591 6.708 2.848 1759 H GLY 128 HN GLY 128 21.442 10.924 1.989 1760 1HA GLY 128 HA2 GLY 128 20.595 13.497 1.386 1761 2HA GLY 128 HA3 GLY 128 22.244 13.043 1.887 1762 H ASN 129 HN ASN 129 23.242 11.672 -0.210 1763 HA ASN 129 HA ASN 129 23.876 13.765 -2.028 1764 1HB ASN 129 HB2 ASN 129 24.397 10.756 -2.068 1765 2HB ASN 129 HB3 ASN 129 24.902 11.802 -3.390 1766 1HD2 ASN 129 HD22 ASN 129 25.434 11.126 0.095 1767 2HD2 ASN 129 HD21 ASN 129 26.958 11.968 0.173 1768 H ARG 130 HN ARG 130 21.650 10.988 -2.306 1769 HA ARG 130 HA ARG 130 21.017 11.517 -5.072 1770 1HB ARG 130 HB2 ARG 130 19.530 9.980 -2.903 1771 2HB ARG 130 HB3 ARG 130 18.987 10.081 -4.588 1772 1HG ARG 130 HG2 ARG 130 21.111 9.105 -5.381 1773 2HG ARG 130 HG3 ARG 130 21.718 9.019 -3.721 1774 1HD ARG 130 HD2 ARG 130 19.726 7.561 -3.155 1775 2HD ARG 130 HD3 ARG 130 19.346 7.542 -4.897 1776 HE ARG 130 HE ARG 130 22.085 6.754 -4.143 1777 1HH1 ARG 130 HH11 ARG 130 18.821 5.495 -4.584 1778 2HH1 ARG 130 HH12 ARG 130 19.351 3.897 -5.054 1779 1HH2 ARG 130 HH21 ARG 130 22.785 4.775 -4.477 1780 2HH2 ARG 130 HH22 ARG 130 21.750 3.431 -4.904 1781 H LEU 131 HN LEU 131 19.404 12.593 -1.990 1782 HA LEU 131 HA LEU 131 17.351 13.939 -3.424 1783 1HB LEU 131 HB2 LEU 131 18.289 13.992 -0.581 1784 2HB LEU 131 HB3 LEU 131 17.393 15.384 -1.149 1785 HG LEU 131 HG LEU 131 15.879 13.849 -0.106 1786 1HD1 LEU 131 HD11 LEU 131 15.323 13.748 -3.103 1787 2HD1 LEU 131 HD12 LEU 131 14.179 13.598 -1.795 1788 3HD1 LEU 131 HD13 LEU 131 15.015 15.145 -2.052 1789 1HD2 LEU 131 HD21 LEU 131 15.380 11.613 -0.963 1790 2HD2 LEU 131 HD22 LEU 131 16.628 11.775 -2.215 1791 3HD2 LEU 131 HD23 LEU 131 17.082 11.728 -0.502 1792 H LYS 132 HN LYS 132 20.636 15.056 -2.498 1793 HA LYS 132 HA LYS 132 20.196 17.760 -3.257 1794 1HB LYS 132 HB2 LYS 132 22.145 16.784 -1.995 1795 2HB LYS 132 HB3 LYS 132 22.731 16.078 -3.510 1796 1HG LYS 132 HG2 LYS 132 22.919 18.358 -4.488 1797 2HG LYS 132 HG3 LYS 132 22.348 19.063 -2.966 1798 1HD LYS 132 HD2 LYS 132 24.815 17.298 -3.253 1799 2HD LYS 132 HD3 LYS 132 24.847 19.075 -3.296 1800 1HE LYS 132 HE2 LYS 132 23.772 19.055 -0.994 1801 2HE LYS 132 HE3 LYS 132 24.008 17.304 -0.956 1802 1HZ LYS 132 HZ1 LYS 132 25.822 18.434 0.146 1803 2HZ LYS 132 HZ2 LYS 132 26.411 17.719 -1.195 1804 3HZ LYS 132 HZ3 LYS 132 26.157 19.336 -1.166 1805 H GLU 133 HN GLU 133 20.754 14.831 -5.323 1806 HA GLU 133 HA GLU 133 21.190 16.412 -7.664 1807 1HB GLU 133 HB2 GLU 133 20.397 13.529 -7.246 1808 2HB GLU 133 HB3 GLU 133 20.045 14.281 -8.821 1809 1HG GLU 133 HG2 GLU 133 22.296 14.965 -9.123 1810 2HG GLU 133 HG3 GLU 133 22.761 14.410 -7.501 1811 H PHE 134 HN PHE 134 18.141 15.711 -5.961 1812 HA PHE 134 HA PHE 134 16.523 16.292 -8.304 1813 1HB PHE 134 HB2 PHE 134 15.879 16.636 -5.345 1814 2HB PHE 134 HB3 PHE 134 14.732 16.902 -6.641 1815 HD1 PHE 134 HD1 PHE 134 17.103 14.299 -5.462 1816 HD2 PHE 134 HD2 PHE 134 13.313 15.121 -7.271 1817 HE1 PHE 134 HE1 PHE 134 16.534 11.867 -5.305 1818 HE2 PHE 134 HE2 PHE 134 12.699 12.713 -7.053 1819 HZ PHE 134 HZ PHE 134 14.296 11.091 -6.077 1820 H ALA 135 HN ALA 135 18.047 18.257 -5.811 1821 HA ALA 135 HA ALA 135 16.890 20.702 -6.660 1822 1HB ALA 135 HB1 ALA 135 18.717 21.752 -5.310 1823 2HB ALA 135 HB2 ALA 135 17.873 20.462 -4.439 1824 3HB ALA 135 HB3 ALA 135 19.480 20.153 -5.131 1825 H GLU 136 HN GLU 136 19.704 18.866 -7.756 1826 HA GLU 136 HA GLU 136 20.777 20.968 -9.401 1827 1HB GLU 136 HB2 GLU 136 21.392 18.011 -9.193 1828 2HB GLU 136 HB3 GLU 136 22.273 19.107 -10.245 1829 1HG GLU 136 HG2 GLU 136 22.050 19.524 -7.236 1830 2HG GLU 136 HG3 GLU 136 23.340 18.607 -7.998 1831 H THR 137 HN THR 137 18.950 18.023 -9.938 1832 HA THR 137 HA THR 137 19.000 18.201 -12.834 1833 HB THR 137 HB THR 137 17.902 15.946 -12.667 1834 HG1 THR 137 HG1 THR 137 18.108 16.260 -9.889 1835 1HG2 THR 137 HG21 THR 137 19.744 14.792 -11.538 1836 2HG2 THR 137 HG22 THR 137 20.316 16.072 -12.622 1837 3HG2 THR 137 HG23 THR 137 20.326 16.337 -10.875 1838 H GLY 138 HN GLY 138 16.799 19.205 -10.322 1839 1HA GLY 138 HA2 GLY 138 14.859 20.403 -10.450 1840 2HA GLY 138 HA3 GLY 138 14.929 20.376 -12.231 1841 H LYS 139 HN LYS 139 15.291 17.356 -10.615 1842 HA LYS 139 HA LYS 139 13.001 16.151 -11.778 1843 1HB LYS 139 HB2 LYS 139 15.106 15.039 -11.304 1844 2HB LYS 139 HB3 LYS 139 14.871 15.301 -9.558 1845 1HG LYS 139 HG2 LYS 139 13.028 13.806 -9.491 1846 2HG LYS 139 HG3 LYS 139 12.866 13.761 -11.248 1847 1HD LYS 139 HD2 LYS 139 13.899 11.718 -10.313 1848 2HD LYS 139 HD3 LYS 139 14.922 12.520 -11.510 1849 1HE LYS 139 HE2 LYS 139 15.372 13.184 -8.597 1850 2HE LYS 139 HE3 LYS 139 15.855 11.590 -9.148 1851 1HZ LYS 139 HZ1 LYS 139 17.681 13.109 -9.337 1852 2HZ LYS 139 HZ2 LYS 139 17.255 12.626 -10.830 1853 3HZ LYS 139 HZ3 LYS 139 16.870 14.134 -10.318 Start of MODEL 15 1 1H MET 1 H1 MET 1 -24.313 -11.405 -7.654 2 2H MET 1 H2 MET 1 -23.661 -10.419 -8.807 3 3H MET 1 H3 MET 1 -22.683 -11.289 -7.794 4 HA MET 1 HA MET 1 -23.254 -13.309 -8.707 5 1HB MET 1 HB2 MET 1 -25.658 -12.699 -9.176 6 2HB MET 1 HB3 MET 1 -25.122 -11.820 -10.608 7 1HG MET 1 HG2 MET 1 -25.899 -14.104 -11.144 8 2HG MET 1 HG3 MET 1 -24.212 -13.863 -11.578 9 1HE MET 1 HE1 MET 1 -25.705 -16.475 -8.028 10 2HE MET 1 HE2 MET 1 -25.830 -14.707 -7.971 11 3HE MET 1 HE3 MET 1 -26.761 -15.626 -9.176 12 H ALA 2 HN ALA 2 -21.340 -13.669 -9.523 13 HA ALA 2 HA ALA 2 -19.510 -13.719 -10.723 14 1HB ALA 2 HB1 ALA 2 -20.751 -11.901 -12.819 15 2HB ALA 2 HB2 ALA 2 -19.282 -12.874 -12.973 16 3HB ALA 2 HB3 ALA 2 -20.852 -13.680 -12.810 17 H ILE 3 HN ILE 3 -17.569 -12.471 -11.091 18 HA ILE 3 HA ILE 3 -17.508 -9.944 -9.597 19 HB ILE 3 HB ILE 3 -15.446 -12.030 -10.321 20 1HG1 ILE 3 HG12 ILE 3 -14.736 -11.580 -7.966 21 2HG1 ILE 3 HG13 ILE 3 -16.061 -10.426 -7.806 22 1HG2 ILE 3 HG21 ILE 3 -14.831 -9.106 -9.692 23 2HG2 ILE 3 HG22 ILE 3 -13.643 -10.435 -9.643 24 3HG2 ILE 3 HG23 ILE 3 -14.382 -9.981 -11.170 25 1HD1 ILE 3 HD11 ILE 3 -16.354 -13.408 -8.313 26 2HD1 ILE 3 HD12 ILE 3 -16.539 -12.538 -6.772 27 3HD1 ILE 3 HD13 ILE 3 -17.689 -12.238 -8.076 28 H VAL 4 HN VAL 4 -18.078 -8.284 -10.766 29 HA VAL 4 HA VAL 4 -17.778 -8.135 -13.674 30 HB VAL 4 HB VAL 4 -18.834 -6.150 -11.626 31 1HG1 VAL 4 HG11 VAL 4 -20.209 -5.242 -13.506 32 2HG1 VAL 4 HG12 VAL 4 -18.494 -4.982 -13.730 33 3HG1 VAL 4 HG13 VAL 4 -19.317 -6.286 -14.629 34 1HG2 VAL 4 HG21 VAL 4 -20.198 -8.178 -11.432 35 2HG2 VAL 4 HG22 VAL 4 -21.126 -6.932 -12.249 36 3HG2 VAL 4 HG23 VAL 4 -20.394 -8.244 -13.198 37 H LYS 5 HN LYS 5 -16.826 -6.027 -14.511 38 HA LYS 5 HA LYS 5 -14.444 -5.214 -12.996 39 1HB LYS 5 HB2 LYS 5 -13.168 -5.081 -15.095 40 2HB LYS 5 HB3 LYS 5 -13.639 -6.723 -14.656 41 1HG LYS 5 HG2 LYS 5 -15.574 -6.524 -16.299 42 2HG LYS 5 HG3 LYS 5 -14.885 -4.977 -16.826 43 1HD LYS 5 HD2 LYS 5 -12.845 -6.082 -17.570 44 2HD LYS 5 HD3 LYS 5 -13.383 -7.632 -16.876 45 1HE LYS 5 HE2 LYS 5 -15.348 -7.641 -18.375 46 2HE LYS 5 HE3 LYS 5 -14.833 -6.105 -19.084 47 1HZ LYS 5 HZ1 LYS 5 -14.161 -7.974 -20.453 48 2HZ LYS 5 HZ2 LYS 5 -12.832 -7.222 -19.891 49 3HZ LYS 5 HZ3 LYS 5 -13.308 -8.643 -19.239 50 H ALA 6 HN ALA 6 -14.492 -3.157 -12.585 51 HA ALA 6 HA ALA 6 -16.376 -1.299 -13.879 52 1HB ALA 6 HB1 ALA 6 -16.198 -0.871 -11.580 53 2HB ALA 6 HB2 ALA 6 -14.452 -1.189 -11.558 54 3HB ALA 6 HB3 ALA 6 -15.093 0.293 -12.285 55 H THR 7 HN THR 7 -15.356 0.808 -14.698 56 HA THR 7 HA THR 7 -12.507 0.709 -15.448 57 HB THR 7 HB THR 7 -12.981 1.597 -17.650 58 HG1 THR 7 HG1 THR 7 -14.877 2.204 -18.315 59 1HG2 THR 7 HG21 THR 7 -13.060 -0.856 -17.443 60 2HG2 THR 7 HG22 THR 7 -14.832 -0.763 -17.239 61 3HG2 THR 7 HG23 THR 7 -14.072 -0.233 -18.764 62 H ASP 8 HN ASP 8 -12.379 3.066 -16.638 63 HA ASP 8 HA ASP 8 -12.282 5.088 -14.677 64 1HB ASP 8 HB2 ASP 8 -11.701 6.519 -16.420 65 2HB ASP 8 HB3 ASP 8 -11.151 4.943 -16.994 66 H GLN 9 HN GLN 9 -15.045 3.936 -16.468 67 HA GLN 9 HA GLN 9 -16.721 5.993 -15.175 68 1HB GLN 9 HB2 GLN 9 -16.605 5.341 -18.131 69 2HB GLN 9 HB3 GLN 9 -18.076 5.997 -17.406 70 1HG GLN 9 HG2 GLN 9 -16.986 8.027 -16.711 71 2HG GLN 9 HG3 GLN 9 -15.398 7.410 -17.118 72 1HE2 GLN 9 HE22 GLN 9 -14.609 7.548 -19.200 73 2HE2 GLN 9 HE21 GLN 9 -15.509 8.273 -20.531 74 H SER 10 HN SER 10 -16.535 2.745 -16.693 75 HA SER 10 HA SER 10 -19.228 2.067 -16.276 76 1HB SER 10 HB2 SER 10 -16.931 0.091 -16.127 77 2HB SER 10 HB3 SER 10 -18.611 -0.217 -16.589 78 HG SER 10 HG SER 10 -16.556 1.113 -17.962 79 H PHE 11 HN PHE 11 -16.733 2.447 -13.842 80 HA PHE 11 HA PHE 11 -17.739 0.844 -11.736 81 1HB PHE 11 HB2 PHE 11 -15.673 2.152 -11.491 82 2HB PHE 11 HB3 PHE 11 -16.529 3.636 -11.785 83 HD1 PHE 11 HD1 PHE 11 -15.996 0.896 -9.241 84 HD2 PHE 11 HD2 PHE 11 -17.728 4.789 -10.067 85 HE1 PHE 11 HE1 PHE 11 -16.115 1.407 -6.823 86 HE2 PHE 11 HE2 PHE 11 -17.961 5.189 -7.640 87 HZ PHE 11 HZ PHE 11 -17.115 3.516 -6.012 88 H SER 12 HN SER 12 -18.675 4.243 -12.672 89 HA SER 12 HA SER 12 -20.654 4.453 -10.690 90 1HB SER 12 HB2 SER 12 -20.722 5.767 -13.442 91 2HB SER 12 HB3 SER 12 -21.345 6.424 -11.921 92 HG SER 12 HG SER 12 -19.322 7.357 -12.472 93 H ALA 13 HN ALA 13 -20.831 3.405 -14.109 94 HA ALA 13 HA ALA 13 -23.618 3.308 -14.231 95 1HB ALA 13 HB1 ALA 13 -22.106 3.280 -16.197 96 2HB ALA 13 HB2 ALA 13 -21.598 1.623 -15.784 97 3HB ALA 13 HB3 ALA 13 -23.278 1.943 -16.264 98 H GLU 14 HN GLU 14 -21.267 0.839 -13.193 99 HA GLU 14 HA GLU 14 -23.240 -1.202 -12.828 100 1HB GLU 14 HB2 GLU 14 -20.313 -0.970 -12.076 101 2HB GLU 14 HB3 GLU 14 -21.278 -2.380 -11.656 102 1HG GLU 14 HG2 GLU 14 -20.838 -1.346 -14.483 103 2HG GLU 14 HG3 GLU 14 -19.999 -2.708 -13.743 104 H THR 15 HN THR 15 -22.200 1.452 -10.798 105 HA THR 15 HA THR 15 -22.980 0.009 -8.328 106 HB THR 15 HB THR 15 -21.686 1.807 -7.205 107 HG1 THR 15 HG1 THR 15 -20.691 2.444 -9.738 108 1HG2 THR 15 HG21 THR 15 -20.361 -0.126 -7.528 109 2HG2 THR 15 HG22 THR 15 -20.231 0.116 -9.284 110 3HG2 THR 15 HG23 THR 15 -19.385 1.204 -8.183 111 H SER 16 HN SER 16 -24.371 2.233 -10.470 112 HA SER 16 HA SER 16 -25.445 4.112 -8.602 113 1HB SER 16 HB2 SER 16 -26.237 3.472 -11.455 114 2HB SER 16 HB3 SER 16 -26.846 4.839 -10.496 115 HG SER 16 HG SER 16 -24.125 4.344 -11.181 116 H GLU 17 HN GLU 17 -26.309 0.875 -8.938 117 HA GLU 17 HA GLU 17 -28.927 1.363 -7.727 118 1HB GLU 17 HB2 GLU 17 -28.431 -0.327 -10.221 119 2HB GLU 17 HB3 GLU 17 -29.886 -0.463 -9.223 120 1HG GLU 17 HG2 GLU 17 -30.377 1.955 -9.665 121 2HG GLU 17 HG3 GLU 17 -29.000 2.006 -10.770 122 H GLY 18 HN GLY 18 -29.677 -0.457 -6.482 123 1HA GLY 18 HA2 GLY 18 -29.550 -2.258 -5.178 124 2HA GLY 18 HA3 GLY 18 -28.349 -2.950 -6.292 125 H VAL 19 HN VAL 19 -27.265 -3.792 -4.481 126 HA VAL 19 HA VAL 19 -25.500 -1.829 -3.104 127 HB VAL 19 HB VAL 19 -26.278 -4.547 -1.959 128 1HG1 VAL 19 HG11 VAL 19 -25.102 -3.559 0.068 129 2HG1 VAL 19 HG12 VAL 19 -24.039 -3.876 -1.301 130 3HG1 VAL 19 HG13 VAL 19 -24.568 -2.222 -0.948 131 1HG2 VAL 19 HG21 VAL 19 -27.281 -1.769 -1.245 132 2HG2 VAL 19 HG22 VAL 19 -28.238 -3.146 -1.809 133 3HG2 VAL 19 HG23 VAL 19 -27.486 -3.187 -0.219 134 H VAL 20 HN VAL 20 -23.429 -1.994 -3.504 135 HA VAL 20 HA VAL 20 -22.493 -4.235 -5.182 136 HB VAL 20 HB VAL 20 -22.192 -1.283 -5.896 137 1HG1 VAL 20 HG11 VAL 20 -21.458 -3.884 -7.300 138 2HG1 VAL 20 HG12 VAL 20 -21.376 -2.275 -8.056 139 3HG1 VAL 20 HG13 VAL 20 -20.333 -2.667 -6.677 140 1HG2 VAL 20 HG21 VAL 20 -24.162 -3.359 -6.935 141 2HG2 VAL 20 HG22 VAL 20 -24.496 -1.742 -6.294 142 3HG2 VAL 20 HG23 VAL 20 -23.710 -1.930 -7.856 143 H LEU 21 HN LEU 21 -20.756 -4.963 -4.340 144 HA LEU 21 HA LEU 21 -18.996 -3.386 -2.538 145 1HB LEU 21 HB2 LEU 21 -19.486 -5.787 -2.035 146 2HB LEU 21 HB3 LEU 21 -18.876 -6.240 -3.623 147 HG LEU 21 HG LEU 21 -16.606 -5.376 -2.964 148 1HD1 LEU 21 HD11 LEU 21 -18.014 -4.954 -0.286 149 2HD1 LEU 21 HD12 LEU 21 -16.260 -5.069 -0.447 150 3HD1 LEU 21 HD13 LEU 21 -17.120 -3.748 -1.246 151 1HD2 LEU 21 HD21 LEU 21 -16.078 -7.270 -1.556 152 2HD2 LEU 21 HD22 LEU 21 -17.778 -7.443 -1.057 153 3HD2 LEU 21 HD23 LEU 21 -17.288 -7.762 -2.736 154 H ALA 22 HN ALA 22 -17.395 -2.119 -3.564 155 HA ALA 22 HA ALA 22 -16.428 -3.124 -6.177 156 1HB ALA 22 HB1 ALA 22 -15.750 -0.868 -6.746 157 2HB ALA 22 HB2 ALA 22 -17.470 -0.851 -6.330 158 3HB ALA 22 HB3 ALA 22 -16.266 -0.269 -5.150 159 H ASP 23 HN ASP 23 -14.225 -3.320 -6.422 160 HA ASP 23 HA ASP 23 -12.544 -3.170 -3.985 161 1HB ASP 23 HB2 ASP 23 -13.469 -5.378 -3.973 162 2HB ASP 23 HB3 ASP 23 -13.182 -5.584 -5.701 163 H PHE 24 HN PHE 24 -10.321 -3.161 -4.410 164 HA PHE 24 HA PHE 24 -9.520 -2.358 -7.174 165 1HB PHE 24 HB2 PHE 24 -9.084 -1.072 -4.469 166 2HB PHE 24 HB3 PHE 24 -8.181 -0.598 -5.880 167 HD1 PHE 24 HD1 PHE 24 -11.740 -0.852 -4.618 168 HD2 PHE 24 HD2 PHE 24 -8.992 1.076 -7.310 169 HE1 PHE 24 HE1 PHE 24 -13.551 0.639 -5.373 170 HE2 PHE 24 HE2 PHE 24 -10.831 2.589 -8.058 171 HZ PHE 24 HZ PHE 24 -13.096 2.390 -7.078 172 H TRP 25 HN TRP 25 -8.010 -3.762 -7.806 173 HA TRP 25 HA TRP 25 -6.126 -4.984 -5.872 174 1HB TRP 25 HB2 TRP 25 -6.540 -7.113 -6.606 175 2HB TRP 25 HB3 TRP 25 -8.158 -6.439 -6.556 176 HD1 TRP 25 HD1 TRP 25 -8.967 -5.427 -9.077 177 HE1 TRP 25 HE1 TRP 25 -8.511 -6.191 -11.429 178 HE3 TRP 25 HE3 TRP 25 -5.142 -8.655 -8.058 179 HZ2 TRP 25 HZ2 TRP 25 -6.362 -7.746 -12.790 180 HZ3 TRP 25 HZ3 TRP 25 -3.859 -9.702 -9.897 181 HH2 TRP 25 HH2 TRP 25 -4.458 -9.236 -12.263 182 H ALA 26 HN ALA 26 -4.003 -5.361 -6.901 183 HA ALA 26 HA ALA 26 -3.690 -5.442 -9.709 184 1HB ALA 26 HB1 ALA 26 -2.091 -3.327 -9.763 185 2HB ALA 26 HB2 ALA 26 -3.825 -3.111 -9.934 186 3HB ALA 26 HB3 ALA 26 -3.052 -2.820 -8.367 187 HA PRO 27 HA PRO 27 -0.092 -7.577 -8.659 188 1HB PRO 27 HB2 PRO 27 1.561 -5.769 -10.428 189 2HB PRO 27 HB3 PRO 27 1.549 -7.560 -10.348 190 1HG PRO 27 HG2 PRO 27 0.173 -6.289 -12.310 191 2HG PRO 27 HG3 PRO 27 -0.613 -7.654 -11.441 192 1HD PRO 27 HD2 PRO 27 -0.961 -4.701 -11.020 193 2HD PRO 27 HD3 PRO 27 -2.194 -5.996 -11.096 194 H TRP 28 HN TRP 28 0.085 -4.145 -7.992 195 HA TRP 28 HA TRP 28 2.545 -3.785 -6.733 196 1HB TRP 28 HB2 TRP 28 -0.041 -2.586 -5.801 197 2HB TRP 28 HB3 TRP 28 1.578 -1.915 -5.683 198 HD1 TRP 28 HD1 TRP 28 -1.421 -1.761 -7.691 199 HE1 TRP 28 HE1 TRP 28 -1.158 -0.548 -9.908 200 HE3 TRP 28 HE3 TRP 28 3.669 -1.623 -7.805 201 HZ2 TRP 28 HZ2 TRP 28 1.063 0.299 -11.593 202 HZ3 TRP 28 HZ3 TRP 28 4.847 -0.608 -9.739 203 HH2 TRP 28 HH2 TRP 28 3.557 0.351 -11.637 204 H CYS 29 HN CYS 29 -0.150 -5.719 -5.449 205 HA CYS 29 HA CYS 29 1.410 -5.968 -2.932 206 1HB CYS 29 HB2 CYS 29 -0.836 -4.367 -3.157 207 2HB CYS 29 HB3 CYS 29 -1.552 -5.882 -2.656 208 H GLY 30 HN GLY 30 1.133 -7.859 -1.757 209 1HA GLY 30 HA2 GLY 30 0.553 -10.283 -3.169 210 2HA GLY 30 HA3 GLY 30 0.813 -10.094 -1.429 211 HA PRO 31 HA PRO 31 -3.600 -10.092 -0.417 212 1HB PRO 31 HB2 PRO 31 -3.527 -7.067 -0.457 213 2HB PRO 31 HB3 PRO 31 -4.488 -8.133 0.628 214 1HG PRO 31 HG2 PRO 31 -2.120 -7.134 1.488 215 2HG PRO 31 HG3 PRO 31 -2.440 -8.885 1.723 216 1HD PRO 31 HD2 PRO 31 -0.769 -7.533 -0.388 217 2HD PRO 31 HD3 PRO 31 -0.450 -9.055 0.486 218 H SER 32 HN SER 32 -2.829 -7.935 -3.236 219 HA SER 32 HA SER 32 -5.458 -7.901 -4.275 220 1HB SER 32 HB2 SER 32 -2.845 -8.255 -5.817 221 2HB SER 32 HB3 SER 32 -4.319 -7.462 -6.388 222 HG SER 32 HG SER 32 -2.534 -6.109 -5.617 223 H LYS 33 HN LYS 33 -3.068 -10.501 -4.205 224 HA LYS 33 HA LYS 33 -4.769 -12.194 -5.916 225 1HB LYS 33 HB2 LYS 33 -2.140 -12.993 -4.648 226 2HB LYS 33 HB3 LYS 33 -3.041 -13.771 -5.946 227 1HG LYS 33 HG2 LYS 33 -1.378 -12.775 -7.148 228 2HG LYS 33 HG3 LYS 33 -2.651 -11.558 -7.290 229 1HD LYS 33 HD2 LYS 33 -1.567 -10.233 -5.494 230 2HD LYS 33 HD3 LYS 33 -0.368 -11.511 -5.255 231 1HE LYS 33 HE2 LYS 33 0.400 -11.162 -7.627 232 2HE LYS 33 HE3 LYS 33 -0.752 -9.827 -7.770 233 1HZ LYS 33 HZ1 LYS 33 0.430 -8.766 -5.883 234 2HZ LYS 33 HZ2 LYS 33 1.554 -9.959 -5.912 235 3HZ LYS 33 HZ3 LYS 33 1.413 -8.955 -7.185 236 H MET 34 HN MET 34 -5.089 -11.329 -2.795 237 HA MET 34 HA MET 34 -5.955 -14.064 -1.931 238 1HB MET 34 HB2 MET 34 -5.026 -11.796 -0.139 239 2HB MET 34 HB3 MET 34 -5.620 -13.382 0.366 240 1HG MET 34 HG2 MET 34 -3.737 -14.416 -0.984 241 2HG MET 34 HG3 MET 34 -3.061 -12.797 -1.168 242 1HE MET 34 HE1 MET 34 -3.555 -11.435 1.709 243 2HE MET 34 HE2 MET 34 -2.044 -11.881 2.525 244 3HE MET 34 HE3 MET 34 -2.008 -11.380 0.823 245 H ILE 35 HN ILE 35 -6.663 -10.516 -1.770 246 HA ILE 35 HA ILE 35 -9.350 -10.813 -0.959 247 HB ILE 35 HB ILE 35 -7.665 -8.712 -1.275 248 1HG1 ILE 35 HG12 ILE 35 -9.819 -7.247 -1.070 249 2HG1 ILE 35 HG13 ILE 35 -10.684 -8.787 -1.032 250 1HG2 ILE 35 HG21 ILE 35 -7.787 -8.655 -3.720 251 2HG2 ILE 35 HG22 ILE 35 -9.551 -8.363 -3.617 252 3HG2 ILE 35 HG23 ILE 35 -8.407 -7.182 -2.964 253 1HD1 ILE 35 HD11 ILE 35 -10.059 -7.907 1.243 254 2HD1 ILE 35 HD12 ILE 35 -9.329 -9.495 0.923 255 3HD1 ILE 35 HD13 ILE 35 -8.348 -8.018 0.786 256 H ALA 36 HN ALA 36 -7.721 -11.083 -4.116 257 HA ALA 36 HA ALA 36 -10.007 -11.094 -5.757 258 1HB ALA 36 HB1 ALA 36 -7.917 -10.904 -6.852 259 2HB ALA 36 HB2 ALA 36 -7.274 -12.384 -6.136 260 3HB ALA 36 HB3 ALA 36 -8.567 -12.471 -7.351 261 HA PRO 37 HA PRO 37 -10.545 -15.831 -5.279 262 1HB PRO 37 HB2 PRO 37 -9.329 -16.836 -2.880 263 2HB PRO 37 HB3 PRO 37 -8.900 -17.226 -4.580 264 1HG PRO 37 HG2 PRO 37 -7.620 -15.358 -2.659 265 2HG PRO 37 HG3 PRO 37 -6.882 -16.177 -4.064 266 1HD PRO 37 HD2 PRO 37 -7.508 -13.492 -4.049 267 2HD PRO 37 HD3 PRO 37 -7.510 -14.497 -5.516 268 H VAL 38 HN VAL 38 -10.043 -13.928 -2.243 269 HA VAL 38 HA VAL 38 -12.190 -15.020 -0.799 270 HB VAL 38 HB VAL 38 -10.605 -12.484 -0.763 271 1HG1 VAL 38 HG11 VAL 38 -13.149 -12.775 0.822 272 2HG1 VAL 38 HG12 VAL 38 -11.801 -11.704 1.300 273 3HG1 VAL 38 HG13 VAL 38 -12.644 -11.456 -0.236 274 1HG2 VAL 38 HG21 VAL 38 -9.931 -13.316 1.423 275 2HG2 VAL 38 HG22 VAL 38 -11.161 -14.597 1.350 276 3HG2 VAL 38 HG23 VAL 38 -9.793 -14.618 0.219 277 H LEU 39 HN LEU 39 -12.206 -12.404 -3.263 278 HA LEU 39 HA LEU 39 -15.004 -11.864 -2.773 279 1HB LEU 39 HB2 LEU 39 -12.916 -10.864 -4.639 280 2HB LEU 39 HB3 LEU 39 -14.544 -10.903 -5.321 281 HG LEU 39 HG LEU 39 -15.447 -9.507 -3.626 282 1HD1 LEU 39 HD11 LEU 39 -14.045 -8.545 -1.761 283 2HD1 LEU 39 HD12 LEU 39 -14.511 -10.238 -1.571 284 3HD1 LEU 39 HD13 LEU 39 -12.853 -9.814 -2.094 285 1HD2 LEU 39 HD21 LEU 39 -14.256 -7.472 -3.951 286 2HD2 LEU 39 HD22 LEU 39 -12.722 -8.324 -4.256 287 3HD2 LEU 39 HD23 LEU 39 -14.056 -8.419 -5.430 288 H GLU 40 HN GLU 40 -13.317 -13.954 -5.179 289 HA GLU 40 HA GLU 40 -15.761 -14.596 -6.514 290 1HB GLU 40 HB2 GLU 40 -13.190 -16.204 -6.295 291 2HB GLU 40 HB3 GLU 40 -14.550 -16.508 -7.410 292 1HG GLU 40 HG2 GLU 40 -14.202 -14.312 -8.467 293 2HG GLU 40 HG3 GLU 40 -12.837 -13.993 -7.402 294 H GLU 41 HN GLU 41 -14.118 -15.920 -3.630 295 HA GLU 41 HA GLU 41 -16.002 -18.002 -3.126 296 1HB GLU 41 HB2 GLU 41 -13.937 -16.581 -1.430 297 2HB GLU 41 HB3 GLU 41 -14.949 -17.853 -0.780 298 1HG GLU 41 HG2 GLU 41 -13.106 -18.177 -3.185 299 2HG GLU 41 HG3 GLU 41 -12.699 -18.634 -1.533 300 H LEU 42 HN LEU 42 -16.179 -14.573 -2.672 301 HA LEU 42 HA LEU 42 -18.289 -14.744 -0.613 302 1HB LEU 42 HB2 LEU 42 -16.573 -12.859 -0.629 303 2HB LEU 42 HB3 LEU 42 -17.095 -12.400 -2.229 304 HG LEU 42 HG LEU 42 -19.325 -11.771 -1.394 305 1HD1 LEU 42 HD11 LEU 42 -18.127 -12.482 1.315 306 2HD1 LEU 42 HD12 LEU 42 -19.644 -11.586 1.054 307 3HD1 LEU 42 HD13 LEU 42 -19.524 -13.277 0.558 308 1HD2 LEU 42 HD21 LEU 42 -17.047 -10.549 0.234 309 2HD2 LEU 42 HD22 LEU 42 -17.431 -10.118 -1.440 310 3HD2 LEU 42 HD23 LEU 42 -18.604 -9.783 -0.157 311 H ASP 43 HN ASP 43 -17.935 -13.986 -4.106 312 HA ASP 43 HA ASP 43 -20.703 -13.334 -4.352 313 1HB ASP 43 HB2 ASP 43 -19.020 -12.509 -6.003 314 2HB ASP 43 HB3 ASP 43 -18.633 -14.162 -6.455 315 H GLN 44 HN GLN 44 -18.851 -16.337 -4.907 316 HA GLN 44 HA GLN 44 -21.113 -17.733 -5.929 317 1HB GLN 44 HB2 GLN 44 -19.826 -19.686 -5.832 318 2HB GLN 44 HB3 GLN 44 -18.721 -18.361 -6.204 319 1HG GLN 44 HG2 GLN 44 -18.115 -18.328 -3.721 320 2HG GLN 44 HG3 GLN 44 -19.062 -19.803 -3.535 321 1HE2 GLN 44 HE22 GLN 44 -16.374 -18.399 -5.465 322 2HE2 GLN 44 HE21 GLN 44 -15.481 -19.905 -5.649 323 H GLU 45 HN GLU 45 -20.584 -16.565 -2.722 324 HA GLU 45 HA GLU 45 -22.255 -18.624 -1.576 325 1HB GLU 45 HB2 GLU 45 -20.485 -18.542 -0.198 326 2HB GLU 45 HB3 GLU 45 -20.108 -16.850 -0.562 327 1HG GLU 45 HG2 GLU 45 -21.708 -16.002 0.843 328 2HG GLU 45 HG3 GLU 45 -22.580 -17.540 1.008 329 H MET 46 HN MET 46 -22.052 -15.076 -1.875 330 HA MET 46 HA MET 46 -24.984 -14.948 -1.330 331 1HB MET 46 HB2 MET 46 -24.513 -12.922 -0.004 332 2HB MET 46 HB3 MET 46 -23.945 -14.434 0.706 333 1HG MET 46 HG2 MET 46 -21.656 -13.948 0.047 334 2HG MET 46 HG3 MET 46 -22.141 -12.512 -0.843 335 1HE MET 46 HE1 MET 46 -22.996 -9.954 1.810 336 2HE MET 46 HE2 MET 46 -22.672 -10.381 0.113 337 3HE MET 46 HE3 MET 46 -24.187 -10.950 0.874 338 H GLY 47 HN GLY 47 -23.063 -14.630 -3.815 339 1HA GLY 47 HA2 GLY 47 -23.561 -11.951 -4.719 340 2HA GLY 47 HA3 GLY 47 -23.115 -13.368 -5.718 341 H ASP 48 HN ASP 48 -25.758 -14.288 -4.085 342 HA ASP 48 HA ASP 48 -27.631 -13.842 -6.232 343 1HB ASP 48 HB2 ASP 48 -27.778 -15.877 -4.864 344 2HB ASP 48 HB3 ASP 48 -27.975 -14.907 -3.403 345 H LYS 49 HN LYS 49 -26.672 -12.173 -3.305 346 HA LYS 49 HA LYS 49 -28.958 -10.357 -3.539 347 1HB LYS 49 HB2 LYS 49 -26.973 -10.426 -1.259 348 2HB LYS 49 HB3 LYS 49 -28.623 -9.819 -1.273 349 1HG LYS 49 HG2 LYS 49 -29.035 -11.715 -0.143 350 2HG LYS 49 HG3 LYS 49 -29.137 -12.445 -1.761 351 1HD LYS 49 HD2 LYS 49 -27.042 -13.503 -1.555 352 2HD LYS 49 HD3 LYS 49 -26.458 -12.277 -0.415 353 1HE LYS 49 HE2 LYS 49 -26.670 -14.262 0.816 354 2HE LYS 49 HE3 LYS 49 -27.871 -13.101 1.362 355 1HZ LYS 49 HZ1 LYS 49 -28.831 -15.311 1.149 356 2HZ LYS 49 HZ2 LYS 49 -29.551 -14.329 0.073 357 3HZ LYS 49 HZ3 LYS 49 -28.432 -15.416 -0.424 358 H LEU 50 HN LEU 50 -25.489 -10.579 -3.868 359 HA LEU 50 HA LEU 50 -25.152 -7.646 -3.791 360 1HB LEU 50 HB2 LEU 50 -24.164 -8.874 -1.914 361 2HB LEU 50 HB3 LEU 50 -23.365 -9.981 -3.033 362 HG LEU 50 HG LEU 50 -21.922 -8.144 -3.841 363 1HD1 LEU 50 HD11 LEU 50 -23.389 -6.205 -3.365 364 2HD1 LEU 50 HD12 LEU 50 -23.282 -6.528 -1.626 365 3HD1 LEU 50 HD13 LEU 50 -21.847 -6.021 -2.546 366 1HD2 LEU 50 HD21 LEU 50 -20.502 -8.038 -1.879 367 2HD2 LEU 50 HD22 LEU 50 -21.864 -8.495 -0.830 368 3HD2 LEU 50 HD23 LEU 50 -21.213 -9.649 -2.017 369 H LYS 51 HN LYS 51 -23.810 -6.670 -5.279 370 HA LYS 51 HA LYS 51 -22.844 -8.324 -7.591 371 1HB LYS 51 HB2 LYS 51 -24.422 -6.458 -8.171 372 2HB LYS 51 HB3 LYS 51 -23.305 -5.324 -7.403 373 1HG LYS 51 HG2 LYS 51 -21.520 -6.089 -9.058 374 2HG LYS 51 HG3 LYS 51 -22.766 -7.035 -9.873 375 1HD LYS 51 HD2 LYS 51 -22.725 -4.007 -9.487 376 2HD LYS 51 HD3 LYS 51 -22.305 -4.876 -10.966 377 1HE LYS 51 HE2 LYS 51 -24.631 -5.777 -11.086 378 2HE LYS 51 HE3 LYS 51 -25.055 -4.845 -9.638 379 1HZ LYS 51 HZ1 LYS 51 -24.469 -2.828 -10.865 380 2HZ LYS 51 HZ2 LYS 51 -24.097 -3.708 -12.200 381 3HZ LYS 51 HZ3 LYS 51 -25.655 -3.659 -11.658 382 H ILE 52 HN ILE 52 -20.562 -8.173 -8.035 383 HA ILE 52 HA ILE 52 -18.959 -6.612 -6.096 384 HB ILE 52 HB ILE 52 -18.399 -9.434 -7.098 385 1HG1 ILE 52 HG12 ILE 52 -19.321 -8.365 -4.400 386 2HG1 ILE 52 HG13 ILE 52 -20.098 -9.578 -5.417 387 1HG2 ILE 52 HG21 ILE 52 -16.366 -8.028 -6.894 388 2HG2 ILE 52 HG22 ILE 52 -16.807 -7.637 -5.215 389 3HG2 ILE 52 HG23 ILE 52 -16.399 -9.305 -5.699 390 1HD1 ILE 52 HD11 ILE 52 -17.678 -9.875 -3.654 391 2HD1 ILE 52 HD12 ILE 52 -19.166 -10.837 -3.691 392 3HD1 ILE 52 HD13 ILE 52 -17.949 -11.002 -4.979 393 H VAL 53 HN VAL 53 -17.422 -5.391 -7.125 394 HA VAL 53 HA VAL 53 -16.992 -5.800 -10.040 395 HB VAL 53 HB VAL 53 -17.437 -3.096 -8.706 396 1HG1 VAL 53 HG11 VAL 53 -17.762 -2.317 -10.997 397 2HG1 VAL 53 HG12 VAL 53 -16.165 -3.047 -10.760 398 3HG1 VAL 53 HG13 VAL 53 -17.439 -3.952 -11.620 399 1HG2 VAL 53 HG21 VAL 53 -19.542 -4.631 -10.287 400 2HG2 VAL 53 HG22 VAL 53 -19.584 -4.310 -8.549 401 3HG2 VAL 53 HG23 VAL 53 -19.657 -2.968 -9.692 402 H LYS 54 HN LYS 54 -14.769 -5.875 -10.447 403 HA LYS 54 HA LYS 54 -12.974 -4.716 -8.354 404 1HB LYS 54 HB2 LYS 54 -12.422 -6.750 -10.540 405 2HB LYS 54 HB3 LYS 54 -11.177 -6.000 -9.533 406 1HG LYS 54 HG2 LYS 54 -12.337 -6.878 -7.479 407 2HG LYS 54 HG3 LYS 54 -13.496 -7.687 -8.520 408 1HD LYS 54 HD2 LYS 54 -12.002 -9.410 -8.047 409 2HD LYS 54 HD3 LYS 54 -11.443 -8.842 -9.615 410 1HE LYS 54 HE2 LYS 54 -9.436 -9.053 -8.462 411 2HE LYS 54 HE3 LYS 54 -9.779 -7.342 -8.186 412 1HZ LYS 54 HZ1 LYS 54 -9.122 -8.652 -6.203 413 2HZ LYS 54 HZ2 LYS 54 -10.449 -7.722 -6.059 414 3HZ LYS 54 HZ3 LYS 54 -10.623 -9.354 -6.227 415 H ILE 55 HN ILE 55 -11.205 -3.378 -9.025 416 HA ILE 55 HA ILE 55 -11.362 -2.112 -11.713 417 HB ILE 55 HB ILE 55 -10.789 -1.020 -8.922 418 1HG1 ILE 55 HG12 ILE 55 -13.026 -0.648 -10.000 419 2HG1 ILE 55 HG13 ILE 55 -12.187 0.773 -9.436 420 1HG2 ILE 55 HG21 ILE 55 -9.587 0.085 -11.475 421 2HG2 ILE 55 HG22 ILE 55 -9.719 0.997 -9.948 422 3HG2 ILE 55 HG23 ILE 55 -8.752 -0.479 -10.033 423 1HD1 ILE 55 HD11 ILE 55 -12.307 -0.064 -12.356 424 2HD1 ILE 55 HD12 ILE 55 -13.225 1.250 -11.575 425 3HD1 ILE 55 HD13 ILE 55 -11.485 1.376 -11.718 426 H ASP 56 HN ASP 56 -9.514 -2.608 -12.860 427 HA ASP 56 HA ASP 56 -7.277 -4.050 -11.561 428 1HB ASP 56 HB2 ASP 56 -8.004 -4.723 -13.826 429 2HB ASP 56 HB3 ASP 56 -7.681 -3.098 -14.433 430 H VAL 57 HN VAL 57 -6.164 -2.682 -10.257 431 HA VAL 57 HA VAL 57 -6.109 0.105 -10.767 432 HB VAL 57 HB VAL 57 -4.632 -1.323 -8.562 433 1HG1 VAL 57 HG11 VAL 57 -5.906 1.437 -8.809 434 2HG1 VAL 57 HG12 VAL 57 -5.282 0.737 -7.314 435 3HG1 VAL 57 HG13 VAL 57 -4.170 1.086 -8.652 436 1HG2 VAL 57 HG21 VAL 57 -7.121 -1.991 -8.641 437 2HG2 VAL 57 HG22 VAL 57 -6.497 -1.274 -7.163 438 3HG2 VAL 57 HG23 VAL 57 -7.466 -0.301 -8.295 439 H ASP 58 HN ASP 58 -4.855 -1.125 -12.865 440 HA ASP 58 HA ASP 58 -2.420 0.511 -12.909 441 1HB ASP 58 HB2 ASP 58 -1.403 -1.620 -12.312 442 2HB ASP 58 HB3 ASP 58 -2.329 -2.466 -13.555 443 H GLU 59 HN GLU 59 -4.585 -1.789 -14.799 444 HA GLU 59 HA GLU 59 -4.028 -0.286 -17.251 445 1HB GLU 59 HB2 GLU 59 -4.162 -2.501 -17.755 446 2HB GLU 59 HB3 GLU 59 -5.246 -2.883 -16.422 447 1HG GLU 59 HG2 GLU 59 -7.138 -1.998 -17.542 448 2HG GLU 59 HG3 GLU 59 -6.155 -1.454 -18.917 449 H ASN 60 HN ASN 60 -6.518 -0.529 -14.758 450 HA ASN 60 HA ASN 60 -8.171 1.477 -16.178 451 1HB ASN 60 HB2 ASN 60 -8.798 -1.337 -15.796 452 2HB ASN 60 HB3 ASN 60 -9.931 -0.393 -14.859 453 1HD2 ASN 60 HD22 ASN 60 -9.443 -1.667 -17.893 454 2HD2 ASN 60 HD21 ASN 60 -10.447 -0.580 -18.820 455 H GLN 61 HN GLN 61 -6.295 1.910 -14.134 456 HA GLN 61 HA GLN 61 -7.520 1.741 -11.582 457 1HB GLN 61 HB2 GLN 61 -5.455 2.157 -10.832 458 2HB GLN 61 HB3 GLN 61 -5.020 1.662 -12.448 459 1HG GLN 61 HG2 GLN 61 -3.836 3.505 -12.657 460 2HG GLN 61 HG3 GLN 61 -5.296 4.475 -12.638 461 1HE2 GLN 61 HE22 GLN 61 -2.952 2.769 -10.471 462 2HE2 GLN 61 HE21 GLN 61 -3.101 3.869 -9.123 463 H GLU 62 HN GLU 62 -8.180 3.844 -14.027 464 HA GLU 62 HA GLU 62 -7.748 6.431 -13.180 465 1HB GLU 62 HB2 GLU 62 -9.789 5.012 -14.893 466 2HB GLU 62 HB3 GLU 62 -9.901 6.774 -14.681 467 1HG GLU 62 HG2 GLU 62 -7.477 5.274 -15.769 468 2HG GLU 62 HG3 GLU 62 -8.701 6.061 -16.755 469 H THR 63 HN THR 63 -10.670 4.411 -12.464 470 HA THR 63 HA THR 63 -11.938 6.432 -10.922 471 HB THR 63 HB THR 63 -12.239 3.443 -11.143 472 HG1 THR 63 HG1 THR 63 -13.646 4.039 -12.639 473 1HG2 THR 63 HG21 THR 63 -14.143 5.326 -9.681 474 2HG2 THR 63 HG22 THR 63 -14.374 3.596 -10.035 475 3HG2 THR 63 HG23 THR 63 -13.131 4.085 -8.901 476 H ALA 64 HN ALA 64 -9.254 4.330 -10.095 477 HA ALA 64 HA ALA 64 -9.681 4.362 -7.218 478 1HB ALA 64 HB1 ALA 64 -7.716 3.100 -7.131 479 2HB ALA 64 HB2 ALA 64 -8.273 2.684 -8.771 480 3HB ALA 64 HB3 ALA 64 -6.991 3.867 -8.551 481 H GLY 65 HN GLY 65 -7.007 5.744 -9.144 482 1HA GLY 65 HA2 GLY 65 -6.274 7.908 -7.676 483 2HA GLY 65 HA3 GLY 65 -6.357 7.944 -9.448 484 H LYS 66 HN LYS 66 -9.246 7.911 -9.767 485 HA LYS 66 HA LYS 66 -9.943 10.630 -9.425 486 1HB LYS 66 HB2 LYS 66 -10.966 9.104 -11.069 487 2HB LYS 66 HB3 LYS 66 -11.663 8.162 -9.745 488 1HG LYS 66 HG2 LYS 66 -12.956 10.342 -9.142 489 2HG LYS 66 HG3 LYS 66 -12.513 10.867 -10.772 490 1HD LYS 66 HD2 LYS 66 -14.032 8.329 -9.994 491 2HD LYS 66 HD3 LYS 66 -14.747 9.774 -10.711 492 1HE LYS 66 HE2 LYS 66 -13.714 9.414 -12.811 493 2HE LYS 66 HE3 LYS 66 -12.585 8.215 -12.175 494 1HZ LYS 66 HZ1 LYS 66 -14.501 7.308 -13.426 495 2HZ LYS 66 HZ2 LYS 66 -14.310 6.632 -11.979 496 3HZ LYS 66 HZ3 LYS 66 -15.509 7.757 -12.218 497 H TYR 67 HN TYR 67 -10.877 7.717 -7.458 498 HA TYR 67 HA TYR 67 -12.280 9.357 -5.554 499 1HB TYR 67 HB2 TYR 67 -11.717 6.439 -5.866 500 2HB TYR 67 HB3 TYR 67 -12.020 7.029 -4.241 501 HD1 TYR 67 HD1 TYR 67 -14.189 7.449 -3.449 502 HD2 TYR 67 HD2 TYR 67 -13.514 7.054 -7.691 503 HE1 TYR 67 HE1 TYR 67 -16.630 7.559 -3.842 504 HE2 TYR 67 HE2 TYR 67 -15.953 7.181 -8.099 505 HH TYR 67 HH TYR 67 -18.064 7.507 -7.133 506 H GLY 68 HN GLY 68 -8.963 8.661 -6.073 507 1HA GLY 68 HA2 GLY 68 -7.088 9.374 -4.974 508 2HA GLY 68 HA3 GLY 68 -8.117 10.277 -3.838 509 H VAL 69 HN VAL 69 -7.437 6.759 -4.684 510 HA VAL 69 HA VAL 69 -8.059 6.100 -1.887 511 HB VAL 69 HB VAL 69 -8.490 3.978 -2.545 512 1HG1 VAL 69 HG11 VAL 69 -10.530 4.259 -3.851 513 2HG1 VAL 69 HG12 VAL 69 -10.310 5.652 -2.777 514 3HG1 VAL 69 HG13 VAL 69 -9.916 5.783 -4.507 515 1HG2 VAL 69 HG21 VAL 69 -7.062 3.330 -4.270 516 2HG2 VAL 69 HG22 VAL 69 -8.689 3.213 -4.919 517 3HG2 VAL 69 HG23 VAL 69 -7.686 4.612 -5.360 518 H MET 70 HN MET 70 -5.781 5.577 -4.462 519 HA MET 70 HA MET 70 -3.667 5.114 -4.642 520 1HB MET 70 HB2 MET 70 -2.139 6.614 -3.660 521 2HB MET 70 HB3 MET 70 -3.596 7.476 -4.144 522 1HG MET 70 HG2 MET 70 -4.311 7.824 -1.951 523 2HG MET 70 HG3 MET 70 -3.358 6.490 -1.340 524 1HE MET 70 HE1 MET 70 -0.867 6.365 -1.339 525 2HE MET 70 HE2 MET 70 -0.239 7.367 -2.650 526 3HE MET 70 HE3 MET 70 0.201 7.728 -0.967 527 H SER 71 HN SER 71 -5.153 3.338 -2.713 528 HA SER 71 HA SER 71 -2.835 2.158 -1.314 529 1HB SER 71 HB2 SER 71 -5.631 2.072 -0.203 530 2HB SER 71 HB3 SER 71 -4.079 1.699 0.580 531 HG SER 71 HG SER 71 -4.995 4.255 -0.256 532 H ILE 72 HN ILE 72 -3.032 -0.285 -1.068 533 HA ILE 72 HA ILE 72 -5.403 -1.439 -2.353 534 HB ILE 72 HB ILE 72 -2.568 -2.015 -3.202 535 1HG1 ILE 72 HG12 ILE 72 -5.081 -1.020 -4.610 536 2HG1 ILE 72 HG13 ILE 72 -3.548 -0.167 -4.359 537 1HG2 ILE 72 HG21 ILE 72 -3.739 -4.233 -2.936 538 2HG2 ILE 72 HG22 ILE 72 -4.973 -3.652 -4.086 539 3HG2 ILE 72 HG23 ILE 72 -3.286 -3.854 -4.577 540 1HD1 ILE 72 HD11 ILE 72 -3.601 -0.719 -6.599 541 2HD1 ILE 72 HD12 ILE 72 -2.467 -1.872 -5.847 542 3HD1 ILE 72 HD13 ILE 72 -4.121 -2.389 -6.293 543 HA PRO 73 HA PRO 73 -6.371 -3.542 -2.446 544 1HB PRO 73 HB2 PRO 73 -7.825 -4.653 -0.075 545 2HB PRO 73 HB3 PRO 73 -7.674 -5.320 -1.727 546 1HG PRO 73 HG2 PRO 73 -6.291 -6.404 0.344 547 2HG PRO 73 HG3 PRO 73 -5.524 -6.192 -1.266 548 1HD PRO 73 HD2 PRO 73 -5.305 -4.367 1.161 549 2HD PRO 73 HD3 PRO 73 -3.990 -5.008 0.138 550 H THR 74 HN THR 74 -8.153 -2.181 -2.758 551 HA THR 74 HA THR 74 -9.115 -0.685 -0.341 552 HB THR 74 HB THR 74 -8.911 0.451 -3.154 553 HG1 THR 74 HG1 THR 74 -7.051 0.856 -2.208 554 1HG2 THR 74 HG21 THR 74 -11.062 1.109 -2.173 555 2HG2 THR 74 HG22 THR 74 -10.247 1.582 -0.663 556 3HG2 THR 74 HG23 THR 74 -9.947 2.457 -2.174 557 H LEU 75 HN LEU 75 -11.290 -0.661 -0.003 558 HA LEU 75 HA LEU 75 -13.086 -2.041 -1.931 559 1HB LEU 75 HB2 LEU 75 -13.160 -2.173 1.117 560 2HB LEU 75 HB3 LEU 75 -14.474 -2.677 0.069 561 HG LEU 75 HG LEU 75 -11.729 -3.985 0.178 562 1HD1 LEU 75 HD11 LEU 75 -13.102 -4.336 2.215 563 2HD1 LEU 75 HD12 LEU 75 -14.449 -4.925 1.215 564 3HD1 LEU 75 HD13 LEU 75 -12.915 -5.819 1.282 565 1HD2 LEU 75 HD21 LEU 75 -12.807 -5.770 -1.193 566 2HD2 LEU 75 HD22 LEU 75 -14.252 -4.734 -1.387 567 3HD2 LEU 75 HD23 LEU 75 -12.697 -4.228 -2.039 568 H LEU 76 HN LEU 76 -14.872 -0.823 -2.340 569 HA LEU 76 HA LEU 76 -15.541 1.384 -0.524 570 1HB LEU 76 HB2 LEU 76 -16.040 1.702 -3.480 571 2HB LEU 76 HB3 LEU 76 -16.085 2.904 -2.185 572 HG LEU 76 HG LEU 76 -13.558 1.696 -3.366 573 1HD1 LEU 76 HD11 LEU 76 -14.782 3.087 -4.994 574 2HD1 LEU 76 HD12 LEU 76 -14.855 4.418 -3.820 575 3HD1 LEU 76 HD13 LEU 76 -13.293 3.882 -4.474 576 1HD2 LEU 76 HD21 LEU 76 -13.120 2.433 -1.126 577 2HD2 LEU 76 HD22 LEU 76 -12.450 3.641 -2.218 578 3HD2 LEU 76 HD23 LEU 76 -13.988 3.961 -1.377 579 H VAL 77 HN VAL 77 -17.399 0.623 0.337 580 HA VAL 77 HA VAL 77 -19.093 -1.271 -1.220 581 HB VAL 77 HB VAL 77 -19.543 -0.206 1.577 582 1HG1 VAL 77 HG11 VAL 77 -20.702 -2.579 0.074 583 2HG1 VAL 77 HG12 VAL 77 -21.022 -2.197 1.786 584 3HG1 VAL 77 HG13 VAL 77 -21.561 -1.093 0.518 585 1HG2 VAL 77 HG21 VAL 77 -18.702 -2.380 2.426 586 2HG2 VAL 77 HG22 VAL 77 -18.193 -2.814 0.783 587 3HG2 VAL 77 HG23 VAL 77 -17.424 -1.458 1.632 588 H LEU 78 HN LEU 78 -20.615 -0.384 -2.521 589 HA LEU 78 HA LEU 78 -21.634 2.347 -1.906 590 1HB LEU 78 HB2 LEU 78 -20.794 1.062 -4.526 591 2HB LEU 78 HB3 LEU 78 -22.140 2.189 -4.502 592 HG LEU 78 HG LEU 78 -20.682 3.910 -3.443 593 1HD1 LEU 78 HD11 LEU 78 -18.229 3.708 -3.704 594 2HD1 LEU 78 HD12 LEU 78 -18.871 2.584 -2.513 595 3HD1 LEU 78 HD13 LEU 78 -18.433 1.988 -4.129 596 1HD2 LEU 78 HD21 LEU 78 -21.217 3.926 -5.830 597 2HD2 LEU 78 HD22 LEU 78 -19.609 4.575 -5.506 598 3HD2 LEU 78 HD23 LEU 78 -19.783 2.928 -6.161 599 H LYS 79 HN LYS 79 -23.871 2.680 -2.337 600 HA LYS 79 HA LYS 79 -25.380 0.486 -3.425 601 1HB LYS 79 HB2 LYS 79 -27.084 0.417 -1.676 602 2HB LYS 79 HB3 LYS 79 -25.525 -0.204 -1.127 603 1HG LYS 79 HG2 LYS 79 -25.103 1.968 0.025 604 2HG LYS 79 HG3 LYS 79 -26.733 2.501 -0.407 605 1HD LYS 79 HD2 LYS 79 -26.106 -0.027 1.188 606 2HD LYS 79 HD3 LYS 79 -26.512 1.530 1.925 607 1HE LYS 79 HE2 LYS 79 -28.702 1.534 0.842 608 2HE LYS 79 HE3 LYS 79 -28.328 0.025 -0.003 609 1HZ LYS 79 HZ1 LYS 79 -29.656 -0.410 1.943 610 2HZ LYS 79 HZ2 LYS 79 -28.178 -1.079 2.163 611 3HZ LYS 79 HZ3 LYS 79 -28.586 0.316 2.932 612 H ASP 80 HN ASP 80 -27.228 1.175 -4.343 613 HA ASP 80 HA ASP 80 -28.284 2.528 -5.724 614 1HB ASP 80 HB2 ASP 80 -29.584 2.552 -3.611 615 2HB ASP 80 HB3 ASP 80 -28.816 4.076 -3.164 616 H GLY 81 HN GLY 81 -25.439 3.263 -5.549 617 1HA GLY 81 HA2 GLY 81 -24.303 4.662 -6.949 618 2HA GLY 81 HA3 GLY 81 -25.606 5.860 -6.903 619 H GLU 82 HN GLU 82 -24.699 4.948 -3.733 620 HA GLU 82 HA GLU 82 -22.562 6.967 -3.597 621 1HB GLU 82 HB2 GLU 82 -23.571 8.050 -1.800 622 2HB GLU 82 HB3 GLU 82 -24.881 7.750 -2.971 623 1HG GLU 82 HG2 GLU 82 -25.607 5.801 -1.617 624 2HG GLU 82 HG3 GLU 82 -24.340 6.167 -0.435 625 H VAL 83 HN VAL 83 -21.015 6.717 -1.950 626 HA VAL 83 HA VAL 83 -20.500 3.981 -1.078 627 HB VAL 83 HB VAL 83 -18.722 5.481 -1.857 628 1HG1 VAL 83 HG11 VAL 83 -19.494 7.658 -0.969 629 2HG1 VAL 83 HG12 VAL 83 -19.139 7.104 0.682 630 3HG1 VAL 83 HG13 VAL 83 -17.831 7.293 -0.498 631 1HG2 VAL 83 HG21 VAL 83 -18.176 3.606 -0.364 632 2HG2 VAL 83 HG22 VAL 83 -17.067 4.965 -0.150 633 3HG2 VAL 83 HG23 VAL 83 -18.335 4.667 1.051 634 H VAL 84 HN VAL 84 -20.723 3.113 0.814 635 HA VAL 84 HA VAL 84 -21.843 4.699 3.068 636 HB VAL 84 HB VAL 84 -23.276 2.739 3.581 637 1HG1 VAL 84 HG11 VAL 84 -25.038 3.320 2.039 638 2HG1 VAL 84 HG12 VAL 84 -24.119 4.779 2.412 639 3HG1 VAL 84 HG13 VAL 84 -23.876 3.956 0.856 640 1HG2 VAL 84 HG21 VAL 84 -22.632 1.762 0.761 641 2HG2 VAL 84 HG22 VAL 84 -22.076 0.991 2.267 642 3HG2 VAL 84 HG23 VAL 84 -23.801 1.068 1.894 643 H GLU 85 HN GLU 85 -19.534 2.285 1.968 644 HA GLU 85 HA GLU 85 -18.280 2.492 4.551 645 1HB GLU 85 HB2 GLU 85 -19.567 -0.034 3.657 646 2HB GLU 85 HB3 GLU 85 -17.858 -0.243 4.029 647 1HG GLU 85 HG2 GLU 85 -19.913 1.034 5.837 648 2HG GLU 85 HG3 GLU 85 -19.453 -0.678 5.863 649 H THR 86 HN THR 86 -16.007 1.676 4.453 650 HA THR 86 HA THR 86 -14.812 1.497 1.775 651 HB THR 86 HB THR 86 -14.110 3.796 3.654 652 HG1 THR 86 HG1 THR 86 -16.137 3.565 1.819 653 1HG2 THR 86 HG21 THR 86 -12.369 3.092 2.040 654 2HG2 THR 86 HG22 THR 86 -13.611 3.156 0.759 655 3HG2 THR 86 HG23 THR 86 -13.060 4.655 1.551 656 H SER 87 HN SER 87 -12.661 0.618 1.978 657 HA SER 87 HA SER 87 -11.339 0.532 4.580 658 1HB SER 87 HB2 SER 87 -12.265 -1.990 3.136 659 2HB SER 87 HB3 SER 87 -10.907 -1.983 4.270 660 HG SER 87 HG SER 87 -13.302 -0.774 5.067 661 H VAL 88 HN VAL 88 -9.078 0.268 4.310 662 HA VAL 88 HA VAL 88 -8.014 0.045 1.565 663 HB VAL 88 HB VAL 88 -6.423 1.833 2.306 664 1HG1 VAL 88 HG11 VAL 88 -7.843 3.619 1.527 665 2HG1 VAL 88 HG12 VAL 88 -8.182 2.117 0.653 666 3HG1 VAL 88 HG13 VAL 88 -9.302 2.660 1.914 667 1HG2 VAL 88 HG21 VAL 88 -8.553 2.593 4.328 668 2HG2 VAL 88 HG22 VAL 88 -6.996 1.846 4.742 669 3HG2 VAL 88 HG23 VAL 88 -7.029 3.443 3.978 670 H GLY 89 HN GLY 89 -8.006 -2.101 2.455 671 1HA GLY 89 HA2 GLY 89 -5.500 -3.043 3.175 672 2HA GLY 89 HA3 GLY 89 -6.382 -2.938 4.705 673 H PHE 90 HN PHE 90 -5.523 -5.377 3.917 674 HA PHE 90 HA PHE 90 -7.411 -6.916 2.413 675 1HB PHE 90 HB2 PHE 90 -5.068 -7.611 2.710 676 2HB PHE 90 HB3 PHE 90 -5.269 -7.657 4.450 677 HD1 PHE 90 HD1 PHE 90 -6.019 -9.622 5.560 678 HD2 PHE 90 HD2 PHE 90 -6.473 -9.295 1.278 679 HE1 PHE 90 HE1 PHE 90 -6.807 -11.971 5.460 680 HE2 PHE 90 HE2 PHE 90 -7.314 -11.627 1.202 681 HZ PHE 90 HZ PHE 90 -7.462 -12.975 3.279 682 H LYS 91 HN LYS 91 -8.937 -8.483 3.235 683 HA LYS 91 HA LYS 91 -9.425 -8.616 6.114 684 1HB LYS 91 HB2 LYS 91 -11.198 -7.058 4.403 685 2HB LYS 91 HB3 LYS 91 -12.006 -8.564 4.808 686 1HG LYS 91 HG2 LYS 91 -12.720 -7.274 6.527 687 2HG LYS 91 HG3 LYS 91 -11.329 -8.057 7.264 688 1HD LYS 91 HD2 LYS 91 -11.300 -5.850 7.992 689 2HD LYS 91 HD3 LYS 91 -10.002 -5.940 6.801 690 1HE LYS 91 HE2 LYS 91 -11.361 -4.810 5.132 691 2HE LYS 91 HE3 LYS 91 -12.821 -5.009 6.111 692 1HZ LYS 91 HZ1 LYS 91 -10.529 -3.282 6.840 693 2HZ LYS 91 HZ2 LYS 91 -11.990 -2.771 6.290 694 3HZ LYS 91 HZ3 LYS 91 -11.873 -3.495 7.747 695 HA PRO 92 HA PRO 92 -9.908 -12.825 4.478 696 1HB PRO 92 HB2 PRO 92 -10.886 -14.164 6.646 697 2HB PRO 92 HB3 PRO 92 -9.201 -13.557 6.589 698 1HG PRO 92 HG2 PRO 92 -11.624 -12.214 7.837 699 2HG PRO 92 HG3 PRO 92 -10.028 -12.529 8.597 700 1HD PRO 92 HD2 PRO 92 -10.568 -10.116 7.481 701 2HD PRO 92 HD3 PRO 92 -8.958 -10.856 7.295 702 H LYS 93 HN LYS 93 -11.733 -14.459 4.221 703 HA LYS 93 HA LYS 93 -13.738 -13.244 2.798 704 1HB LYS 93 HB2 LYS 93 -12.865 -15.863 3.236 705 2HB LYS 93 HB3 LYS 93 -14.499 -15.928 3.861 706 1HG LYS 93 HG2 LYS 93 -13.626 -15.043 1.084 707 2HG LYS 93 HG3 LYS 93 -14.327 -16.594 1.485 708 1HD LYS 93 HD2 LYS 93 -15.767 -13.912 1.741 709 2HD LYS 93 HD3 LYS 93 -15.887 -14.994 0.373 710 1HE LYS 93 HE2 LYS 93 -16.712 -15.763 3.207 711 2HE LYS 93 HE3 LYS 93 -17.805 -15.116 1.987 712 1HZ LYS 93 HZ1 LYS 93 -17.989 -17.444 1.958 713 2HZ LYS 93 HZ2 LYS 93 -17.253 -17.043 0.569 714 3HZ LYS 93 HZ3 LYS 93 -16.372 -17.698 1.808 715 H GLU 94 HN GLU 94 -14.061 -14.476 6.146 716 HA GLU 94 HA GLU 94 -16.844 -13.958 6.277 717 1HB GLU 94 HB2 GLU 94 -14.715 -14.149 8.462 718 2HB GLU 94 HB3 GLU 94 -16.465 -14.082 8.772 719 1HG GLU 94 HG2 GLU 94 -16.778 -16.166 7.440 720 2HG GLU 94 HG3 GLU 94 -15.037 -16.263 7.177 721 H ALA 95 HN ALA 95 -14.003 -11.963 7.233 722 HA ALA 95 HA ALA 95 -15.585 -9.861 8.382 723 1HB ALA 95 HB1 ALA 95 -13.490 -8.608 8.336 724 2HB ALA 95 HB2 ALA 95 -13.194 -10.251 8.928 725 3HB ALA 95 HB3 ALA 95 -12.773 -9.828 7.248 726 H LEU 96 HN LEU 96 -14.377 -10.617 5.141 727 HA LEU 96 HA LEU 96 -15.053 -8.191 3.871 728 1HB LEU 96 HB2 LEU 96 -13.944 -10.627 3.065 729 2HB LEU 96 HB3 LEU 96 -15.508 -10.696 2.308 730 HG LEU 96 HG LEU 96 -14.081 -9.794 0.712 731 1HD1 LEU 96 HD11 LEU 96 -14.778 -7.499 0.264 732 2HD1 LEU 96 HD12 LEU 96 -16.164 -8.450 0.831 733 3HD1 LEU 96 HD13 LEU 96 -15.365 -7.294 1.911 734 1HD2 LEU 96 HD21 LEU 96 -12.205 -9.300 2.246 735 2HD2 LEU 96 HD22 LEU 96 -12.465 -8.038 1.042 736 3HD2 LEU 96 HD23 LEU 96 -13.006 -7.788 2.722 737 H GLN 97 HN GLN 97 -16.919 -11.242 4.212 738 HA GLN 97 HA GLN 97 -19.230 -10.230 2.899 739 1HB GLN 97 HB2 GLN 97 -20.110 -12.228 3.147 740 2HB GLN 97 HB3 GLN 97 -18.440 -12.692 3.433 741 1HG GLN 97 HG2 GLN 97 -18.884 -12.730 5.817 742 2HG GLN 97 HG3 GLN 97 -20.586 -12.289 5.517 743 1HE2 GLN 97 HE22 GLN 97 -21.570 -13.845 3.567 744 2HE2 GLN 97 HE21 GLN 97 -21.273 -15.551 3.862 745 H GLU 98 HN GLU 98 -18.256 -10.293 6.358 746 HA GLU 98 HA GLU 98 -20.682 -9.266 7.365 747 1HB GLU 98 HB2 GLU 98 -18.969 -10.249 8.773 748 2HB GLU 98 HB3 GLU 98 -17.841 -8.938 8.391 749 1HG GLU 98 HG2 GLU 98 -19.301 -7.309 9.502 750 2HG GLU 98 HG3 GLU 98 -20.529 -8.551 9.773 751 H LEU 99 HN LEU 99 -17.769 -7.533 6.210 752 HA LEU 99 HA LEU 99 -18.503 -4.945 6.925 753 1HB LEU 99 HB2 LEU 99 -16.261 -5.493 6.223 754 2HB LEU 99 HB3 LEU 99 -16.823 -6.021 4.640 755 HG LEU 99 HG LEU 99 -17.439 -3.712 4.038 756 1HD1 LEU 99 HD11 LEU 99 -16.568 -1.831 5.465 757 2HD1 LEU 99 HD12 LEU 99 -17.924 -2.694 6.193 758 3HD1 LEU 99 HD13 LEU 99 -16.266 -3.002 6.767 759 1HD2 LEU 99 HD21 LEU 99 -15.213 -4.651 3.527 760 2HD2 LEU 99 HD22 LEU 99 -15.150 -2.897 3.769 761 3HD2 LEU 99 HD23 LEU 99 -14.583 -3.991 5.049 762 H VAL 100 HN VAL 100 -19.251 -6.728 3.935 763 HA VAL 100 HA VAL 100 -20.742 -4.429 2.888 764 HB VAL 100 HB VAL 100 -19.463 -5.753 1.399 765 1HG1 VAL 100 HG11 VAL 100 -19.688 -8.019 2.410 766 2HG1 VAL 100 HG12 VAL 100 -21.369 -8.094 1.864 767 3HG1 VAL 100 HG13 VAL 100 -20.038 -8.010 0.688 768 1HG2 VAL 100 HG21 VAL 100 -21.569 -4.597 0.637 769 2HG2 VAL 100 HG22 VAL 100 -21.039 -5.940 -0.384 770 3HG2 VAL 100 HG23 VAL 100 -22.397 -6.159 0.734 771 H ASN 101 HN ASN 101 -21.518 -7.525 4.526 772 HA ASN 101 HA ASN 101 -24.298 -7.558 4.076 773 1HB ASN 101 HB2 ASN 101 -23.251 -9.495 4.874 774 2HB ASN 101 HB3 ASN 101 -22.643 -8.674 6.325 775 1HD2 ASN 101 HD22 ASN 101 -24.069 -8.297 8.087 776 2HD2 ASN 101 HD21 ASN 101 -25.670 -8.988 8.149 777 H LYS 102 HN LYS 102 -22.405 -5.601 6.320 778 HA LYS 102 HA LYS 102 -24.451 -4.700 8.064 779 1HB LYS 102 HB2 LYS 102 -21.975 -3.355 6.949 780 2HB LYS 102 HB3 LYS 102 -22.986 -2.600 8.196 781 1HG LYS 102 HG2 LYS 102 -22.555 -4.343 9.773 782 2HG LYS 102 HG3 LYS 102 -21.829 -5.366 8.567 783 1HD LYS 102 HD2 LYS 102 -20.543 -3.494 10.320 784 2HD LYS 102 HD3 LYS 102 -19.890 -4.772 9.308 785 1HE LYS 102 HE2 LYS 102 -18.726 -2.908 8.649 786 2HE LYS 102 HE3 LYS 102 -19.908 -3.165 7.360 787 1HZ LYS 102 HZ1 LYS 102 -19.483 -0.819 8.288 788 2HZ LYS 102 HZ2 LYS 102 -21.036 -1.237 7.988 789 3HZ LYS 102 HZ3 LYS 102 -20.446 -1.242 9.536 790 H HIS 103 HN HIS 103 -24.023 -3.989 4.650 791 HA HIS 103 HA HIS 103 -26.146 -1.883 4.817 792 1HB HIS 103 HB2 HIS 103 -23.717 -1.895 2.985 793 2HB HIS 103 HB3 HIS 103 -24.932 -0.621 3.147 794 HD1 HIS 103 HD1 HIS 103 -24.904 0.706 5.616 795 HD2 HIS 103 HD2 HIS 103 -21.779 -2.002 4.807 796 HE1 HIS 103 HE1 HIS 103 -23.189 1.029 7.460 797 H LEU 104 HN LEU 104 -25.050 -4.763 3.293 798 HA LEU 104 HA LEU 104 -26.675 -4.785 0.892 799 1HB LEU 104 HB2 LEU 104 -24.647 -5.907 0.962 800 2HB LEU 104 HB3 LEU 104 -25.020 -6.696 2.475 801 HG LEU 104 HG LEU 104 -24.948 -8.105 0.550 802 1HD1 LEU 104 HD11 LEU 104 -27.710 -8.262 1.769 803 2HD1 LEU 104 HD12 LEU 104 -26.745 -9.567 1.076 804 3HD1 LEU 104 HD13 LEU 104 -26.207 -8.789 2.568 805 1HD2 LEU 104 HD21 LEU 104 -25.906 -6.625 -1.129 806 2HD2 LEU 104 HD22 LEU 104 -26.777 -8.154 -1.087 807 3HD2 LEU 104 HD23 LEU 104 -27.505 -6.722 -0.347 808 1H MET 1 H1 MET 1 8.654 27.410 -11.933 809 2H MET 1 H2 MET 1 7.405 27.331 -12.994 810 3H MET 1 H3 MET 1 7.598 26.166 -11.848 811 HA MET 1 HA MET 1 6.989 28.978 -11.333 812 1HB MET 1 HB2 MET 1 4.791 28.371 -10.668 813 2HB MET 1 HB3 MET 1 5.046 27.744 -12.286 814 1HG MET 1 HG2 MET 1 5.118 26.125 -9.704 815 2HG MET 1 HG3 MET 1 3.774 26.226 -10.826 816 1HE MET 1 HE1 MET 1 4.856 22.514 -11.218 817 2HE MET 1 HE2 MET 1 4.831 23.503 -9.742 818 3HE MET 1 HE3 MET 1 3.508 23.636 -10.923 819 H GLU 2 HN GLU 2 6.713 29.544 -9.058 820 HA GLU 2 HA GLU 2 8.606 28.212 -7.330 821 1HB GLU 2 HB2 GLU 2 6.502 30.352 -6.792 822 2HB GLU 2 HB3 GLU 2 7.682 29.780 -5.604 823 1HG GLU 2 HG2 GLU 2 9.539 30.478 -7.090 824 2HG GLU 2 HG3 GLU 2 8.379 31.083 -8.274 825 H ASN 3 HN ASN 3 8.275 26.514 -6.087 826 HA ASN 3 HA ASN 3 7.519 24.835 -4.996 827 1HB ASN 3 HB2 ASN 3 4.719 25.868 -4.781 828 2HB ASN 3 HB3 ASN 3 5.510 24.584 -3.864 829 1HD2 ASN 3 HD21 ASN 3 7.638 25.458 -2.562 830 2HD2 ASN 3 HD22 ASN 3 7.442 27.038 -1.857 831 H LYS 4 HN LYS 4 7.339 23.095 -5.750 832 HA LYS 4 HA LYS 4 5.399 22.108 -7.666 833 1HB LYS 4 HB2 LYS 4 7.512 20.734 -8.628 834 2HB LYS 4 HB3 LYS 4 6.959 22.238 -9.362 835 1HG LYS 4 HG2 LYS 4 8.638 23.526 -8.210 836 2HG LYS 4 HG3 LYS 4 9.212 22.088 -7.327 837 1HD LYS 4 HD2 LYS 4 10.056 21.124 -9.380 838 2HD LYS 4 HD3 LYS 4 9.315 22.435 -10.346 839 1HE LYS 4 HE2 LYS 4 10.673 24.116 -9.187 840 2HE LYS 4 HE3 LYS 4 11.357 22.889 -8.125 841 1HZ LYS 4 HZ1 LYS 4 11.799 22.974 -11.052 842 2HZ LYS 4 HZ2 LYS 4 12.848 23.532 -9.918 843 3HZ LYS 4 HZ3 LYS 4 12.498 21.930 -9.986 844 H ILE 5 HN ILE 5 4.770 20.088 -6.845 845 HA ILE 5 HA ILE 5 5.815 19.729 -4.116 846 HB ILE 5 HB ILE 5 3.189 18.930 -5.399 847 1HG1 ILE 5 HG12 ILE 5 4.120 21.226 -3.667 848 2HG1 ILE 5 HG13 ILE 5 3.197 21.267 -5.160 849 1HG2 ILE 5 HG21 ILE 5 4.122 18.682 -2.518 850 2HG2 ILE 5 HG22 ILE 5 2.492 18.262 -3.129 851 3HG2 ILE 5 HG23 ILE 5 3.864 17.310 -3.645 852 1HD1 ILE 5 HD11 ILE 5 1.794 21.907 -3.323 853 2HD1 ILE 5 HD12 ILE 5 1.241 20.313 -3.906 854 3HD1 ILE 5 HD13 ILE 5 2.210 20.444 -2.413 855 H ILE 6 HN ILE 6 6.434 17.820 -3.278 856 HA ILE 6 HA ILE 6 6.773 15.430 -4.957 857 HB ILE 6 HB ILE 6 8.607 16.720 -5.657 858 1HG1 ILE 6 HG12 ILE 6 8.976 14.258 -4.904 859 2HG1 ILE 6 HG13 ILE 6 10.271 15.254 -5.510 860 1HG2 ILE 6 HG21 ILE 6 9.213 17.402 -2.774 861 2HG2 ILE 6 HG22 ILE 6 10.341 17.685 -4.108 862 3HG2 ILE 6 HG23 ILE 6 8.794 18.495 -4.113 863 1HD1 ILE 6 HD11 ILE 6 9.777 14.670 -2.559 864 2HD1 ILE 6 HD12 ILE 6 11.041 13.978 -3.597 865 3HD1 ILE 6 HD13 ILE 6 11.092 15.687 -3.210 866 H TYR 7 HN TYR 7 7.121 13.546 -3.636 867 HA TYR 7 HA TYR 7 6.610 13.992 -0.727 868 1HB TYR 7 HB2 TYR 7 4.785 13.114 -2.798 869 2HB TYR 7 HB3 TYR 7 5.112 11.754 -1.763 870 HD1 TYR 7 HD1 TYR 7 4.717 11.941 0.755 871 HD2 TYR 7 HD2 TYR 7 3.392 14.910 -2.077 872 HE1 TYR 7 HE1 TYR 7 3.019 12.731 2.373 873 HE2 TYR 7 HE2 TYR 7 1.692 15.665 -0.481 874 HH TYR 7 HH TYR 7 1.249 14.193 2.767 875 H PHE 8 HN PHE 8 7.426 12.493 0.655 876 HA PHE 8 HA PHE 8 8.907 10.160 -0.439 877 1HB PHE 8 HB2 PHE 8 8.770 11.320 2.364 878 2HB PHE 8 HB3 PHE 8 9.752 9.939 1.872 879 HD1 PHE 8 HD1 PHE 8 9.896 13.373 2.536 880 HD2 PHE 8 HD2 PHE 8 11.297 10.453 -0.298 881 HE1 PHE 8 HE1 PHE 8 11.644 14.929 1.775 882 HE2 PHE 8 HE2 PHE 8 13.019 12.033 -1.087 883 HZ PHE 8 HZ PHE 8 13.196 14.294 -0.040 884 H LEU 9 HN LEU 9 8.241 8.046 0.097 885 HA LEU 9 HA LEU 9 5.870 7.727 1.834 886 1HB LEU 9 HB2 LEU 9 5.160 8.169 -0.538 887 2HB LEU 9 HB3 LEU 9 6.027 6.724 -1.045 888 HG LEU 9 HG LEU 9 4.477 5.294 0.164 889 1HD1 LEU 9 HD11 LEU 9 2.465 6.258 1.333 890 2HD1 LEU 9 HD12 LEU 9 3.981 6.558 2.175 891 3HD1 LEU 9 HD13 LEU 9 3.224 7.863 1.232 892 1HD2 LEU 9 HD21 LEU 9 3.090 7.530 -1.398 893 2HD2 LEU 9 HD22 LEU 9 3.753 6.012 -2.052 894 3HD2 LEU 9 HD23 LEU 9 2.330 5.995 -0.990 895 H SER 10 HN SER 10 6.057 5.914 3.073 896 HA SER 10 HA SER 10 7.334 3.473 2.312 897 1HB SER 10 HB2 SER 10 8.852 5.435 4.095 898 2HB SER 10 HB3 SER 10 9.095 3.680 4.214 899 HG SER 10 HG SER 10 9.211 5.047 1.767 900 H THR 11 HN THR 11 7.409 2.001 4.329 901 HA THR 11 HA THR 11 5.109 1.829 5.807 902 HB THR 11 HB THR 11 7.930 1.041 6.630 903 HG1 THR 11 HG1 THR 11 7.660 -0.702 5.340 904 1HG2 THR 11 HG21 THR 11 6.791 -0.880 7.718 905 2HG2 THR 11 HG22 THR 11 6.284 0.656 8.420 906 3HG2 THR 11 HG23 THR 11 5.209 -0.181 7.281 907 H GLY 12 HN GLY 12 4.262 3.011 7.401 908 1HA GLY 12 HA2 GLY 12 3.939 4.407 9.162 909 2HA GLY 12 HA3 GLY 12 5.414 3.659 9.769 910 H ASN 13 HN ASN 13 6.243 5.485 7.040 911 HA ASN 13 HA ASN 13 7.689 7.196 6.825 912 1HB ASN 13 HB2 ASN 13 5.388 8.310 7.243 913 2HB ASN 13 HB3 ASN 13 6.070 8.827 8.802 914 1HD2 ASN 13 HD22 ASN 13 7.294 10.831 8.653 915 2HD2 ASN 13 HD21 ASN 13 7.828 11.481 7.140 916 H SER 14 HN SER 14 8.014 5.301 9.221 917 HA SER 14 HA SER 14 9.159 6.817 11.348 918 1HB SER 14 HB2 SER 14 9.365 4.437 12.293 919 2HB SER 14 HB3 SER 14 7.755 5.064 11.924 920 HG SER 14 HG SER 14 8.023 2.950 11.128 921 H ALA 15 HN ALA 15 10.769 7.598 9.566 922 HA ALA 15 HA ALA 15 13.032 8.004 10.385 923 1HB ALA 15 HB1 ALA 15 14.842 6.361 9.936 924 2HB ALA 15 HB2 ALA 15 13.679 5.753 11.115 925 3HB ALA 15 HB3 ALA 15 13.657 5.167 9.446 926 H ARG 16 HN ARG 16 12.462 5.933 7.569 927 HA ARG 16 HA ARG 16 14.488 6.905 5.950 928 1HB ARG 16 HB2 ARG 16 11.744 5.816 5.177 929 2HB ARG 16 HB3 ARG 16 13.101 5.971 4.065 930 1HG ARG 16 HG2 ARG 16 14.274 4.229 4.945 931 2HG ARG 16 HG3 ARG 16 13.750 4.501 6.592 932 1HD ARG 16 HD2 ARG 16 12.092 3.237 4.400 933 2HD ARG 16 HD3 ARG 16 12.921 2.363 5.678 934 HE ARG 16 HE ARG 16 10.340 3.475 5.758 935 1HH1 ARG 16 HH21 ARG 16 12.947 2.785 8.125 936 2HH1 ARG 16 HH22 ARG 16 12.048 3.493 9.428 937 1HH2 ARG 16 HH11 ARG 16 9.057 3.656 7.637 938 2HH2 ARG 16 HH12 ARG 16 9.762 3.595 9.191 939 H SER 17 HN SER 17 11.059 8.034 5.763 940 HA SER 17 HA SER 17 11.668 10.171 3.998 941 1HB SER 17 HB2 SER 17 9.432 10.083 6.002 942 2HB SER 17 HB3 SER 17 9.435 10.858 4.413 943 HG SER 17 HG SER 17 8.313 8.816 4.617 944 H GLN 18 HN GLN 18 11.730 9.973 7.570 945 HA GLN 18 HA GLN 18 11.662 12.742 8.149 946 1HB GLN 18 HB2 GLN 18 13.311 10.667 9.635 947 2HB GLN 18 HB3 GLN 18 12.788 12.203 10.242 948 1HG GLN 18 HG2 GLN 18 10.958 9.875 9.570 949 2HG GLN 18 HG3 GLN 18 11.511 10.319 11.177 950 1HE2 GLN 18 HE22 GLN 18 8.804 10.112 10.752 951 2HE2 GLN 18 HE21 GLN 18 8.053 11.697 10.633 952 H MET 19 HN MET 19 14.422 10.507 7.550 953 HA MET 19 HA MET 19 16.317 12.625 7.848 954 1HB MET 19 HB2 MET 19 17.977 11.091 6.962 955 2HB MET 19 HB3 MET 19 17.041 10.387 8.274 956 1HG MET 19 HG2 MET 19 15.877 8.939 6.756 957 2HG MET 19 HG3 MET 19 16.414 9.854 5.356 958 1HE MET 19 HE1 MET 19 17.519 7.874 8.379 959 2HE MET 19 HE2 MET 19 16.937 6.726 7.119 960 3HE MET 19 HE3 MET 19 18.649 6.684 7.656 961 H ALA 20 HN ALA 20 14.691 11.117 5.015 962 HA ALA 20 HA ALA 20 16.151 12.448 3.015 963 1HB ALA 20 HB1 ALA 20 13.291 11.462 2.915 964 2HB ALA 20 HB2 ALA 20 14.359 11.801 1.537 965 3HB ALA 20 HB3 ALA 20 14.753 10.470 2.631 966 H GLU 21 HN GLU 21 13.077 13.470 4.622 967 HA GLU 21 HA GLU 21 12.936 15.854 3.089 968 1HB GLU 21 HB2 GLU 21 11.060 16.425 4.354 969 2HB GLU 21 HB3 GLU 21 11.041 14.662 4.263 970 1HG GLU 21 HG2 GLU 21 11.991 14.559 6.562 971 2HG GLU 21 HG3 GLU 21 11.930 16.323 6.628 972 H GLY 22 HN GLY 22 14.644 15.144 6.119 973 1HA GLY 22 HA2 GLY 22 15.414 17.851 6.706 974 2HA GLY 22 HA3 GLY 22 16.263 16.368 7.186 975 H TRP 23 HN TRP 23 17.024 15.196 4.867 976 HA TRP 23 HA TRP 23 19.238 16.627 3.849 977 1HB TRP 23 HB2 TRP 23 17.688 14.155 3.082 978 2HB TRP 23 HB3 TRP 23 18.714 14.868 1.850 979 HD1 TRP 23 HD1 TRP 23 18.876 12.693 4.839 980 HE1 TRP 23 HE1 TRP 23 21.273 12.109 5.414 981 HE3 TRP 23 HE3 TRP 23 21.264 15.856 1.613 982 HZ2 TRP 23 HZ2 TRP 23 23.939 12.974 4.664 983 HZ3 TRP 23 HZ3 TRP 23 23.747 15.927 1.533 984 HH2 TRP 23 HH2 TRP 23 25.094 14.504 3.063 985 H ALA 24 HN ALA 24 15.894 16.400 2.683 986 HA ALA 24 HA ALA 24 16.429 17.395 0.135 987 1HB ALA 24 HB1 ALA 24 13.807 17.561 1.725 988 2HB ALA 24 HB2 ALA 24 13.972 17.689 -0.024 989 3HB ALA 24 HB3 ALA 24 14.341 16.158 0.779 990 H LYS 25 HN LYS 25 15.022 19.150 3.023 991 HA LYS 25 HA LYS 25 14.607 21.458 1.436 992 1HB LYS 25 HB2 LYS 25 14.514 21.029 4.433 993 2HB LYS 25 HB3 LYS 25 14.273 22.625 3.703 994 1HG LYS 25 HG2 LYS 25 12.480 21.666 2.228 995 2HG LYS 25 HG3 LYS 25 12.626 20.132 3.114 996 1HD LYS 25 HD2 LYS 25 12.033 21.280 5.212 997 2HD LYS 25 HD3 LYS 25 11.943 22.830 4.357 998 1HE LYS 25 HE2 LYS 25 10.044 21.989 2.974 999 2HE LYS 25 HE3 LYS 25 10.175 20.406 3.743 1000 1HZ LYS 25 HZ1 LYS 25 9.588 21.448 5.856 1001 2HZ LYS 25 HZ2 LYS 25 9.468 22.916 5.149 1002 3HZ LYS 25 HZ3 LYS 25 8.429 21.726 4.746 1003 H GLN 26 HN GLN 26 17.526 20.501 3.179 1004 HA GLN 26 HA GLN 26 18.650 23.108 3.065 1005 1HB GLN 26 HB2 GLN 26 20.814 22.105 3.394 1006 2HB GLN 26 HB3 GLN 26 19.647 21.440 4.530 1007 1HG GLN 26 HG2 GLN 26 19.656 19.340 3.566 1008 2HG GLN 26 HG3 GLN 26 20.011 19.937 1.959 1009 1HE2 GLN 26 HE22 GLN 26 21.389 17.918 2.182 1010 2HE2 GLN 26 HE21 GLN 26 23.038 18.154 2.715 1011 H TYR 27 HN TYR 27 17.971 20.950 0.445 1012 HA TYR 27 HA TYR 27 19.621 22.639 -1.376 1013 1HB TYR 27 HB2 TYR 27 19.287 19.649 -1.227 1014 2HB TYR 27 HB3 TYR 27 19.351 20.366 -2.815 1015 HD1 TYR 27 HD1 TYR 27 21.303 21.533 -3.684 1016 HD2 TYR 27 HD2 TYR 27 21.339 19.615 0.173 1017 HE1 TYR 27 HE1 TYR 27 23.776 21.680 -3.641 1018 HE2 TYR 27 HE2 TYR 27 23.805 19.799 0.258 1019 HH TYR 27 HH TYR 27 25.721 21.230 -2.427 1020 H LEU 28 HN LEU 28 16.456 21.696 -0.536 1021 HA LEU 28 HA LEU 28 15.367 22.338 -3.214 1022 1HB LEU 28 HB2 LEU 28 14.099 20.712 -0.964 1023 2HB LEU 28 HB3 LEU 28 13.338 21.174 -2.471 1024 HG LEU 28 HG LEU 28 15.517 19.133 -2.027 1025 1HD1 LEU 28 HD11 LEU 28 13.005 18.657 -1.723 1026 2HD1 LEU 28 HD12 LEU 28 12.832 18.934 -3.452 1027 3HD1 LEU 28 HD13 LEU 28 13.862 17.606 -2.857 1028 1HD2 LEU 28 HD21 LEU 28 16.144 20.382 -4.075 1029 2HD2 LEU 28 HD22 LEU 28 15.633 18.730 -4.424 1030 3HD2 LEU 28 HD23 LEU 28 14.528 20.089 -4.745 1031 H GLY 29 HN GLY 29 15.627 24.543 -2.665 1032 1HA GLY 29 HA2 GLY 29 14.523 25.884 -0.375 1033 2HA GLY 29 HA3 GLY 29 14.973 26.622 -1.916 1034 H ASP 30 HN ASP 30 12.962 27.925 -1.306 1035 HA ASP 30 HA ASP 30 10.377 26.768 -1.347 1036 1HB ASP 30 HB2 ASP 30 10.963 28.974 -0.360 1037 2HB ASP 30 HB3 ASP 30 11.146 29.631 -1.990 1038 H GLU 31 HN GLU 31 12.496 26.980 -3.915 1039 HA GLU 31 HA GLU 31 10.657 27.363 -6.119 1040 1HB GLU 31 HB2 GLU 31 12.995 27.545 -6.561 1041 2HB GLU 31 HB3 GLU 31 13.374 26.029 -5.729 1042 1HG GLU 31 HG2 GLU 31 12.321 24.724 -7.445 1043 2HG GLU 31 HG3 GLU 31 11.755 26.173 -8.296 1044 H TRP 32 HN TRP 32 11.156 24.812 -3.774 1045 HA TRP 32 HA TRP 32 9.443 22.906 -5.303 1046 1HB TRP 32 HB2 TRP 32 11.543 22.162 -3.283 1047 2HB TRP 32 HB3 TRP 32 10.770 21.125 -4.467 1048 HD1 TRP 32 HD1 TRP 32 13.426 23.882 -4.195 1049 HE1 TRP 32 HE1 TRP 32 15.179 23.605 -6.038 1050 HE3 TRP 32 HE3 TRP 32 11.239 20.065 -6.829 1051 HZ2 TRP 32 HZ2 TRP 32 15.594 21.960 -8.330 1052 HZ3 TRP 32 HZ3 TRP 32 12.369 19.143 -8.835 1053 HH2 TRP 32 HH2 TRP 32 14.556 20.077 -9.590 1054 H LYS 33 HN LYS 33 8.551 21.199 -3.574 1055 HA LYS 33 HA LYS 33 8.384 22.261 -0.882 1056 1HB LYS 33 HB2 LYS 33 6.406 23.248 -2.362 1057 2HB LYS 33 HB3 LYS 33 5.762 21.609 -2.284 1058 1HG LYS 33 HG2 LYS 33 4.703 22.853 -0.632 1059 2HG LYS 33 HG3 LYS 33 5.867 21.801 0.249 1060 1HD LYS 33 HD2 LYS 33 7.383 23.752 0.506 1061 2HD LYS 33 HD3 LYS 33 6.216 24.763 -0.380 1062 1HE LYS 33 HE2 LYS 33 4.475 24.213 1.317 1063 2HE LYS 33 HE3 LYS 33 5.659 23.263 2.217 1064 1HZ LYS 33 HZ1 LYS 33 5.835 26.184 1.713 1065 2HZ LYS 33 HZ2 LYS 33 5.430 25.490 3.128 1066 3HZ LYS 33 HZ3 LYS 33 6.942 25.313 2.546 1067 H VAL 34 HN VAL 34 8.553 20.477 0.450 1068 HA VAL 34 HA VAL 34 8.044 17.842 -0.783 1069 HB VAL 34 HB VAL 34 10.347 18.606 -0.743 1070 1HG1 VAL 34 HG11 VAL 34 11.664 18.739 1.301 1071 2HG1 VAL 34 HG12 VAL 34 10.411 19.985 1.265 1072 3HG1 VAL 34 HG13 VAL 34 10.206 18.535 2.288 1073 1HG2 VAL 34 HG21 VAL 34 9.896 16.256 1.132 1074 2HG2 VAL 34 HG22 VAL 34 9.777 16.186 -0.637 1075 3HG2 VAL 34 HG23 VAL 34 11.330 16.567 0.123 1076 H TYR 35 HN TYR 35 7.237 16.202 0.439 1077 HA TYR 35 HA TYR 35 6.253 16.712 3.188 1078 1HB TYR 35 HB2 TYR 35 4.602 15.897 0.787 1079 2HB TYR 35 HB3 TYR 35 4.034 15.854 2.450 1080 HD1 TYR 35 HD1 TYR 35 3.526 17.933 3.693 1081 HD2 TYR 35 HD2 TYR 35 4.734 17.985 -0.443 1082 HE1 TYR 35 HE1 TYR 35 2.635 20.234 3.472 1083 HE2 TYR 35 HE2 TYR 35 3.835 20.284 -0.685 1084 HH TYR 35 HH TYR 35 2.701 22.043 0.369 1085 H SER 36 HN SER 36 5.194 14.534 3.958 1086 HA SER 36 HA SER 36 6.594 12.141 2.916 1087 1HB SER 36 HB2 SER 36 6.761 13.156 5.787 1088 2HB SER 36 HB3 SER 36 7.562 11.738 5.101 1089 HG SER 36 HG SER 36 8.785 13.762 5.411 1090 H ALA 37 HN ALA 37 5.479 10.179 3.524 1091 HA ALA 37 HA ALA 37 3.181 10.303 5.337 1092 1HB ALA 37 HB1 ALA 37 2.008 11.074 3.429 1093 2HB ALA 37 HB2 ALA 37 2.927 10.022 2.315 1094 3HB ALA 37 HB3 ALA 37 1.733 9.333 3.419 1095 H GLY 38 HN GLY 38 2.063 8.136 5.394 1096 1HA GLY 38 HA2 GLY 38 3.103 5.802 4.194 1097 2HA GLY 38 HA3 GLY 38 3.737 5.924 5.840 1098 H ILE 39 HN ILE 39 2.245 3.834 5.494 1099 HA ILE 39 HA ILE 39 -0.460 3.743 5.433 1100 HB ILE 39 HB ILE 39 0.679 1.782 5.314 1101 1HG1 ILE 39 HG12 ILE 39 -0.335 1.399 8.135 1102 2HG1 ILE 39 HG13 ILE 39 -1.461 1.839 6.855 1103 1HG2 ILE 39 HG21 ILE 39 2.792 2.157 6.293 1104 2HG2 ILE 39 HG22 ILE 39 2.107 2.394 7.921 1105 3HG2 ILE 39 HG23 ILE 39 2.104 0.803 7.181 1106 1HD1 ILE 39 HD11 ILE 39 0.317 -0.622 6.809 1107 2HD1 ILE 39 HD12 ILE 39 -1.425 -0.573 7.126 1108 3HD1 ILE 39 HD13 ILE 39 -0.812 -0.113 5.528 1109 H GLU 40 HN GLU 40 1.338 4.049 8.518 1110 HA GLU 40 HA GLU 40 -1.061 5.178 9.868 1111 1HB GLU 40 HB2 GLU 40 -0.566 3.741 11.813 1112 2HB GLU 40 HB3 GLU 40 -1.071 2.835 10.395 1113 1HG GLU 40 HG2 GLU 40 1.180 2.039 9.971 1114 2HG GLU 40 HG3 GLU 40 1.863 3.130 11.169 1115 H ALA 41 HN ALA 41 1.090 6.453 8.651 1116 HA ALA 41 HA ALA 41 3.403 6.811 10.185 1117 1HB ALA 41 HB1 ALA 41 2.072 8.238 7.868 1118 2HB ALA 41 HB2 ALA 41 3.634 8.763 8.495 1119 3HB ALA 41 HB3 ALA 41 3.442 7.111 7.832 1120 H HIS 42 HN HIS 42 3.890 7.968 11.795 1121 HA HIS 42 HA HIS 42 3.414 10.788 11.955 1122 1HB HIS 42 HB2 HIS 42 2.248 8.962 14.137 1123 2HB HIS 42 HB3 HIS 42 2.574 10.662 14.401 1124 HD1 HIS 42 HD1 HIS 42 1.141 12.290 12.355 1125 HD2 HIS 42 HD2 HIS 42 -0.264 8.555 13.718 1126 HE1 HIS 42 HE1 HIS 42 -1.371 12.278 11.960 1127 H GLY 43 HN GLY 43 5.419 8.129 12.305 1128 1HA GLY 43 HA2 GLY 43 6.548 8.677 14.930 1129 2HA GLY 43 HA3 GLY 43 6.984 7.399 13.814 1130 H LEU 44 HN LEU 44 7.927 10.379 15.133 1131 HA LEU 44 HA LEU 44 10.043 10.887 13.134 1132 1HB LEU 44 HB2 LEU 44 9.065 12.833 14.240 1133 2HB LEU 44 HB3 LEU 44 9.439 12.162 15.831 1134 HG LEU 44 HG LEU 44 11.872 12.332 15.361 1135 1HD1 LEU 44 HD11 LEU 44 10.982 13.468 12.683 1136 2HD1 LEU 44 HD12 LEU 44 12.615 13.653 13.343 1137 3HD1 LEU 44 HD13 LEU 44 12.012 12.040 12.963 1138 1HD2 LEU 44 HD21 LEU 44 12.061 14.726 15.454 1139 2HD2 LEU 44 HD22 LEU 44 10.439 14.938 14.776 1140 3HD2 LEU 44 HD23 LEU 44 10.649 14.224 16.392 1141 H ASN 45 HN ASN 45 10.917 8.768 13.189 1142 HA ASN 45 HA ASN 45 11.643 7.347 15.507 1143 1HB ASN 45 HB2 ASN 45 11.402 6.448 13.204 1144 2HB ASN 45 HB3 ASN 45 12.939 7.210 12.760 1145 1HD2 ASN 45 HD22 ASN 45 12.348 4.389 12.568 1146 2HD2 ASN 45 HD21 ASN 45 13.437 3.575 13.666 1147 HA PRO 46 HA PRO 46 15.019 10.023 16.750 1148 1HB PRO 46 HB2 PRO 46 16.216 8.462 18.705 1149 2HB PRO 46 HB3 PRO 46 14.748 9.458 18.927 1150 1HG PRO 46 HG2 PRO 46 14.920 6.500 18.298 1151 2HG PRO 46 HG3 PRO 46 13.897 7.318 19.525 1152 1HD PRO 46 HD2 PRO 46 12.885 6.602 17.134 1153 2HD PRO 46 HD3 PRO 46 12.437 8.174 17.858 1154 H ASN 47 HN ASN 47 15.577 6.722 15.477 1155 HA ASN 47 HA ASN 47 18.432 6.990 15.264 1156 1HB ASN 47 HB2 ASN 47 18.378 5.049 14.152 1157 2HB ASN 47 HB3 ASN 47 16.766 4.901 14.842 1158 1HD2 ASN 47 HD22 ASN 47 18.616 4.961 11.937 1159 2HD2 ASN 47 HD21 ASN 47 17.258 5.049 10.821 1160 H ALA 48 HN ALA 48 15.692 8.178 13.303 1161 HA ALA 48 HA ALA 48 17.390 8.933 11.084 1162 1HB ALA 48 HB1 ALA 48 15.053 8.371 10.818 1163 2HB ALA 48 HB2 ALA 48 14.540 9.774 11.786 1164 3HB ALA 48 HB3 ALA 48 15.372 10.012 10.226 1165 H VAL 49 HN VAL 49 16.006 10.463 13.981 1166 HA VAL 49 HA VAL 49 16.866 13.145 13.456 1167 HB VAL 49 HB VAL 49 16.731 11.794 16.184 1168 1HG1 VAL 49 HG11 VAL 49 16.332 14.086 17.021 1169 2HG1 VAL 49 HG12 VAL 49 17.900 13.972 16.216 1170 3HG1 VAL 49 HG13 VAL 49 16.529 14.733 15.378 1171 1HG2 VAL 49 HG21 VAL 49 14.526 13.324 14.733 1172 2HG2 VAL 49 HG22 VAL 49 14.537 11.574 14.998 1173 3HG2 VAL 49 HG23 VAL 49 14.450 12.670 16.377 1174 H LYS 50 HN LYS 50 18.535 10.424 15.125 1175 HA LYS 50 HA LYS 50 21.057 11.679 15.402 1176 1HB LYS 50 HB2 LYS 50 20.391 9.611 16.533 1177 2HB LYS 50 HB3 LYS 50 20.354 8.739 14.998 1178 1HG LYS 50 HG2 LYS 50 22.763 9.011 14.712 1179 2HG LYS 50 HG3 LYS 50 22.849 10.047 16.155 1180 1HD LYS 50 HD2 LYS 50 22.082 8.175 17.567 1181 2HD LYS 50 HD3 LYS 50 21.947 7.127 16.137 1182 1HE LYS 50 HE2 LYS 50 24.352 7.302 15.725 1183 2HE LYS 50 HE3 LYS 50 24.529 8.480 17.033 1184 1HZ LYS 50 HZ1 LYS 50 23.720 5.649 17.398 1185 2HZ LYS 50 HZ2 LYS 50 25.179 6.285 17.765 1186 3HZ LYS 50 HZ3 LYS 50 23.862 6.749 18.601 1187 H ALA 51 HN ALA 51 19.799 9.702 12.672 1188 HA ALA 51 HA ALA 51 22.013 9.741 11.032 1189 1HB ALA 51 HB1 ALA 51 20.500 9.267 9.219 1190 2HB ALA 51 HB2 ALA 51 19.874 8.479 10.669 1191 3HB ALA 51 HB3 ALA 51 19.138 9.988 10.077 1192 H MET 52 HN MET 52 19.714 12.473 11.575 1193 HA MET 52 HA MET 52 20.972 13.999 9.396 1194 1HB MET 52 HB2 MET 52 18.671 14.645 11.290 1195 2HB MET 52 HB3 MET 52 19.242 15.675 9.975 1196 1HG MET 52 HG2 MET 52 17.908 12.980 9.752 1197 2HG MET 52 HG3 MET 52 17.372 14.524 9.108 1198 1HE MET 52 HE1 MET 52 18.526 15.766 7.214 1199 2HE MET 52 HE2 MET 52 20.212 15.576 7.775 1200 3HE MET 52 HE3 MET 52 19.774 15.123 6.120 1201 H LYS 53 HN LYS 53 21.016 13.860 12.955 1202 HA LYS 53 HA LYS 53 22.578 16.255 13.244 1203 1HB LYS 53 HB2 LYS 53 22.552 13.707 14.930 1204 2HB LYS 53 HB3 LYS 53 23.322 15.210 15.416 1205 1HG LYS 53 HG2 LYS 53 20.342 15.009 14.826 1206 2HG LYS 53 HG3 LYS 53 21.031 14.703 16.413 1207 1HD LYS 53 HD2 LYS 53 21.809 16.992 16.594 1208 2HD LYS 53 HD3 LYS 53 21.334 17.340 14.911 1209 1HE LYS 53 HE2 LYS 53 18.991 16.930 15.411 1210 2HE LYS 53 HE3 LYS 53 19.368 16.380 17.045 1211 1HZ LYS 53 HZ1 LYS 53 19.852 18.556 17.705 1212 2HZ LYS 53 HZ2 LYS 53 19.991 19.133 16.182 1213 3HZ LYS 53 HZ3 LYS 53 18.514 18.718 16.758 1214 H GLU 54 HN GLU 54 23.413 12.981 12.084 1215 HA GLU 54 HA GLU 54 26.209 13.097 12.302 1216 1HB GLU 54 HB2 GLU 54 24.615 12.066 9.920 1217 2HB GLU 54 HB3 GLU 54 26.318 11.788 10.205 1218 1HG GLU 54 HG2 GLU 54 25.754 10.536 12.301 1219 2HG GLU 54 HG3 GLU 54 24.041 10.677 11.875 1220 H VAL 55 HN VAL 55 24.076 14.722 9.967 1221 HA VAL 55 HA VAL 55 26.404 16.138 8.781 1222 HB VAL 55 HB VAL 55 24.938 16.428 6.803 1223 1HG1 VAL 55 HG11 VAL 55 25.291 14.217 5.951 1224 2HG1 VAL 55 HG12 VAL 55 26.614 14.575 7.057 1225 3HG1 VAL 55 HG13 VAL 55 25.297 13.501 7.579 1226 1HG2 VAL 55 HG21 VAL 55 22.706 16.140 7.933 1227 2HG2 VAL 55 HG22 VAL 55 22.916 15.118 6.505 1228 3HG2 VAL 55 HG23 VAL 55 23.055 14.407 8.123 1229 H GLY 56 HN GLY 56 24.663 16.732 11.283 1230 1HA GLY 56 HA2 GLY 56 24.118 18.621 12.401 1231 2HA GLY 56 HA3 GLY 56 25.043 19.508 11.181 1232 H ILE 57 HN ILE 57 21.951 17.607 10.792 1233 HA ILE 57 HA ILE 57 20.562 20.205 10.173 1234 HB ILE 57 HB ILE 57 20.053 17.490 8.927 1235 1HG1 ILE 57 HG12 ILE 57 21.112 20.118 7.801 1236 2HG1 ILE 57 HG13 ILE 57 21.967 18.580 7.914 1237 1HG2 ILE 57 HG21 ILE 57 18.216 18.591 7.712 1238 2HG2 ILE 57 HG22 ILE 57 17.940 18.737 9.438 1239 3HG2 ILE 57 HG23 ILE 57 18.565 20.129 8.531 1240 1HD1 ILE 57 HD11 ILE 57 19.694 19.290 6.025 1241 2HD1 ILE 57 HD12 ILE 57 21.361 18.815 5.659 1242 3HD1 ILE 57 HD13 ILE 57 20.238 17.615 6.299 1243 H ASP 58 HN ASP 58 19.269 20.642 11.926 1244 HA ASP 58 HA ASP 58 18.553 18.513 13.809 1245 1HB ASP 58 HB2 ASP 58 18.802 20.728 14.764 1246 2HB ASP 58 HB3 ASP 58 17.625 21.407 13.620 1247 H ILE 59 HN ILE 59 16.790 17.277 13.707 1248 HA ILE 59 HA ILE 59 14.416 18.298 12.275 1249 HB ILE 59 HB ILE 59 13.837 16.226 11.384 1250 1HG1 ILE 59 HG12 ILE 59 16.531 15.005 12.159 1251 2HG1 ILE 59 HG13 ILE 59 15.063 14.764 13.102 1252 1HG2 ILE 59 HG21 ILE 59 16.724 16.804 10.555 1253 2HG2 ILE 59 HG22 ILE 59 15.448 16.084 9.542 1254 3HG2 ILE 59 HG23 ILE 59 15.311 17.767 10.065 1255 1HD1 ILE 59 HD11 ILE 59 13.918 13.839 11.116 1256 2HD1 ILE 59 HD12 ILE 59 15.445 13.906 10.213 1257 3HD1 ILE 59 HD13 ILE 59 15.302 12.870 11.641 1258 H SER 60 HN SER 60 15.482 17.876 15.254 1259 HA SER 60 HA SER 60 13.634 15.993 16.311 1260 1HB SER 60 HB2 SER 60 14.054 17.158 18.480 1261 2HB SER 60 HB3 SER 60 15.532 16.703 17.619 1262 HG SER 60 HG SER 60 15.803 18.828 16.954 1263 H ASN 61 HN ASN 61 13.213 19.047 14.919 1264 HA ASN 61 HA ASN 61 10.717 19.832 16.125 1265 1HB ASN 61 HB2 ASN 61 10.833 21.664 14.520 1266 2HB ASN 61 HB3 ASN 61 12.396 21.464 15.298 1267 1HD2 ASN 61 HD22 ASN 61 14.250 20.830 13.991 1268 2HD2 ASN 61 HD21 ASN 61 14.116 20.662 12.261 1269 H GLN 62 HN GLN 62 11.435 17.432 13.667 1270 HA GLN 62 HA GLN 62 9.434 18.212 11.813 1271 1HB GLN 62 HB2 GLN 62 11.239 15.842 12.118 1272 2HB GLN 62 HB3 GLN 62 9.819 15.691 11.074 1273 1HG GLN 62 HG2 GLN 62 10.414 17.680 9.815 1274 2HG GLN 62 HG3 GLN 62 11.784 17.999 10.887 1275 1HE2 GLN 62 HE22 GLN 62 11.264 14.581 9.893 1276 2HE2 GLN 62 HE21 GLN 62 12.635 14.616 8.780 1277 H THR 63 HN THR 63 7.583 17.145 11.227 1278 HA THR 63 HA THR 63 6.089 15.534 13.227 1279 HB THR 63 HB THR 63 4.089 16.858 12.466 1280 HG1 THR 63 HG1 THR 63 4.740 17.693 10.510 1281 1HG2 THR 63 HG21 THR 63 4.605 18.892 13.713 1282 2HG2 THR 63 HG22 THR 63 5.397 17.518 14.510 1283 3HG2 THR 63 HG23 THR 63 6.351 18.624 13.494 1284 H SER 64 HN SER 64 4.134 14.387 12.027 1285 HA SER 64 HA SER 64 4.526 13.823 9.206 1286 1HB SER 64 HB2 SER 64 5.232 11.776 11.344 1287 2HB SER 64 HB3 SER 64 4.803 11.315 9.680 1288 HG SER 64 HG SER 64 6.628 13.364 9.890 1289 H ASP 65 HN ASP 65 2.957 11.985 8.574 1290 HA ASP 65 HA ASP 65 0.426 11.858 9.943 1291 1HB ASP 65 HB2 ASP 65 0.482 14.251 9.116 1292 2HB ASP 65 HB3 ASP 65 0.724 13.627 7.477 1293 H ILE 66 HN ILE 66 -1.170 10.723 8.449 1294 HA ILE 66 HA ILE 66 0.109 8.560 7.069 1295 HB ILE 66 HB ILE 66 -2.285 7.895 6.646 1296 1HG1 ILE 66 HG12 ILE 66 -2.977 10.286 8.395 1297 2HG1 ILE 66 HG13 ILE 66 -3.198 10.252 6.642 1298 1HG2 ILE 66 HG21 ILE 66 -2.664 7.257 8.966 1299 2HG2 ILE 66 HG22 ILE 66 -0.958 7.144 8.545 1300 3HG2 ILE 66 HG23 ILE 66 -1.530 8.511 9.530 1301 1HD1 ILE 66 HD11 ILE 66 -5.295 9.772 7.722 1302 2HD1 ILE 66 HD12 ILE 66 -4.728 8.286 6.926 1303 3HD1 ILE 66 HD13 ILE 66 -4.572 8.481 8.694 1304 H ILE 67 HN ILE 67 -0.826 7.811 4.883 1305 HA ILE 67 HA ILE 67 -0.267 9.577 2.805 1306 HB ILE 67 HB ILE 67 -0.804 7.945 1.359 1307 1HG1 ILE 67 HG12 ILE 67 -3.191 7.056 3.014 1308 2HG1 ILE 67 HG13 ILE 67 -3.221 8.077 1.571 1309 1HG2 ILE 67 HG21 ILE 67 -0.307 5.762 2.161 1310 2HG2 ILE 67 HG22 ILE 67 0.626 6.918 3.107 1311 3HG2 ILE 67 HG23 ILE 67 -0.835 6.160 3.804 1312 1HD1 ILE 67 HD11 ILE 67 -2.734 5.114 1.711 1313 2HD1 ILE 67 HD12 ILE 67 -3.839 6.075 0.681 1314 3HD1 ILE 67 HD13 ILE 67 -2.105 6.042 0.355 1315 H ASP 68 HN ASP 68 -1.365 11.133 1.748 1316 HA ASP 68 HA ASP 68 -4.258 11.523 2.212 1317 1HB ASP 68 HB2 ASP 68 -3.156 12.790 4.023 1318 2HB ASP 68 HB3 ASP 68 -2.265 13.726 2.820 1319 H SER 69 HN SER 69 -4.724 11.115 0.190 1320 HA SER 69 HA SER 69 -3.507 11.678 -2.146 1321 1HB SER 69 HB2 SER 69 -6.487 11.863 -1.615 1322 2HB SER 69 HB3 SER 69 -5.691 11.290 -3.099 1323 HG SER 69 HG SER 69 -6.444 9.588 -1.635 1324 H ASP 70 HN ASP 70 -5.121 14.105 -0.108 1325 HA ASP 70 HA ASP 70 -5.779 15.960 -2.198 1326 1HB ASP 70 HB2 ASP 70 -6.704 15.995 0.141 1327 2HB ASP 70 HB3 ASP 70 -5.112 16.548 0.699 1328 H ILE 71 HN ILE 71 -2.756 15.103 -0.760 1329 HA ILE 71 HA ILE 71 -1.454 17.400 -2.146 1330 HB ILE 71 HB ILE 71 -0.291 16.123 0.277 1331 1HG1 ILE 71 HG12 ILE 71 -1.236 18.532 1.319 1332 2HG1 ILE 71 HG13 ILE 71 -2.606 18.023 0.345 1333 1HG2 ILE 71 HG21 ILE 71 1.121 17.655 -1.141 1334 2HG2 ILE 71 HG22 ILE 71 0.030 18.977 -0.689 1335 3HG2 ILE 71 HG23 ILE 71 0.948 18.104 0.570 1336 1HD1 ILE 71 HD11 ILE 71 -2.719 17.134 2.640 1337 2HD1 ILE 71 HD12 ILE 71 -2.504 15.789 1.485 1338 3HD1 ILE 71 HD13 ILE 71 -1.107 16.401 2.422 1339 H LEU 72 HN LEU 72 -1.306 13.915 -1.150 1340 HA LEU 72 HA LEU 72 1.152 13.384 -2.479 1341 1HB LEU 72 HB2 LEU 72 0.126 11.952 -0.735 1342 2HB LEU 72 HB3 LEU 72 -1.140 11.474 -1.852 1343 HG LEU 72 HG LEU 72 0.616 9.802 -1.516 1344 1HD1 LEU 72 HD11 LEU 72 0.919 9.022 -3.728 1345 2HD1 LEU 72 HD12 LEU 72 -0.632 9.878 -3.732 1346 3HD1 LEU 72 HD13 LEU 72 0.826 10.627 -4.431 1347 1HD2 LEU 72 HD21 LEU 72 2.547 11.658 -2.919 1348 2HD2 LEU 72 HD22 LEU 72 2.533 11.228 -1.189 1349 3HD2 LEU 72 HD23 LEU 72 2.850 9.986 -2.402 1350 H ASN 73 HN ASN 73 -2.266 12.775 -3.608 1351 HA ASN 73 HA ASN 73 -1.428 12.021 -6.237 1352 1HB ASN 73 HB2 ASN 73 -3.543 11.476 -6.477 1353 2HB ASN 73 HB3 ASN 73 -3.910 12.094 -4.887 1354 1HD2 ASN 73 HD22 ASN 73 -4.638 14.417 -4.757 1355 2HD2 ASN 73 HD21 ASN 73 -5.453 15.117 -6.145 1356 H ASN 74 HN ASN 74 -1.839 15.075 -4.619 1357 HA ASN 74 HA ASN 74 -2.001 16.768 -6.917 1358 1HB ASN 74 HB2 ASN 74 -2.385 17.011 -4.192 1359 2HB ASN 74 HB3 ASN 74 -0.889 17.910 -4.403 1360 1HD2 ASN 74 HD22 ASN 74 -3.825 18.601 -3.783 1361 2HD2 ASN 74 HD21 ASN 74 -4.197 19.894 -4.913 1362 H ALA 75 HN ALA 75 0.679 15.268 -5.182 1363 HA ALA 75 HA ALA 75 2.773 16.960 -5.855 1364 1HB ALA 75 HB1 ALA 75 4.222 15.102 -5.311 1365 2HB ALA 75 HB2 ALA 75 2.822 15.041 -4.227 1366 3HB ALA 75 HB3 ALA 75 2.936 13.926 -5.601 1367 H ASP 76 HN ASP 76 4.553 16.559 -7.270 1368 HA ASP 76 HA ASP 76 3.797 15.681 -10.016 1369 1HB ASP 76 HB2 ASP 76 5.030 17.813 -9.722 1370 2HB ASP 76 HB3 ASP 76 6.357 16.933 -8.953 1371 H LEU 77 HN LEU 77 5.769 14.669 -7.225 1372 HA LEU 77 HA LEU 77 6.574 12.232 -8.632 1373 1HB LEU 77 HB2 LEU 77 8.282 13.938 -9.051 1374 2HB LEU 77 HB3 LEU 77 8.463 14.247 -7.340 1375 HG LEU 77 HG LEU 77 10.226 12.893 -8.620 1376 1HD1 LEU 77 HD11 LEU 77 10.670 11.327 -6.693 1377 2HD1 LEU 77 HD12 LEU 77 10.531 13.041 -6.311 1378 3HD1 LEU 77 HD13 LEU 77 9.186 11.941 -5.950 1379 1HD2 LEU 77 HD21 LEU 77 8.495 11.308 -9.612 1380 2HD2 LEU 77 HD22 LEU 77 10.032 10.629 -9.023 1381 3HD2 LEU 77 HD23 LEU 77 8.560 10.448 -8.064 1382 H VAL 78 HN VAL 78 6.597 10.469 -7.338 1383 HA VAL 78 HA VAL 78 6.622 10.779 -4.365 1384 HB VAL 78 HB VAL 78 5.420 8.434 -5.830 1385 1HG1 VAL 78 HG11 VAL 78 4.474 7.966 -3.588 1386 2HG1 VAL 78 HG12 VAL 78 6.237 8.016 -3.525 1387 3HG1 VAL 78 HG13 VAL 78 5.292 9.400 -2.933 1388 1HG2 VAL 78 HG21 VAL 78 4.085 10.989 -4.868 1389 2HG2 VAL 78 HG22 VAL 78 3.926 10.102 -6.406 1390 3HG2 VAL 78 HG23 VAL 78 3.210 9.439 -4.949 1391 H VAL 79 HN VAL 79 8.537 10.365 -3.604 1392 HA VAL 79 HA VAL 79 10.255 8.386 -4.992 1393 HB VAL 79 HB VAL 79 11.631 10.120 -4.824 1394 1HG1 VAL 79 HG11 VAL 79 11.765 11.800 -3.027 1395 2HG1 VAL 79 HG12 VAL 79 10.207 11.802 -3.841 1396 3HG1 VAL 79 HG13 VAL 79 10.347 11.050 -2.249 1397 1HG2 VAL 79 HG21 VAL 79 13.163 9.849 -2.910 1398 2HG2 VAL 79 HG22 VAL 79 11.949 8.944 -2.039 1399 3HG2 VAL 79 HG23 VAL 79 12.623 8.279 -3.543 1400 H THR 80 HN THR 80 9.786 6.415 -4.316 1401 HA THR 80 HA THR 80 8.893 5.906 -1.575 1402 HB THR 80 HB THR 80 9.732 4.080 -3.868 1403 HG1 THR 80 HG1 THR 80 7.714 5.576 -3.653 1404 1HG2 THR 80 HG21 THR 80 8.415 3.416 -1.189 1405 2HG2 THR 80 HG22 THR 80 8.437 2.334 -2.600 1406 3HG2 THR 80 HG23 THR 80 9.958 2.792 -1.827 1407 H LEU 81 HN LEU 81 10.236 4.994 0.054 1408 HA LEU 81 HA LEU 81 13.185 5.181 -0.414 1409 1HB LEU 81 HB2 LEU 81 11.579 6.243 1.934 1410 2HB LEU 81 HB3 LEU 81 13.339 6.155 1.861 1411 HG LEU 81 HG LEU 81 11.635 7.886 0.056 1412 1HD1 LEU 81 HD11 LEU 81 12.688 9.667 1.430 1413 2HD1 LEU 81 HD12 LEU 81 11.682 8.580 2.398 1414 3HD1 LEU 81 HD13 LEU 81 13.455 8.438 2.439 1415 1HD2 LEU 81 HD21 LEU 81 14.651 7.441 0.272 1416 2HD2 LEU 81 HD22 LEU 81 13.642 7.271 -1.169 1417 3HD2 LEU 81 HD23 LEU 81 13.935 8.877 -0.494 1418 H SER 82 HN SER 82 11.687 2.715 -0.475 1419 HA SER 82 HA SER 82 13.079 1.312 1.533 1420 1HB SER 82 HB2 SER 82 10.896 0.199 2.467 1421 2HB SER 82 HB3 SER 82 11.383 1.766 3.092 1422 HG SER 82 HG SER 82 9.825 2.766 1.983 1423 H GLY 83 HN GLY 83 12.273 -1.168 1.311 1424 1HA GLY 83 HA2 GLY 83 11.326 -1.797 -1.441 1425 2HA GLY 83 HA3 GLY 83 12.791 -2.558 -0.780 1426 H ASP 84 HN ASP 84 9.462 -1.736 0.318 1427 HA ASP 84 HA ASP 84 9.143 -4.401 1.588 1428 1HB ASP 84 HB2 ASP 84 10.096 -2.436 3.096 1429 2HB ASP 84 HB3 ASP 84 8.433 -1.868 3.081 1430 H ALA 85 HN ALA 85 6.750 -4.261 2.644 1431 HA ALA 85 HA ALA 85 4.830 -3.081 0.702 1432 1HB ALA 85 HB1 ALA 85 5.223 -5.415 0.018 1433 2HB ALA 85 HB2 ALA 85 4.862 -5.972 1.672 1434 3HB ALA 85 HB3 ALA 85 3.592 -5.222 0.689 1435 H ALA 86 HN ALA 86 5.781 -3.572 3.983 1436 HA ALA 86 HA ALA 86 3.265 -3.534 5.306 1437 1HB ALA 86 HB1 ALA 86 5.991 -2.397 6.096 1438 2HB ALA 86 HB2 ALA 86 4.594 -2.525 7.186 1439 3HB ALA 86 HB3 ALA 86 5.344 -3.986 6.513 1440 H ASP 87 HN ASP 87 4.935 -1.103 3.471 1441 HA ASP 87 HA ASP 87 3.765 1.281 4.353 1442 1HB ASP 87 HB2 ASP 87 4.603 2.226 2.389 1443 2HB ASP 87 HB3 ASP 87 5.739 0.952 2.816 1444 H LYS 88 HN LYS 88 2.056 -1.287 2.886 1445 HA LYS 88 HA LYS 88 -0.207 -1.465 2.617 1446 1HB LYS 88 HB2 LYS 88 -0.461 0.954 3.629 1447 2HB LYS 88 HB3 LYS 88 -0.640 1.451 1.954 1448 1HG LYS 88 HG2 LYS 88 -2.567 -0.149 1.741 1449 2HG LYS 88 HG3 LYS 88 -2.380 -0.586 3.430 1450 1HD LYS 88 HD2 LYS 88 -2.841 2.288 2.507 1451 2HD LYS 88 HD3 LYS 88 -4.168 1.167 2.731 1452 1HE LYS 88 HE2 LYS 88 -2.251 2.059 4.914 1453 2HE LYS 88 HE3 LYS 88 -3.887 2.668 4.638 1454 1HZ LYS 88 HZ1 LYS 88 -3.236 -0.113 5.425 1455 2HZ LYS 88 HZ2 LYS 88 -3.995 1.020 6.338 1456 3HZ LYS 88 HZ3 LYS 88 -4.719 0.402 5.005 1457 H CYS 89 HN CYS 89 2.159 -1.132 0.636 1458 HA CYS 89 HA CYS 89 2.637 -0.958 -1.530 1459 1HB CYS 89 HB2 CYS 89 0.046 -2.409 -2.074 1460 2HB CYS 89 HB3 CYS 89 1.525 -2.485 -3.020 1461 HA PRO 90 HA PRO 90 -0.827 2.264 -1.929 1462 1HB PRO 90 HB2 PRO 90 1.297 4.330 -2.055 1463 2HB PRO 90 HB3 PRO 90 -0.220 4.311 -1.084 1464 1HG PRO 90 HG2 PRO 90 2.189 3.931 0.124 1465 2HG PRO 90 HG3 PRO 90 0.695 3.097 0.630 1466 1HD PRO 90 HD2 PRO 90 2.911 2.055 -1.158 1467 2HD PRO 90 HD3 PRO 90 2.102 1.253 0.214 1468 H MET 91 HN MET 91 -1.548 2.721 -4.008 1469 HA MET 91 HA MET 91 0.332 1.815 -6.045 1470 1HB MET 91 HB2 MET 91 -1.698 1.493 -7.436 1471 2HB MET 91 HB3 MET 91 -1.643 0.629 -5.896 1472 1HG MET 91 HG2 MET 91 -3.794 1.455 -6.126 1473 2HG MET 91 HG3 MET 91 -3.065 2.426 -4.890 1474 1HE MET 91 HE1 MET 91 -5.582 2.700 -6.621 1475 2HE MET 91 HE2 MET 91 -5.110 3.654 -5.232 1476 3HE MET 91 HE3 MET 91 -5.717 4.497 -6.748 1477 H THR 92 HN THR 92 0.036 4.800 -5.006 1478 HA THR 92 HA THR 92 0.347 6.899 -5.903 1479 HB THR 92 HB THR 92 2.440 6.844 -7.371 1480 HG1 THR 92 HG1 THR 92 2.059 4.691 -8.116 1481 1HG2 THR 92 HG21 THR 92 2.511 5.386 -4.689 1482 2HG2 THR 92 HG22 THR 92 3.869 6.222 -5.479 1483 3HG2 THR 92 HG23 THR 92 2.476 7.144 -4.905 1484 HA PRO 93 HA PRO 93 -2.450 6.243 -9.397 1485 1HB PRO 93 HB2 PRO 93 -3.924 8.561 -9.268 1486 2HB PRO 93 HB3 PRO 93 -4.183 7.151 -8.184 1487 1HG PRO 93 HG2 PRO 93 -2.506 9.606 -7.580 1488 2HG PRO 93 HG3 PRO 93 -3.797 8.846 -6.584 1489 1HD PRO 93 HD2 PRO 93 -1.212 8.271 -6.141 1490 2HD PRO 93 HD3 PRO 93 -2.424 6.948 -6.113 1491 HA PRO 94 HA PRO 94 0.122 7.671 -12.583 1492 1HB PRO 94 HB2 PRO 94 -2.415 8.234 -14.143 1493 2HB PRO 94 HB3 PRO 94 -0.919 7.417 -14.700 1494 1HG PRO 94 HG2 PRO 94 -3.086 5.986 -13.882 1495 2HG PRO 94 HG3 PRO 94 -1.423 5.468 -13.441 1496 1HD PRO 94 HD2 PRO 94 -3.497 6.791 -11.749 1497 2HD PRO 94 HD3 PRO 94 -2.182 5.630 -11.329 1498 H HIS 95 HN HIS 95 -2.038 10.109 -11.399 1499 HA HIS 95 HA HIS 95 -1.252 12.280 -13.090 1500 1HB HIS 95 HB2 HIS 95 -3.215 12.253 -11.527 1501 2HB HIS 95 HB3 HIS 95 -2.095 12.311 -10.163 1502 HD1 HIS 95 HD1 HIS 95 -1.669 14.739 -9.334 1503 HD2 HIS 95 HD2 HIS 95 -2.822 14.470 -13.376 1504 HE1 HIS 95 HE1 HIS 95 -1.837 17.135 -10.194 1505 H VAL 96 HN VAL 96 0.518 10.403 -10.758 1506 HA VAL 96 HA VAL 96 2.582 12.527 -10.456 1507 HB VAL 96 HB VAL 96 2.118 10.273 -8.479 1508 1HG1 VAL 96 HG11 VAL 96 3.011 12.046 -6.925 1509 2HG1 VAL 96 HG12 VAL 96 4.138 11.623 -8.231 1510 3HG1 VAL 96 HG13 VAL 96 3.187 13.112 -8.313 1511 1HG2 VAL 96 HG21 VAL 96 0.586 12.904 -8.463 1512 2HG2 VAL 96 HG22 VAL 96 -0.113 11.269 -8.560 1513 3HG2 VAL 96 HG23 VAL 96 0.716 11.778 -7.097 1514 H LYS 97 HN LYS 97 4.735 11.938 -10.837 1515 HA LYS 97 HA LYS 97 5.289 9.354 -12.145 1516 1HB LYS 97 HB2 LYS 97 6.188 11.589 -12.881 1517 2HB LYS 97 HB3 LYS 97 7.140 11.673 -11.411 1518 1HG LYS 97 HG2 LYS 97 7.417 9.210 -13.130 1519 2HG LYS 97 HG3 LYS 97 8.006 10.707 -13.817 1520 1HD LYS 97 HD2 LYS 97 8.881 9.668 -11.109 1521 2HD LYS 97 HD3 LYS 97 9.711 9.272 -12.598 1522 1HE LYS 97 HE2 LYS 97 9.391 12.114 -11.485 1523 2HE LYS 97 HE3 LYS 97 10.843 11.125 -11.352 1524 1HZ LYS 97 HZ1 LYS 97 10.942 11.092 -13.808 1525 2HZ LYS 97 HZ2 LYS 97 9.666 12.111 -13.892 1526 3HZ LYS 97 HZ3 LYS 97 11.072 12.608 -13.228 1527 H ARG 98 HN ARG 98 6.964 7.866 -11.170 1528 HA ARG 98 HA ARG 98 7.457 8.309 -8.305 1529 1HB ARG 98 HB2 ARG 98 5.345 6.966 -8.452 1530 2HB ARG 98 HB3 ARG 98 6.231 5.737 -9.363 1531 1HG ARG 98 HG2 ARG 98 7.767 5.502 -7.271 1532 2HG ARG 98 HG3 ARG 98 6.593 6.556 -6.444 1533 1HD ARG 98 HD2 ARG 98 4.826 4.914 -7.168 1534 2HD ARG 98 HD3 ARG 98 6.090 3.846 -7.775 1535 HE ARG 98 HE ARG 98 6.931 4.206 -5.248 1536 1HH1 ARG 98 HH11 ARG 98 3.607 3.567 -6.328 1537 2HH1 ARG 98 HH12 ARG 98 3.181 2.680 -4.916 1538 1HH2 ARG 98 HH21 ARG 98 6.337 3.254 -3.365 1539 2HH2 ARG 98 HH22 ARG 98 4.817 2.418 -3.177 1540 H GLU 99 HN GLU 99 9.277 7.273 -7.517 1541 HA GLU 99 HA GLU 99 10.683 5.251 -9.074 1542 1HB GLU 99 HB2 GLU 99 11.938 7.928 -8.313 1543 2HB GLU 99 HB3 GLU 99 12.865 6.482 -8.739 1544 1HG GLU 99 HG2 GLU 99 11.723 6.517 -10.996 1545 2HG GLU 99 HG3 GLU 99 11.070 8.112 -10.563 1546 H HIS 100 HN HIS 100 12.275 4.206 -7.611 1547 HA HIS 100 HA HIS 100 11.881 4.764 -4.723 1548 1HB HIS 100 HB2 HIS 100 13.086 2.418 -6.277 1549 2HB HIS 100 HB3 HIS 100 13.328 2.626 -4.558 1550 HD1 HIS 100 HD1 HIS 100 11.692 1.215 -3.135 1551 HD2 HIS 100 HD2 HIS 100 10.206 2.343 -6.923 1552 HE1 HIS 100 HE1 HIS 100 9.479 0.016 -3.427 1553 H TRP 101 HN TRP 101 13.418 6.010 -3.760 1554 HA TRP 101 HA TRP 101 16.193 5.975 -4.904 1555 1HB TRP 101 HB2 TRP 101 15.045 8.157 -3.164 1556 2HB TRP 101 HB3 TRP 101 16.616 8.122 -3.928 1557 HD1 TRP 101 HD1 TRP 101 14.880 7.091 -6.780 1558 HE1 TRP 101 HE1 TRP 101 13.701 8.862 -8.125 1559 HE3 TRP 101 HE3 TRP 101 15.326 10.960 -3.473 1560 HZ2 TRP 101 HZ2 TRP 101 12.872 11.649 -7.746 1561 HZ3 TRP 101 HZ3 TRP 101 14.296 13.165 -3.982 1562 HH2 TRP 101 HH2 TRP 101 13.022 13.493 -6.085 1563 H GLY 102 HN GLY 102 14.340 4.532 -2.665 1564 1HA GLY 102 HA2 GLY 102 16.671 3.714 -1.118 1565 2HA GLY 102 HA3 GLY 102 15.255 4.261 -0.190 1566 H PHE 103 HN PHE 103 16.359 1.561 -0.474 1567 HA PHE 103 HA PHE 103 14.096 0.007 -1.585 1568 1HB PHE 103 HB2 PHE 103 15.697 -1.379 -2.867 1569 2HB PHE 103 HB3 PHE 103 15.619 0.272 -3.439 1570 HD1 PHE 103 HD1 PHE 103 17.537 1.788 -3.263 1571 HD2 PHE 103 HD2 PHE 103 17.739 -2.217 -1.665 1572 HE1 PHE 103 HE1 PHE 103 19.994 2.013 -2.996 1573 HE2 PHE 103 HE2 PHE 103 20.193 -1.985 -1.402 1574 HZ PHE 103 HZ PHE 103 21.326 0.131 -2.062 1575 H ASP 104 HN ASP 104 15.638 0.690 1.096 1576 HA ASP 104 HA ASP 104 15.594 -1.919 2.347 1577 1HB ASP 104 HB2 ASP 104 17.896 -1.894 1.431 1578 2HB ASP 104 HB3 ASP 104 18.157 -0.275 2.085 1579 H ASP 105 HN ASP 105 16.108 -1.390 4.812 1580 HA ASP 105 HA ASP 105 14.999 1.305 5.447 1581 1HB ASP 105 HB2 ASP 105 13.146 -0.194 5.311 1582 2HB ASP 105 HB3 ASP 105 13.945 -1.370 6.351 1583 HA PRO 106 HA PRO 106 18.580 0.742 8.082 1584 1HB PRO 106 HB2 PRO 106 18.720 3.249 9.158 1585 2HB PRO 106 HB3 PRO 106 19.219 2.851 7.482 1586 1HG PRO 106 HG2 PRO 106 16.635 4.097 8.440 1587 2HG PRO 106 HG3 PRO 106 17.641 4.545 7.021 1588 1HD PRO 106 HD2 PRO 106 15.412 2.959 6.849 1589 2HD PRO 106 HD3 PRO 106 16.800 2.780 5.747 1590 H ALA 107 HN ALA 107 15.386 1.791 9.306 1591 HA ALA 107 HA ALA 107 16.098 1.834 12.063 1592 1HB ALA 107 HB1 ALA 107 14.139 3.001 11.183 1593 2HB ALA 107 HB2 ALA 107 13.427 1.465 10.644 1594 3HB ALA 107 HB3 ALA 107 13.625 1.791 12.380 1595 H ARG 108 HN ARG 108 15.946 -0.721 9.886 1596 HA ARG 108 HA ARG 108 15.050 -2.841 11.734 1597 1HB ARG 108 HB2 ARG 108 16.161 -3.091 8.937 1598 2HB ARG 108 HB3 ARG 108 15.131 -4.228 9.796 1599 1HG ARG 108 HG2 ARG 108 14.313 -1.469 8.765 1600 2HG ARG 108 HG3 ARG 108 13.911 -3.019 8.049 1601 1HD ARG 108 HD2 ARG 108 11.974 -2.345 9.145 1602 2HD ARG 108 HD3 ARG 108 12.729 -3.597 10.159 1603 HE ARG 108 HE ARG 108 13.314 -2.012 11.782 1604 1HH1 ARG 108 HH21 ARG 108 11.402 -0.333 9.309 1605 2HH1 ARG 108 HH22 ARG 108 10.385 0.468 10.463 1606 1HH2 ARG 108 HH11 ARG 108 12.184 -0.737 13.278 1607 2HH2 ARG 108 HH12 ARG 108 10.961 0.355 12.756 1608 H ALA 109 HN ALA 109 17.829 -1.190 11.649 1609 HA ALA 109 HA ALA 109 19.934 -2.641 10.973 1610 1HB ALA 109 HB1 ALA 109 19.987 -0.374 12.047 1611 2HB ALA 109 HB2 ALA 109 19.755 -1.159 13.629 1612 3HB ALA 109 HB3 ALA 109 21.211 -1.505 12.671 1613 H GLN 110 HN GLN 110 21.382 -4.085 11.851 1614 HA GLN 110 HA GLN 110 20.252 -6.387 12.873 1615 1HB GLN 110 HB2 GLN 110 22.376 -6.413 11.646 1616 2HB GLN 110 HB3 GLN 110 23.163 -5.481 12.925 1617 1HG GLN 110 HG2 GLN 110 23.842 -7.820 12.981 1618 2HG GLN 110 HG3 GLN 110 23.074 -7.315 14.472 1619 1HE2 GLN 110 HE22 GLN 110 20.865 -8.092 14.951 1620 2HE2 GLN 110 HE21 GLN 110 20.331 -9.597 14.222 1621 H GLY 111 HN GLY 111 22.118 -3.893 14.641 1622 1HA GLY 111 HA2 GLY 111 20.820 -3.351 16.706 1623 2HA GLY 111 HA3 GLY 111 21.064 -5.081 17.138 1624 H THR 112 HN THR 112 23.883 -4.717 15.933 1625 HA THR 112 HA THR 112 25.175 -4.279 18.509 1626 HB THR 112 HB THR 112 27.258 -4.685 17.356 1627 HG1 THR 112 HG1 THR 112 27.258 -4.967 15.097 1628 1HG2 THR 112 HG21 THR 112 26.894 -6.874 16.482 1629 2HG2 THR 112 HG22 THR 112 25.688 -6.620 17.772 1630 3HG2 THR 112 HG23 THR 112 25.208 -6.499 16.052 1631 H GLU 113 HN GLU 113 26.813 -2.555 18.834 1632 HA GLU 113 HA GLU 113 25.622 -0.103 18.390 1633 1HB GLU 113 HB2 GLU 113 28.576 -0.755 18.911 1634 2HB GLU 113 HB3 GLU 113 27.841 0.843 19.189 1635 1HG GLU 113 HG2 GLU 113 26.250 -0.232 20.819 1636 2HG GLU 113 HG3 GLU 113 27.123 -1.753 20.616 1637 H GLU 114 HN GLU 114 28.073 -1.768 16.498 1638 HA GLU 114 HA GLU 114 28.650 0.439 14.743 1639 1HB GLU 114 HB2 GLU 114 29.761 -1.476 13.409 1640 2HB GLU 114 HB3 GLU 114 30.467 -1.016 14.971 1641 1HG GLU 114 HG2 GLU 114 29.276 -2.964 16.020 1642 2HG GLU 114 HG3 GLU 114 28.696 -3.403 14.394 1643 H GLU 115 HN GLU 115 26.445 -2.529 14.656 1644 HA GLU 115 HA GLU 115 26.037 -2.019 11.845 1645 1HB GLU 115 HB2 GLU 115 24.689 -3.879 13.786 1646 2HB GLU 115 HB3 GLU 115 24.248 -3.743 12.080 1647 1HG GLU 115 HG2 GLU 115 27.149 -4.251 12.848 1648 2HG GLU 115 HG3 GLU 115 25.979 -5.573 12.800 1649 H LYS 116 HN LYS 116 24.462 -1.002 14.852 1650 HA LYS 116 HA LYS 116 22.131 0.102 13.598 1651 1HB LYS 116 HB2 LYS 116 23.532 0.939 16.176 1652 2HB LYS 116 HB3 LYS 116 21.979 1.561 15.604 1653 1HG LYS 116 HG2 LYS 116 21.319 -1.033 15.534 1654 2HG LYS 116 HG3 LYS 116 22.664 -1.169 16.648 1655 1HD LYS 116 HD2 LYS 116 21.090 -0.872 18.213 1656 2HD LYS 116 HD3 LYS 116 21.381 0.844 17.894 1657 1HE LYS 116 HE2 LYS 116 19.492 0.776 16.207 1658 2HE LYS 116 HE3 LYS 116 19.241 -0.929 16.615 1659 1HZ LYS 116 HZ1 LYS 116 18.690 -0.245 18.877 1660 2HZ LYS 116 HZ2 LYS 116 18.928 1.330 18.515 1661 3HZ LYS 116 HZ3 LYS 116 17.708 0.505 17.817 1662 H TRP 117 HN TRP 117 25.229 1.689 14.496 1663 HA TRP 117 HA TRP 117 24.421 4.098 13.194 1664 1HB TRP 117 HB2 TRP 117 26.386 3.681 14.868 1665 2HB TRP 117 HB3 TRP 117 27.340 3.314 13.434 1666 HD1 TRP 117 HD1 TRP 117 26.491 5.622 11.508 1667 HE1 TRP 117 HE1 TRP 117 26.844 8.078 11.997 1668 HE3 TRP 117 HE3 TRP 117 27.270 5.285 16.561 1669 HZ2 TRP 117 HZ2 TRP 117 27.409 9.703 14.284 1670 HZ3 TRP 117 HZ3 TRP 117 27.747 7.341 17.878 1671 HH2 TRP 117 HH2 TRP 117 27.803 9.563 16.761 1672 H ALA 118 HN ALA 118 26.147 1.195 11.991 1673 HA ALA 118 HA ALA 118 26.826 2.270 9.485 1674 1HB ALA 118 HB1 ALA 118 27.818 0.188 10.480 1675 2HB ALA 118 HB2 ALA 118 26.258 -0.620 10.302 1676 3HB ALA 118 HB3 ALA 118 27.163 -0.127 8.855 1677 H PHE 119 HN PHE 119 23.828 0.524 10.463 1678 HA PHE 119 HA PHE 119 22.785 0.428 7.787 1679 1HB PHE 119 HB2 PHE 119 21.643 0.050 10.533 1680 2HB PHE 119 HB3 PHE 119 20.514 0.467 9.270 1681 HD1 PHE 119 HD1 PHE 119 19.367 -1.312 8.327 1682 HD2 PHE 119 HD2 PHE 119 23.470 -1.902 9.543 1683 HE1 PHE 119 HE1 PHE 119 19.251 -3.665 7.589 1684 HE2 PHE 119 HE2 PHE 119 23.338 -4.262 8.813 1685 HZ PHE 119 HZ PHE 119 21.231 -5.154 7.835 1686 H PHE 120 HN PHE 120 22.412 2.776 10.501 1687 HA PHE 120 HA PHE 120 20.581 4.453 9.110 1688 1HB PHE 120 HB2 PHE 120 22.603 5.511 11.087 1689 2HB PHE 120 HB3 PHE 120 20.999 6.123 10.716 1690 HD1 PHE 120 HD1 PHE 120 22.081 5.792 13.445 1691 HD2 PHE 120 HD2 PHE 120 19.857 2.984 11.027 1692 HE1 PHE 120 HE1 PHE 120 21.288 4.635 15.488 1693 HE2 PHE 120 HE2 PHE 120 19.059 1.863 13.059 1694 HZ PHE 120 HZ PHE 120 19.770 2.677 15.304 1695 H GLN 121 HN GLN 121 24.174 4.668 9.411 1696 HA GLN 121 HA GLN 121 24.462 7.005 7.892 1697 1HB GLN 121 HB2 GLN 121 26.108 6.148 9.417 1698 2HB GLN 121 HB3 GLN 121 26.363 4.687 8.452 1699 1HG GLN 121 HG2 GLN 121 27.404 5.913 6.681 1700 2HG GLN 121 HG3 GLN 121 26.866 7.459 7.334 1701 1HE2 GLN 121 HE22 GLN 121 27.632 7.848 9.778 1702 2HE2 GLN 121 HE21 GLN 121 29.325 7.470 10.050 1703 H ARG 122 HN ARG 122 24.564 3.547 6.839 1704 HA ARG 122 HA ARG 122 25.463 4.066 4.215 1705 1HB ARG 122 HB2 ARG 122 25.530 1.841 5.185 1706 2HB ARG 122 HB3 ARG 122 23.775 1.826 5.414 1707 1HG ARG 122 HG2 ARG 122 23.414 1.761 2.985 1708 2HG ARG 122 HG3 ARG 122 25.150 1.920 2.694 1709 1HD ARG 122 HD2 ARG 122 24.338 -0.413 2.435 1710 2HD ARG 122 HD3 ARG 122 25.592 -0.240 3.662 1711 HE ARG 122 HE ARG 122 24.165 -0.993 5.257 1712 1HH1 ARG 122 HH11 ARG 122 22.116 -0.050 2.469 1713 2HH1 ARG 122 HH12 ARG 122 20.665 -0.646 3.264 1714 1HH2 ARG 122 HH21 ARG 122 22.119 -1.797 6.155 1715 2HH2 ARG 122 HH22 ARG 122 20.674 -1.570 5.191 1716 H VAL 123 HN VAL 123 22.086 3.629 5.469 1717 HA VAL 123 HA VAL 123 21.005 4.180 2.848 1718 HB VAL 123 HB VAL 123 19.564 4.244 5.523 1719 1HG1 VAL 123 HG11 VAL 123 17.560 3.756 4.052 1720 2HG1 VAL 123 HG12 VAL 123 18.282 5.331 3.741 1721 3HG1 VAL 123 HG13 VAL 123 18.591 3.982 2.632 1722 1HG2 VAL 123 HG21 VAL 123 18.868 1.914 4.936 1723 2HG2 VAL 123 HG22 VAL 123 19.931 1.960 3.517 1724 3HG2 VAL 123 HG23 VAL 123 20.611 2.015 5.155 1725 H ARG 124 HN ARG 124 21.689 6.232 5.731 1726 HA ARG 124 HA ARG 124 20.403 8.562 4.808 1727 1HB ARG 124 HB2 ARG 124 21.091 8.224 7.053 1728 2HB ARG 124 HB3 ARG 124 22.802 8.106 6.624 1729 1HG ARG 124 HG2 ARG 124 21.187 10.621 6.203 1730 2HG ARG 124 HG3 ARG 124 21.866 10.224 7.765 1731 1HD ARG 124 HD2 ARG 124 23.566 10.558 5.279 1732 2HD ARG 124 HD3 ARG 124 23.279 11.799 6.510 1733 HE ARG 124 HE ARG 124 24.193 9.808 8.070 1734 1HH1 ARG 124 HH11 ARG 124 25.529 11.139 5.029 1735 2HH1 ARG 124 HH12 ARG 124 27.164 11.006 5.543 1736 1HH2 ARG 124 HH21 ARG 124 26.379 9.559 8.693 1737 2HH2 ARG 124 HH22 ARG 124 27.657 10.130 7.667 1738 H ASP 125 HN ASP 125 23.764 7.452 4.165 1739 HA ASP 125 HA ASP 125 24.544 9.699 2.619 1740 1HB ASP 125 HB2 ASP 125 26.135 8.018 3.406 1741 2HB ASP 125 HB3 ASP 125 25.363 6.772 2.423 1742 H GLU 126 HN GLU 126 22.920 6.641 1.649 1743 HA GLU 126 HA GLU 126 22.858 7.174 -1.141 1744 1HB GLU 126 HB2 GLU 126 22.502 4.954 0.014 1745 2HB GLU 126 HB3 GLU 126 20.933 5.525 0.566 1746 1HG GLU 126 HG2 GLU 126 20.506 4.172 -1.310 1747 2HG GLU 126 HG3 GLU 126 20.266 5.833 -1.862 1748 H ILE 127 HN ILE 127 20.382 7.673 1.399 1749 HA ILE 127 HA ILE 127 18.363 8.847 -0.166 1750 HB ILE 127 HB ILE 127 19.054 8.595 2.734 1751 1HG1 ILE 127 HG12 ILE 127 16.483 8.321 1.146 1752 2HG1 ILE 127 HG13 ILE 127 17.637 7.011 1.412 1753 1HG2 ILE 127 HG21 ILE 127 17.271 10.089 3.487 1754 2HG2 ILE 127 HG22 ILE 127 18.648 10.932 2.827 1755 3HG2 ILE 127 HG23 ILE 127 17.163 10.763 1.838 1756 1HD1 ILE 127 HD11 ILE 127 17.086 7.199 3.930 1757 2HD1 ILE 127 HD12 ILE 127 15.789 8.303 3.447 1758 3HD1 ILE 127 HD13 ILE 127 15.785 6.624 2.867 1759 H GLY 128 HN GLY 128 21.066 10.457 1.623 1760 1HA GLY 128 HA2 GLY 128 20.255 13.088 0.907 1761 2HA GLY 128 HA3 GLY 128 21.873 12.571 1.457 1762 H ASN 129 HN ASN 129 22.682 10.863 -0.664 1763 HA ASN 129 HA ASN 129 23.552 12.827 -2.502 1764 1HB ASN 129 HB2 ASN 129 24.631 10.555 -1.980 1765 2HB ASN 129 HB3 ASN 129 23.495 9.859 -3.136 1766 1HD2 ASN 129 HD22 ASN 129 23.638 12.240 -5.088 1767 2HD2 ASN 129 HD21 ASN 129 25.245 12.131 -5.753 1768 H ARG 130 HN ARG 130 20.943 10.379 -2.765 1769 HA ARG 130 HA ARG 130 20.254 11.160 -5.476 1770 1HB ARG 130 HB2 ARG 130 18.911 9.512 -3.326 1771 2HB ARG 130 HB3 ARG 130 17.968 10.075 -4.698 1772 1HG ARG 130 HG2 ARG 130 18.783 7.831 -5.077 1773 2HG ARG 130 HG3 ARG 130 19.382 8.940 -6.297 1774 1HD ARG 130 HD2 ARG 130 21.111 8.209 -3.908 1775 2HD ARG 130 HD3 ARG 130 20.917 7.090 -5.256 1776 HE ARG 130 HE ARG 130 21.643 9.616 -6.346 1777 1HH1 ARG 130 HH11 ARG 130 23.102 6.954 -4.442 1778 2HH1 ARG 130 HH12 ARG 130 24.675 7.199 -5.133 1779 1HH2 ARG 130 HH21 ARG 130 23.593 9.889 -7.201 1780 2HH2 ARG 130 HH22 ARG 130 24.991 8.917 -6.773 1781 H LEU 131 HN LEU 131 19.167 12.372 -2.244 1782 HA LEU 131 HA LEU 131 17.191 14.073 -3.373 1783 1HB LEU 131 HB2 LEU 131 18.517 13.814 -0.734 1784 2HB LEU 131 HB3 LEU 131 18.265 15.489 -1.151 1785 HG LEU 131 HG LEU 131 16.395 14.761 0.104 1786 1HD1 LEU 131 HD11 LEU 131 15.406 14.906 -2.790 1787 2HD1 LEU 131 HD12 LEU 131 14.555 15.387 -1.342 1788 3HD1 LEU 131 HD13 LEU 131 15.971 16.306 -1.865 1789 1HD2 LEU 131 HD21 LEU 131 14.978 12.905 -0.503 1790 2HD2 LEU 131 HD22 LEU 131 15.946 12.567 -1.953 1791 3HD2 LEU 131 HD23 LEU 131 16.630 12.343 -0.330 1792 H LYS 132 HN LYS 132 20.681 14.647 -2.742 1793 HA LYS 132 HA LYS 132 20.643 17.361 -3.559 1794 1HB LYS 132 HB2 LYS 132 22.419 16.156 -2.261 1795 2HB LYS 132 HB3 LYS 132 22.885 15.287 -3.732 1796 1HG LYS 132 HG2 LYS 132 23.443 17.459 -4.819 1797 2HG LYS 132 HG3 LYS 132 23.000 18.314 -3.332 1798 1HD LYS 132 HD2 LYS 132 25.150 16.165 -3.537 1799 2HD LYS 132 HD3 LYS 132 25.463 17.912 -3.630 1800 1HE LYS 132 HE2 LYS 132 24.438 18.148 -1.337 1801 2HE LYS 132 HE3 LYS 132 24.326 16.387 -1.244 1802 1HZ LYS 132 HZ1 LYS 132 26.755 16.303 -1.471 1803 2HZ LYS 132 HZ2 LYS 132 26.840 17.934 -1.532 1804 3HZ LYS 132 HZ3 LYS 132 26.335 17.194 -0.174 1805 H GLU 133 HN GLU 133 21.154 14.302 -5.469 1806 HA GLU 133 HA GLU 133 21.423 15.697 -7.949 1807 1HB GLU 133 HB2 GLU 133 20.528 12.889 -7.183 1808 2HB GLU 133 HB3 GLU 133 20.271 13.455 -8.845 1809 1HG GLU 133 HG2 GLU 133 22.552 13.869 -9.221 1810 2HG GLU 133 HG3 GLU 133 22.989 13.578 -7.518 1811 H PHE 134 HN PHE 134 18.401 14.627 -6.202 1812 HA PHE 134 HA PHE 134 16.764 15.268 -8.417 1813 1HB PHE 134 HB2 PHE 134 15.904 14.016 -6.559 1814 2HB PHE 134 HB3 PHE 134 16.220 15.335 -5.434 1815 HD1 PHE 134 HD1 PHE 134 14.370 16.582 -4.766 1816 HD2 PHE 134 HD2 PHE 134 14.419 14.878 -8.705 1817 HE1 PHE 134 HE1 PHE 134 12.136 17.540 -5.210 1818 HE2 PHE 134 HE2 PHE 134 12.147 15.806 -9.147 1819 HZ PHE 134 HZ PHE 134 11.003 17.146 -7.389 1820 H ALA 135 HN ALA 135 18.095 17.398 -5.892 1821 HA ALA 135 HA ALA 135 16.716 19.755 -6.629 1822 1HB ALA 135 HB1 ALA 135 18.145 19.358 -4.563 1823 2HB ALA 135 HB2 ALA 135 19.573 19.581 -5.602 1824 3HB ALA 135 HB3 ALA 135 18.400 20.912 -5.371 1825 H GLU 136 HN GLU 136 19.426 18.113 -8.142 1826 HA GLU 136 HA GLU 136 20.240 20.397 -9.737 1827 1HB GLU 136 HB2 GLU 136 21.267 17.547 -9.504 1828 2HB GLU 136 HB3 GLU 136 21.995 18.753 -10.549 1829 1HG GLU 136 HG2 GLU 136 21.715 19.227 -7.558 1830 2HG GLU 136 HG3 GLU 136 23.025 18.269 -8.226 1831 H THR 137 HN THR 137 18.973 17.154 -10.164 1832 HA THR 137 HA THR 137 18.891 17.291 -13.068 1833 HB THR 137 HB THR 137 18.243 14.905 -12.814 1834 HG1 THR 137 HG1 THR 137 18.395 15.285 -10.032 1835 1HG2 THR 137 HG21 THR 137 20.632 15.413 -12.705 1836 2HG2 THR 137 HG22 THR 137 20.548 15.672 -10.957 1837 3HG2 THR 137 HG23 THR 137 20.229 14.063 -11.626 1838 H GLY 138 HN GLY 138 16.631 17.696 -10.397 1839 1HA GLY 138 HA2 GLY 138 14.402 17.928 -10.220 1840 2HA GLY 138 HA3 GLY 138 14.378 18.535 -11.891 1841 H LYS 139 HN LYS 139 15.560 15.308 -11.046 1842 HA LYS 139 HA LYS 139 15.159 13.410 -12.232 1843 1HB LYS 139 HB2 LYS 139 13.244 13.775 -10.107 1844 2HB LYS 139 HB3 LYS 139 12.508 12.816 -11.356 1845 1HG LYS 139 HG2 LYS 139 13.574 11.296 -9.928 1846 2HG LYS 139 HG3 LYS 139 14.502 11.343 -11.424 1847 1HD LYS 139 HD2 LYS 139 15.948 13.177 -10.071 1848 2HD LYS 139 HD3 LYS 139 15.278 12.357 -8.672 1849 1HE LYS 139 HE2 LYS 139 16.844 11.060 -10.954 1850 2HE LYS 139 HE3 LYS 139 17.536 11.546 -9.407 1851 1HZ LYS 139 HZ1 LYS 139 15.413 9.493 -9.731 1852 2HZ LYS 139 HZ2 LYS 139 17.003 9.184 -9.482 1853 3HZ LYS 139 HZ3 LYS 139 16.123 9.922 -8.316 Start of MODEL 16 1 1H MET 1 H1 MET 1 -23.069 -12.616 -7.580 2 2H MET 1 H2 MET 1 -24.540 -11.903 -7.324 3 3H MET 1 H3 MET 1 -23.210 -11.000 -7.621 4 HA MET 1 HA MET 1 -24.728 -12.714 -9.437 5 1HB MET 1 HB2 MET 1 -23.755 -9.851 -9.845 6 2HB MET 1 HB3 MET 1 -24.776 -10.795 -10.935 7 1HG MET 1 HG2 MET 1 -25.476 -9.813 -8.142 8 2HG MET 1 HG3 MET 1 -26.145 -9.247 -9.664 9 1HE MET 1 HE1 MET 1 -28.410 -9.543 -8.047 10 2HE MET 1 HE2 MET 1 -28.993 -11.136 -7.512 11 3HE MET 1 HE3 MET 1 -27.517 -10.449 -6.800 12 H ALA 2 HN ALA 2 -21.717 -10.684 -9.788 13 HA ALA 2 HA ALA 2 -20.027 -12.970 -10.198 14 1HB ALA 2 HB1 ALA 2 -19.310 -12.314 -12.488 15 2HB ALA 2 HB2 ALA 2 -21.016 -12.778 -12.507 16 3HB ALA 2 HB3 ALA 2 -20.563 -11.058 -12.538 17 H ILE 3 HN ILE 3 -17.785 -12.044 -10.723 18 HA ILE 3 HA ILE 3 -17.343 -9.519 -9.282 19 HB ILE 3 HB ILE 3 -15.553 -11.823 -10.151 20 1HG1 ILE 3 HG12 ILE 3 -14.690 -11.538 -7.804 21 2HG1 ILE 3 HG13 ILE 3 -15.917 -10.304 -7.536 22 1HG2 ILE 3 HG21 ILE 3 -13.586 -10.428 -9.482 23 2HG2 ILE 3 HG22 ILE 3 -14.349 -9.838 -10.951 24 3HG2 ILE 3 HG23 ILE 3 -14.655 -9.001 -9.416 25 1HD1 ILE 3 HD11 ILE 3 -16.485 -12.369 -6.536 26 2HD1 ILE 3 HD12 ILE 3 -17.680 -11.979 -7.780 27 3HD1 ILE 3 HD13 ILE 3 -16.438 -13.232 -8.095 28 H VAL 4 HN VAL 4 -18.144 -8.003 -10.586 29 HA VAL 4 HA VAL 4 -17.731 -7.963 -13.479 30 HB VAL 4 HB VAL 4 -18.949 -5.944 -11.547 31 1HG1 VAL 4 HG11 VAL 4 -19.263 -6.179 -14.569 32 2HG1 VAL 4 HG12 VAL 4 -20.262 -5.149 -13.528 33 3HG1 VAL 4 HG13 VAL 4 -18.550 -4.816 -13.662 34 1HG2 VAL 4 HG21 VAL 4 -20.318 -8.164 -13.127 35 2HG2 VAL 4 HG22 VAL 4 -20.242 -8.003 -11.357 36 3HG2 VAL 4 HG23 VAL 4 -21.175 -6.850 -12.296 37 H LYS 5 HN LYS 5 -16.834 -5.813 -14.373 38 HA LYS 5 HA LYS 5 -14.481 -5.001 -12.815 39 1HB LYS 5 HB2 LYS 5 -14.092 -6.807 -14.612 40 2HB LYS 5 HB3 LYS 5 -14.259 -5.500 -15.788 41 1HG LYS 5 HG2 LYS 5 -12.414 -4.272 -14.774 42 2HG LYS 5 HG3 LYS 5 -12.350 -5.377 -13.397 43 1HD LYS 5 HD2 LYS 5 -11.724 -6.153 -16.271 44 2HD LYS 5 HD3 LYS 5 -10.531 -5.798 -15.006 45 1HE LYS 5 HE2 LYS 5 -11.396 -7.691 -13.649 46 2HE LYS 5 HE3 LYS 5 -12.575 -8.066 -14.908 47 1HZ LYS 5 HZ1 LYS 5 -10.734 -8.524 -16.419 48 2HZ LYS 5 HZ2 LYS 5 -9.634 -8.181 -15.260 49 3HZ LYS 5 HZ3 LYS 5 -10.624 -9.464 -15.096 50 H ALA 6 HN ALA 6 -14.544 -2.966 -12.478 51 HA ALA 6 HA ALA 6 -16.396 -1.140 -13.817 52 1HB ALA 6 HB1 ALA 6 -15.280 0.445 -12.124 53 2HB ALA 6 HB2 ALA 6 -16.285 -0.824 -11.488 54 3HB ALA 6 HB3 ALA 6 -14.518 -1.003 -11.450 55 H THR 7 HN THR 7 -15.349 1.111 -14.214 56 HA THR 7 HA THR 7 -12.621 1.449 -14.705 57 HB THR 7 HB THR 7 -13.020 0.245 -16.788 58 HG1 THR 7 HG1 THR 7 -12.152 1.755 -18.126 59 1HG2 THR 7 HG21 THR 7 -15.357 0.577 -17.222 60 2HG2 THR 7 HG22 THR 7 -15.145 2.338 -17.390 61 3HG2 THR 7 HG23 THR 7 -14.445 1.225 -18.585 62 H ASP 8 HN ASP 8 -12.754 3.785 -16.081 63 HA ASP 8 HA ASP 8 -12.997 5.669 -14.204 64 1HB ASP 8 HB2 ASP 8 -11.946 6.064 -16.314 65 2HB ASP 8 HB3 ASP 8 -13.485 5.960 -17.169 66 H GLN 9 HN GLN 9 -15.837 4.693 -16.118 67 HA GLN 9 HA GLN 9 -17.533 6.407 -14.407 68 1HB GLN 9 HB2 GLN 9 -17.571 6.128 -17.427 69 2HB GLN 9 HB3 GLN 9 -18.950 6.767 -16.519 70 1HG GLN 9 HG2 GLN 9 -17.729 8.663 -15.735 71 2HG GLN 9 HG3 GLN 9 -16.183 7.968 -16.178 72 1HE2 GLN 9 HE22 GLN 9 -15.255 8.887 -17.913 73 2HE2 GLN 9 HE21 GLN 9 -16.114 9.567 -19.293 74 H SER 10 HN SER 10 -17.240 3.418 -16.373 75 HA SER 10 HA SER 10 -19.747 2.366 -15.786 76 1HB SER 10 HB2 SER 10 -17.203 0.741 -15.974 77 2HB SER 10 HB3 SER 10 -18.851 0.252 -16.404 78 HG SER 10 HG SER 10 -17.725 0.838 -18.275 79 H PHE 11 HN PHE 11 -17.006 2.785 -13.563 80 HA PHE 11 HA PHE 11 -17.729 0.994 -11.495 81 1HB PHE 11 HB2 PHE 11 -15.725 2.339 -11.268 82 2HB PHE 11 HB3 PHE 11 -16.609 3.817 -11.517 83 HD1 PHE 11 HD1 PHE 11 -16.273 0.953 -8.998 84 HD2 PHE 11 HD2 PHE 11 -17.390 5.085 -9.727 85 HE1 PHE 11 HE1 PHE 11 -16.340 1.404 -6.575 86 HE2 PHE 11 HE2 PHE 11 -17.483 5.480 -7.287 87 HZ PHE 11 HZ PHE 11 -16.928 3.642 -5.706 88 H SER 12 HN SER 12 -18.883 4.409 -12.025 89 HA SER 12 HA SER 12 -20.766 4.307 -9.940 90 1HB SER 12 HB2 SER 12 -21.041 5.891 -12.533 91 2HB SER 12 HB3 SER 12 -21.612 6.355 -10.922 92 HG SER 12 HG SER 12 -19.675 7.453 -11.472 93 H ALA 13 HN ALA 13 -21.069 3.605 -13.449 94 HA ALA 13 HA ALA 13 -23.847 3.398 -13.446 95 1HB ALA 13 HB1 ALA 13 -21.901 1.894 -15.248 96 2HB ALA 13 HB2 ALA 13 -23.592 2.291 -15.614 97 3HB ALA 13 HB3 ALA 13 -22.392 3.595 -15.461 98 H GLU 14 HN GLU 14 -21.400 0.905 -12.739 99 HA GLU 14 HA GLU 14 -23.322 -1.204 -12.477 100 1HB GLU 14 HB2 GLU 14 -20.365 -0.963 -11.846 101 2HB GLU 14 HB3 GLU 14 -21.271 -2.422 -11.476 102 1HG GLU 14 HG2 GLU 14 -21.006 -1.194 -14.245 103 2HG GLU 14 HG3 GLU 14 -20.096 -2.578 -13.639 104 H THR 15 HN THR 15 -22.292 1.300 -10.285 105 HA THR 15 HA THR 15 -22.979 -0.370 -7.923 106 HB THR 15 HB THR 15 -21.558 1.250 -6.703 107 HG1 THR 15 HG1 THR 15 -20.680 2.202 -9.175 108 1HG2 THR 15 HG21 THR 15 -19.331 0.793 -7.932 109 2HG2 THR 15 HG22 THR 15 -20.247 -0.610 -7.348 110 3HG2 THR 15 HG23 THR 15 -20.261 -0.175 -9.071 111 H SER 16 HN SER 16 -24.375 2.087 -9.792 112 HA SER 16 HA SER 16 -25.371 3.725 -7.657 113 1HB SER 16 HB2 SER 16 -26.138 3.539 -10.596 114 2HB SER 16 HB3 SER 16 -26.738 4.774 -9.475 115 HG SER 16 HG SER 16 -24.040 4.282 -10.217 116 H GLU 17 HN GLU 17 -26.334 0.600 -8.403 117 HA GLU 17 HA GLU 17 -28.943 1.027 -7.164 118 1HB GLU 17 HB2 GLU 17 -28.538 -0.425 -9.823 119 2HB GLU 17 HB3 GLU 17 -29.990 -0.567 -8.826 120 1HG GLU 17 HG2 GLU 17 -30.356 1.900 -9.051 121 2HG GLU 17 HG3 GLU 17 -28.975 1.980 -10.154 122 H GLY 18 HN GLY 18 -29.646 -0.820 -5.992 123 1HA GLY 18 HA2 GLY 18 -29.463 -2.753 -4.822 124 2HA GLY 18 HA3 GLY 18 -28.271 -3.350 -5.992 125 H VAL 19 HN VAL 19 -27.420 -4.184 -3.883 126 HA VAL 19 HA VAL 19 -25.536 -2.219 -2.669 127 HB VAL 19 HB VAL 19 -26.326 -4.913 -1.465 128 1HG1 VAL 19 HG11 VAL 19 -25.115 -3.969 0.495 129 2HG1 VAL 19 HG12 VAL 19 -24.052 -4.190 -0.896 130 3HG1 VAL 19 HG13 VAL 19 -24.651 -2.568 -0.495 131 1HG2 VAL 19 HG21 VAL 19 -28.260 -3.479 -1.345 132 2HG2 VAL 19 HG22 VAL 19 -27.492 -3.493 0.237 133 3HG2 VAL 19 HG23 VAL 19 -27.273 -2.105 -0.831 134 H VAL 20 HN VAL 20 -23.522 -2.267 -3.225 135 HA VAL 20 HA VAL 20 -22.556 -4.497 -4.907 136 HB VAL 20 HB VAL 20 -22.491 -1.558 -5.730 137 1HG1 VAL 20 HG11 VAL 20 -21.684 -2.537 -7.889 138 2HG1 VAL 20 HG12 VAL 20 -20.574 -2.837 -6.541 139 3HG1 VAL 20 HG13 VAL 20 -21.628 -4.135 -7.110 140 1HG2 VAL 20 HG21 VAL 20 -24.773 -2.218 -5.985 141 2HG2 VAL 20 HG22 VAL 20 -24.049 -2.312 -7.583 142 3HG2 VAL 20 HG23 VAL 20 -24.333 -3.795 -6.661 143 H LEU 21 HN LEU 21 -20.663 -5.052 -4.161 144 HA LEU 21 HA LEU 21 -19.031 -3.198 -2.501 145 1HB LEU 21 HB2 LEU 21 -19.511 -5.477 -1.717 146 2HB LEU 21 HB3 LEU 21 -18.755 -6.161 -3.154 147 HG LEU 21 HG LEU 21 -17.097 -4.260 -1.521 148 1HD1 LEU 21 HD11 LEU 21 -17.922 -7.036 -0.551 149 2HD1 LEU 21 HD12 LEU 21 -16.511 -6.168 0.072 150 3HD1 LEU 21 HD13 LEU 21 -18.124 -5.480 0.288 151 1HD2 LEU 21 HD21 LEU 21 -16.508 -6.971 -2.774 152 2HD2 LEU 21 HD22 LEU 21 -16.147 -5.401 -3.519 153 3HD2 LEU 21 HD23 LEU 21 -15.313 -5.877 -2.041 154 H ALA 22 HN ALA 22 -17.141 -2.222 -3.350 155 HA ALA 22 HA ALA 22 -16.240 -3.219 -5.971 156 1HB ALA 22 HB1 ALA 22 -15.580 -1.010 -6.637 157 2HB ALA 22 HB2 ALA 22 -17.267 -0.925 -6.119 158 3HB ALA 22 HB3 ALA 22 -15.962 -0.351 -5.037 159 H ASP 23 HN ASP 23 -14.023 -3.472 -6.203 160 HA ASP 23 HA ASP 23 -12.278 -3.073 -3.818 161 1HB ASP 23 HB2 ASP 23 -12.988 -5.347 -3.692 162 2HB ASP 23 HB3 ASP 23 -12.748 -5.596 -5.417 163 H PHE 24 HN PHE 24 -10.048 -2.869 -4.383 164 HA PHE 24 HA PHE 24 -9.521 -2.015 -7.195 165 1HB PHE 24 HB2 PHE 24 -8.865 -0.698 -4.543 166 2HB PHE 24 HB3 PHE 24 -8.165 -0.216 -6.061 167 HD1 PHE 24 HD1 PHE 24 -9.136 1.542 -7.225 168 HD2 PHE 24 HD2 PHE 24 -11.602 -0.674 -4.478 169 HE1 PHE 24 HE1 PHE 24 -11.075 3.027 -7.737 170 HE2 PHE 24 HE2 PHE 24 -13.528 0.756 -5.042 171 HZ PHE 24 HZ PHE 24 -13.270 2.627 -6.659 172 H TRP 25 HN TRP 25 -8.006 -3.340 -7.979 173 HA TRP 25 HA TRP 25 -5.959 -4.555 -6.198 174 1HB TRP 25 HB2 TRP 25 -6.335 -6.672 -7.045 175 2HB TRP 25 HB3 TRP 25 -7.964 -6.078 -6.777 176 HD1 TRP 25 HD1 TRP 25 -9.087 -4.959 -9.131 177 HE1 TRP 25 HE1 TRP 25 -8.889 -5.620 -11.564 178 HE3 TRP 25 HE3 TRP 25 -5.036 -8.052 -8.737 179 HZ2 TRP 25 HZ2 TRP 25 -6.987 -7.158 -13.219 180 HZ3 TRP 25 HZ3 TRP 25 -4.012 -9.045 -10.755 181 HH2 TRP 25 HH2 TRP 25 -4.979 -8.596 -13.002 182 H ALA 26 HN ALA 26 -3.944 -5.065 -7.460 183 HA ALA 26 HA ALA 26 -3.883 -4.864 -10.291 184 1HB ALA 26 HB1 ALA 26 -3.827 -2.471 -10.104 185 2HB ALA 26 HB2 ALA 26 -2.740 -2.555 -8.700 186 3HB ALA 26 HB3 ALA 26 -2.146 -2.927 -10.328 187 HA PRO 27 HA PRO 27 -0.464 -7.462 -9.708 188 1HB PRO 27 HB2 PRO 27 1.229 -5.674 -11.460 189 2HB PRO 27 HB3 PRO 27 1.038 -7.455 -11.524 190 1HG PRO 27 HG2 PRO 27 -0.330 -5.876 -13.255 191 2HG PRO 27 HG3 PRO 27 -1.177 -7.248 -12.457 192 1HD PRO 27 HD2 PRO 27 -1.247 -4.326 -11.766 193 2HD PRO 27 HD3 PRO 27 -2.581 -5.517 -11.829 194 H TRP 28 HN TRP 28 0.141 -4.110 -8.811 195 HA TRP 28 HA TRP 28 2.799 -4.155 -8.019 196 1HB TRP 28 HB2 TRP 28 0.687 -2.627 -6.536 197 2HB TRP 28 HB3 TRP 28 2.358 -2.185 -6.835 198 HD1 TRP 28 HD1 TRP 28 -1.006 -1.622 -7.991 199 HE1 TRP 28 HE1 TRP 28 -1.138 -0.271 -10.177 200 HE3 TRP 28 HE3 TRP 28 3.876 -2.024 -9.375 201 HZ2 TRP 28 HZ2 TRP 28 0.711 0.486 -12.286 202 HZ3 TRP 28 HZ3 TRP 28 4.680 -0.984 -11.481 203 HH2 TRP 28 HH2 TRP 28 3.107 0.271 -12.942 204 H CYS 29 HN CYS 29 0.125 -5.702 -6.261 205 HA CYS 29 HA CYS 29 1.979 -6.052 -3.959 206 1HB CYS 29 HB2 CYS 29 -0.195 -4.291 -4.040 207 2HB CYS 29 HB3 CYS 29 -0.865 -5.690 -3.242 208 H GLY 30 HN GLY 30 1.370 -7.696 -2.426 209 1HA GLY 30 HA2 GLY 30 0.716 -10.204 -3.635 210 2HA GLY 30 HA3 GLY 30 0.943 -9.871 -1.913 211 HA PRO 31 HA PRO 31 -3.402 -9.773 -0.984 212 1HB PRO 31 HB2 PRO 31 -3.635 -6.780 -1.285 213 2HB PRO 31 HB3 PRO 31 -4.396 -7.853 -0.060 214 1HG PRO 31 HG2 PRO 31 -2.114 -6.508 0.561 215 2HG PRO 31 HG3 PRO 31 -2.256 -8.242 0.999 216 1HD PRO 31 HD2 PRO 31 -0.808 -6.998 -1.336 217 2HD PRO 31 HD3 PRO 31 -0.287 -8.344 -0.280 218 H SER 32 HN SER 32 -2.663 -7.770 -3.893 219 HA SER 32 HA SER 32 -5.201 -7.878 -5.083 220 1HB SER 32 HB2 SER 32 -2.559 -8.145 -6.566 221 2HB SER 32 HB3 SER 32 -3.993 -7.225 -7.042 222 HG SER 32 HG SER 32 -2.262 -5.957 -6.281 223 H LYS 33 HN LYS 33 -3.094 -10.495 -4.451 224 HA LYS 33 HA LYS 33 -4.703 -12.213 -6.281 225 1HB LYS 33 HB2 LYS 33 -1.945 -12.956 -5.316 226 2HB LYS 33 HB3 LYS 33 -2.974 -13.743 -6.510 227 1HG LYS 33 HG2 LYS 33 -1.506 -12.709 -7.909 228 2HG LYS 33 HG3 LYS 33 -2.772 -11.476 -7.846 229 1HD LYS 33 HD2 LYS 33 -1.449 -10.267 -6.103 230 2HD LYS 33 HD3 LYS 33 -0.223 -11.541 -6.157 231 1HE LYS 33 HE2 LYS 33 0.137 -11.002 -8.604 232 2HE LYS 33 HE3 LYS 33 -0.995 -9.654 -8.429 233 1HZ LYS 33 HZ1 LYS 33 0.514 -8.799 -6.665 234 2HZ LYS 33 HZ2 LYS 33 1.602 -9.968 -7.037 235 3HZ LYS 33 HZ3 LYS 33 1.230 -8.814 -8.134 236 H MET 34 HN MET 34 -4.886 -11.284 -3.241 237 HA MET 34 HA MET 34 -5.533 -14.012 -2.190 238 1HB MET 34 HB2 MET 34 -4.484 -11.668 -0.560 239 2HB MET 34 HB3 MET 34 -4.976 -13.250 0.048 240 1HG MET 34 HG2 MET 34 -3.197 -14.288 -1.411 241 2HG MET 34 HG3 MET 34 -2.611 -12.666 -1.774 242 1HE MET 34 HE1 MET 34 -1.218 -11.458 1.706 243 2HE MET 34 HE2 MET 34 -1.408 -11.070 -0.014 244 3HE MET 34 HE3 MET 34 -2.832 -11.119 1.056 245 H ILE 35 HN ILE 35 -6.283 -10.452 -1.964 246 HA ILE 35 HA ILE 35 -8.889 -10.876 -0.924 247 HB ILE 35 HB ILE 35 -7.366 -8.684 -1.220 248 1HG1 ILE 35 HG12 ILE 35 -9.572 -7.322 -0.919 249 2HG1 ILE 35 HG13 ILE 35 -10.390 -8.888 -0.994 250 1HG2 ILE 35 HG21 ILE 35 -8.228 -7.136 -2.864 251 2HG2 ILE 35 HG22 ILE 35 -7.490 -8.536 -3.653 252 3HG2 ILE 35 HG23 ILE 35 -9.263 -8.386 -3.576 253 1HD1 ILE 35 HD11 ILE 35 -9.803 -8.116 1.336 254 2HD1 ILE 35 HD12 ILE 35 -9.079 -9.686 0.936 255 3HD1 ILE 35 HD13 ILE 35 -8.079 -8.219 0.895 256 H ALA 36 HN ALA 36 -7.502 -10.932 -4.187 257 HA ALA 36 HA ALA 36 -9.814 -10.803 -5.681 258 1HB ALA 36 HB1 ALA 36 -8.478 -12.062 -7.447 259 2HB ALA 36 HB2 ALA 36 -7.717 -10.606 -6.773 260 3HB ALA 36 HB3 ALA 36 -7.163 -12.199 -6.263 261 HA PRO 37 HA PRO 37 -10.489 -15.565 -5.511 262 1HB PRO 37 HB2 PRO 37 -9.246 -16.862 -3.321 263 2HB PRO 37 HB3 PRO 37 -8.806 -16.999 -5.053 264 1HG PRO 37 HG2 PRO 37 -7.555 -15.333 -2.902 265 2HG PRO 37 HG3 PRO 37 -6.776 -16.085 -4.322 266 1HD PRO 37 HD2 PRO 37 -7.334 -13.402 -4.225 267 2HD PRO 37 HD3 PRO 37 -7.399 -14.338 -5.732 268 H VAL 38 HN VAL 38 -9.800 -13.885 -2.394 269 HA VAL 38 HA VAL 38 -11.927 -14.980 -0.910 270 HB VAL 38 HB VAL 38 -10.137 -12.587 -0.803 271 1HG1 VAL 38 HG11 VAL 38 -12.545 -12.813 0.959 272 2HG1 VAL 38 HG12 VAL 38 -11.048 -11.997 1.481 273 3HG1 VAL 38 HG13 VAL 38 -11.899 -11.421 0.049 274 1HG2 VAL 38 HG21 VAL 38 -10.688 -14.851 1.157 275 2HG2 VAL 38 HG22 VAL 38 -9.414 -14.862 -0.082 276 3HG2 VAL 38 HG23 VAL 38 -9.355 -13.678 1.237 277 H LEU 39 HN LEU 39 -11.948 -12.284 -3.265 278 HA LEU 39 HA LEU 39 -14.671 -11.517 -2.690 279 1HB LEU 39 HB2 LEU 39 -12.894 -11.149 -5.135 280 2HB LEU 39 HB3 LEU 39 -14.541 -10.546 -5.072 281 HG LEU 39 HG LEU 39 -12.567 -9.862 -2.847 282 1HD1 LEU 39 HD11 LEU 39 -11.855 -7.892 -3.984 283 2HD1 LEU 39 HD12 LEU 39 -11.447 -9.296 -4.962 284 3HD1 LEU 39 HD13 LEU 39 -12.840 -8.276 -5.420 285 1HD2 LEU 39 HD21 LEU 39 -14.810 -8.164 -3.969 286 2HD2 LEU 39 HD22 LEU 39 -15.045 -9.311 -2.639 287 3HD2 LEU 39 HD23 LEU 39 -13.918 -7.954 -2.459 288 H GLU 40 HN GLU 40 -13.184 -13.760 -5.124 289 HA GLU 40 HA GLU 40 -15.680 -14.369 -6.350 290 1HB GLU 40 HB2 GLU 40 -13.179 -16.074 -6.211 291 2HB GLU 40 HB3 GLU 40 -14.586 -16.319 -7.270 292 1HG GLU 40 HG2 GLU 40 -14.187 -14.132 -8.340 293 2HG GLU 40 HG3 GLU 40 -12.760 -13.886 -7.338 294 H GLU 41 HN GLU 41 -13.971 -15.736 -3.521 295 HA GLU 41 HA GLU 41 -15.925 -17.753 -2.987 296 1HB GLU 41 HB2 GLU 41 -13.780 -16.438 -1.276 297 2HB GLU 41 HB3 GLU 41 -14.815 -17.748 -0.707 298 1HG GLU 41 HG2 GLU 41 -14.020 -19.192 -2.574 299 2HG GLU 41 HG3 GLU 41 -12.898 -17.932 -3.072 300 H LEU 42 HN LEU 42 -15.951 -14.289 -2.432 301 HA LEU 42 HA LEU 42 -18.030 -14.426 -0.368 302 1HB LEU 42 HB2 LEU 42 -16.482 -12.492 -0.436 303 2HB LEU 42 HB3 LEU 42 -16.995 -12.099 -2.068 304 HG LEU 42 HG LEU 42 -19.317 -11.670 -1.260 305 1HD1 LEU 42 HD11 LEU 42 -18.028 -12.102 1.464 306 2HD1 LEU 42 HD12 LEU 42 -19.629 -11.373 1.191 307 3HD1 LEU 42 HD13 LEU 42 -19.356 -13.066 0.778 308 1HD2 LEU 42 HD21 LEU 42 -17.311 -10.047 0.348 309 2HD2 LEU 42 HD22 LEU 42 -17.607 -9.808 -1.395 310 3HD2 LEU 42 HD23 LEU 42 -18.905 -9.556 -0.221 311 H ASP 43 HN ASP 43 -17.815 -13.745 -3.890 312 HA ASP 43 HA ASP 43 -20.619 -13.302 -4.143 313 1HB ASP 43 HB2 ASP 43 -19.060 -12.446 -5.846 314 2HB ASP 43 HB3 ASP 43 -18.425 -14.062 -6.136 315 H GLN 44 HN GLN 44 -18.625 -16.234 -4.504 316 HA GLN 44 HA GLN 44 -20.741 -17.923 -5.399 317 1HB GLN 44 HB2 GLN 44 -18.125 -18.387 -3.938 318 2HB GLN 44 HB3 GLN 44 -19.211 -19.740 -4.322 319 1HG GLN 44 HG2 GLN 44 -19.147 -19.229 -6.687 320 2HG GLN 44 HG3 GLN 44 -18.225 -17.756 -6.393 321 1HE2 GLN 44 HE22 GLN 44 -16.042 -17.969 -5.514 322 2HE2 GLN 44 HE21 GLN 44 -15.078 -19.405 -5.860 323 H GLU 45 HN GLU 45 -20.182 -16.481 -2.290 324 HA GLU 45 HA GLU 45 -21.681 -18.512 -0.884 325 1HB GLU 45 HB2 GLU 45 -19.752 -18.008 0.304 326 2HB GLU 45 HB3 GLU 45 -19.717 -16.364 -0.289 327 1HG GLU 45 HG2 GLU 45 -19.997 -16.145 1.950 328 2HG GLU 45 HG3 GLU 45 -21.518 -15.714 1.203 329 H MET 46 HN MET 46 -21.893 -15.043 -1.589 330 HA MET 46 HA MET 46 -24.802 -15.128 -0.940 331 1HB MET 46 HB2 MET 46 -24.435 -12.986 0.284 332 2HB MET 46 HB3 MET 46 -23.747 -14.418 1.052 333 1HG MET 46 HG2 MET 46 -21.505 -13.816 0.191 334 2HG MET 46 HG3 MET 46 -22.155 -12.410 -0.626 335 1HE MET 46 HE1 MET 46 -24.208 -11.071 1.305 336 2HE MET 46 HE2 MET 46 -23.008 -9.998 2.140 337 3HE MET 46 HE3 MET 46 -22.829 -10.390 0.405 338 H GLY 47 HN GLY 47 -22.992 -14.820 -3.468 339 1HA GLY 47 HA2 GLY 47 -23.600 -12.246 -4.535 340 2HA GLY 47 HA3 GLY 47 -23.257 -13.742 -5.460 341 H ASP 48 HN ASP 48 -25.760 -14.580 -3.646 342 HA ASP 48 HA ASP 48 -27.788 -14.250 -5.664 343 1HB ASP 48 HB2 ASP 48 -27.828 -16.175 -4.146 344 2HB ASP 48 HB3 ASP 48 -27.965 -15.100 -2.753 345 H LYS 49 HN LYS 49 -26.622 -12.352 -2.964 346 HA LYS 49 HA LYS 49 -28.903 -10.527 -3.219 347 1HB LYS 49 HB2 LYS 49 -27.015 -10.570 -0.866 348 2HB LYS 49 HB3 LYS 49 -28.690 -10.038 -0.951 349 1HG LYS 49 HG2 LYS 49 -29.038 -11.933 0.204 350 2HG LYS 49 HG3 LYS 49 -29.090 -12.675 -1.411 351 1HD LYS 49 HD2 LYS 49 -26.976 -13.669 -1.159 352 2HD LYS 49 HD3 LYS 49 -26.437 -12.421 -0.029 353 1HE LYS 49 HE2 LYS 49 -26.612 -14.439 1.184 354 2HE LYS 49 HE3 LYS 49 -27.812 -13.282 1.748 355 1HZ LYS 49 HZ1 LYS 49 -28.379 -15.594 -0.037 356 2HZ LYS 49 HZ2 LYS 49 -28.772 -15.487 1.537 357 3HZ LYS 49 HZ3 LYS 49 -29.499 -14.507 0.461 358 H LEU 50 HN LEU 50 -25.520 -10.815 -3.797 359 HA LEU 50 HA LEU 50 -25.056 -7.900 -3.589 360 1HB LEU 50 HB2 LEU 50 -24.045 -9.180 -1.765 361 2HB LEU 50 HB3 LEU 50 -23.359 -10.327 -2.914 362 HG LEU 50 HG LEU 50 -21.845 -8.559 -3.788 363 1HD1 LEU 50 HD11 LEU 50 -21.564 -6.491 -2.414 364 2HD1 LEU 50 HD12 LEU 50 -23.124 -6.534 -3.221 365 3HD1 LEU 50 HD13 LEU 50 -23.032 -6.922 -1.497 366 1HD2 LEU 50 HD21 LEU 50 -21.141 -10.149 -2.049 367 2HD2 LEU 50 HD22 LEU 50 -20.329 -8.579 -1.916 368 3HD2 LEU 50 HD23 LEU 50 -21.650 -8.989 -0.800 369 H LYS 51 HN LYS 51 -23.655 -6.951 -5.059 370 HA LYS 51 HA LYS 51 -22.679 -8.623 -7.356 371 1HB LYS 51 HB2 LYS 51 -24.378 -6.888 -8.030 372 2HB LYS 51 HB3 LYS 51 -23.342 -5.655 -7.306 373 1HG LYS 51 HG2 LYS 51 -21.497 -6.461 -8.940 374 2HG LYS 51 HG3 LYS 51 -22.767 -7.373 -9.755 375 1HD LYS 51 HD2 LYS 51 -22.640 -4.353 -9.329 376 2HD LYS 51 HD3 LYS 51 -22.280 -5.207 -10.827 377 1HE LYS 51 HE2 LYS 51 -24.629 -5.996 -10.958 378 2HE LYS 51 HE3 LYS 51 -25.002 -5.142 -9.447 379 1HZ LYS 51 HZ1 LYS 51 -25.598 -3.818 -11.381 380 2HZ LYS 51 HZ2 LYS 51 -24.382 -3.069 -10.554 381 3HZ LYS 51 HZ3 LYS 51 -24.051 -3.864 -11.948 382 H ILE 52 HN ILE 52 -20.393 -8.298 -7.823 383 HA ILE 52 HA ILE 52 -18.950 -6.552 -5.910 384 HB ILE 52 HB ILE 52 -18.168 -9.304 -6.937 385 1HG1 ILE 52 HG12 ILE 52 -18.577 -8.214 -4.109 386 2HG1 ILE 52 HG13 ILE 52 -19.680 -9.297 -4.968 387 1HG2 ILE 52 HG21 ILE 52 -16.024 -8.920 -5.704 388 2HG2 ILE 52 HG22 ILE 52 -16.206 -7.839 -7.064 389 3HG2 ILE 52 HG23 ILE 52 -16.512 -7.233 -5.419 390 1HD1 ILE 52 HD11 ILE 52 -16.961 -9.926 -3.828 391 2HD1 ILE 52 HD12 ILE 52 -18.520 -10.726 -3.549 392 3HD1 ILE 52 HD13 ILE 52 -17.676 -10.931 -5.096 393 H VAL 53 HN VAL 53 -17.378 -5.278 -6.936 394 HA VAL 53 HA VAL 53 -17.002 -5.675 -9.846 395 HB VAL 53 HB VAL 53 -17.313 -2.916 -8.607 396 1HG1 VAL 53 HG11 VAL 53 -16.147 -2.975 -10.702 397 2HG1 VAL 53 HG12 VAL 53 -17.423 -3.964 -11.460 398 3HG1 VAL 53 HG13 VAL 53 -17.767 -2.299 -10.963 399 1HG2 VAL 53 HG21 VAL 53 -19.497 -4.016 -8.297 400 2HG2 VAL 53 HG22 VAL 53 -19.579 -2.757 -9.526 401 3HG2 VAL 53 HG23 VAL 53 -19.538 -4.468 -10.006 402 H LYS 54 HN LYS 54 -14.833 -5.241 -10.508 403 HA LYS 54 HA LYS 54 -13.001 -4.299 -8.343 404 1HB LYS 54 HB2 LYS 54 -12.535 -6.405 -10.467 405 2HB LYS 54 HB3 LYS 54 -11.236 -5.644 -9.542 406 1HG LYS 54 HG2 LYS 54 -12.320 -6.377 -7.413 407 2HG LYS 54 HG3 LYS 54 -13.578 -7.186 -8.346 408 1HD LYS 54 HD2 LYS 54 -12.093 -8.908 -7.765 409 2HD LYS 54 HD3 LYS 54 -11.711 -8.535 -9.450 410 1HE LYS 54 HE2 LYS 54 -9.911 -6.885 -8.242 411 2HE LYS 54 HE3 LYS 54 -10.128 -7.991 -6.914 412 1HZ LYS 54 HZ1 LYS 54 -9.550 -9.824 -8.497 413 2HZ LYS 54 HZ2 LYS 54 -9.257 -8.716 -9.663 414 3HZ LYS 54 HZ3 LYS 54 -8.330 -8.737 -8.325 415 H ILE 55 HN ILE 55 -11.340 -2.879 -8.886 416 HA ILE 55 HA ILE 55 -11.397 -1.604 -11.570 417 HB ILE 55 HB ILE 55 -10.930 -0.513 -8.750 418 1HG1 ILE 55 HG12 ILE 55 -13.198 -0.265 -9.792 419 2HG1 ILE 55 HG13 ILE 55 -12.421 1.206 -9.247 420 1HG2 ILE 55 HG21 ILE 55 -8.952 0.110 -9.898 421 2HG2 ILE 55 HG22 ILE 55 -9.827 0.674 -11.312 422 3HG2 ILE 55 HG23 ILE 55 -9.972 1.548 -9.764 423 1HD1 ILE 55 HD11 ILE 55 -12.538 0.321 -12.152 424 2HD1 ILE 55 HD12 ILE 55 -13.507 1.602 -11.375 425 3HD1 ILE 55 HD13 ILE 55 -11.773 1.803 -11.547 426 H ASP 56 HN ASP 56 -9.476 -1.850 -12.610 427 HA ASP 56 HA ASP 56 -7.244 -3.341 -11.324 428 1HB ASP 56 HB2 ASP 56 -8.008 -4.185 -13.485 429 2HB ASP 56 HB3 ASP 56 -7.815 -2.597 -14.214 430 H VAL 57 HN VAL 57 -6.166 -1.823 -10.102 431 HA VAL 57 HA VAL 57 -6.048 0.896 -10.945 432 HB VAL 57 HB VAL 57 -4.907 1.424 -8.946 433 1HG1 VAL 57 HG11 VAL 57 -6.734 0.973 -7.415 434 2HG1 VAL 57 HG12 VAL 57 -7.335 1.358 -9.032 435 3HG1 VAL 57 HG13 VAL 57 -7.320 -0.340 -8.457 436 1HG2 VAL 57 HG21 VAL 57 -5.054 -1.520 -8.231 437 2HG2 VAL 57 HG22 VAL 57 -3.590 -0.523 -8.416 438 3HG2 VAL 57 HG23 VAL 57 -4.723 -0.226 -7.086 439 H ASP 58 HN ASP 58 -4.979 -0.286 -12.943 440 HA ASP 58 HA ASP 58 -2.548 1.294 -13.165 441 1HB ASP 58 HB2 ASP 58 -1.453 -0.815 -12.612 442 2HB ASP 58 HB3 ASP 58 -2.527 -1.718 -13.684 443 H GLU 59 HN GLU 59 -4.848 -1.120 -14.776 444 HA GLU 59 HA GLU 59 -4.613 0.016 -17.380 445 1HB GLU 59 HB2 GLU 59 -5.081 -2.329 -16.857 446 2HB GLU 59 HB3 GLU 59 -6.447 -1.830 -15.845 447 1HG GLU 59 HG2 GLU 59 -7.414 -2.578 -17.711 448 2HG GLU 59 HG3 GLU 59 -7.493 -0.817 -17.794 449 H ASN 60 HN ASN 60 -6.969 0.147 -14.712 450 HA ASN 60 HA ASN 60 -8.257 2.496 -15.940 451 1HB ASN 60 HB2 ASN 60 -10.488 1.598 -15.526 452 2HB ASN 60 HB3 ASN 60 -9.590 0.736 -16.752 453 1HD2 ASN 60 HD22 ASN 60 -10.017 -1.423 -16.691 454 2HD2 ASN 60 HD21 ASN 60 -10.366 -2.335 -15.247 455 H GLN 61 HN GLN 61 -6.414 2.572 -13.979 456 HA GLN 61 HA GLN 61 -7.506 2.646 -11.377 457 1HB GLN 61 HB2 GLN 61 -5.417 3.489 -10.677 458 2HB GLN 61 HB3 GLN 61 -5.081 2.444 -12.054 459 1HG GLN 61 HG2 GLN 61 -4.921 4.466 -13.520 460 2HG GLN 61 HG3 GLN 61 -5.001 5.453 -12.057 461 1HE2 GLN 61 HE22 GLN 61 -3.381 4.460 -10.183 462 2HE2 GLN 61 HE21 GLN 61 -1.769 4.180 -10.767 463 H GLU 62 HN GLU 62 -8.253 4.615 -13.920 464 HA GLU 62 HA GLU 62 -8.049 7.278 -13.125 465 1HB GLU 62 HB2 GLU 62 -9.881 5.652 -14.895 466 2HB GLU 62 HB3 GLU 62 -10.173 7.396 -14.678 467 1HG GLU 62 HG2 GLU 62 -7.843 7.859 -15.427 468 2HG GLU 62 HG3 GLU 62 -7.581 6.133 -15.676 469 H THR 63 HN THR 63 -10.837 4.991 -12.512 470 HA THR 63 HA THR 63 -12.427 6.726 -11.007 471 HB THR 63 HB THR 63 -11.889 3.760 -10.621 472 HG1 THR 63 HG1 THR 63 -13.737 3.642 -12.072 473 1HG2 THR 63 HG21 THR 63 -13.222 4.648 -8.722 474 2HG2 THR 63 HG22 THR 63 -14.397 5.321 -9.879 475 3HG2 THR 63 HG23 THR 63 -14.145 3.560 -9.737 476 H ALA 64 HN ALA 64 -9.548 4.896 -10.065 477 HA ALA 64 HA ALA 64 -10.051 5.043 -7.248 478 1HB ALA 64 HB1 ALA 64 -7.959 3.866 -7.066 479 2HB ALA 64 HB2 ALA 64 -8.757 3.254 -8.524 480 3HB ALA 64 HB3 ALA 64 -7.427 4.386 -8.675 481 H GLY 65 HN GLY 65 -7.305 6.336 -9.144 482 1HA GLY 65 HA2 GLY 65 -6.392 8.379 -7.566 483 2HA GLY 65 HA3 GLY 65 -6.448 8.468 -9.341 484 H LYS 66 HN LYS 66 -9.247 8.667 -9.801 485 HA LYS 66 HA LYS 66 -9.714 11.421 -9.323 486 1HB LYS 66 HB2 LYS 66 -10.643 10.218 -11.215 487 2HB LYS 66 HB3 LYS 66 -11.576 9.162 -10.136 488 1HG LYS 66 HG2 LYS 66 -13.010 11.008 -9.464 489 2HG LYS 66 HG3 LYS 66 -11.978 12.171 -10.316 490 1HD LYS 66 HD2 LYS 66 -13.991 11.704 -11.606 491 2HD LYS 66 HD3 LYS 66 -12.547 11.150 -12.470 492 1HE LYS 66 HE2 LYS 66 -13.031 8.809 -11.574 493 2HE LYS 66 HE3 LYS 66 -14.561 9.439 -10.943 494 1HZ LYS 66 HZ1 LYS 66 -13.712 9.258 -13.780 495 2HZ LYS 66 HZ2 LYS 66 -14.896 8.426 -13.082 496 3HZ LYS 66 HZ3 LYS 66 -15.090 10.048 -13.293 497 H TYR 67 HN TYR 67 -11.007 8.477 -7.615 498 HA TYR 67 HA TYR 67 -12.782 10.013 -6.000 499 1HB TYR 67 HB2 TYR 67 -13.002 7.573 -6.469 500 2HB TYR 67 HB3 TYR 67 -11.579 7.259 -5.492 501 HD1 TYR 67 HD1 TYR 67 -11.678 7.724 -2.962 502 HD2 TYR 67 HD2 TYR 67 -15.170 7.900 -5.495 503 HE1 TYR 67 HE1 TYR 67 -13.115 7.561 -0.970 504 HE2 TYR 67 HE2 TYR 67 -16.624 7.749 -3.495 505 HH TYR 67 HH TYR 67 -15.294 7.549 -0.156 506 H GLY 68 HN GLY 68 -9.416 8.952 -5.711 507 1HA GLY 68 HA2 GLY 68 -7.781 10.149 -4.332 508 2HA GLY 68 HA3 GLY 68 -9.051 10.422 -3.118 509 H VAL 69 HN VAL 69 -7.404 7.792 -4.972 510 HA VAL 69 HA VAL 69 -7.363 5.981 -2.689 511 HB VAL 69 HB VAL 69 -8.701 5.310 -5.360 512 1HG1 VAL 69 HG11 VAL 69 -7.167 3.517 -4.893 513 2HG1 VAL 69 HG12 VAL 69 -7.723 3.431 -3.218 514 3HG1 VAL 69 HG13 VAL 69 -8.811 2.970 -4.559 515 1HG2 VAL 69 HG21 VAL 69 -10.579 4.479 -4.040 516 2HG2 VAL 69 HG22 VAL 69 -9.788 5.060 -2.548 517 3HG2 VAL 69 HG23 VAL 69 -10.302 6.203 -3.806 518 H MET 70 HN MET 70 -5.333 5.107 -2.819 519 HA MET 70 HA MET 70 -3.844 5.209 -5.376 520 1HB MET 70 HB2 MET 70 -2.762 6.415 -2.844 521 2HB MET 70 HB3 MET 70 -2.046 6.490 -4.454 522 1HG MET 70 HG2 MET 70 -4.017 7.923 -5.158 523 2HG MET 70 HG3 MET 70 -4.537 7.921 -3.477 524 1HE MET 70 HE1 MET 70 -1.346 7.986 -2.243 525 2HE MET 70 HE2 MET 70 -1.446 9.684 -1.721 526 3HE MET 70 HE3 MET 70 -2.841 8.607 -1.491 527 H SER 71 HN SER 71 -4.937 3.175 -3.194 528 HA SER 71 HA SER 71 -2.377 1.941 -2.458 529 1HB SER 71 HB2 SER 71 -3.983 1.400 -0.374 530 2HB SER 71 HB3 SER 71 -3.078 2.912 -0.504 531 HG SER 71 HG SER 71 -5.836 2.477 -1.050 532 H ILE 72 HN ILE 72 -2.460 -0.361 -1.868 533 HA ILE 72 HA ILE 72 -4.764 -1.726 -3.096 534 HB ILE 72 HB ILE 72 -2.261 -3.268 -3.034 535 1HG1 ILE 72 HG12 ILE 72 -1.274 -1.133 -3.713 536 2HG1 ILE 72 HG13 ILE 72 -1.136 -2.418 -4.885 537 1HG2 ILE 72 HG21 ILE 72 -3.051 -3.886 -5.340 538 2HG2 ILE 72 HG22 ILE 72 -4.139 -4.303 -4.022 539 3HG2 ILE 72 HG23 ILE 72 -4.486 -2.885 -5.052 540 1HD1 ILE 72 HD11 ILE 72 -2.770 -1.453 -6.331 541 2HD1 ILE 72 HD12 ILE 72 -3.210 -0.200 -5.149 542 3HD1 ILE 72 HD13 ILE 72 -1.593 -0.213 -5.856 543 HA PRO 73 HA PRO 73 -6.044 -3.268 -2.801 544 1HB PRO 73 HB2 PRO 73 -7.851 -4.745 -1.484 545 2HB PRO 73 HB3 PRO 73 -6.363 -5.481 -2.170 546 1HG PRO 73 HG2 PRO 73 -6.959 -4.741 0.685 547 2HG PRO 73 HG3 PRO 73 -6.109 -6.181 0.065 548 1HD PRO 73 HD2 PRO 73 -4.875 -3.830 1.033 549 2HD PRO 73 HD3 PRO 73 -4.082 -5.020 -0.023 550 H THR 74 HN THR 74 -7.581 -1.646 -2.985 551 HA THR 74 HA THR 74 -8.597 -0.418 -0.426 552 HB THR 74 HB THR 74 -8.582 0.852 -3.178 553 HG1 THR 74 HG1 THR 74 -6.583 0.931 -2.368 554 1HG2 THR 74 HG21 THR 74 -9.294 2.865 -1.713 555 2HG2 THR 74 HG22 THR 74 -10.531 1.646 -2.078 556 3HG2 THR 74 HG23 THR 74 -9.741 1.662 -0.495 557 H LEU 75 HN LEU 75 -10.874 -0.263 -0.172 558 HA LEU 75 HA LEU 75 -12.559 -1.844 -2.035 559 1HB LEU 75 HB2 LEU 75 -11.291 -3.200 -0.206 560 2HB LEU 75 HB3 LEU 75 -12.364 -2.420 0.949 561 HG LEU 75 HG LEU 75 -13.314 -3.976 -1.495 562 1HD1 LEU 75 HD11 LEU 75 -12.910 -5.017 1.346 563 2HD1 LEU 75 HD12 LEU 75 -13.696 -5.895 0.019 564 3HD1 LEU 75 HD13 LEU 75 -11.979 -5.496 -0.103 565 1HD2 LEU 75 HD21 LEU 75 -15.105 -2.646 -0.687 566 2HD2 LEU 75 HD22 LEU 75 -15.373 -4.226 0.047 567 3HD2 LEU 75 HD23 LEU 75 -14.674 -2.933 1.022 568 H LEU 76 HN LEU 76 -14.339 -0.717 -2.385 569 HA LEU 76 HA LEU 76 -15.238 1.288 -0.420 570 1HB LEU 76 HB2 LEU 76 -15.549 1.574 -3.436 571 2HB LEU 76 HB3 LEU 76 -16.023 2.715 -2.189 572 HG LEU 76 HG LEU 76 -13.217 2.048 -3.128 573 1HD1 LEU 76 HD11 LEU 76 -13.187 4.386 -3.862 574 2HD1 LEU 76 HD12 LEU 76 -14.527 3.505 -4.609 575 3HD1 LEU 76 HD13 LEU 76 -14.842 4.618 -3.261 576 1HD2 LEU 76 HD21 LEU 76 -13.199 2.497 -0.649 577 2HD2 LEU 76 HD22 LEU 76 -12.374 3.755 -1.579 578 3HD2 LEU 76 HD23 LEU 76 -14.012 4.045 -0.964 579 H VAL 77 HN VAL 77 -17.113 0.363 0.372 580 HA VAL 77 HA VAL 77 -18.675 -1.419 -1.424 581 HB VAL 77 HB VAL 77 -19.265 -0.885 1.492 582 1HG1 VAL 77 HG11 VAL 77 -20.295 -3.144 1.263 583 2HG1 VAL 77 HG12 VAL 77 -20.988 -1.935 0.165 584 3HG1 VAL 77 HG13 VAL 77 -19.859 -3.173 -0.447 585 1HG2 VAL 77 HG21 VAL 77 -18.071 -2.997 2.044 586 2HG2 VAL 77 HG22 VAL 77 -17.391 -3.016 0.409 587 3HG2 VAL 77 HG23 VAL 77 -16.966 -1.713 1.548 588 H LEU 78 HN LEU 78 -20.680 -0.781 -2.201 589 HA LEU 78 HA LEU 78 -21.615 1.935 -1.468 590 1HB LEU 78 HB2 LEU 78 -21.565 0.705 -4.263 591 2HB LEU 78 HB3 LEU 78 -22.176 2.285 -3.816 592 HG LEU 78 HG LEU 78 -19.613 2.493 -2.877 593 1HD1 LEU 78 HD11 LEU 78 -19.351 0.910 -5.467 594 2HD1 LEU 78 HD12 LEU 78 -18.042 1.566 -4.465 595 3HD1 LEU 78 HD13 LEU 78 -19.036 0.232 -3.870 596 1HD2 LEU 78 HD21 LEU 78 -20.792 4.130 -4.315 597 2HD2 LEU 78 HD22 LEU 78 -19.136 3.851 -4.852 598 3HD2 LEU 78 HD23 LEU 78 -20.487 3.107 -5.729 599 H LYS 79 HN LYS 79 -23.893 2.336 -1.948 600 HA LYS 79 HA LYS 79 -25.451 0.082 -2.822 601 1HB LYS 79 HB2 LYS 79 -27.092 0.061 -1.071 602 2HB LYS 79 HB3 LYS 79 -25.511 -0.399 -0.425 603 1HG LYS 79 HG2 LYS 79 -25.296 1.972 0.419 604 2HG LYS 79 HG3 LYS 79 -26.976 2.249 -0.034 605 1HD LYS 79 HD2 LYS 79 -26.036 0.108 1.931 606 2HD LYS 79 HD3 LYS 79 -26.712 1.677 2.383 607 1HE LYS 79 HE2 LYS 79 -28.807 1.170 1.278 608 2HE LYS 79 HE3 LYS 79 -28.185 -0.384 0.705 609 1HZ LYS 79 HZ1 LYS 79 -28.091 -1.166 2.979 610 2HZ LYS 79 HZ2 LYS 79 -28.547 0.306 3.565 611 3HZ LYS 79 HZ3 LYS 79 -29.583 -0.589 2.689 612 H ASP 80 HN ASP 80 -27.085 0.730 -3.952 613 HA ASP 80 HA ASP 80 -28.309 2.018 -5.283 614 1HB ASP 80 HB2 ASP 80 -29.566 1.493 -3.203 615 2HB ASP 80 HB3 ASP 80 -29.182 3.102 -2.590 616 H GLY 81 HN GLY 81 -25.685 3.356 -4.988 617 1HA GLY 81 HA2 GLY 81 -25.676 5.485 -6.502 618 2HA GLY 81 HA3 GLY 81 -26.444 6.224 -5.094 619 H GLU 82 HN GLU 82 -24.749 4.804 -3.057 620 HA GLU 82 HA GLU 82 -22.302 6.384 -3.523 621 1HB GLU 82 HB2 GLU 82 -22.798 7.721 -1.615 622 2HB GLU 82 HB3 GLU 82 -24.266 7.647 -2.629 623 1HG GLU 82 HG2 GLU 82 -25.194 5.897 -1.106 624 2HG GLU 82 HG3 GLU 82 -23.790 6.098 -0.055 625 H VAL 83 HN VAL 83 -20.642 6.182 -1.895 626 HA VAL 83 HA VAL 83 -20.170 3.494 -0.943 627 HB VAL 83 HB VAL 83 -18.730 6.093 -0.271 628 1HG1 VAL 83 HG11 VAL 83 -17.768 3.202 -0.009 629 2HG1 VAL 83 HG12 VAL 83 -16.808 4.650 0.331 630 3HG1 VAL 83 HG13 VAL 83 -18.189 4.260 1.351 631 1HG2 VAL 83 HG21 VAL 83 -18.616 5.660 -2.711 632 2HG2 VAL 83 HG22 VAL 83 -17.048 5.386 -1.951 633 3HG2 VAL 83 HG23 VAL 83 -18.050 4.005 -2.395 634 H VAL 84 HN VAL 84 -20.538 2.647 0.928 635 HA VAL 84 HA VAL 84 -21.663 4.259 3.163 636 HB VAL 84 HB VAL 84 -23.082 2.175 3.594 637 1HG1 VAL 84 HG11 VAL 84 -24.892 3.053 2.307 638 2HG1 VAL 84 HG12 VAL 84 -23.882 4.413 2.768 639 3HG1 VAL 84 HG13 VAL 84 -23.789 3.779 1.111 640 1HG2 VAL 84 HG21 VAL 84 -21.935 0.642 1.921 641 2HG2 VAL 84 HG22 VAL 84 -23.693 0.750 1.742 642 3HG2 VAL 84 HG23 VAL 84 -22.644 1.624 0.625 643 H GLU 85 HN GLU 85 -19.382 1.785 2.124 644 HA GLU 85 HA GLU 85 -18.271 1.972 4.763 645 1HB GLU 85 HB2 GLU 85 -19.274 -0.666 3.652 646 2HB GLU 85 HB3 GLU 85 -17.780 -0.660 4.563 647 1HG GLU 85 HG2 GLU 85 -20.486 0.264 5.581 648 2HG GLU 85 HG3 GLU 85 -19.699 -1.258 5.943 649 H THR 86 HN THR 86 -16.005 1.226 4.783 650 HA THR 86 HA THR 86 -14.714 1.263 2.121 651 HB THR 86 HB THR 86 -13.651 3.257 4.052 652 HG1 THR 86 HG1 THR 86 -15.780 3.815 4.344 653 1HG2 THR 86 HG21 THR 86 -13.378 4.580 2.027 654 2HG2 THR 86 HG22 THR 86 -12.775 2.931 1.772 655 3HG2 THR 86 HG23 THR 86 -14.377 3.404 1.135 656 H SER 87 HN SER 87 -12.569 0.418 2.238 657 HA SER 87 HA SER 87 -11.215 0.152 4.802 658 1HB SER 87 HB2 SER 87 -12.050 -2.284 3.168 659 2HB SER 87 HB3 SER 87 -10.751 -2.308 4.375 660 HG SER 87 HG SER 87 -13.149 -1.166 5.179 661 H VAL 88 HN VAL 88 -8.967 -0.075 4.480 662 HA VAL 88 HA VAL 88 -7.975 0.060 1.694 663 HB VAL 88 HB VAL 88 -7.187 2.083 3.835 664 1HG1 VAL 88 HG11 VAL 88 -6.642 1.769 0.849 665 2HG1 VAL 88 HG12 VAL 88 -6.148 3.187 1.812 666 3HG1 VAL 88 HG13 VAL 88 -5.462 1.596 2.156 667 1HG2 VAL 88 HG21 VAL 88 -9.479 2.627 3.201 668 2HG2 VAL 88 HG22 VAL 88 -8.370 3.770 2.442 669 3HG2 VAL 88 HG23 VAL 88 -9.073 2.454 1.480 670 H GLY 89 HN GLY 89 -7.647 -2.158 2.354 671 1HA GLY 89 HA2 GLY 89 -5.193 -3.048 3.136 672 2HA GLY 89 HA3 GLY 89 -6.035 -2.835 4.682 673 H PHE 90 HN PHE 90 -5.218 -5.393 3.666 674 HA PHE 90 HA PHE 90 -7.448 -6.669 2.371 675 1HB PHE 90 HB2 PHE 90 -6.158 -8.725 2.620 676 2HB PHE 90 HB3 PHE 90 -5.179 -7.430 1.967 677 HD1 PHE 90 HD1 PHE 90 -3.226 -6.575 3.149 678 HD2 PHE 90 HD2 PHE 90 -5.774 -9.562 4.952 679 HE1 PHE 90 HE1 PHE 90 -1.512 -6.994 4.890 680 HE2 PHE 90 HE2 PHE 90 -4.051 -9.973 6.688 681 HZ PHE 90 HZ PHE 90 -1.920 -8.690 6.664 682 H LYS 91 HN LYS 91 -8.706 -8.458 3.288 683 HA LYS 91 HA LYS 91 -8.644 -8.935 6.148 684 1HB LYS 91 HB2 LYS 91 -10.829 -8.263 6.706 685 2HB LYS 91 HB3 LYS 91 -10.015 -6.884 6.023 686 1HG LYS 91 HG2 LYS 91 -11.224 -7.274 3.841 687 2HG LYS 91 HG3 LYS 91 -12.078 -8.626 4.604 688 1HD LYS 91 HD2 LYS 91 -13.568 -6.775 4.761 689 2HD LYS 91 HD3 LYS 91 -12.900 -6.995 6.375 690 1HE LYS 91 HE2 LYS 91 -11.094 -5.205 5.269 691 2HE LYS 91 HE3 LYS 91 -12.578 -4.781 4.412 692 1HZ LYS 91 HZ1 LYS 91 -12.508 -3.462 6.312 693 2HZ LYS 91 HZ2 LYS 91 -13.617 -4.595 6.693 694 3HZ LYS 91 HZ3 LYS 91 -12.109 -4.688 7.331 695 HA PRO 92 HA PRO 92 -9.696 -12.842 4.428 696 1HB PRO 92 HB2 PRO 92 -10.765 -14.232 6.543 697 2HB PRO 92 HB3 PRO 92 -9.046 -13.745 6.464 698 1HG PRO 92 HG2 PRO 92 -11.323 -12.304 7.857 699 2HG PRO 92 HG3 PRO 92 -9.725 -12.758 8.537 700 1HD PRO 92 HD2 PRO 92 -10.165 -10.267 7.572 701 2HD PRO 92 HD3 PRO 92 -8.610 -11.091 7.273 702 H LYS 93 HN LYS 93 -11.565 -14.474 4.218 703 HA LYS 93 HA LYS 93 -13.580 -13.224 2.781 704 1HB LYS 93 HB2 LYS 93 -12.671 -15.814 3.132 705 2HB LYS 93 HB3 LYS 93 -14.247 -15.929 3.893 706 1HG LYS 93 HG2 LYS 93 -13.639 -14.940 1.075 707 2HG LYS 93 HG3 LYS 93 -14.218 -16.544 1.479 708 1HD LYS 93 HD2 LYS 93 -15.782 -13.966 1.965 709 2HD LYS 93 HD3 LYS 93 -15.938 -14.983 0.569 710 1HE LYS 93 HE2 LYS 93 -16.486 -15.949 3.406 711 2HE LYS 93 HE3 LYS 93 -17.719 -15.316 2.318 712 1HZ LYS 93 HZ1 LYS 93 -17.663 -17.716 2.220 713 2HZ LYS 93 HZ2 LYS 93 -17.201 -17.125 0.758 714 3HZ LYS 93 HZ3 LYS 93 -16.094 -17.744 1.805 715 H GLU 94 HN GLU 94 -13.863 -14.556 6.117 716 HA GLU 94 HA GLU 94 -16.590 -13.898 6.391 717 1HB GLU 94 HB2 GLU 94 -14.497 -13.972 8.620 718 2HB GLU 94 HB3 GLU 94 -16.245 -14.117 8.787 719 1HG GLU 94 HG2 GLU 94 -15.769 -16.322 8.881 720 2HG GLU 94 HG3 GLU 94 -15.889 -16.204 7.131 721 H ALA 95 HN ALA 95 -13.661 -11.922 7.017 722 HA ALA 95 HA ALA 95 -15.070 -9.749 8.241 723 1HB ALA 95 HB1 ALA 95 -12.376 -9.806 6.821 724 2HB ALA 95 HB2 ALA 95 -12.951 -8.565 7.964 725 3HB ALA 95 HB3 ALA 95 -12.637 -10.206 8.534 726 H LEU 96 HN LEU 96 -14.210 -10.614 4.915 727 HA LEU 96 HA LEU 96 -14.992 -8.200 3.619 728 1HB LEU 96 HB2 LEU 96 -13.918 -10.656 2.824 729 2HB LEU 96 HB3 LEU 96 -15.546 -10.771 2.201 730 HG LEU 96 HG LEU 96 -15.111 -8.417 1.144 731 1HD1 LEU 96 HD11 LEU 96 -13.098 -7.826 2.387 732 2HD1 LEU 96 HD12 LEU 96 -12.265 -9.297 1.842 733 3HD1 LEU 96 HD13 LEU 96 -12.668 -8.012 0.687 734 1HD2 LEU 96 HD21 LEU 96 -14.072 -11.104 0.307 735 2HD2 LEU 96 HD22 LEU 96 -15.263 -10.064 -0.451 736 3HD2 LEU 96 HD23 LEU 96 -13.551 -9.693 -0.639 737 H GLN 97 HN GLN 97 -16.774 -11.250 4.175 738 HA GLN 97 HA GLN 97 -19.206 -10.276 3.061 739 1HB GLN 97 HB2 GLN 97 -20.003 -12.309 3.345 740 2HB GLN 97 HB3 GLN 97 -18.311 -12.730 3.507 741 1HG GLN 97 HG2 GLN 97 -18.551 -12.813 5.898 742 2HG GLN 97 HG3 GLN 97 -20.277 -12.365 5.756 743 1HE2 GLN 97 HE22 GLN 97 -21.539 -13.850 4.073 744 2HE2 GLN 97 HE21 GLN 97 -21.230 -15.568 4.195 745 H GLU 98 HN GLU 98 -17.930 -10.268 6.418 746 HA GLU 98 HA GLU 98 -20.261 -9.236 7.621 747 1HB GLU 98 HB2 GLU 98 -18.415 -10.147 8.904 748 2HB GLU 98 HB3 GLU 98 -17.332 -8.862 8.337 749 1HG GLU 98 HG2 GLU 98 -18.638 -7.172 9.511 750 2HG GLU 98 HG3 GLU 98 -19.856 -8.370 9.966 751 H LEU 99 HN LEU 99 -17.498 -7.519 6.067 752 HA LEU 99 HA LEU 99 -18.190 -4.943 6.842 753 1HB LEU 99 HB2 LEU 99 -16.050 -5.584 5.742 754 2HB LEU 99 HB3 LEU 99 -16.915 -5.836 4.227 755 HG LEU 99 HG LEU 99 -17.581 -3.408 4.228 756 1HD1 LEU 99 HD11 LEU 99 -16.209 -1.887 5.732 757 2HD1 LEU 99 HD12 LEU 99 -17.488 -2.799 6.539 758 3HD1 LEU 99 HD13 LEU 99 -15.793 -3.317 6.692 759 1HD2 LEU 99 HD21 LEU 99 -15.394 -2.570 3.547 760 2HD2 LEU 99 HD22 LEU 99 -14.597 -3.943 4.338 761 3HD2 LEU 99 HD23 LEU 99 -15.666 -4.213 2.945 762 H VAL 100 HN VAL 100 -19.316 -6.817 4.035 763 HA VAL 100 HA VAL 100 -20.965 -4.547 3.193 764 HB VAL 100 HB VAL 100 -19.832 -5.691 1.560 765 1HG1 VAL 100 HG11 VAL 100 -19.704 -8.001 2.445 766 2HG1 VAL 100 HG12 VAL 100 -21.432 -8.224 2.129 767 3HG1 VAL 100 HG13 VAL 100 -20.293 -7.966 0.790 768 1HG2 VAL 100 HG21 VAL 100 -22.125 -4.720 1.093 769 2HG2 VAL 100 HG22 VAL 100 -21.477 -5.862 -0.092 770 3HG2 VAL 100 HG23 VAL 100 -22.722 -6.393 1.059 771 H ASN 101 HN ASN 101 -21.518 -7.797 4.684 772 HA ASN 101 HA ASN 101 -24.319 -7.864 4.576 773 1HB ASN 101 HB2 ASN 101 -23.094 -9.800 5.134 774 2HB ASN 101 HB3 ASN 101 -22.447 -9.052 6.611 775 1HD2 ASN 101 HD22 ASN 101 -23.791 -8.949 8.481 776 2HD2 ASN 101 HD21 ASN 101 -25.366 -9.694 8.539 777 H LYS 102 HN LYS 102 -22.242 -5.963 6.674 778 HA LYS 102 HA LYS 102 -23.963 -5.207 8.761 779 1HB LYS 102 HB2 LYS 102 -21.689 -3.955 7.240 780 2HB LYS 102 HB3 LYS 102 -22.622 -2.907 8.302 781 1HG LYS 102 HG2 LYS 102 -21.997 -3.982 10.234 782 2HG LYS 102 HG3 LYS 102 -21.670 -5.526 9.440 783 1HD LYS 102 HD2 LYS 102 -19.646 -4.302 10.349 784 2HD LYS 102 HD3 LYS 102 -19.570 -4.859 8.686 785 1HE LYS 102 HE2 LYS 102 -18.609 -2.706 8.690 786 2HE LYS 102 HE3 LYS 102 -20.177 -2.594 7.886 787 1HZ LYS 102 HZ1 LYS 102 -21.063 -1.651 9.977 788 2HZ LYS 102 HZ2 LYS 102 -19.563 -1.691 10.639 789 3HZ LYS 102 HZ3 LYS 102 -19.860 -0.750 9.324 790 H HIS 103 HN HIS 103 -24.059 -4.170 5.343 791 HA HIS 103 HA HIS 103 -26.542 -2.628 5.981 792 1HB HIS 103 HB2 HIS 103 -25.712 -0.802 4.654 793 2HB HIS 103 HB3 HIS 103 -24.501 -1.232 5.870 794 HD1 HIS 103 HD1 HIS 103 -25.132 -1.884 2.101 795 HD2 HIS 103 HD2 HIS 103 -22.080 -1.915 5.001 796 HE1 HIS 103 HE1 HIS 103 -22.949 -2.230 0.860 797 H LEU 104 HN LEU 104 -25.254 -5.078 4.069 798 HA LEU 104 HA LEU 104 -26.806 -4.910 1.618 799 1HB LEU 104 HB2 LEU 104 -24.860 -6.108 1.618 800 2HB LEU 104 HB3 LEU 104 -25.221 -6.928 3.117 801 HG LEU 104 HG LEU 104 -25.192 -8.272 1.111 802 1HD1 LEU 104 HD11 LEU 104 -26.296 -9.058 3.167 803 2HD1 LEU 104 HD12 LEU 104 -27.860 -8.502 2.515 804 3HD1 LEU 104 HD13 LEU 104 -26.951 -9.771 1.688 805 1HD2 LEU 104 HD21 LEU 104 -27.769 -6.843 0.383 806 2HD2 LEU 104 HD22 LEU 104 -26.224 -6.853 -0.502 807 3HD2 LEU 104 HD23 LEU 104 -27.177 -8.321 -0.377 808 1H MET 1 H1 MET 1 9.372 28.983 -11.415 809 2H MET 1 H2 MET 1 8.367 28.535 -12.628 810 3H MET 1 H3 MET 1 8.880 27.431 -11.521 811 HA MET 1 HA MET 1 7.205 29.761 -10.933 812 1HB MET 1 HB2 MET 1 5.319 28.334 -10.621 813 2HB MET 1 HB3 MET 1 5.956 28.057 -12.234 814 1HG MET 1 HG2 MET 1 7.049 25.952 -11.399 815 2HG MET 1 HG3 MET 1 6.331 26.248 -9.810 816 1HE MET 1 HE1 MET 1 6.021 23.498 -11.195 817 2HE MET 1 HE2 MET 1 5.230 23.914 -9.656 818 3HE MET 1 HE3 MET 1 4.288 23.172 -10.968 819 H GLU 2 HN GLU 2 6.888 30.218 -8.752 820 HA GLU 2 HA GLU 2 8.579 28.832 -6.792 821 1HB GLU 2 HB2 GLU 2 6.520 31.075 -6.560 822 2HB GLU 2 HB3 GLU 2 7.454 30.425 -5.204 823 1HG GLU 2 HG2 GLU 2 9.566 31.069 -6.320 824 2HG GLU 2 HG3 GLU 2 8.661 31.731 -7.683 825 H ASN 3 HN ASN 3 7.844 27.466 -5.226 826 HA ASN 3 HA ASN 3 6.774 25.941 -4.164 827 1HB ASN 3 HB2 ASN 3 4.074 26.887 -5.093 828 2HB ASN 3 HB3 ASN 3 4.474 25.651 -3.891 829 1HD2 ASN 3 HD21 ASN 3 5.841 26.440 -1.937 830 2HD2 ASN 3 HD22 ASN 3 5.510 28.047 -1.359 831 H LYS 4 HN LYS 4 6.921 24.077 -4.642 832 HA LYS 4 HA LYS 4 5.832 22.687 -6.963 833 1HB LYS 4 HB2 LYS 4 8.798 22.693 -6.196 834 2HB LYS 4 HB3 LYS 4 8.069 21.663 -7.430 835 1HG LYS 4 HG2 LYS 4 7.602 23.646 -8.833 836 2HG LYS 4 HG3 LYS 4 8.265 24.711 -7.573 837 1HD LYS 4 HD2 LYS 4 10.440 23.560 -7.726 838 2HD LYS 4 HD3 LYS 4 9.812 22.552 -9.051 839 1HE LYS 4 HE2 LYS 4 9.417 24.593 -10.396 840 2HE LYS 4 HE3 LYS 4 10.006 25.598 -9.057 841 1HZ LYS 4 HZ1 LYS 4 12.179 24.638 -9.298 842 2HZ LYS 4 HZ2 LYS 4 11.665 23.575 -10.453 843 3HZ LYS 4 HZ3 LYS 4 11.707 25.174 -10.766 844 H ILE 5 HN ILE 5 5.533 20.399 -6.267 845 HA ILE 5 HA ILE 5 6.160 19.968 -3.386 846 HB ILE 5 HB ILE 5 3.609 19.361 -4.909 847 1HG1 ILE 5 HG12 ILE 5 4.410 21.393 -2.814 848 2HG1 ILE 5 HG13 ILE 5 3.593 21.649 -4.350 849 1HG2 ILE 5 HG21 ILE 5 4.341 18.699 -2.032 850 2HG2 ILE 5 HG22 ILE 5 2.766 18.384 -2.826 851 3HG2 ILE 5 HG23 ILE 5 4.175 17.518 -3.376 852 1HD1 ILE 5 HD11 ILE 5 2.032 22.006 -2.564 853 2HD1 ILE 5 HD12 ILE 5 1.573 20.492 -3.386 854 3HD1 ILE 5 HD13 ILE 5 2.427 20.443 -1.819 855 H ILE 6 HN ILE 6 6.700 17.918 -2.763 856 HA ILE 6 HA ILE 6 6.927 15.762 -4.741 857 HB ILE 6 HB ILE 6 8.904 16.959 -5.194 858 1HG1 ILE 6 HG12 ILE 6 8.941 14.391 -4.914 859 2HG1 ILE 6 HG13 ILE 6 10.385 15.299 -5.246 860 1HG2 ILE 6 HG21 ILE 6 9.242 18.405 -3.353 861 2HG2 ILE 6 HG22 ILE 6 9.483 17.057 -2.233 862 3HG2 ILE 6 HG23 ILE 6 10.689 17.419 -3.479 863 1HD1 ILE 6 HD11 ILE 6 10.797 13.533 -3.634 864 2HD1 ILE 6 HD12 ILE 6 11.146 15.111 -2.930 865 3HD1 ILE 6 HD13 ILE 6 9.651 14.254 -2.485 866 H TYR 7 HN TYR 7 7.112 13.704 -3.742 867 HA TYR 7 HA TYR 7 6.345 13.700 -0.854 868 1HB TYR 7 HB2 TYR 7 4.606 13.534 -2.901 869 2HB TYR 7 HB3 TYR 7 5.135 11.875 -2.933 870 HD1 TYR 7 HD1 TYR 7 3.707 14.547 -0.748 871 HD2 TYR 7 HD2 TYR 7 4.071 10.299 -1.414 872 HE1 TYR 7 HE1 TYR 7 1.881 14.135 0.871 873 HE2 TYR 7 HE2 TYR 7 2.163 9.901 0.091 874 HH TYR 7 HH TYR 7 0.425 12.550 1.768 875 H PHE 8 HN PHE 8 6.959 11.824 0.310 876 HA PHE 8 HA PHE 8 8.597 9.779 -1.126 877 1HB PHE 8 HB2 PHE 8 8.689 10.510 1.825 878 2HB PHE 8 HB3 PHE 8 9.600 9.231 1.050 879 HD1 PHE 8 HD1 PHE 8 11.308 9.888 -0.806 880 HD2 PHE 8 HD2 PHE 8 9.652 12.664 2.038 881 HE1 PHE 8 HE1 PHE 8 13.078 11.514 -1.361 882 HE2 PHE 8 HE2 PHE 8 11.461 14.239 1.531 883 HZ PHE 8 HZ PHE 8 13.178 13.704 -0.136 884 H LEU 9 HN LEU 9 8.060 7.621 -0.736 885 HA LEU 9 HA LEU 9 5.691 7.043 0.984 886 1HB LEU 9 HB2 LEU 9 6.297 6.158 -1.863 887 2HB LEU 9 HB3 LEU 9 5.367 5.132 -0.775 888 HG LEU 9 HG LEU 9 4.571 7.932 -1.662 889 1HD1 LEU 9 HD11 LEU 9 4.456 6.239 -3.439 890 2HD1 LEU 9 HD12 LEU 9 3.615 5.129 -2.375 891 3HD1 LEU 9 HD13 LEU 9 2.809 6.625 -2.900 892 1HD2 LEU 9 HD21 LEU 9 3.132 5.918 0.132 893 2HD2 LEU 9 HD22 LEU 9 3.634 7.569 0.553 894 3HD2 LEU 9 HD23 LEU 9 2.347 7.319 -0.628 895 H SER 10 HN SER 10 6.189 5.575 2.494 896 HA SER 10 HA SER 10 8.260 3.523 1.986 897 1HB SER 10 HB2 SER 10 8.286 5.339 4.411 898 2HB SER 10 HB3 SER 10 9.500 4.139 3.949 899 HG SER 10 HG SER 10 10.210 5.445 2.348 900 H THR 11 HN THR 11 8.323 1.958 3.883 901 HA THR 11 HA THR 11 5.779 1.210 4.857 902 HB THR 11 HB THR 11 8.547 0.381 5.794 903 HG1 THR 11 HG1 THR 11 8.168 -1.282 4.195 904 1HG2 THR 11 HG21 THR 11 7.387 -1.742 6.371 905 2HG2 THR 11 HG22 THR 11 6.756 -0.392 7.307 906 3HG2 THR 11 HG23 THR 11 5.824 -0.993 5.922 907 H GLY 12 HN GLY 12 4.878 3.029 5.881 908 1HA GLY 12 HA2 GLY 12 4.030 3.694 7.940 909 2HA GLY 12 HA3 GLY 12 5.390 2.918 8.748 910 H ASN 13 HN ASN 13 6.133 5.234 6.239 911 HA ASN 13 HA ASN 13 7.733 6.854 6.505 912 1HB ASN 13 HB2 ASN 13 6.533 8.371 5.618 913 2HB ASN 13 HB3 ASN 13 5.079 7.787 6.380 914 1HD2 ASN 13 HD22 ASN 13 8.021 9.774 7.445 915 2HD2 ASN 13 HD21 ASN 13 7.007 10.948 8.237 916 H SER 14 HN SER 14 9.173 6.339 7.656 917 HA SER 14 HA SER 14 9.657 7.326 10.319 918 1HB SER 14 HB2 SER 14 10.208 4.858 10.967 919 2HB SER 14 HB3 SER 14 8.515 5.367 10.999 920 HG SER 14 HG SER 14 8.722 3.377 9.966 921 H ALA 15 HN ALA 15 11.948 6.785 10.737 922 HA ALA 15 HA ALA 15 14.165 6.912 10.163 923 1HB ALA 15 HB1 ALA 15 13.732 4.537 10.418 924 2HB ALA 15 HB2 ALA 15 13.453 4.387 8.671 925 3HB ALA 15 HB3 ALA 15 15.047 4.877 9.311 926 H ARG 16 HN ARG 16 13.906 5.401 7.088 927 HA ARG 16 HA ARG 16 15.405 7.321 5.738 928 1HB ARG 16 HB2 ARG 16 14.089 6.216 3.635 929 2HB ARG 16 HB3 ARG 16 15.468 5.526 4.461 930 1HG ARG 16 HG2 ARG 16 13.864 3.803 4.047 931 2HG ARG 16 HG3 ARG 16 14.093 4.076 5.764 932 1HD ARG 16 HD2 ARG 16 11.913 5.501 5.608 933 2HD ARG 16 HD3 ARG 16 11.662 4.623 4.104 934 HE ARG 16 HE ARG 16 12.415 2.699 5.980 935 1HH1 ARG 16 HH22 ARG 16 9.976 5.181 6.338 936 2HH1 ARG 16 HH21 ARG 16 8.995 4.159 7.367 937 1HH2 ARG 16 HH11 ARG 16 10.994 1.335 7.026 938 2HH2 ARG 16 HH12 ARG 16 9.435 1.952 7.583 939 H SER 17 HN SER 17 11.801 7.341 6.054 940 HA SER 17 HA SER 17 11.448 9.210 3.929 941 1HB SER 17 HB2 SER 17 9.528 9.047 6.225 942 2HB SER 17 HB3 SER 17 9.221 9.071 4.481 943 HG SER 17 HG SER 17 9.724 6.936 4.353 944 H GLN 18 HN GLN 18 11.341 9.653 7.453 945 HA GLN 18 HA GLN 18 11.297 12.362 7.792 946 1HB GLN 18 HB2 GLN 18 12.669 10.102 9.281 947 2HB GLN 18 HB3 GLN 18 12.923 11.741 9.794 948 1HG GLN 18 HG2 GLN 18 11.273 10.623 11.159 949 2HG GLN 18 HG3 GLN 18 10.579 12.016 10.365 950 1HE2 GLN 18 HE22 GLN 18 8.425 10.858 10.979 951 2HE2 GLN 18 HE21 GLN 18 7.916 9.550 9.947 952 H MET 19 HN MET 19 14.087 10.275 7.290 953 HA MET 19 HA MET 19 16.050 12.277 7.581 954 1HB MET 19 HB2 MET 19 16.202 9.711 7.815 955 2HB MET 19 HB3 MET 19 16.239 9.643 6.047 956 1HG MET 19 HG2 MET 19 18.248 11.325 6.357 957 2HG MET 19 HG3 MET 19 18.280 10.682 7.990 958 1HE MET 19 HE1 MET 19 17.359 7.409 7.109 959 2HE MET 19 HE2 MET 19 19.039 6.890 7.365 960 3HE MET 19 HE3 MET 19 18.295 8.078 8.476 961 H ALA 20 HN ALA 20 14.471 10.838 4.683 962 HA ALA 20 HA ALA 20 16.038 12.169 2.712 963 1HB ALA 20 HB1 ALA 20 13.253 11.035 2.477 964 2HB ALA 20 HB2 ALA 20 14.378 11.473 1.161 965 3HB ALA 20 HB3 ALA 20 14.787 10.146 2.247 966 H GLU 21 HN GLU 21 12.984 13.058 4.388 967 HA GLU 21 HA GLU 21 12.749 15.383 2.739 968 1HB GLU 21 HB2 GLU 21 10.848 15.922 3.853 969 2HB GLU 21 HB3 GLU 21 10.881 14.160 3.832 970 1HG GLU 21 HG2 GLU 21 11.219 13.995 6.147 971 2HG GLU 21 HG3 GLU 21 11.682 15.705 6.297 972 H GLY 22 HN GLY 22 14.424 14.837 5.804 973 1HA GLY 22 HA2 GLY 22 15.110 17.604 6.278 974 2HA GLY 22 HA3 GLY 22 15.970 16.165 6.863 975 H TRP 23 HN TRP 23 16.810 14.875 4.619 976 HA TRP 23 HA TRP 23 19.048 16.315 3.679 977 1HB TRP 23 HB2 TRP 23 17.603 13.790 2.847 978 2HB TRP 23 HB3 TRP 23 18.826 14.457 1.779 979 HD1 TRP 23 HD1 TRP 23 18.546 12.116 4.488 980 HE1 TRP 23 HE1 TRP 23 20.801 11.546 5.529 981 HE3 TRP 23 HE3 TRP 23 21.306 15.871 2.414 982 HZ2 TRP 23 HZ2 TRP 23 23.528 12.574 5.417 983 HZ3 TRP 23 HZ3 TRP 23 23.756 15.978 2.787 984 HH2 TRP 23 HH2 TRP 23 24.876 14.335 4.263 985 H ALA 24 HN ALA 24 15.807 15.893 2.208 986 HA ALA 24 HA ALA 24 16.433 17.002 -0.280 987 1HB ALA 24 HB1 ALA 24 13.832 17.104 1.344 988 2HB ALA 24 HB2 ALA 24 13.937 17.554 -0.348 989 3HB ALA 24 HB3 ALA 24 14.278 15.877 0.135 990 H LYS 25 HN LYS 25 15.259 18.651 2.750 991 HA LYS 25 HA LYS 25 14.891 21.058 1.354 992 1HB LYS 25 HB2 LYS 25 14.219 20.112 3.907 993 2HB LYS 25 HB3 LYS 25 15.372 21.396 4.264 994 1HG LYS 25 HG2 LYS 25 13.215 22.423 4.204 995 2HG LYS 25 HG3 LYS 25 14.031 22.898 2.707 996 1HD LYS 25 HD2 LYS 25 12.780 20.902 1.591 997 2HD LYS 25 HD3 LYS 25 11.900 20.759 3.105 998 1HE LYS 25 HE2 LYS 25 10.589 21.968 1.419 999 2HE LYS 25 HE3 LYS 25 10.934 23.014 2.796 1000 1HZ LYS 25 HZ1 LYS 25 12.639 23.068 0.366 1001 2HZ LYS 25 HZ2 LYS 25 11.254 23.917 0.442 1002 3HZ LYS 25 HZ3 LYS 25 12.462 24.220 1.516 1003 H GLN 26 HN GLN 26 17.881 19.796 2.663 1004 HA GLN 26 HA GLN 26 19.145 22.346 2.780 1005 1HB GLN 26 HB2 GLN 26 21.251 21.281 2.899 1006 2HB GLN 26 HB3 GLN 26 20.125 20.419 3.927 1007 1HG GLN 26 HG2 GLN 26 20.355 18.478 2.765 1008 2HG GLN 26 HG3 GLN 26 20.369 19.263 1.186 1009 1HE2 GLN 26 HE22 GLN 26 22.404 18.323 3.960 1010 2HE2 GLN 26 HE21 GLN 26 23.926 18.518 3.130 1011 H TYR 27 HN TYR 27 18.197 20.473 -0.004 1012 HA TYR 27 HA TYR 27 19.768 22.325 -1.718 1013 1HB TYR 27 HB2 TYR 27 20.245 19.537 -1.401 1014 2HB TYR 27 HB3 TYR 27 19.445 19.697 -2.948 1015 HD1 TYR 27 HD1 TYR 27 20.808 20.152 -4.823 1016 HD2 TYR 27 HD2 TYR 27 22.164 21.338 -0.908 1017 HE1 TYR 27 HE1 TYR 27 22.955 20.897 -5.804 1018 HE2 TYR 27 HE2 TYR 27 24.311 22.104 -1.875 1019 HH TYR 27 HH TYR 27 25.590 22.327 -3.814 1020 H LEU 28 HN LEU 28 16.706 21.473 -0.889 1021 HA LEU 28 HA LEU 28 15.556 22.216 -3.526 1022 1HB LEU 28 HB2 LEU 28 14.560 20.190 -1.482 1023 2HB LEU 28 HB3 LEU 28 13.548 20.847 -2.751 1024 HG LEU 28 HG LEU 28 16.194 19.647 -3.553 1025 1HD1 LEU 28 HD11 LEU 28 15.251 17.427 -3.714 1026 2HD1 LEU 28 HD12 LEU 28 15.351 17.980 -2.058 1027 3HD1 LEU 28 HD13 LEU 28 13.763 17.964 -2.868 1028 1HD2 LEU 28 HD21 LEU 28 14.790 20.730 -5.267 1029 2HD2 LEU 28 HD22 LEU 28 14.919 18.986 -5.558 1030 3HD2 LEU 28 HD23 LEU 28 13.440 19.651 -4.850 1031 H GLY 29 HN GLY 29 15.703 24.316 -2.856 1032 1HA GLY 29 HA2 GLY 29 15.392 25.376 -0.273 1033 2HA GLY 29 HA3 GLY 29 15.415 26.280 -1.789 1034 H ASP 30 HN ASP 30 13.927 27.681 -0.476 1035 HA ASP 30 HA ASP 30 11.342 26.965 0.356 1036 1HB ASP 30 HB2 ASP 30 12.487 29.058 0.935 1037 2HB ASP 30 HB3 ASP 30 12.369 29.605 -0.740 1038 H GLU 31 HN GLU 31 12.539 27.366 -2.853 1039 HA GLU 31 HA GLU 31 10.208 27.781 -4.400 1040 1HB GLU 31 HB2 GLU 31 12.451 27.949 -5.273 1041 2HB GLU 31 HB3 GLU 31 12.830 26.288 -4.825 1042 1HG GLU 31 HG2 GLU 31 11.260 25.436 -6.491 1043 2HG GLU 31 HG3 GLU 31 10.804 27.086 -6.948 1044 H TRP 32 HN TRP 32 11.168 25.009 -2.479 1045 HA TRP 32 HA TRP 32 9.163 23.252 -3.807 1046 1HB TRP 32 HB2 TRP 32 11.796 22.533 -2.467 1047 2HB TRP 32 HB3 TRP 32 10.645 21.390 -3.136 1048 HD1 TRP 32 HD1 TRP 32 13.134 24.080 -4.258 1049 HE1 TRP 32 HE1 TRP 32 13.700 23.756 -6.741 1050 HE3 TRP 32 HE3 TRP 32 9.967 20.201 -5.344 1051 HZ2 TRP 32 HZ2 TRP 32 13.219 21.789 -8.768 1052 HZ3 TRP 32 HZ3 TRP 32 10.014 19.150 -7.589 1053 HH2 TRP 32 HH2 TRP 32 11.652 19.904 -9.300 1054 H LYS 33 HN LYS 33 8.076 21.783 -2.473 1055 HA LYS 33 HA LYS 33 8.352 22.014 0.473 1056 1HB LYS 33 HB2 LYS 33 5.769 21.774 -1.138 1057 2HB LYS 33 HB3 LYS 33 5.862 21.632 0.601 1058 1HG LYS 33 HG2 LYS 33 6.653 24.128 -0.965 1059 2HG LYS 33 HG3 LYS 33 5.073 23.875 -0.236 1060 1HD LYS 33 HD2 LYS 33 7.708 24.055 1.295 1061 2HD LYS 33 HD3 LYS 33 6.529 25.353 1.098 1062 1HE LYS 33 HE2 LYS 33 4.799 23.943 2.228 1063 2HE LYS 33 HE3 LYS 33 6.018 22.694 2.506 1064 1HZ LYS 33 HZ1 LYS 33 5.747 24.107 4.437 1065 2HZ LYS 33 HZ2 LYS 33 7.254 24.301 3.853 1066 3HZ LYS 33 HZ3 LYS 33 6.116 25.449 3.595 1067 H VAL 34 HN VAL 34 8.183 20.019 1.474 1068 HA VAL 34 HA VAL 34 8.072 17.636 -0.273 1069 HB VAL 34 HB VAL 34 10.310 18.587 0.168 1070 1HG1 VAL 34 HG11 VAL 34 9.881 17.833 3.075 1071 2HG1 VAL 34 HG12 VAL 34 11.416 18.335 2.334 1072 3HG1 VAL 34 HG13 VAL 34 10.057 19.468 2.427 1073 1HG2 VAL 34 HG21 VAL 34 9.929 15.855 1.444 1074 2HG2 VAL 34 HG22 VAL 34 9.979 16.145 -0.301 1075 3HG2 VAL 34 HG23 VAL 34 11.411 16.486 0.668 1076 H TYR 35 HN TYR 35 7.268 15.725 0.737 1077 HA TYR 35 HA TYR 35 6.471 15.870 3.566 1078 1HB TYR 35 HB2 TYR 35 4.594 16.757 1.935 1079 2HB TYR 35 HB3 TYR 35 4.406 15.071 1.499 1080 HD1 TYR 35 HD1 TYR 35 4.193 17.568 4.235 1081 HD2 TYR 35 HD2 TYR 35 3.294 13.511 3.064 1082 HE1 TYR 35 HE1 TYR 35 2.750 17.322 6.224 1083 HE2 TYR 35 HE2 TYR 35 1.877 13.242 5.071 1084 HH TYR 35 HH TYR 35 1.339 15.907 7.429 1085 H SER 36 HN SER 36 5.730 13.695 4.317 1086 HA SER 36 HA SER 36 6.841 11.419 2.751 1087 1HB SER 36 HB2 SER 36 7.261 12.047 5.714 1088 2HB SER 36 HB3 SER 36 7.795 10.587 4.870 1089 HG SER 36 HG SER 36 8.740 13.209 4.808 1090 H ALA 37 HN ALA 37 5.572 9.563 2.924 1091 HA ALA 37 HA ALA 37 3.531 9.419 5.039 1092 1HB ALA 37 HB1 ALA 37 1.741 9.144 3.432 1093 2HB ALA 37 HB2 ALA 37 2.521 10.700 3.148 1094 3HB ALA 37 HB3 ALA 37 2.878 9.320 2.074 1095 H GLY 38 HN GLY 38 2.210 7.291 4.667 1096 1HA GLY 38 HA2 GLY 38 3.374 5.116 3.245 1097 2HA GLY 38 HA3 GLY 38 3.969 5.138 4.913 1098 H ILE 39 HN ILE 39 2.760 3.005 4.515 1099 HA ILE 39 HA ILE 39 0.117 2.640 4.267 1100 HB ILE 39 HB ILE 39 1.508 0.808 4.154 1101 1HG1 ILE 39 HG12 ILE 39 0.379 0.057 6.839 1102 2HG1 ILE 39 HG13 ILE 39 -0.743 0.542 5.584 1103 1HG2 ILE 39 HG21 ILE 39 2.644 1.483 6.879 1104 2HG2 ILE 39 HG22 ILE 39 2.844 -0.099 6.137 1105 3HG2 ILE 39 HG23 ILE 39 3.462 1.324 5.309 1106 1HD1 ILE 39 HD11 ILE 39 1.249 -1.730 5.342 1107 2HD1 ILE 39 HD12 ILE 39 -0.509 -1.858 5.528 1108 3HD1 ILE 39 HD13 ILE 39 0.166 -1.160 4.043 1109 H GLU 40 HN GLU 40 1.638 2.930 7.497 1110 HA GLU 40 HA GLU 40 -0.959 3.705 8.721 1111 1HB GLU 40 HB2 GLU 40 -0.525 2.124 10.555 1112 2HB GLU 40 HB3 GLU 40 -0.788 1.321 9.015 1113 1HG GLU 40 HG2 GLU 40 1.573 0.796 8.775 1114 2HG GLU 40 HG3 GLU 40 2.001 1.805 10.151 1115 H ALA 41 HN ALA 41 1.203 5.258 7.846 1116 HA ALA 41 HA ALA 41 3.286 5.678 9.729 1117 1HB ALA 41 HB1 ALA 41 2.197 7.291 7.392 1118 2HB ALA 41 HB2 ALA 41 3.774 7.548 8.169 1119 3HB ALA 41 HB3 ALA 41 3.427 6.038 7.281 1120 H HIS 42 HN HIS 42 3.817 7.503 10.849 1121 HA HIS 42 HA HIS 42 3.181 9.954 11.158 1122 1HB HIS 42 HB2 HIS 42 0.773 9.727 11.459 1123 2HB HIS 42 HB3 HIS 42 0.998 8.558 12.767 1124 HD1 HIS 42 HD1 HIS 42 1.698 12.312 12.027 1125 HD2 HIS 42 HD2 HIS 42 1.202 9.570 15.193 1126 HE1 HIS 42 HE1 HIS 42 1.671 13.688 14.175 1127 H GLY 43 HN GLY 43 5.177 10.149 12.149 1128 1HA GLY 43 HA2 GLY 43 5.753 9.133 14.759 1129 2HA GLY 43 HA3 GLY 43 6.403 8.079 13.483 1130 H LEU 44 HN LEU 44 8.252 9.215 15.068 1131 HA LEU 44 HA LEU 44 9.748 10.867 13.220 1132 1HB LEU 44 HB2 LEU 44 8.421 12.562 14.438 1133 2HB LEU 44 HB3 LEU 44 9.062 11.987 15.973 1134 HG LEU 44 HG LEU 44 11.279 12.800 15.446 1135 1HD1 LEU 44 HD11 LEU 44 10.228 13.260 12.629 1136 2HD1 LEU 44 HD12 LEU 44 11.723 13.997 13.246 1137 3HD1 LEU 44 HD13 LEU 44 11.604 12.243 13.128 1138 1HD2 LEU 44 HD21 LEU 44 10.841 15.192 15.113 1139 2HD2 LEU 44 HD22 LEU 44 9.215 14.838 14.507 1140 3HD2 LEU 44 HD23 LEU 44 9.636 14.483 16.199 1141 H ASN 45 HN ASN 45 10.490 8.588 13.400 1142 HA ASN 45 HA ASN 45 11.583 7.303 15.577 1143 1HB ASN 45 HB2 ASN 45 11.238 6.245 13.429 1144 2HB ASN 45 HB3 ASN 45 12.451 7.289 12.668 1145 1HD2 ASN 45 HD22 ASN 45 12.681 4.508 12.319 1146 2HD2 ASN 45 HD21 ASN 45 14.185 4.103 13.119 1147 HA PRO 46 HA PRO 46 14.844 10.189 16.559 1148 1HB PRO 46 HB2 PRO 46 16.173 8.839 18.559 1149 2HB PRO 46 HB3 PRO 46 14.617 9.701 18.760 1150 1HG PRO 46 HG2 PRO 46 15.060 6.745 18.251 1151 2HG PRO 46 HG3 PRO 46 13.992 7.510 19.473 1152 1HD PRO 46 HD2 PRO 46 13.021 6.609 17.110 1153 2HD PRO 46 HD3 PRO 46 12.407 8.132 17.824 1154 H ASN 47 HN ASN 47 15.590 6.854 15.467 1155 HA ASN 47 HA ASN 47 18.411 7.435 15.092 1156 1HB ASN 47 HB2 ASN 47 18.674 5.407 14.233 1157 2HB ASN 47 HB3 ASN 47 17.215 5.125 15.178 1158 1HD2 ASN 47 HD22 ASN 47 18.208 5.888 11.723 1159 2HD2 ASN 47 HD21 ASN 47 17.143 4.621 11.098 1160 H ALA 48 HN ALA 48 15.584 8.436 13.426 1161 HA ALA 48 HA ALA 48 16.979 9.087 10.914 1162 1HB ALA 48 HB1 ALA 48 14.255 10.113 11.748 1163 2HB ALA 48 HB2 ALA 48 14.852 9.597 10.156 1164 3HB ALA 48 HB3 ALA 48 14.478 8.395 11.443 1165 H VAL 49 HN VAL 49 15.659 10.641 13.840 1166 HA VAL 49 HA VAL 49 16.300 13.350 13.138 1167 HB VAL 49 HB VAL 49 16.169 12.128 15.931 1168 1HG1 VAL 49 HG11 VAL 49 17.186 14.382 15.911 1169 2HG1 VAL 49 HG12 VAL 49 15.805 15.010 14.985 1170 3HG1 VAL 49 HG13 VAL 49 15.580 14.425 16.645 1171 1HG2 VAL 49 HG21 VAL 49 13.823 12.898 15.984 1172 2HG2 VAL 49 HG22 VAL 49 13.939 13.403 14.284 1173 3HG2 VAL 49 HG23 VAL 49 14.047 11.689 14.725 1174 H LYS 50 HN LYS 50 18.105 10.896 15.071 1175 HA LYS 50 HA LYS 50 20.493 12.342 15.364 1176 1HB LYS 50 HB2 LYS 50 19.789 10.236 16.537 1177 2HB LYS 50 HB3 LYS 50 20.147 9.324 15.061 1178 1HG LYS 50 HG2 LYS 50 22.512 10.017 15.200 1179 2HG LYS 50 HG3 LYS 50 22.155 11.023 16.616 1180 1HD LYS 50 HD2 LYS 50 21.494 9.056 17.915 1181 2HD LYS 50 HD3 LYS 50 21.722 8.003 16.504 1182 1HE LYS 50 HE2 LYS 50 24.114 8.552 16.439 1183 2HE LYS 50 HE3 LYS 50 23.917 9.686 17.784 1184 1HZ LYS 50 HZ1 LYS 50 23.312 7.811 19.196 1185 2HZ LYS 50 HZ2 LYS 50 23.490 6.756 17.960 1186 3HZ LYS 50 HZ3 LYS 50 24.780 7.565 18.540 1187 H ALA 51 HN ALA 51 19.477 10.145 12.666 1188 HA ALA 51 HA ALA 51 21.800 10.309 11.145 1189 1HB ALA 51 HB1 ALA 51 20.362 9.802 9.203 1190 2HB ALA 51 HB2 ALA 51 19.973 8.788 10.600 1191 3HB ALA 51 HB3 ALA 51 18.921 10.144 10.171 1192 H MET 52 HN MET 52 19.289 12.861 11.544 1193 HA MET 52 HA MET 52 20.480 14.452 9.400 1194 1HB MET 52 HB2 MET 52 18.320 15.190 11.437 1195 2HB MET 52 HB3 MET 52 18.792 16.118 10.023 1196 1HG MET 52 HG2 MET 52 17.201 13.604 10.176 1197 2HG MET 52 HG3 MET 52 16.871 15.078 9.294 1198 1HE MET 52 HE1 MET 52 18.164 15.772 7.115 1199 2HE MET 52 HE2 MET 52 19.822 15.372 7.643 1200 3HE MET 52 HE3 MET 52 19.173 14.685 6.140 1201 H LYS 53 HN LYS 53 20.400 14.447 12.991 1202 HA LYS 53 HA LYS 53 21.876 16.850 13.303 1203 1HB LYS 53 HB2 LYS 53 21.890 14.351 15.060 1204 2HB LYS 53 HB3 LYS 53 22.503 15.924 15.555 1205 1HG LYS 53 HG2 LYS 53 19.602 15.411 14.779 1206 2HG LYS 53 HG3 LYS 53 20.213 15.330 16.425 1207 1HD LYS 53 HD2 LYS 53 20.750 17.687 16.428 1208 2HD LYS 53 HD3 LYS 53 20.392 17.830 14.688 1209 1HE LYS 53 HE2 LYS 53 18.063 17.267 15.035 1210 2HE LYS 53 HE3 LYS 53 18.333 16.917 16.745 1211 1HZ LYS 53 HZ1 LYS 53 17.355 19.146 16.121 1212 2HZ LYS 53 HZ2 LYS 53 18.597 19.179 17.205 1213 3HZ LYS 53 HZ3 LYS 53 18.850 19.601 15.643 1214 H GLU 54 HN GLU 54 22.966 13.590 12.432 1215 HA GLU 54 HA GLU 54 25.731 13.899 12.920 1216 1HB GLU 54 HB2 GLU 54 24.199 12.318 10.821 1217 2HB GLU 54 HB3 GLU 54 25.944 12.246 10.970 1218 1HG GLU 54 HG2 GLU 54 24.862 11.831 13.611 1219 2HG GLU 54 HG3 GLU 54 23.950 10.834 12.485 1220 H VAL 55 HN VAL 55 23.735 15.214 10.321 1221 HA VAL 55 HA VAL 55 26.150 16.396 9.050 1222 HB VAL 55 HB VAL 55 24.845 16.371 6.971 1223 1HG1 VAL 55 HG11 VAL 55 26.388 14.510 7.615 1224 2HG1 VAL 55 HG12 VAL 55 25.001 13.607 8.263 1225 3HG1 VAL 55 HG13 VAL 55 25.091 13.995 6.541 1226 1HG2 VAL 55 HG21 VAL 55 22.532 16.381 7.990 1227 2HG2 VAL 55 HG22 VAL 55 22.763 15.165 6.734 1228 3HG2 VAL 55 HG23 VAL 55 22.767 14.678 8.436 1229 H GLY 56 HN GLY 56 24.272 17.316 11.355 1230 1HA GLY 56 HA2 GLY 56 23.697 19.350 12.171 1231 2HA GLY 56 HA3 GLY 56 24.578 20.082 10.820 1232 H ILE 57 HN ILE 57 21.641 17.933 10.685 1233 HA ILE 57 HA ILE 57 20.059 20.275 9.709 1234 HB ILE 57 HB ILE 57 20.042 17.407 8.706 1235 1HG1 ILE 57 HG12 ILE 57 20.548 20.049 7.271 1236 2HG1 ILE 57 HG13 ILE 57 21.786 18.889 7.742 1237 1HG2 ILE 57 HG21 ILE 57 17.694 18.182 8.916 1238 2HG2 ILE 57 HG22 ILE 57 18.097 19.671 8.029 1239 3HG2 ILE 57 HG23 ILE 57 18.146 18.096 7.228 1240 1HD1 ILE 57 HD11 ILE 57 20.722 17.178 6.244 1241 2HD1 ILE 57 HD12 ILE 57 19.644 18.463 5.634 1242 3HD1 ILE 57 HD13 ILE 57 21.389 18.600 5.426 1243 H ASP 58 HN ASP 58 17.865 20.234 10.509 1244 HA ASP 58 HA ASP 58 17.441 18.494 12.897 1245 1HB ASP 58 HB2 ASP 58 18.021 20.709 13.711 1246 2HB ASP 58 HB3 ASP 58 16.876 21.467 12.593 1247 H ILE 59 HN ILE 59 15.453 17.680 13.100 1248 HA ILE 59 HA ILE 59 13.237 18.549 11.361 1249 HB ILE 59 HB ILE 59 12.706 16.235 10.775 1250 1HG1 ILE 59 HG12 ILE 59 15.526 15.440 11.673 1251 2HG1 ILE 59 HG13 ILE 59 14.098 15.171 12.667 1252 1HG2 ILE 59 HG21 ILE 59 14.281 15.986 8.924 1253 2HG2 ILE 59 HG22 ILE 59 13.927 17.700 9.193 1254 3HG2 ILE 59 HG23 ILE 59 15.463 17.013 9.755 1255 1HD1 ILE 59 HD11 ILE 59 13.101 13.755 10.922 1256 2HD1 ILE 59 HD12 ILE 59 14.559 13.956 9.915 1257 3HD1 ILE 59 HD13 ILE 59 14.661 13.134 11.477 1258 H SER 60 HN SER 60 14.070 18.514 14.366 1259 HA SER 60 HA SER 60 12.605 16.477 15.616 1260 1HB SER 60 HB2 SER 60 13.509 19.136 16.796 1261 2HB SER 60 HB3 SER 60 13.183 17.633 17.680 1262 HG SER 60 HG SER 60 15.287 18.280 15.902 1263 H ASN 61 HN ASN 61 10.990 18.356 13.812 1264 HA ASN 61 HA ASN 61 8.618 18.734 15.474 1265 1HB ASN 61 HB2 ASN 61 9.834 20.882 15.552 1266 2HB ASN 61 HB3 ASN 61 9.994 20.884 13.799 1267 1HD2 ASN 61 HD22 ASN 61 8.393 21.906 12.618 1268 2HD2 ASN 61 HD21 ASN 61 6.881 22.467 13.282 1269 H GLN 62 HN GLN 62 9.994 17.483 12.608 1270 HA GLN 62 HA GLN 62 8.424 18.478 10.589 1271 1HB GLN 62 HB2 GLN 62 9.068 16.785 9.206 1272 2HB GLN 62 HB3 GLN 62 10.445 17.287 10.172 1273 1HG GLN 62 HG2 GLN 62 10.463 15.234 11.380 1274 2HG GLN 62 HG3 GLN 62 8.827 14.799 10.870 1275 1HE2 GLN 62 HE22 GLN 62 11.997 15.633 9.339 1276 2HE2 GLN 62 HE21 GLN 62 11.909 14.401 8.106 1277 H THR 63 HN THR 63 6.596 17.840 9.547 1278 HA THR 63 HA THR 63 4.473 16.436 10.944 1279 HB THR 63 HB THR 63 3.416 16.763 8.560 1280 HG1 THR 63 HG1 THR 63 5.305 17.233 7.414 1281 1HG2 THR 63 HG21 THR 63 2.844 18.151 10.514 1282 2HG2 THR 63 HG22 THR 63 4.268 19.175 10.229 1283 3HG2 THR 63 HG23 THR 63 2.940 19.134 9.045 1284 H SER 64 HN SER 64 3.429 14.471 10.147 1285 HA SER 64 HA SER 64 4.539 12.759 8.132 1286 1HB SER 64 HB2 SER 64 5.155 12.278 11.081 1287 2HB SER 64 HB3 SER 64 5.029 10.930 9.946 1288 HG SER 64 HG SER 64 6.632 13.184 9.375 1289 H ASP 65 HN ASP 65 2.992 10.994 7.780 1290 HA ASP 65 HA ASP 65 0.614 10.646 9.354 1291 1HB ASP 65 HB2 ASP 65 0.277 13.018 8.469 1292 2HB ASP 65 HB3 ASP 65 0.348 12.343 6.837 1293 H ILE 66 HN ILE 66 -1.068 9.349 7.942 1294 HA ILE 66 HA ILE 66 0.198 7.380 6.287 1295 HB ILE 66 HB ILE 66 -2.204 6.800 5.761 1296 1HG1 ILE 66 HG12 ILE 66 -2.895 8.918 7.831 1297 2HG1 ILE 66 HG13 ILE 66 -3.133 9.112 6.089 1298 1HG2 ILE 66 HG21 ILE 66 -2.593 5.808 7.944 1299 2HG2 ILE 66 HG22 ILE 66 -0.885 5.758 7.522 1300 3HG2 ILE 66 HG23 ILE 66 -1.466 6.960 8.703 1301 1HD1 ILE 66 HD11 ILE 66 -4.477 7.094 7.915 1302 2HD1 ILE 66 HD12 ILE 66 -5.213 8.488 7.111 1303 3HD1 ILE 66 HD13 ILE 66 -4.647 7.112 6.137 1304 H ILE 67 HN ILE 67 -0.605 6.937 3.990 1305 HA ILE 67 HA ILE 67 -0.008 8.977 2.237 1306 HB ILE 67 HB ILE 67 -0.627 7.681 0.513 1307 1HG1 ILE 67 HG12 ILE 67 -2.801 6.235 2.068 1308 2HG1 ILE 67 HG13 ILE 67 -3.048 7.545 0.908 1309 1HG2 ILE 67 HG21 ILE 67 0.122 5.441 0.903 1310 2HG2 ILE 67 HG22 ILE 67 0.989 6.493 2.021 1311 3HG2 ILE 67 HG23 ILE 67 -0.364 5.485 2.604 1312 1HD1 ILE 67 HD11 ILE 67 -1.878 6.086 -0.830 1313 2HD1 ILE 67 HD12 ILE 67 -2.174 4.735 0.298 1314 3HD1 ILE 67 HD13 ILE 67 -3.535 5.696 -0.365 1315 H ASP 68 HN ASP 68 -1.018 10.671 1.339 1316 HA ASP 68 HA ASP 68 -3.944 11.010 1.709 1317 1HB ASP 68 HB2 ASP 68 -2.864 12.062 3.653 1318 2HB ASP 68 HB3 ASP 68 -1.920 13.091 2.576 1319 H SER 69 HN SER 69 -4.478 10.911 -0.317 1320 HA SER 69 HA SER 69 -3.240 11.749 -2.602 1321 1HB SER 69 HB2 SER 69 -6.203 11.998 -1.996 1322 2HB SER 69 HB3 SER 69 -5.454 11.650 -3.570 1323 HG SER 69 HG SER 69 -4.723 9.674 -2.673 1324 H ASP 70 HN ASP 70 -4.673 13.922 -0.176 1325 HA ASP 70 HA ASP 70 -5.314 16.070 -1.937 1326 1HB ASP 70 HB2 ASP 70 -6.120 15.901 0.395 1327 2HB ASP 70 HB3 ASP 70 -4.466 16.155 0.976 1328 H ILE 71 HN ILE 71 -2.275 14.861 -0.744 1329 HA ILE 71 HA ILE 71 -0.848 17.283 -1.771 1330 HB ILE 71 HB ILE 71 0.140 15.277 0.226 1331 1HG1 ILE 71 HG12 ILE 71 -0.258 17.714 1.644 1332 2HG1 ILE 71 HG13 ILE 71 -1.737 17.517 0.705 1333 1HG2 ILE 71 HG21 ILE 71 1.929 16.517 -0.885 1334 2HG2 ILE 71 HG22 ILE 71 1.178 18.057 -0.400 1335 3HG2 ILE 71 HG23 ILE 71 1.806 16.934 0.833 1336 1HD1 ILE 71 HD11 ILE 71 -1.981 15.220 1.576 1337 2HD1 ILE 71 HD12 ILE 71 -0.464 15.433 2.503 1338 3HD1 ILE 71 HD13 ILE 71 -1.899 16.419 2.894 1339 H LEU 72 HN LEU 72 -0.803 13.624 -1.536 1340 HA LEU 72 HA LEU 72 1.472 13.373 -3.200 1341 1HB LEU 72 HB2 LEU 72 0.446 11.544 -1.839 1342 2HB LEU 72 HB3 LEU 72 -0.822 11.387 -3.047 1343 HG LEU 72 HG LEU 72 2.150 11.146 -3.706 1344 1HD1 LEU 72 HD11 LEU 72 2.149 8.837 -3.462 1345 2HD1 LEU 72 HD12 LEU 72 1.319 9.389 -2.007 1346 3HD1 LEU 72 HD13 LEU 72 0.390 8.718 -3.363 1347 1HD2 LEU 72 HD21 LEU 72 -0.381 10.540 -5.254 1348 2HD2 LEU 72 HD22 LEU 72 1.132 11.304 -5.799 1349 3HD2 LEU 72 HD23 LEU 72 1.067 9.573 -5.567 1350 H ASN 73 HN ASN 73 -2.059 13.370 -4.150 1351 HA ASN 73 HA ASN 73 -1.439 13.027 -6.893 1352 1HB ASN 73 HB2 ASN 73 -3.619 12.910 -7.237 1353 2HB ASN 73 HB3 ASN 73 -3.817 12.965 -5.504 1354 1HD2 ASN 73 HD22 ASN 73 -4.156 15.237 -4.554 1355 2HD2 ASN 73 HD21 ASN 73 -4.980 16.431 -5.542 1356 H ASN 74 HN ASN 74 -1.322 15.866 -4.857 1357 HA ASN 74 HA ASN 74 -1.256 17.754 -7.076 1358 1HB ASN 74 HB2 ASN 74 -1.247 17.972 -4.067 1359 2HB ASN 74 HB3 ASN 74 -0.557 19.289 -4.989 1360 1HD2 ASN 74 HD22 ASN 74 -3.394 18.488 -3.543 1361 2HD2 ASN 74 HD21 ASN 74 -4.490 19.351 -4.601 1362 H ALA 75 HN ALA 75 1.081 15.839 -5.282 1363 HA ALA 75 HA ALA 75 3.350 17.440 -5.611 1364 1HB ALA 75 HB1 ALA 75 3.250 14.399 -5.693 1365 2HB ALA 75 HB2 ALA 75 4.623 15.427 -5.259 1366 3HB ALA 75 HB3 ALA 75 3.203 15.381 -4.206 1367 H ASP 76 HN ASP 76 5.142 17.080 -6.994 1368 HA ASP 76 HA ASP 76 4.435 16.693 -9.865 1369 1HB ASP 76 HB2 ASP 76 5.787 18.655 -9.251 1370 2HB ASP 76 HB3 ASP 76 7.000 17.608 -8.504 1371 H LEU 77 HN LEU 77 6.221 15.144 -7.204 1372 HA LEU 77 HA LEU 77 6.860 12.845 -8.889 1373 1HB LEU 77 HB2 LEU 77 8.866 14.207 -9.069 1374 2HB LEU 77 HB3 LEU 77 8.837 14.553 -7.344 1375 HG LEU 77 HG LEU 77 9.311 12.104 -6.896 1376 1HD1 LEU 77 HD11 LEU 77 8.566 11.318 -9.237 1377 2HD1 LEU 77 HD12 LEU 77 10.176 11.870 -9.753 1378 3HD1 LEU 77 HD13 LEU 77 10.023 10.607 -8.524 1379 1HD2 LEU 77 HD21 LEU 77 11.708 12.245 -7.527 1380 2HD2 LEU 77 HD22 LEU 77 11.337 13.679 -8.493 1381 3HD2 LEU 77 HD23 LEU 77 11.099 13.697 -6.725 1382 H VAL 78 HN VAL 78 6.837 10.939 -7.770 1383 HA VAL 78 HA VAL 78 6.726 10.975 -4.792 1384 HB VAL 78 HB VAL 78 5.500 8.862 -6.562 1385 1HG1 VAL 78 HG11 VAL 78 5.294 9.523 -3.583 1386 2HG1 VAL 78 HG12 VAL 78 4.370 8.270 -4.424 1387 3HG1 VAL 78 HG13 VAL 78 6.126 8.120 -4.285 1388 1HG2 VAL 78 HG21 VAL 78 4.176 11.288 -5.274 1389 2HG2 VAL 78 HG22 VAL 78 4.204 10.818 -6.989 1390 3HG2 VAL 78 HG23 VAL 78 3.313 9.834 -5.846 1391 H VAL 79 HN VAL 79 8.668 10.566 -4.088 1392 HA VAL 79 HA VAL 79 10.498 8.769 -5.555 1393 HB VAL 79 HB VAL 79 10.747 10.431 -3.015 1394 1HG1 VAL 79 HG11 VAL 79 12.121 8.419 -2.701 1395 2HG1 VAL 79 HG12 VAL 79 12.789 8.587 -4.324 1396 3HG1 VAL 79 HG13 VAL 79 13.181 9.783 -3.072 1397 1HG2 VAL 79 HG21 VAL 79 10.838 11.722 -5.105 1398 2HG2 VAL 79 HG22 VAL 79 12.424 11.684 -4.331 1399 3HG2 VAL 79 HG23 VAL 79 12.103 10.645 -5.737 1400 H THR 80 HN THR 80 9.793 6.648 -5.382 1401 HA THR 80 HA THR 80 8.600 5.647 -2.915 1402 HB THR 80 HB THR 80 10.118 3.984 -4.956 1403 HG1 THR 80 HG1 THR 80 7.828 5.453 -5.212 1404 1HG2 THR 80 HG21 THR 80 7.716 3.354 -3.200 1405 2HG2 THR 80 HG22 THR 80 8.478 2.257 -4.390 1406 3HG2 THR 80 HG23 THR 80 9.376 2.770 -2.955 1407 H LEU 81 HN LEU 81 9.689 5.101 -1.048 1408 HA LEU 81 HA LEU 81 12.650 5.166 -1.112 1409 1HB LEU 81 HB2 LEU 81 11.525 7.434 -0.752 1410 2HB LEU 81 HB3 LEU 81 10.873 6.780 0.731 1411 HG LEU 81 HG LEU 81 13.492 6.152 1.145 1412 1HD1 LEU 81 HD11 LEU 81 14.984 7.865 0.290 1413 2HD1 LEU 81 HD12 LEU 81 14.200 7.077 -1.089 1414 3HD1 LEU 81 HD13 LEU 81 13.653 8.677 -0.557 1415 1HD2 LEU 81 HD21 LEU 81 13.678 8.228 2.393 1416 2HD2 LEU 81 HD22 LEU 81 12.268 8.904 1.547 1417 3HD2 LEU 81 HD23 LEU 81 12.083 7.486 2.607 1418 H SER 82 HN SER 82 12.025 2.735 -0.836 1419 HA SER 82 HA SER 82 12.793 2.165 1.815 1420 1HB SER 82 HB2 SER 82 10.898 0.634 2.453 1421 2HB SER 82 HB3 SER 82 10.426 2.334 2.433 1422 HG SER 82 HG SER 82 8.935 0.847 1.362 1423 H GLY 83 HN GLY 83 11.070 0.696 -0.919 1424 1HA GLY 83 HA2 GLY 83 11.935 -0.802 -2.547 1425 2HA GLY 83 HA3 GLY 83 13.319 -1.161 -1.486 1426 H ASP 84 HN ASP 84 9.977 -0.809 -0.257 1427 HA ASP 84 HA ASP 84 9.860 -3.700 0.274 1428 1HB ASP 84 HB2 ASP 84 10.993 -2.820 2.178 1429 2HB ASP 84 HB3 ASP 84 9.908 -1.432 2.266 1430 H ALA 85 HN ALA 85 7.947 -4.468 -0.192 1431 HA ALA 85 HA ALA 85 5.743 -2.950 -1.104 1432 1HB ALA 85 HB1 ALA 85 5.973 -5.860 -0.208 1433 2HB ALA 85 HB2 ALA 85 4.625 -5.186 -1.131 1434 3HB ALA 85 HB3 ALA 85 6.242 -5.233 -1.856 1435 H ALA 86 HN ALA 86 6.604 -3.779 2.210 1436 HA ALA 86 HA ALA 86 3.958 -3.826 3.298 1437 1HB ALA 86 HB1 ALA 86 5.923 -4.578 4.591 1438 2HB ALA 86 HB2 ALA 86 6.545 -2.920 4.606 1439 3HB ALA 86 HB3 ALA 86 5.039 -3.294 5.448 1440 H ASP 87 HN ASP 87 5.689 -1.221 1.814 1441 HA ASP 87 HA ASP 87 4.498 0.995 3.106 1442 1HB ASP 87 HB2 ASP 87 5.310 2.269 1.353 1443 2HB ASP 87 HB3 ASP 87 6.471 0.959 1.502 1444 H LYS 88 HN LYS 88 2.885 -1.400 1.346 1445 HA LYS 88 HA LYS 88 0.615 -1.654 1.173 1446 1HB LYS 88 HB2 LYS 88 0.264 0.630 2.363 1447 2HB LYS 88 HB3 LYS 88 0.082 1.295 0.741 1448 1HG LYS 88 HG2 LYS 88 -1.821 -0.246 0.350 1449 2HG LYS 88 HG3 LYS 88 -1.607 -0.948 1.949 1450 1HD LYS 88 HD2 LYS 88 -2.195 2.009 1.438 1451 2HD LYS 88 HD3 LYS 88 -3.453 0.787 1.629 1452 1HE LYS 88 HE2 LYS 88 -1.378 1.378 3.756 1453 2HE LYS 88 HE3 LYS 88 -2.943 2.185 3.665 1454 1HZ LYS 88 HZ1 LYS 88 -4.052 0.081 3.978 1455 2HZ LYS 88 HZ2 LYS 88 -2.638 -0.751 3.993 1456 3HZ LYS 88 HZ3 LYS 88 -3.007 0.309 5.187 1457 H CYS 89 HN CYS 89 2.933 -1.011 -0.797 1458 HA CYS 89 HA CYS 89 3.409 -0.732 -2.928 1459 1HB CYS 89 HB2 CYS 89 0.998 -2.400 -3.621 1460 2HB CYS 89 HB3 CYS 89 2.550 -2.347 -4.433 1461 HA PRO 90 HA PRO 90 -0.376 2.169 -3.222 1462 1HB PRO 90 HB2 PRO 90 1.755 4.298 -3.344 1463 2HB PRO 90 HB3 PRO 90 0.151 4.400 -2.570 1464 1HG PRO 90 HG2 PRO 90 2.282 3.972 -0.993 1465 2HG PRO 90 HG3 PRO 90 0.824 2.961 -0.773 1466 1HD PRO 90 HD2 PRO 90 3.319 2.305 -2.375 1467 2HD PRO 90 HD3 PRO 90 2.533 1.351 -1.095 1468 H MET 91 HN MET 91 -1.284 2.635 -5.238 1469 HA MET 91 HA MET 91 0.461 2.135 -7.506 1470 1HB MET 91 HB2 MET 91 -1.673 2.161 -8.830 1471 2HB MET 91 HB3 MET 91 -1.503 0.947 -7.594 1472 1HG MET 91 HG2 MET 91 -3.636 1.714 -7.314 1473 2HG MET 91 HG3 MET 91 -2.814 2.544 -6.037 1474 1HE MET 91 HE1 MET 91 -5.555 2.921 -7.592 1475 2HE MET 91 HE2 MET 91 -4.957 3.533 -6.057 1476 3HE MET 91 HE3 MET 91 -5.714 4.672 -7.286 1477 H THR 92 HN THR 92 -0.064 5.034 -5.944 1478 HA THR 92 HA THR 92 0.250 7.185 -6.528 1479 HB THR 92 HB THR 92 2.250 7.515 -8.042 1480 HG1 THR 92 HG1 THR 92 1.856 5.495 -9.154 1481 1HG2 THR 92 HG21 THR 92 3.842 6.590 -6.422 1482 2HG2 THR 92 HG22 THR 92 2.462 7.316 -5.584 1483 3HG2 THR 92 HG23 THR 92 2.574 5.552 -5.729 1484 HA PRO 93 HA PRO 93 -2.733 7.167 -9.922 1485 1HB PRO 93 HB2 PRO 93 -3.906 9.644 -9.506 1486 2HB PRO 93 HB3 PRO 93 -4.280 8.177 -8.540 1487 1HG PRO 93 HG2 PRO 93 -2.309 10.361 -7.828 1488 2HG PRO 93 HG3 PRO 93 -3.624 9.657 -6.828 1489 1HD PRO 93 HD2 PRO 93 -1.104 8.758 -6.587 1490 2HD PRO 93 HD3 PRO 93 -2.450 7.576 -6.610 1491 HA PRO 94 HA PRO 94 0.084 8.684 -12.842 1492 1HB PRO 94 HB2 PRO 94 -1.447 8.918 -15.170 1493 2HB PRO 94 HB3 PRO 94 -0.874 7.396 -14.431 1494 1HG PRO 94 HG2 PRO 94 -3.557 8.760 -14.047 1495 2HG PRO 94 HG3 PRO 94 -3.233 7.037 -14.443 1496 1HD PRO 94 HD2 PRO 94 -3.714 7.747 -11.903 1497 2HD PRO 94 HD3 PRO 94 -2.367 6.617 -12.264 1498 H HIS 95 HN HIS 95 -1.935 10.956 -11.606 1499 HA HIS 95 HA HIS 95 -1.434 13.194 -13.362 1500 1HB HIS 95 HB2 HIS 95 -1.997 13.222 -10.374 1501 2HB HIS 95 HB3 HIS 95 -2.290 14.516 -11.529 1502 HD1 HIS 95 HD1 HIS 95 -4.105 13.220 -13.683 1503 HD2 HIS 95 HD2 HIS 95 -4.260 12.276 -9.582 1504 HE1 HIS 95 HE1 HIS 95 -6.394 12.187 -13.269 1505 H VAL 96 HN VAL 96 0.704 11.296 -11.500 1506 HA VAL 96 HA VAL 96 2.575 13.559 -10.994 1507 HB VAL 96 HB VAL 96 2.165 11.163 -9.160 1508 1HG1 VAL 96 HG11 VAL 96 3.384 13.924 -8.815 1509 2HG1 VAL 96 HG12 VAL 96 3.102 12.804 -7.471 1510 3HG1 VAL 96 HG13 VAL 96 4.227 12.379 -8.765 1511 1HG2 VAL 96 HG21 VAL 96 0.726 13.837 -8.922 1512 2HG2 VAL 96 HG22 VAL 96 -0.032 12.238 -9.169 1513 3HG2 VAL 96 HG23 VAL 96 0.804 12.575 -7.677 1514 H LYS 97 HN LYS 97 4.839 13.018 -11.088 1515 HA LYS 97 HA LYS 97 5.556 10.690 -12.743 1516 1HB LYS 97 HB2 LYS 97 6.446 13.086 -12.967 1517 2HB LYS 97 HB3 LYS 97 7.343 12.804 -11.477 1518 1HG LYS 97 HG2 LYS 97 7.693 10.635 -13.464 1519 2HG LYS 97 HG3 LYS 97 8.124 12.207 -14.125 1520 1HD LYS 97 HD2 LYS 97 9.151 11.105 -11.516 1521 2HD LYS 97 HD3 LYS 97 9.986 10.866 -13.048 1522 1HE LYS 97 HE2 LYS 97 9.486 13.537 -11.656 1523 2HE LYS 97 HE3 LYS 97 11.037 12.700 -11.821 1524 1HZ LYS 97 HZ1 LYS 97 10.854 14.468 -13.433 1525 2HZ LYS 97 HZ2 LYS 97 10.879 13.042 -14.235 1526 3HZ LYS 97 HZ3 LYS 97 9.480 13.866 -14.057 1527 H ARG 98 HN ARG 98 7.249 9.126 -11.907 1528 HA ARG 98 HA ARG 98 7.623 9.082 -8.988 1529 1HB ARG 98 HB2 ARG 98 5.428 7.902 -9.448 1530 2HB ARG 98 HB3 ARG 98 6.304 6.789 -10.502 1531 1HG ARG 98 HG2 ARG 98 7.735 6.203 -8.402 1532 2HG ARG 98 HG3 ARG 98 6.517 7.109 -7.478 1533 1HD ARG 98 HD2 ARG 98 4.774 5.647 -8.417 1534 2HD ARG 98 HD3 ARG 98 5.978 4.741 -9.340 1535 HE ARG 98 HE ARG 98 6.991 4.492 -6.879 1536 1HH1 ARG 98 HH11 ARG 98 3.588 4.150 -7.815 1537 2HH1 ARG 98 HH12 ARG 98 3.239 2.982 -6.600 1538 1HH2 ARG 98 HH21 ARG 98 6.517 3.029 -5.248 1539 2HH2 ARG 98 HH22 ARG 98 4.961 2.270 -5.143 1540 H GLU 99 HN GLU 99 9.483 7.914 -8.413 1541 HA GLU 99 HA GLU 99 10.587 5.939 -10.157 1542 1HB GLU 99 HB2 GLU 99 11.554 8.036 -11.166 1543 2HB GLU 99 HB3 GLU 99 12.345 8.387 -9.628 1544 1HG GLU 99 HG2 GLU 99 13.724 6.426 -9.786 1545 2HG GLU 99 HG3 GLU 99 12.712 5.711 -11.038 1546 H HIS 100 HN HIS 100 12.045 4.591 -8.898 1547 HA HIS 100 HA HIS 100 11.665 4.947 -6.001 1548 1HB HIS 100 HB2 HIS 100 13.019 2.593 -7.341 1549 2HB HIS 100 HB3 HIS 100 12.150 2.628 -5.817 1550 HD1 HIS 100 HD1 HIS 100 9.272 3.627 -6.801 1551 HD2 HIS 100 HD2 HIS 100 11.784 0.917 -8.825 1552 HE1 HIS 100 HE1 HIS 100 7.774 2.278 -8.358 1553 H TRP 101 HN TRP 101 13.329 5.364 -4.590 1554 HA TRP 101 HA TRP 101 16.128 5.288 -5.630 1555 1HB TRP 101 HB2 TRP 101 14.844 7.629 -4.187 1556 2HB TRP 101 HB3 TRP 101 16.547 7.468 -4.523 1557 HD1 TRP 101 HD1 TRP 101 13.243 8.125 -6.385 1558 HE1 TRP 101 HE1 TRP 101 13.751 9.443 -8.501 1559 HE3 TRP 101 HE3 TRP 101 18.347 7.680 -6.406 1560 HZ2 TRP 101 HZ2 TRP 101 16.090 10.388 -9.907 1561 HZ3 TRP 101 HZ3 TRP 101 19.691 8.812 -8.169 1562 HH2 TRP 101 HH2 TRP 101 18.574 10.189 -9.904 1563 H GLY 102 HN GLY 102 13.938 4.810 -2.902 1564 1HA GLY 102 HA2 GLY 102 16.241 4.652 -1.019 1565 2HA GLY 102 HA3 GLY 102 14.551 4.590 -0.572 1566 H PHE 103 HN PHE 103 16.671 2.772 0.160 1567 HA PHE 103 HA PHE 103 15.544 0.186 -0.454 1568 1HB PHE 103 HB2 PHE 103 16.999 0.678 -2.459 1569 2HB PHE 103 HB3 PHE 103 18.369 0.869 -1.376 1570 HD1 PHE 103 HD1 PHE 103 15.631 -1.614 -2.179 1571 HD2 PHE 103 HD2 PHE 103 19.767 -1.020 -1.091 1572 HE1 PHE 103 HE1 PHE 103 16.022 -4.061 -2.313 1573 HE2 PHE 103 HE2 PHE 103 20.151 -3.465 -1.232 1574 HZ PHE 103 HZ PHE 103 18.281 -4.992 -1.837 1575 H ASP 104 HN ASP 104 16.873 -1.457 0.837 1576 HA ASP 104 HA ASP 104 17.800 -2.205 2.758 1577 1HB ASP 104 HB2 ASP 104 19.739 -1.662 1.386 1578 2HB ASP 104 HB3 ASP 104 19.810 -0.040 2.079 1579 H ASP 105 HN ASP 105 15.703 -0.801 3.396 1580 HA ASP 105 HA ASP 105 15.589 1.480 4.757 1581 1HB ASP 105 HB2 ASP 105 13.674 0.215 4.169 1582 2HB ASP 105 HB3 ASP 105 14.101 -1.089 5.275 1583 HA PRO 106 HA PRO 106 18.184 0.664 8.344 1584 1HB PRO 106 HB2 PRO 106 18.348 3.192 9.401 1585 2HB PRO 106 HB3 PRO 106 19.226 2.662 7.934 1586 1HG PRO 106 HG2 PRO 106 16.649 4.208 8.086 1587 2HG PRO 106 HG3 PRO 106 18.051 4.493 7.027 1588 1HD PRO 106 HD2 PRO 106 15.772 3.097 6.272 1589 2HD PRO 106 HD3 PRO 106 17.361 2.761 5.553 1590 H ALA 107 HN ALA 107 14.823 1.785 8.532 1591 HA ALA 107 HA ALA 107 14.527 1.564 11.353 1592 1HB ALA 107 HB1 ALA 107 12.779 2.535 9.851 1593 2HB ALA 107 HB2 ALA 107 12.529 0.933 9.132 1594 3HB ALA 107 HB3 ALA 107 12.137 1.223 10.836 1595 H ARG 108 HN ARG 108 15.717 -0.695 9.304 1596 HA ARG 108 HA ARG 108 14.481 -3.083 10.647 1597 1HB ARG 108 HB2 ARG 108 15.560 -3.169 7.852 1598 2HB ARG 108 HB3 ARG 108 14.412 -4.254 8.616 1599 1HG ARG 108 HG2 ARG 108 13.889 -1.389 7.714 1600 2HG ARG 108 HG3 ARG 108 13.438 -2.809 6.803 1601 1HD ARG 108 HD2 ARG 108 12.354 -2.617 9.605 1602 2HD ARG 108 HD3 ARG 108 11.744 -1.443 8.445 1603 HE ARG 108 HE ARG 108 11.181 -4.284 8.491 1604 1HH1 ARG 108 HH11 ARG 108 11.269 -1.328 6.422 1605 2HH1 ARG 108 HH12 ARG 108 10.079 -2.011 5.320 1606 1HH2 ARG 108 HH21 ARG 108 9.562 -5.021 6.918 1607 2HH2 ARG 108 HH22 ARG 108 9.166 -3.946 5.587 1608 H ALA 109 HN ALA 109 17.132 -1.369 10.776 1609 HA ALA 109 HA ALA 109 19.370 -2.944 10.287 1610 1HB ALA 109 HB1 ALA 109 19.274 -0.601 11.295 1611 2HB ALA 109 HB2 ALA 109 18.797 -1.363 12.830 1612 3HB ALA 109 HB3 ALA 109 20.378 -1.729 12.115 1613 H GLN 110 HN GLN 110 20.517 -4.372 11.661 1614 HA GLN 110 HA GLN 110 19.034 -6.573 12.376 1615 1HB GLN 110 HB2 GLN 110 21.436 -6.727 11.892 1616 2HB GLN 110 HB3 GLN 110 21.821 -5.739 13.306 1617 1HG GLN 110 HG2 GLN 110 22.365 -8.079 13.694 1618 2HG GLN 110 HG3 GLN 110 21.171 -7.487 14.832 1619 1HE2 GLN 110 HE22 GLN 110 18.916 -8.218 14.618 1620 2HE2 GLN 110 HE21 GLN 110 18.595 -9.748 13.816 1621 H GLY 111 HN GLY 111 20.259 -3.997 14.520 1622 1HA GLY 111 HA2 GLY 111 18.305 -3.440 15.995 1623 2HA GLY 111 HA3 GLY 111 18.529 -5.105 16.647 1624 H THR 112 HN THR 112 21.526 -4.602 16.321 1625 HA THR 112 HA THR 112 21.958 -3.876 19.085 1626 HB THR 112 HB THR 112 24.318 -4.237 18.570 1627 HG1 THR 112 HG1 THR 112 24.862 -4.755 16.391 1628 1HG2 THR 112 HG21 THR 112 24.257 -6.513 17.858 1629 2HG2 THR 112 HG22 THR 112 22.738 -6.220 18.743 1630 3HG2 THR 112 HG23 THR 112 22.746 -6.271 16.953 1631 H GLU 113 HN GLU 113 23.548 -2.127 19.657 1632 HA GLU 113 HA GLU 113 22.581 0.335 18.758 1633 1HB GLU 113 HB2 GLU 113 25.246 -0.388 20.092 1634 2HB GLU 113 HB3 GLU 113 24.579 1.260 20.020 1635 1HG GLU 113 HG2 GLU 113 22.547 0.436 21.259 1636 2HG GLU 113 HG3 GLU 113 23.331 -1.136 21.430 1637 H GLU 114 HN GLU 114 25.429 -1.558 17.836 1638 HA GLU 114 HA GLU 114 26.606 0.415 16.140 1639 1HB GLU 114 HB2 GLU 114 27.916 -1.641 15.326 1640 2HB GLU 114 HB3 GLU 114 28.149 -1.111 17.006 1641 1HG GLU 114 HG2 GLU 114 26.540 -2.918 17.714 1642 2HG GLU 114 HG3 GLU 114 26.495 -3.437 16.009 1643 H GLU 115 HN GLU 115 24.311 -2.432 15.609 1644 HA GLU 115 HA GLU 115 24.712 -2.120 12.773 1645 1HB GLU 115 HB2 GLU 115 22.752 -3.723 14.403 1646 2HB GLU 115 HB3 GLU 115 22.767 -3.713 12.638 1647 1HG GLU 115 HG2 GLU 115 25.346 -4.280 14.159 1648 2HG GLU 115 HG3 GLU 115 24.148 -5.551 13.930 1649 H LYS 116 HN LYS 116 22.289 -0.950 15.132 1650 HA LYS 116 HA LYS 116 20.562 0.323 13.258 1651 1HB LYS 116 HB2 LYS 116 21.376 0.979 16.131 1652 2HB LYS 116 HB3 LYS 116 20.208 1.967 15.262 1653 1HG LYS 116 HG2 LYS 116 19.715 -1.000 15.473 1654 2HG LYS 116 HG3 LYS 116 19.422 0.056 16.867 1655 1HD LYS 116 HD2 LYS 116 17.897 1.473 15.555 1656 2HD LYS 116 HD3 LYS 116 18.274 0.578 14.085 1657 1HE LYS 116 HE2 LYS 116 16.164 -0.182 14.851 1658 2HE LYS 116 HE3 LYS 116 17.337 -1.481 15.105 1659 1HZ LYS 116 HZ1 LYS 116 17.395 -0.859 17.468 1660 2HZ LYS 116 HZ2 LYS 116 16.328 0.355 17.211 1661 3HZ LYS 116 HZ3 LYS 116 15.863 -1.190 17.018 1662 H TRP 117 HN TRP 117 23.469 1.612 14.911 1663 HA TRP 117 HA TRP 117 23.253 4.089 13.519 1664 1HB TRP 117 HB2 TRP 117 24.602 3.680 15.604 1665 2HB TRP 117 HB3 TRP 117 25.815 2.883 14.603 1666 HD1 TRP 117 HD1 TRP 117 24.559 5.710 12.638 1667 HE1 TRP 117 HE1 TRP 117 26.009 7.818 12.904 1668 HE3 TRP 117 HE3 TRP 117 27.295 4.291 16.740 1669 HZ2 TRP 117 HZ2 TRP 117 27.964 8.793 14.745 1670 HZ3 TRP 117 HZ3 TRP 117 28.934 5.859 17.753 1671 HH2 TRP 117 HH2 TRP 117 29.278 8.121 16.771 1672 H ALA 118 HN ALA 118 25.088 1.125 12.832 1673 HA ALA 118 HA ALA 118 26.471 1.997 10.580 1674 1HB ALA 118 HB1 ALA 118 26.624 -0.478 10.077 1675 2HB ALA 118 HB2 ALA 118 26.914 -0.138 11.803 1676 3HB ALA 118 HB3 ALA 118 25.348 -0.758 11.289 1677 H PHE 119 HN PHE 119 23.178 0.560 10.721 1678 HA PHE 119 HA PHE 119 22.841 0.583 7.869 1679 1HB PHE 119 HB2 PHE 119 21.009 0.316 10.242 1680 2HB PHE 119 HB3 PHE 119 20.314 0.702 8.689 1681 HD1 PHE 119 HD1 PHE 119 19.395 -1.072 7.527 1682 HD2 PHE 119 HD2 PHE 119 22.967 -1.756 9.861 1683 HE1 PHE 119 HE1 PHE 119 19.380 -3.450 6.871 1684 HE2 PHE 119 HE2 PHE 119 22.939 -4.135 9.198 1685 HZ PHE 119 HZ PHE 119 21.144 -4.995 7.703 1686 H PHE 120 HN PHE 120 21.899 2.954 10.481 1687 HA PHE 120 HA PHE 120 20.713 4.629 8.473 1688 1HB PHE 120 HB2 PHE 120 20.051 6.069 10.058 1689 2HB PHE 120 HB3 PHE 120 20.114 4.543 10.923 1690 HD1 PHE 120 HD1 PHE 120 22.315 7.571 10.308 1691 HD2 PHE 120 HD2 PHE 120 20.719 4.709 13.119 1692 HE1 PHE 120 HE1 PHE 120 23.421 8.756 12.160 1693 HE2 PHE 120 HE2 PHE 120 21.787 5.947 14.978 1694 HZ PHE 120 HZ PHE 120 23.177 7.957 14.489 1695 H GLN 121 HN GLN 121 24.021 4.469 9.721 1696 HA GLN 121 HA GLN 121 24.941 6.947 8.675 1697 1HB GLN 121 HB2 GLN 121 26.131 5.639 10.343 1698 2HB GLN 121 HB3 GLN 121 26.353 4.299 9.211 1699 1HG GLN 121 HG2 GLN 121 27.754 5.712 7.761 1700 2HG GLN 121 HG3 GLN 121 27.492 7.101 8.833 1701 1HE2 GLN 121 HE22 GLN 121 27.975 6.388 11.347 1702 2HE2 GLN 121 HE21 GLN 121 29.531 5.624 11.541 1703 H ARG 122 HN ARG 122 24.967 3.593 7.343 1704 HA ARG 122 HA ARG 122 26.115 4.249 4.851 1705 1HB ARG 122 HB2 ARG 122 25.963 1.978 5.759 1706 2HB ARG 122 HB3 ARG 122 24.197 2.026 5.710 1707 1HG ARG 122 HG2 ARG 122 24.219 2.053 3.255 1708 2HG ARG 122 HG3 ARG 122 25.987 2.178 3.250 1709 1HD ARG 122 HD2 ARG 122 25.306 -0.105 2.784 1710 2HD ARG 122 HD3 ARG 122 26.172 -0.039 4.315 1711 HE ARG 122 HE ARG 122 23.223 -0.428 3.903 1712 1HH1 ARG 122 HH11 ARG 122 25.944 -0.620 6.212 1713 2HH1 ARG 122 HH12 ARG 122 25.051 -1.571 7.339 1714 1HH2 ARG 122 HH21 ARG 122 22.118 -1.564 5.295 1715 2HH2 ARG 122 HH22 ARG 122 22.732 -2.109 6.841 1716 H VAL 123 HN VAL 123 22.659 3.957 5.837 1717 HA VAL 123 HA VAL 123 21.668 4.610 3.252 1718 HB VAL 123 HB VAL 123 20.370 4.619 5.997 1719 1HG1 VAL 123 HG11 VAL 123 18.196 4.533 4.690 1720 2HG1 VAL 123 HG12 VAL 123 19.033 6.078 4.602 1721 3HG1 VAL 123 HG13 VAL 123 19.112 4.940 3.236 1722 1HG2 VAL 123 HG21 VAL 123 20.087 2.642 3.681 1723 2HG2 VAL 123 HG22 VAL 123 21.216 2.395 5.019 1724 3HG2 VAL 123 HG23 VAL 123 19.494 2.463 5.344 1725 H ARG 124 HN ARG 124 22.387 6.812 6.105 1726 HA ARG 124 HA ARG 124 21.079 8.977 4.836 1727 1HB ARG 124 HB2 ARG 124 22.110 10.469 6.355 1728 2HB ARG 124 HB3 ARG 124 21.652 9.010 7.224 1729 1HG ARG 124 HG2 ARG 124 23.970 8.291 7.311 1730 2HG ARG 124 HG3 ARG 124 24.492 9.677 6.347 1731 1HD ARG 124 HD2 ARG 124 23.836 11.220 8.124 1732 2HD ARG 124 HD3 ARG 124 23.063 9.915 9.022 1733 HE ARG 124 HE ARG 124 25.039 9.476 10.031 1734 1HH1 ARG 124 HH11 ARG 124 25.942 11.019 6.936 1735 2HH1 ARG 124 HH12 ARG 124 27.625 11.005 7.308 1736 1HH2 ARG 124 HH21 ARG 124 27.133 9.524 10.513 1737 2HH2 ARG 124 HH22 ARG 124 28.354 10.098 9.399 1738 H ASP 125 HN ASP 125 24.423 7.836 4.519 1739 HA ASP 125 HA ASP 125 25.373 9.979 2.898 1740 1HB ASP 125 HB2 ASP 125 26.877 8.297 3.834 1741 2HB ASP 125 HB3 ASP 125 26.112 7.026 2.876 1742 H GLU 126 HN GLU 126 23.701 6.923 2.017 1743 HA GLU 126 HA GLU 126 23.715 7.355 -0.796 1744 1HB GLU 126 HB2 GLU 126 23.285 5.196 0.509 1745 2HB GLU 126 HB3 GLU 126 21.672 5.797 0.847 1746 1HG GLU 126 HG2 GLU 126 21.456 4.333 -0.991 1747 2HG GLU 126 HG3 GLU 126 21.272 5.954 -1.651 1748 H ILE 127 HN ILE 127 21.076 7.916 1.617 1749 HA ILE 127 HA ILE 127 19.191 8.949 -0.186 1750 HB ILE 127 HB ILE 127 19.572 9.135 2.818 1751 1HG1 ILE 127 HG12 ILE 127 17.580 7.791 0.930 1752 2HG1 ILE 127 HG13 ILE 127 18.839 7.005 1.876 1753 1HG2 ILE 127 HG21 ILE 127 18.474 11.280 2.186 1754 2HG2 ILE 127 HG22 ILE 127 17.195 10.356 1.370 1755 3HG2 ILE 127 HG23 ILE 127 17.448 10.231 3.134 1756 1HD1 ILE 127 HD11 ILE 127 16.259 8.261 2.903 1757 2HD1 ILE 127 HD12 ILE 127 16.735 6.562 2.907 1758 3HD1 ILE 127 HD13 ILE 127 17.567 7.717 3.977 1759 H GLY 128 HN GLY 128 21.621 10.786 1.798 1760 1HA GLY 128 HA2 GLY 128 20.716 13.348 0.991 1761 2HA GLY 128 HA3 GLY 128 22.370 12.933 1.522 1762 H ASN 129 HN ASN 129 23.202 11.181 -0.513 1763 HA ASN 129 HA ASN 129 23.868 12.998 -2.582 1764 1HB ASN 129 HB2 ASN 129 25.310 11.102 -2.063 1765 2HB ASN 129 HB3 ASN 129 24.021 9.961 -2.449 1766 1HD2 ASN 129 HD22 ASN 129 24.208 9.051 -4.470 1767 2HD2 ASN 129 HD21 ASN 129 24.898 9.842 -5.865 1768 H ARG 130 HN ARG 130 21.352 10.445 -2.452 1769 HA ARG 130 HA ARG 130 20.637 10.891 -5.244 1770 1HB ARG 130 HB2 ARG 130 19.015 9.511 -3.061 1771 2HB ARG 130 HB3 ARG 130 18.680 9.482 -4.788 1772 1HG ARG 130 HG2 ARG 130 20.961 8.167 -3.304 1773 2HG ARG 130 HG3 ARG 130 19.740 7.409 -4.301 1774 1HD ARG 130 HD2 ARG 130 20.786 8.252 -6.330 1775 2HD ARG 130 HD3 ARG 130 21.893 9.280 -5.400 1776 HE ARG 130 HE ARG 130 22.307 6.685 -4.470 1777 1HH1 ARG 130 HH21 ARG 130 22.945 8.622 -7.420 1778 2HH1 ARG 130 HH22 ARG 130 24.200 7.548 -7.955 1779 1HH2 ARG 130 HH11 ARG 130 23.973 5.518 -5.008 1780 2HH2 ARG 130 HH12 ARG 130 24.875 5.710 -6.501 1781 H LEU 131 HN LEU 131 19.353 12.270 -2.178 1782 HA LEU 131 HA LEU 131 17.295 13.643 -3.676 1783 1HB LEU 131 HB2 LEU 131 18.301 13.795 -0.840 1784 2HB LEU 131 HB3 LEU 131 17.457 15.193 -1.476 1785 HG LEU 131 HG LEU 131 15.920 13.678 -0.289 1786 1HD1 LEU 131 HD11 LEU 131 14.150 13.596 -2.009 1787 2HD1 LEU 131 HD12 LEU 131 15.061 15.107 -2.133 1788 3HD1 LEU 131 HD13 LEU 131 15.306 13.780 -3.290 1789 1HD2 LEU 131 HD21 LEU 131 17.051 11.529 -0.836 1790 2HD2 LEU 131 HD22 LEU 131 15.313 11.495 -1.113 1791 3HD2 LEU 131 HD23 LEU 131 16.416 11.631 -2.491 1792 H LYS 132 HN LYS 132 20.668 14.471 -2.807 1793 HA LYS 132 HA LYS 132 20.562 17.098 -3.870 1794 1HB LYS 132 HB2 LYS 132 22.359 16.052 -2.488 1795 2HB LYS 132 HB3 LYS 132 22.886 15.110 -3.878 1796 1HG LYS 132 HG2 LYS 132 23.717 16.962 -5.022 1797 2HG LYS 132 HG3 LYS 132 22.673 18.106 -4.176 1798 1HD LYS 132 HD2 LYS 132 24.930 16.593 -2.808 1799 2HD LYS 132 HD3 LYS 132 25.105 18.219 -3.516 1800 1HE LYS 132 HE2 LYS 132 23.189 18.986 -2.067 1801 2HE LYS 132 HE3 LYS 132 23.191 17.414 -1.272 1802 1HZ LYS 132 HZ1 LYS 132 24.386 19.040 -0.018 1803 2HZ LYS 132 HZ2 LYS 132 25.437 17.873 -0.498 1804 3HZ LYS 132 HZ3 LYS 132 25.441 19.335 -1.241 1805 H GLU 133 HN GLU 133 21.212 13.894 -5.522 1806 HA GLU 133 HA GLU 133 21.380 15.111 -8.082 1807 1HB GLU 133 HB2 GLU 133 20.576 12.292 -7.200 1808 2HB GLU 133 HB3 GLU 133 20.356 12.794 -8.889 1809 1HG GLU 133 HG2 GLU 133 22.649 13.308 -9.162 1810 2HG GLU 133 HG3 GLU 133 23.021 12.944 -7.459 1811 H PHE 134 HN PHE 134 18.383 14.039 -6.300 1812 HA PHE 134 HA PHE 134 16.761 14.456 -8.557 1813 1HB PHE 134 HB2 PHE 134 15.724 13.371 -6.762 1814 2HB PHE 134 HB3 PHE 134 16.259 14.580 -5.598 1815 HD1 PHE 134 HD1 PHE 134 14.294 14.848 -8.820 1816 HD2 PHE 134 HD2 PHE 134 14.441 15.608 -4.592 1817 HE1 PHE 134 HE1 PHE 134 12.212 16.184 -8.995 1818 HE2 PHE 134 HE2 PHE 134 12.395 16.978 -4.770 1819 HZ PHE 134 HZ PHE 134 11.260 17.258 -6.963 1820 H ALA 135 HN ALA 135 17.909 16.820 -6.161 1821 HA ALA 135 HA ALA 135 16.530 19.072 -7.181 1822 1HB ALA 135 HB1 ALA 135 19.269 18.957 -5.879 1823 2HB ALA 135 HB2 ALA 135 18.168 20.368 -5.921 1824 3HB ALA 135 HB3 ALA 135 17.735 18.930 -4.983 1825 H GLU 136 HN GLU 136 19.506 17.495 -8.255 1826 HA GLU 136 HA GLU 136 20.365 19.671 -9.950 1827 1HB GLU 136 HB2 GLU 136 21.357 16.836 -9.504 1828 2HB GLU 136 HB3 GLU 136 22.146 17.953 -10.599 1829 1HG GLU 136 HG2 GLU 136 21.732 18.716 -7.689 1830 2HG GLU 136 HG3 GLU 136 23.032 17.635 -8.172 1831 H THR 137 HN THR 137 18.928 16.480 -10.321 1832 HA THR 137 HA THR 137 19.089 16.540 -13.254 1833 HB THR 137 HB THR 137 18.534 14.119 -13.020 1834 HG1 THR 137 HG1 THR 137 18.551 14.583 -10.254 1835 1HG2 THR 137 HG21 THR 137 20.913 14.820 -12.831 1836 2HG2 THR 137 HG22 THR 137 20.744 14.936 -11.070 1837 3HG2 THR 137 HG23 THR 137 20.547 13.375 -11.874 1838 H GLY 138 HN GLY 138 16.717 17.167 -10.787 1839 1HA GLY 138 HA2 GLY 138 14.579 17.891 -10.915 1840 2HA GLY 138 HA3 GLY 138 14.736 18.010 -12.679 1841 H LYS 139 HN LYS 139 15.307 14.937 -10.918 1842 HA LYS 139 HA LYS 139 12.790 13.791 -11.688 1843 1HB LYS 139 HB2 LYS 139 13.646 13.730 -13.838 1844 2HB LYS 139 HB3 LYS 139 15.306 13.535 -13.332 1845 1HG LYS 139 HG2 LYS 139 13.231 11.322 -13.102 1846 2HG LYS 139 HG3 LYS 139 14.156 11.619 -14.564 1847 1HD LYS 139 HD2 LYS 139 15.219 10.676 -11.897 1848 2HD LYS 139 HD3 LYS 139 15.223 9.824 -13.418 1849 1HE LYS 139 HE2 LYS 139 16.881 12.297 -12.756 1850 2HE LYS 139 HE3 LYS 139 17.453 10.635 -12.729 1851 1HZ LYS 139 HZ1 LYS 139 17.008 10.483 -15.110 1852 2HZ LYS 139 HZ2 LYS 139 16.515 12.041 -15.164 1853 3HZ LYS 139 HZ3 LYS 139 18.060 11.680 -14.796 Start of MODEL 17 1 1H MET 1 H1 MET 1 -23.315 -12.138 -7.539 2 2H MET 1 H2 MET 1 -24.803 -11.449 -7.364 3 3H MET 1 H3 MET 1 -23.542 -10.573 -7.929 4 HA MET 1 HA MET 1 -25.002 -12.747 -9.246 5 1HB MET 1 HB2 MET 1 -24.398 -9.897 -10.154 6 2HB MET 1 HB3 MET 1 -25.152 -11.137 -11.155 7 1HG MET 1 HG2 MET 1 -26.260 -9.973 -8.573 8 2HG MET 1 HG3 MET 1 -26.841 -9.661 -10.200 9 1HE MET 1 HE1 MET 1 -27.045 -12.489 -11.638 10 2HE MET 1 HE2 MET 1 -28.705 -12.928 -11.192 11 3HE MET 1 HE3 MET 1 -28.321 -11.249 -11.622 12 H ALA 2 HN ALA 2 -22.108 -10.609 -9.912 13 HA ALA 2 HA ALA 2 -20.419 -12.925 -10.238 14 1HB ALA 2 HB1 ALA 2 -20.925 -11.025 -12.592 15 2HB ALA 2 HB2 ALA 2 -19.666 -12.275 -12.519 16 3HB ALA 2 HB3 ALA 2 -21.373 -12.746 -12.551 17 H ILE 3 HN ILE 3 -18.167 -12.122 -10.525 18 HA ILE 3 HA ILE 3 -17.700 -9.562 -9.182 19 HB ILE 3 HB ILE 3 -15.935 -11.914 -10.007 20 1HG1 ILE 3 HG12 ILE 3 -15.165 -11.693 -7.610 21 2HG1 ILE 3 HG13 ILE 3 -16.426 -10.490 -7.360 22 1HG2 ILE 3 HG21 ILE 3 -14.680 -9.907 -10.673 23 2HG2 ILE 3 HG22 ILE 3 -15.021 -9.148 -9.105 24 3HG2 ILE 3 HG23 ILE 3 -13.980 -10.590 -9.211 25 1HD1 ILE 3 HD11 ILE 3 -18.144 -12.180 -7.740 26 2HD1 ILE 3 HD12 ILE 3 -16.872 -13.399 -8.070 27 3HD1 ILE 3 HD13 ILE 3 -16.992 -12.622 -6.469 28 H VAL 4 HN VAL 4 -18.200 -7.898 -10.508 29 HA VAL 4 HA VAL 4 -17.894 -8.055 -13.425 30 HB VAL 4 HB VAL 4 -18.834 -5.867 -11.559 31 1HG1 VAL 4 HG11 VAL 4 -18.266 -4.831 -13.687 32 2HG1 VAL 4 HG12 VAL 4 -19.171 -6.086 -14.577 33 3HG1 VAL 4 HG13 VAL 4 -20.007 -4.908 -13.543 34 1HG2 VAL 4 HG21 VAL 4 -20.377 -7.733 -11.353 35 2HG2 VAL 4 HG22 VAL 4 -21.148 -6.497 -12.334 36 3HG2 VAL 4 HG23 VAL 4 -20.448 -7.924 -13.120 37 H LYS 5 HN LYS 5 -16.665 -6.118 -14.385 38 HA LYS 5 HA LYS 5 -14.408 -5.274 -12.705 39 1HB LYS 5 HB2 LYS 5 -13.607 -7.009 -14.278 40 2HB LYS 5 HB3 LYS 5 -14.147 -6.006 -15.639 41 1HG LYS 5 HG2 LYS 5 -12.587 -4.223 -14.976 42 2HG LYS 5 HG3 LYS 5 -12.169 -5.088 -13.492 43 1HD LYS 5 HD2 LYS 5 -10.389 -5.329 -15.124 44 2HD LYS 5 HD3 LYS 5 -11.132 -6.900 -14.798 45 1HE LYS 5 HE2 LYS 5 -12.405 -6.794 -16.887 46 2HE LYS 5 HE3 LYS 5 -11.856 -5.138 -17.185 47 1HZ LYS 5 HZ1 LYS 5 -9.593 -5.969 -17.390 48 2HZ LYS 5 HZ2 LYS 5 -10.089 -7.514 -17.119 49 3HZ LYS 5 HZ3 LYS 5 -10.573 -6.727 -18.462 50 H ALA 6 HN ALA 6 -14.752 -3.240 -12.334 51 HA ALA 6 HA ALA 6 -16.527 -1.537 -13.896 52 1HB ALA 6 HB1 ALA 6 -15.634 0.148 -12.183 53 2HB ALA 6 HB2 ALA 6 -16.639 -1.170 -11.606 54 3HB ALA 6 HB3 ALA 6 -14.870 -1.231 -11.385 55 H THR 7 HN THR 7 -15.423 0.788 -14.350 56 HA THR 7 HA THR 7 -12.638 1.012 -14.693 57 HB THR 7 HB THR 7 -12.898 -0.296 -16.698 58 HG1 THR 7 HG1 THR 7 -12.034 1.120 -18.151 59 1HG2 THR 7 HG21 THR 7 -15.198 -0.081 -17.301 60 2HG2 THR 7 HG22 THR 7 -15.037 1.680 -17.552 61 3HG2 THR 7 HG23 THR 7 -14.238 0.530 -18.646 62 H ASP 8 HN ASP 8 -12.583 3.237 -16.262 63 HA ASP 8 HA ASP 8 -12.771 5.289 -14.570 64 1HB ASP 8 HB2 ASP 8 -11.666 5.457 -16.698 65 2HB ASP 8 HB3 ASP 8 -13.181 5.270 -17.572 66 H GLN 9 HN GLN 9 -15.545 4.414 -16.632 67 HA GLN 9 HA GLN 9 -17.276 6.237 -15.069 68 1HB GLN 9 HB2 GLN 9 -17.097 5.826 -18.066 69 2HB GLN 9 HB3 GLN 9 -18.559 6.473 -17.311 70 1HG GLN 9 HG2 GLN 9 -17.457 8.420 -16.500 71 2HG GLN 9 HG3 GLN 9 -15.860 7.752 -16.786 72 1HE2 GLN 9 HE22 GLN 9 -14.824 8.306 -18.654 73 2HE2 GLN 9 HE21 GLN 9 -15.606 9.021 -20.063 74 H SER 10 HN SER 10 -16.930 3.141 -16.836 75 HA SER 10 HA SER 10 -19.521 2.201 -16.329 76 1HB SER 10 HB2 SER 10 -17.032 0.496 -16.283 77 2HB SER 10 HB3 SER 10 -18.669 0.015 -16.750 78 HG SER 10 HG SER 10 -18.515 1.330 -18.570 79 H PHE 11 HN PHE 11 -16.861 2.685 -13.979 80 HA PHE 11 HA PHE 11 -17.876 1.038 -11.889 81 1HB PHE 11 HB2 PHE 11 -15.740 2.181 -11.585 82 2HB PHE 11 HB3 PHE 11 -16.472 3.730 -11.884 83 HD1 PHE 11 HD1 PHE 11 -17.735 4.924 -10.227 84 HD2 PHE 11 HD2 PHE 11 -15.975 1.068 -9.225 85 HE1 PHE 11 HE1 PHE 11 -17.985 5.408 -7.823 86 HE2 PHE 11 HE2 PHE 11 -16.167 1.642 -6.855 87 HZ PHE 11 HZ PHE 11 -17.145 3.798 -6.134 88 H SER 12 HN SER 12 -18.671 4.500 -12.743 89 HA SER 12 HA SER 12 -20.708 4.799 -10.851 90 1HB SER 12 HB2 SER 12 -20.742 6.015 -13.635 91 2HB SER 12 HB3 SER 12 -21.339 6.719 -12.128 92 HG SER 12 HG SER 12 -19.312 7.610 -12.715 93 H ALA 13 HN ALA 13 -20.887 3.702 -14.282 94 HA ALA 13 HA ALA 13 -23.674 3.570 -14.330 95 1HB ALA 13 HB1 ALA 13 -21.732 1.858 -15.945 96 2HB ALA 13 HB2 ALA 13 -23.408 2.244 -16.377 97 3HB ALA 13 HB3 ALA 13 -22.190 3.538 -16.333 98 H GLU 14 HN GLU 14 -21.302 1.063 -13.439 99 HA GLU 14 HA GLU 14 -23.256 -0.991 -13.070 100 1HB GLU 14 HB2 GLU 14 -20.309 -0.828 -12.392 101 2HB GLU 14 HB3 GLU 14 -21.279 -2.269 -12.130 102 1HG GLU 14 HG2 GLU 14 -20.917 -0.927 -14.837 103 2HG GLU 14 HG3 GLU 14 -19.983 -2.308 -14.261 104 H THR 15 HN THR 15 -22.151 1.605 -11.027 105 HA THR 15 HA THR 15 -22.938 0.157 -8.563 106 HB THR 15 HB THR 15 -21.741 2.001 -7.395 107 HG1 THR 15 HG1 THR 15 -20.808 2.773 -9.910 108 1HG2 THR 15 HG21 THR 15 -20.083 0.421 -7.575 109 2HG2 THR 15 HG22 THR 15 -20.230 0.274 -9.340 110 3HG2 THR 15 HG23 THR 15 -19.371 1.641 -8.614 111 H SER 16 HN SER 16 -24.352 2.335 -10.741 112 HA SER 16 HA SER 16 -25.592 4.123 -8.871 113 1HB SER 16 HB2 SER 16 -26.273 3.515 -11.749 114 2HB SER 16 HB3 SER 16 -26.956 4.826 -10.756 115 HG SER 16 HG SER 16 -24.197 4.488 -11.374 116 H GLU 17 HN GLU 17 -26.158 0.877 -9.157 117 HA GLU 17 HA GLU 17 -28.772 1.124 -7.945 118 1HB GLU 17 HB2 GLU 17 -28.163 -0.494 -10.469 119 2HB GLU 17 HB3 GLU 17 -29.542 -0.856 -9.418 120 1HG GLU 17 HG2 GLU 17 -30.408 1.465 -9.812 121 2HG GLU 17 HG3 GLU 17 -29.097 1.724 -10.971 122 H GLY 18 HN GLY 18 -29.253 -0.812 -6.680 123 1HA GLY 18 HA2 GLY 18 -28.857 -2.729 -5.563 124 2HA GLY 18 HA3 GLY 18 -27.510 -3.078 -6.667 125 H VAL 19 HN VAL 19 -26.652 -3.926 -4.603 126 HA VAL 19 HA VAL 19 -24.998 -1.838 -3.290 127 HB VAL 19 HB VAL 19 -25.957 -4.369 -1.892 128 1HG1 VAL 19 HG11 VAL 19 -24.964 -3.111 0.099 129 2HG1 VAL 19 HG12 VAL 19 -23.817 -3.749 -1.077 130 3HG1 VAL 19 HG13 VAL 19 -24.206 -2.029 -1.069 131 1HG2 VAL 19 HG21 VAL 19 -27.910 -3.124 -2.016 132 2HG2 VAL 19 HG22 VAL 19 -27.231 -2.622 -0.467 133 3HG2 VAL 19 HG23 VAL 19 -27.086 -1.572 -1.895 134 H VAL 20 HN VAL 20 -22.991 -1.953 -3.723 135 HA VAL 20 HA VAL 20 -21.960 -4.453 -4.870 136 HB VAL 20 HB VAL 20 -22.717 -3.140 -6.727 137 1HG1 VAL 20 HG11 VAL 20 -21.782 -1.035 -7.350 138 2HG1 VAL 20 HG12 VAL 20 -22.652 -0.876 -5.818 139 3HG1 VAL 20 HG13 VAL 20 -20.864 -0.925 -5.840 140 1HG2 VAL 20 HG21 VAL 20 -20.473 -2.906 -7.984 141 2HG2 VAL 20 HG22 VAL 20 -19.697 -3.285 -6.446 142 3HG2 VAL 20 HG23 VAL 20 -20.761 -4.464 -7.202 143 H LEU 21 HN LEU 21 -20.230 -5.033 -4.000 144 HA LEU 21 HA LEU 21 -18.563 -3.260 -2.327 145 1HB LEU 21 HB2 LEU 21 -19.127 -5.583 -1.624 146 2HB LEU 21 HB3 LEU 21 -18.377 -6.212 -3.087 147 HG LEU 21 HG LEU 21 -16.171 -5.396 -2.331 148 1HD1 LEU 21 HD11 LEU 21 -16.027 -4.558 0.084 149 2HD1 LEU 21 HD12 LEU 21 -16.731 -3.419 -1.057 150 3HD1 LEU 21 HD13 LEU 21 -17.775 -4.356 0.049 151 1HD2 LEU 21 HD21 LEU 21 -15.873 -6.947 -0.458 152 2HD2 LEU 21 HD22 LEU 21 -17.624 -6.966 -0.149 153 3HD2 LEU 21 HD23 LEU 21 -16.973 -7.656 -1.649 154 H ALA 22 HN ALA 22 -17.371 -1.828 -3.688 155 HA ALA 22 HA ALA 22 -16.215 -2.916 -6.159 156 1HB ALA 22 HB1 ALA 22 -17.120 -0.564 -6.114 157 2HB ALA 22 HB2 ALA 22 -15.807 -0.145 -4.988 158 3HB ALA 22 HB3 ALA 22 -15.446 -0.684 -6.649 159 H ASP 23 HN ASP 23 -14.014 -3.317 -6.405 160 HA ASP 23 HA ASP 23 -12.359 -3.366 -3.929 161 1HB ASP 23 HB2 ASP 23 -13.316 -5.570 -4.014 162 2HB ASP 23 HB3 ASP 23 -13.044 -5.691 -5.748 163 H PHE 24 HN PHE 24 -10.168 -3.246 -4.291 164 HA PHE 24 HA PHE 24 -9.303 -2.495 -7.048 165 1HB PHE 24 HB2 PHE 24 -8.826 -1.098 -4.397 166 2HB PHE 24 HB3 PHE 24 -7.991 -0.705 -5.888 167 HD1 PHE 24 HD1 PHE 24 -8.939 0.802 -7.437 168 HD2 PHE 24 HD2 PHE 24 -11.470 -0.891 -4.400 169 HE1 PHE 24 HE1 PHE 24 -10.815 2.293 -8.142 170 HE2 PHE 24 HE2 PHE 24 -13.347 0.511 -5.170 171 HZ PHE 24 HZ PHE 24 -13.016 2.140 -7.020 172 H TRP 25 HN TRP 25 -7.860 -3.958 -7.627 173 HA TRP 25 HA TRP 25 -6.173 -5.324 -5.589 174 1HB TRP 25 HB2 TRP 25 -6.499 -7.372 -6.599 175 2HB TRP 25 HB3 TRP 25 -8.109 -6.687 -6.570 176 HD1 TRP 25 HD1 TRP 25 -8.708 -5.347 -9.012 177 HE1 TRP 25 HE1 TRP 25 -8.299 -6.078 -11.408 178 HE3 TRP 25 HE3 TRP 25 -5.074 -8.827 -8.119 179 HZ2 TRP 25 HZ2 TRP 25 -6.397 -7.830 -12.808 180 HZ3 TRP 25 HZ3 TRP 25 -3.912 -9.938 -9.998 181 HH2 TRP 25 HH2 TRP 25 -4.573 -9.451 -12.345 182 H ALA 26 HN ALA 26 -4.038 -6.064 -6.569 183 HA ALA 26 HA ALA 26 -3.411 -5.114 -9.253 184 1HB ALA 26 HB1 ALA 26 -3.220 -3.183 -7.454 185 2HB ALA 26 HB2 ALA 26 -1.734 -3.983 -6.992 186 3HB ALA 26 HB3 ALA 26 -1.950 -3.391 -8.680 187 HA PRO 27 HA PRO 27 -0.085 -8.116 -8.893 188 1HB PRO 27 HB2 PRO 27 1.584 -6.010 -10.270 189 2HB PRO 27 HB3 PRO 27 1.460 -7.763 -10.624 190 1HG PRO 27 HG2 PRO 27 0.135 -5.975 -12.172 191 2HG PRO 27 HG3 PRO 27 -0.696 -7.476 -11.645 192 1HD PRO 27 HD2 PRO 27 -0.920 -4.701 -10.468 193 2HD PRO 27 HD3 PRO 27 -2.207 -5.886 -10.850 194 H TRP 28 HN TRP 28 0.346 -4.712 -7.819 195 HA TRP 28 HA TRP 28 2.832 -4.819 -6.626 196 1HB TRP 28 HB2 TRP 28 0.484 -3.255 -5.577 197 2HB TRP 28 HB3 TRP 28 2.192 -2.874 -5.422 198 HD1 TRP 28 HD1 TRP 28 -0.699 -2.007 -7.355 199 HE1 TRP 28 HE1 TRP 28 -0.134 -0.701 -9.499 200 HE3 TRP 28 HE3 TRP 28 4.324 -2.906 -7.506 201 HZ2 TRP 28 HZ2 TRP 28 2.236 -0.099 -11.055 202 HZ3 TRP 28 HZ3 TRP 28 5.720 -1.949 -9.319 203 HH2 TRP 28 HH2 TRP 28 4.689 -0.547 -11.096 204 H CYS 29 HN CYS 29 -0.051 -6.395 -5.284 205 HA CYS 29 HA CYS 29 1.444 -6.693 -2.722 206 1HB CYS 29 HB2 CYS 29 -0.719 -4.962 -3.120 207 2HB CYS 29 HB3 CYS 29 -1.482 -6.384 -2.450 208 H GLY 30 HN GLY 30 0.948 -8.494 -1.461 209 1HA GLY 30 HA2 GLY 30 0.273 -10.919 -2.802 210 2HA GLY 30 HA3 GLY 30 0.454 -10.680 -1.059 211 HA PRO 31 HA PRO 31 -3.925 -10.545 -0.236 212 1HB PRO 31 HB2 PRO 31 -4.048 -7.540 -0.436 213 2HB PRO 31 HB3 PRO 31 -4.903 -8.619 0.716 214 1HG PRO 31 HG2 PRO 31 -2.604 -7.387 1.488 215 2HG PRO 31 HG3 PRO 31 -2.810 -9.136 1.841 216 1HD PRO 31 HD2 PRO 31 -1.247 -7.832 -0.384 217 2HD PRO 31 HD3 PRO 31 -0.802 -9.240 0.625 218 H SER 32 HN SER 32 -3.076 -8.436 -3.049 219 HA SER 32 HA SER 32 -5.597 -8.412 -4.285 220 1HB SER 32 HB2 SER 32 -2.889 -8.769 -5.630 221 2HB SER 32 HB3 SER 32 -4.298 -7.925 -6.277 222 HG SER 32 HG SER 32 -2.470 -6.711 -5.303 223 H LYS 33 HN LYS 33 -3.498 -11.111 -3.776 224 HA LYS 33 HA LYS 33 -5.121 -12.725 -5.687 225 1HB LYS 33 HB2 LYS 33 -2.444 -13.588 -4.612 226 2HB LYS 33 HB3 LYS 33 -3.431 -14.288 -5.895 227 1HG LYS 33 HG2 LYS 33 -1.850 -13.237 -7.160 228 2HG LYS 33 HG3 LYS 33 -3.091 -11.977 -7.116 229 1HD LYS 33 HD2 LYS 33 -1.844 -10.872 -5.254 230 2HD LYS 33 HD3 LYS 33 -0.647 -12.173 -5.290 231 1HE LYS 33 HE2 LYS 33 -0.106 -11.542 -7.670 232 2HE LYS 33 HE3 LYS 33 -1.240 -10.188 -7.533 233 1HZ LYS 33 HZ1 LYS 33 0.999 -9.417 -7.055 234 2HZ LYS 33 HZ2 LYS 33 0.126 -9.368 -5.670 235 3HZ LYS 33 HZ3 LYS 33 1.218 -10.568 -5.919 236 H MET 34 HN MET 34 -5.428 -11.908 -2.627 237 HA MET 34 HA MET 34 -6.248 -14.646 -1.729 238 1HB MET 34 HB2 MET 34 -5.239 -12.387 0.041 239 2HB MET 34 HB3 MET 34 -5.828 -13.967 0.567 240 1HG MET 34 HG2 MET 34 -3.988 -15.028 -0.797 241 2HG MET 34 HG3 MET 34 -3.322 -13.417 -1.066 242 1HE MET 34 HE1 MET 34 -2.225 -11.911 0.826 243 2HE MET 34 HE2 MET 34 -3.717 -11.959 1.802 244 3HE MET 34 HE3 MET 34 -2.156 -12.360 2.542 245 H ILE 35 HN ILE 35 -6.881 -11.080 -1.488 246 HA ILE 35 HA ILE 35 -9.553 -11.366 -0.601 247 HB ILE 35 HB ILE 35 -7.902 -9.279 -0.787 248 1HG1 ILE 35 HG12 ILE 35 -10.079 -7.801 -0.734 249 2HG1 ILE 35 HG13 ILE 35 -10.924 -9.358 -0.746 250 1HG2 ILE 35 HG21 ILE 35 -9.583 -8.843 -3.278 251 2HG2 ILE 35 HG22 ILE 35 -8.507 -7.680 -2.476 252 3HG2 ILE 35 HG23 ILE 35 -7.826 -9.130 -3.224 253 1HD1 ILE 35 HD11 ILE 35 -9.653 -10.042 1.280 254 2HD1 ILE 35 HD12 ILE 35 -8.733 -8.520 1.219 255 3HD1 ILE 35 HD13 ILE 35 -10.478 -8.494 1.560 256 H ALA 36 HN ALA 36 -8.015 -11.451 -3.813 257 HA ALA 36 HA ALA 36 -10.279 -11.295 -5.402 258 1HB ALA 36 HB1 ALA 36 -8.876 -12.584 -7.104 259 2HB ALA 36 HB2 ALA 36 -8.167 -11.100 -6.439 260 3HB ALA 36 HB3 ALA 36 -7.599 -12.673 -5.874 261 HA PRO 37 HA PRO 37 -10.978 -16.043 -5.223 262 1HB PRO 37 HB2 PRO 37 -9.821 -17.263 -2.906 263 2HB PRO 37 HB3 PRO 37 -9.377 -17.529 -4.624 264 1HG PRO 37 HG2 PRO 37 -8.070 -15.844 -2.550 265 2HG PRO 37 HG3 PRO 37 -7.336 -16.609 -3.985 266 1HD PRO 37 HD2 PRO 37 -7.867 -13.901 -3.835 267 2HD PRO 37 HD3 PRO 37 -7.883 -14.819 -5.357 268 H VAL 38 HN VAL 38 -10.429 -14.338 -2.076 269 HA VAL 38 HA VAL 38 -12.633 -15.423 -0.709 270 HB VAL 38 HB VAL 38 -10.890 -13.005 -0.514 271 1HG1 VAL 38 HG11 VAL 38 -13.457 -13.213 1.026 272 2HG1 VAL 38 HG12 VAL 38 -12.025 -12.345 1.648 273 3HG1 VAL 38 HG13 VAL 38 -12.763 -11.850 0.119 274 1HG2 VAL 38 HG21 VAL 38 -10.220 -15.255 0.320 275 2HG2 VAL 38 HG22 VAL 38 -10.268 -14.029 1.605 276 3HG2 VAL 38 HG23 VAL 38 -11.584 -15.213 1.461 277 H LEU 39 HN LEU 39 -12.523 -12.689 -3.013 278 HA LEU 39 HA LEU 39 -15.242 -11.880 -2.602 279 1HB LEU 39 HB2 LEU 39 -13.292 -11.583 -4.920 280 2HB LEU 39 HB3 LEU 39 -14.922 -10.964 -5.032 281 HG LEU 39 HG LEU 39 -13.139 -10.226 -2.669 282 1HD1 LEU 39 HD11 LEU 39 -11.841 -9.701 -4.673 283 2HD1 LEU 39 HD12 LEU 39 -13.203 -8.766 -5.337 284 3HD1 LEU 39 HD13 LEU 39 -12.380 -8.243 -3.844 285 1HD2 LEU 39 HD21 LEU 39 -15.302 -8.571 -4.011 286 2HD2 LEU 39 HD22 LEU 39 -15.612 -9.645 -2.640 287 3HD2 LEU 39 HD23 LEU 39 -14.499 -8.275 -2.466 288 H GLU 40 HN GLU 40 -13.728 -14.108 -5.023 289 HA GLU 40 HA GLU 40 -16.184 -14.660 -6.346 290 1HB GLU 40 HB2 GLU 40 -13.615 -16.268 -6.265 291 2HB GLU 40 HB3 GLU 40 -14.987 -16.514 -7.375 292 1HG GLU 40 HG2 GLU 40 -14.679 -14.251 -8.295 293 2HG GLU 40 HG3 GLU 40 -13.299 -13.986 -7.234 294 H GLU 41 HN GLU 41 -14.497 -16.225 -3.626 295 HA GLU 41 HA GLU 41 -16.293 -18.396 -3.265 296 1HB GLU 41 HB2 GLU 41 -14.336 -16.972 -1.440 297 2HB GLU 41 HB3 GLU 41 -15.298 -18.333 -0.891 298 1HG GLU 41 HG2 GLU 41 -13.393 -18.436 -3.268 299 2HG GLU 41 HG3 GLU 41 -12.992 -18.956 -1.635 300 H LEU 42 HN LEU 42 -16.543 -14.974 -2.437 301 HA LEU 42 HA LEU 42 -18.687 -15.531 -0.543 302 1HB LEU 42 HB2 LEU 42 -17.122 -13.548 -0.269 303 2HB LEU 42 HB3 LEU 42 -17.810 -12.852 -1.736 304 HG LEU 42 HG LEU 42 -20.052 -12.783 -0.685 305 1HD1 LEU 42 HD11 LEU 42 -19.954 -14.713 0.830 306 2HD1 LEU 42 HD12 LEU 42 -18.599 -13.970 1.722 307 3HD1 LEU 42 HD13 LEU 42 -20.218 -13.286 1.760 308 1HD2 LEU 42 HD21 LEU 42 -19.673 -11.031 0.916 309 2HD2 LEU 42 HD22 LEU 42 -17.972 -11.526 1.137 310 3HD2 LEU 42 HD23 LEU 42 -18.524 -10.853 -0.415 311 H ASP 43 HN ASP 43 -18.355 -14.392 -3.908 312 HA ASP 43 HA ASP 43 -21.085 -13.585 -4.108 313 1HB ASP 43 HB2 ASP 43 -19.401 -12.706 -5.661 314 2HB ASP 43 HB3 ASP 43 -18.987 -14.331 -6.197 315 H GLN 44 HN GLN 44 -19.429 -16.657 -4.733 316 HA GLN 44 HA GLN 44 -21.765 -17.913 -5.800 317 1HB GLN 44 HB2 GLN 44 -20.525 -19.942 -5.731 318 2HB GLN 44 HB3 GLN 44 -19.460 -18.616 -6.221 319 1HG GLN 44 HG2 GLN 44 -18.637 -18.516 -3.826 320 2HG GLN 44 HG3 GLN 44 -19.546 -19.994 -3.503 321 1HE2 GLN 44 HE22 GLN 44 -16.983 -18.568 -5.564 322 2HE2 GLN 44 HE21 GLN 44 -16.111 -20.072 -5.837 323 H GLU 45 HN GLU 45 -21.342 -16.746 -2.662 324 HA GLU 45 HA GLU 45 -23.025 -18.809 -1.484 325 1HB GLU 45 HB2 GLU 45 -21.155 -18.957 -0.215 326 2HB GLU 45 HB3 GLU 45 -20.625 -17.315 -0.565 327 1HG GLU 45 HG2 GLU 45 -22.117 -16.347 0.970 328 2HG GLU 45 HG3 GLU 45 -22.949 -17.884 1.285 329 H MET 46 HN MET 46 -22.565 -15.269 -1.682 330 HA MET 46 HA MET 46 -25.478 -14.989 -1.100 331 1HB MET 46 HB2 MET 46 -24.921 -12.968 0.208 332 2HB MET 46 HB3 MET 46 -24.398 -14.490 0.931 333 1HG MET 46 HG2 MET 46 -22.115 -14.101 0.233 334 2HG MET 46 HG3 MET 46 -22.559 -12.662 -0.679 335 1HE MET 46 HE1 MET 46 -23.187 -9.986 1.929 336 2HE MET 46 HE2 MET 46 -22.927 -10.478 0.243 337 3HE MET 46 HE3 MET 46 -24.458 -10.931 1.037 338 H GLY 47 HN GLY 47 -23.611 -14.816 -3.630 339 1HA GLY 47 HA2 GLY 47 -23.915 -12.146 -4.599 340 2HA GLY 47 HA3 GLY 47 -23.695 -13.631 -5.567 341 H ASP 48 HN ASP 48 -26.299 -14.322 -3.846 342 HA ASP 48 HA ASP 48 -28.210 -13.669 -5.885 343 1HB ASP 48 HB2 ASP 48 -28.502 -15.657 -4.440 344 2HB ASP 48 HB3 ASP 48 -28.573 -14.616 -3.015 345 H LYS 49 HN LYS 49 -26.975 -12.059 -3.093 346 HA LYS 49 HA LYS 49 -28.967 -9.930 -3.364 347 1HB LYS 49 HB2 LYS 49 -27.160 -10.213 -0.981 348 2HB LYS 49 HB3 LYS 49 -28.758 -9.487 -1.100 349 1HG LYS 49 HG2 LYS 49 -29.289 -11.345 0.076 350 2HG LYS 49 HG3 LYS 49 -29.480 -12.035 -1.554 351 1HD LYS 49 HD2 LYS 49 -27.509 -13.305 -1.383 352 2HD LYS 49 HD3 LYS 49 -26.778 -12.149 -0.263 353 1HE LYS 49 HE2 LYS 49 -27.162 -14.172 0.904 354 2HE LYS 49 HE3 LYS 49 -28.136 -12.853 1.557 355 1HZ LYS 49 HZ1 LYS 49 -29.425 -14.899 1.380 356 2HZ LYS 49 HZ2 LYS 49 -30.067 -13.788 0.383 357 3HZ LYS 49 HZ3 LYS 49 -29.160 -15.011 -0.222 358 H LEU 50 HN LEU 50 -25.562 -10.771 -3.358 359 HA LEU 50 HA LEU 50 -24.662 -7.993 -3.113 360 1HB LEU 50 HB2 LEU 50 -23.697 -9.674 -1.658 361 2HB LEU 50 HB3 LEU 50 -23.278 -10.696 -3.030 362 HG LEU 50 HG LEU 50 -21.610 -9.002 -3.783 363 1HD1 LEU 50 HD11 LEU 50 -20.921 -7.232 -2.221 364 2HD1 LEU 50 HD12 LEU 50 -22.599 -6.972 -2.689 365 3HD1 LEU 50 HD13 LEU 50 -22.234 -7.681 -1.105 366 1HD2 LEU 50 HD21 LEU 50 -19.939 -9.495 -2.107 367 2HD2 LEU 50 HD22 LEU 50 -21.182 -9.969 -0.940 368 3HD2 LEU 50 HD23 LEU 50 -20.931 -10.926 -2.418 369 H LYS 51 HN LYS 51 -23.235 -7.000 -4.567 370 HA LYS 51 HA LYS 51 -22.550 -8.419 -7.094 371 1HB LYS 51 HB2 LYS 51 -24.402 -6.735 -7.419 372 2HB LYS 51 HB3 LYS 51 -23.329 -5.481 -6.794 373 1HG LYS 51 HG2 LYS 51 -21.763 -5.899 -8.720 374 2HG LYS 51 HG3 LYS 51 -22.872 -7.155 -9.311 375 1HD LYS 51 HD2 LYS 51 -24.674 -5.448 -9.493 376 2HD LYS 51 HD3 LYS 51 -23.550 -4.204 -8.903 377 1HE LYS 51 HE2 LYS 51 -22.062 -4.644 -10.864 378 2HE LYS 51 HE3 LYS 51 -23.207 -5.852 -11.453 379 1HZ LYS 51 HZ1 LYS 51 -24.876 -4.090 -11.628 380 2HZ LYS 51 HZ2 LYS 51 -23.800 -2.968 -11.074 381 3HZ LYS 51 HZ3 LYS 51 -23.548 -3.720 -12.516 382 H ILE 52 HN ILE 52 -20.388 -7.705 -7.898 383 HA ILE 52 HA ILE 52 -18.786 -6.113 -5.985 384 HB ILE 52 HB ILE 52 -18.200 -8.892 -7.064 385 1HG1 ILE 52 HG12 ILE 52 -17.694 -8.017 -4.213 386 2HG1 ILE 52 HG13 ILE 52 -19.335 -8.408 -4.702 387 1HG2 ILE 52 HG21 ILE 52 -15.872 -8.678 -6.168 388 2HG2 ILE 52 HG22 ILE 52 -16.169 -7.592 -7.511 389 3HG2 ILE 52 HG23 ILE 52 -16.170 -6.962 -5.848 390 1HD1 ILE 52 HD11 ILE 52 -16.997 -10.311 -4.942 391 2HD1 ILE 52 HD12 ILE 52 -18.271 -10.357 -3.717 392 3HD1 ILE 52 HD13 ILE 52 -18.671 -10.630 -5.424 393 H VAL 53 HN VAL 53 -17.315 -4.723 -7.164 394 HA VAL 53 HA VAL 53 -17.056 -5.246 -10.056 395 HB VAL 53 HB VAL 53 -17.047 -2.751 -10.203 396 1HG1 VAL 53 HG11 VAL 53 -19.543 -2.476 -10.339 397 2HG1 VAL 53 HG12 VAL 53 -18.738 -3.654 -11.344 398 3HG1 VAL 53 HG13 VAL 53 -19.613 -4.194 -9.869 399 1HG2 VAL 53 HG21 VAL 53 -16.831 -1.681 -8.330 400 2HG2 VAL 53 HG22 VAL 53 -18.541 -1.450 -8.632 401 3HG2 VAL 53 HG23 VAL 53 -17.995 -2.663 -7.451 402 H LYS 54 HN LYS 54 -14.868 -5.789 -10.261 403 HA LYS 54 HA LYS 54 -12.943 -4.675 -8.334 404 1HB LYS 54 HB2 LYS 54 -12.736 -6.741 -10.554 405 2HB LYS 54 HB3 LYS 54 -11.309 -6.042 -9.772 406 1HG LYS 54 HG2 LYS 54 -12.213 -6.715 -7.543 407 2HG LYS 54 HG3 LYS 54 -13.573 -7.494 -8.336 408 1HD LYS 54 HD2 LYS 54 -11.961 -9.171 -7.712 409 2HD LYS 54 HD3 LYS 54 -11.980 -9.035 -9.482 410 1HE LYS 54 HE2 LYS 54 -9.941 -7.522 -9.278 411 2HE LYS 54 HE3 LYS 54 -9.882 -7.878 -7.555 412 1HZ LYS 54 HZ1 LYS 54 -8.420 -9.339 -8.780 413 2HZ LYS 54 HZ2 LYS 54 -9.647 -10.258 -8.202 414 3HZ LYS 54 HZ3 LYS 54 -9.608 -9.836 -9.781 415 H ILE 55 HN ILE 55 -11.104 -3.453 -8.987 416 HA ILE 55 HA ILE 55 -11.095 -2.196 -11.673 417 HB ILE 55 HB ILE 55 -10.816 -1.030 -8.877 418 1HG1 ILE 55 HG12 ILE 55 -13.026 -0.851 -9.996 419 2HG1 ILE 55 HG13 ILE 55 -12.300 0.671 -9.512 420 1HG2 ILE 55 HG21 ILE 55 -9.883 1.059 -9.992 421 2HG2 ILE 55 HG22 ILE 55 -8.791 -0.329 -9.857 422 3HG2 ILE 55 HG23 ILE 55 -9.555 0.046 -11.415 423 1HD1 ILE 55 HD11 ILE 55 -13.370 0.867 -11.707 424 2HD1 ILE 55 HD12 ILE 55 -11.639 1.177 -11.818 425 3HD1 ILE 55 HD13 ILE 55 -12.289 -0.386 -12.363 426 H ASP 56 HN ASP 56 -9.184 -2.596 -12.628 427 HA ASP 56 HA ASP 56 -6.937 -3.872 -11.144 428 1HB ASP 56 HB2 ASP 56 -7.633 -4.971 -13.242 429 2HB ASP 56 HB3 ASP 56 -7.441 -3.457 -14.124 430 H VAL 57 HN VAL 57 -5.804 -2.299 -10.169 431 HA VAL 57 HA VAL 57 -5.991 0.362 -10.947 432 HB VAL 57 HB VAL 57 -4.545 0.869 -9.083 433 1HG1 VAL 57 HG11 VAL 57 -6.387 -1.455 -8.352 434 2HG1 VAL 57 HG12 VAL 57 -5.843 -0.141 -7.301 435 3HG1 VAL 57 HG13 VAL 57 -6.906 0.219 -8.656 436 1HG2 VAL 57 HG21 VAL 57 -3.931 -2.097 -9.194 437 2HG2 VAL 57 HG22 VAL 57 -2.787 -0.766 -9.402 438 3HG2 VAL 57 HG23 VAL 57 -3.495 -1.054 -7.823 439 H ASP 58 HN ASP 58 -4.270 -1.712 -12.759 440 HA ASP 58 HA ASP 58 -2.315 0.452 -13.502 441 1HB ASP 58 HB2 ASP 58 -1.164 -1.615 -12.809 442 2HB ASP 58 HB3 ASP 58 -2.134 -2.551 -13.956 443 H GLU 59 HN GLU 59 -4.801 -1.925 -14.649 444 HA GLU 59 HA GLU 59 -4.482 -1.020 -17.401 445 1HB GLU 59 HB2 GLU 59 -4.909 -3.238 -17.426 446 2HB GLU 59 HB3 GLU 59 -5.807 -3.219 -15.911 447 1HG GLU 59 HG2 GLU 59 -7.759 -2.382 -16.913 448 2HG GLU 59 HG3 GLU 59 -6.965 -2.168 -18.483 449 H ASN 60 HN ASN 60 -6.862 -0.599 -14.789 450 HA ASN 60 HA ASN 60 -8.206 1.503 -16.355 451 1HB ASN 60 HB2 ASN 60 -10.421 0.580 -15.990 452 2HB ASN 60 HB3 ASN 60 -9.432 -0.400 -17.052 453 1HD2 ASN 60 HD22 ASN 60 -10.667 -2.284 -16.778 454 2HD2 ASN 60 HD21 ASN 60 -10.790 -3.116 -15.246 455 H GLN 61 HN GLN 61 -6.549 2.059 -14.405 456 HA GLN 61 HA GLN 61 -7.661 1.844 -11.798 457 1HB GLN 61 HB2 GLN 61 -5.612 2.376 -11.116 458 2HB GLN 61 HB3 GLN 61 -5.226 1.829 -12.755 459 1HG GLN 61 HG2 GLN 61 -4.062 3.655 -13.075 460 2HG GLN 61 HG3 GLN 61 -5.500 4.649 -12.950 461 1HE2 GLN 61 HE22 GLN 61 -3.128 2.846 -10.901 462 2HE2 GLN 61 HE21 GLN 61 -3.104 3.994 -9.579 463 H GLU 62 HN GLU 62 -8.422 3.982 -14.226 464 HA GLU 62 HA GLU 62 -7.957 6.546 -13.294 465 1HB GLU 62 HB2 GLU 62 -10.083 5.241 -14.995 466 2HB GLU 62 HB3 GLU 62 -10.101 7.002 -14.732 467 1HG GLU 62 HG2 GLU 62 -7.804 5.404 -15.948 468 2HG GLU 62 HG3 GLU 62 -9.010 6.298 -16.863 469 H THR 63 HN THR 63 -10.851 4.485 -12.594 470 HA THR 63 HA THR 63 -12.215 6.240 -10.920 471 HB THR 63 HB THR 63 -11.924 3.220 -10.709 472 HG1 THR 63 HG1 THR 63 -13.698 3.287 -12.236 473 1HG2 THR 63 HG21 THR 63 -14.168 3.185 -9.878 474 2HG2 THR 63 HG22 THR 63 -13.249 4.265 -8.846 475 3HG2 THR 63 HG23 THR 63 -14.349 4.950 -10.068 476 H ALA 64 HN ALA 64 -9.375 4.236 -10.201 477 HA ALA 64 HA ALA 64 -9.716 4.256 -7.329 478 1HB ALA 64 HB1 ALA 64 -8.462 2.520 -8.872 479 2HB ALA 64 HB2 ALA 64 -7.129 3.652 -8.852 480 3HB ALA 64 HB3 ALA 64 -7.724 2.963 -7.319 481 H GLY 65 HN GLY 65 -7.036 5.603 -9.290 482 1HA GLY 65 HA2 GLY 65 -6.179 7.662 -7.724 483 2HA GLY 65 HA3 GLY 65 -6.307 7.788 -9.492 484 H LYS 66 HN LYS 66 -9.172 7.886 -9.788 485 HA LYS 66 HA LYS 66 -9.706 10.614 -9.264 486 1HB LYS 66 HB2 LYS 66 -10.686 9.316 -11.059 487 2HB LYS 66 HB3 LYS 66 -11.569 8.298 -9.908 488 1HG LYS 66 HG2 LYS 66 -12.866 10.348 -9.215 489 2HG LYS 66 HG3 LYS 66 -12.042 11.239 -10.505 490 1HD LYS 66 HD2 LYS 66 -13.881 8.818 -10.804 491 2HD LYS 66 HD3 LYS 66 -14.239 10.485 -11.273 492 1HE LYS 66 HE2 LYS 66 -12.388 10.387 -12.959 493 2HE LYS 66 HE3 LYS 66 -12.079 8.707 -12.509 494 1HZ LYS 66 HZ1 LYS 66 -14.324 8.151 -13.291 495 2HZ LYS 66 HZ2 LYS 66 -14.561 9.715 -13.759 496 3HZ LYS 66 HZ3 LYS 66 -13.396 8.774 -14.452 497 H TYR 67 HN TYR 67 -10.767 7.651 -7.470 498 HA TYR 67 HA TYR 67 -12.145 9.232 -5.497 499 1HB TYR 67 HB2 TYR 67 -11.664 6.317 -5.966 500 2HB TYR 67 HB3 TYR 67 -11.960 6.815 -4.315 501 HD1 TYR 67 HD1 TYR 67 -14.071 7.707 -3.557 502 HD2 TYR 67 HD2 TYR 67 -13.480 6.700 -7.708 503 HE1 TYR 67 HE1 TYR 67 -16.500 7.937 -3.951 504 HE2 TYR 67 HE2 TYR 67 -15.907 6.923 -8.115 505 HH TYR 67 HH TYR 67 -18.220 7.856 -5.519 506 H GLY 68 HN GLY 68 -8.834 8.657 -6.028 507 1HA GLY 68 HA2 GLY 68 -6.975 9.108 -4.764 508 2HA GLY 68 HA3 GLY 68 -8.016 9.787 -3.493 509 H VAL 69 HN VAL 69 -7.222 6.608 -5.027 510 HA VAL 69 HA VAL 69 -8.039 5.225 -2.471 511 HB VAL 69 HB VAL 69 -7.940 4.337 -5.363 512 1HG1 VAL 69 HG11 VAL 69 -6.620 2.604 -4.366 513 2HG1 VAL 69 HG12 VAL 69 -7.725 2.494 -2.985 514 3HG1 VAL 69 HG13 VAL 69 -8.258 1.988 -4.608 515 1HG2 VAL 69 HG21 VAL 69 -10.145 3.477 -4.876 516 2HG2 VAL 69 HG22 VAL 69 -9.984 3.963 -3.171 517 3HG2 VAL 69 HG23 VAL 69 -10.033 5.192 -4.455 518 H MET 70 HN MET 70 -5.663 4.773 -5.003 519 HA MET 70 HA MET 70 -3.510 4.641 -5.154 520 1HB MET 70 HB2 MET 70 -3.085 6.080 -2.584 521 2HB MET 70 HB3 MET 70 -2.133 6.155 -4.075 522 1HG MET 70 HG2 MET 70 -4.186 7.333 -5.118 523 2HG MET 70 HG3 MET 70 -4.809 7.452 -3.469 524 1HE MET 70 HE1 MET 70 -1.533 7.742 -2.247 525 2HE MET 70 HE2 MET 70 -1.832 9.415 -1.715 526 3HE MET 70 HE3 MET 70 -3.094 8.193 -1.494 527 H SER 71 HN SER 71 -5.004 2.850 -2.917 528 HA SER 71 HA SER 71 -2.534 1.537 -2.002 529 1HB SER 71 HB2 SER 71 -3.742 1.336 0.222 530 2HB SER 71 HB3 SER 71 -3.057 2.905 -0.225 531 HG SER 71 HG SER 71 -5.135 3.622 -0.789 532 H ILE 72 HN ILE 72 -2.835 -0.665 -1.156 533 HA ILE 72 HA ILE 72 -5.131 -2.003 -2.438 534 HB ILE 72 HB ILE 72 -2.224 -2.764 -2.727 535 1HG1 ILE 72 HG12 ILE 72 -2.700 -0.730 -4.078 536 2HG1 ILE 72 HG13 ILE 72 -2.278 -2.116 -5.048 537 1HG2 ILE 72 HG21 ILE 72 -3.015 -4.318 -4.508 538 2HG2 ILE 72 HG22 ILE 72 -3.592 -4.780 -2.903 539 3HG2 ILE 72 HG23 ILE 72 -4.681 -3.963 -4.048 540 1HD1 ILE 72 HD11 ILE 72 -4.497 -2.429 -5.831 541 2HD1 ILE 72 HD12 ILE 72 -5.208 -1.419 -4.561 542 3HD1 ILE 72 HD13 ILE 72 -4.239 -0.685 -5.827 543 HA PRO 73 HA PRO 73 -6.173 -3.829 -2.326 544 1HB PRO 73 HB2 PRO 73 -7.889 -5.422 -1.009 545 2HB PRO 73 HB3 PRO 73 -6.344 -6.066 -1.652 546 1HG PRO 73 HG2 PRO 73 -6.982 -5.203 1.173 547 2HG PRO 73 HG3 PRO 73 -6.155 -6.688 0.646 548 1HD PRO 73 HD2 PRO 73 -4.831 -4.378 1.477 549 2HD PRO 73 HD3 PRO 73 -4.115 -5.524 0.320 550 H THR 74 HN THR 74 -7.862 -2.378 -2.529 551 HA THR 74 HA THR 74 -8.960 -1.169 0.005 552 HB THR 74 HB THR 74 -8.601 0.122 -2.712 553 HG1 THR 74 HG1 THR 74 -6.788 0.458 -1.741 554 1HG2 THR 74 HG21 THR 74 -10.675 0.999 -1.930 555 2HG2 THR 74 HG22 THR 74 -10.110 1.083 -0.251 556 3HG2 THR 74 HG23 THR 74 -9.452 2.189 -1.471 557 H LEU 75 HN LEU 75 -11.086 -1.067 0.319 558 HA LEU 75 HA LEU 75 -12.960 -2.190 -1.726 559 1HB LEU 75 HB2 LEU 75 -13.010 -2.414 1.311 560 2HB LEU 75 HB3 LEU 75 -14.358 -2.836 0.264 561 HG LEU 75 HG LEU 75 -11.635 -4.209 0.287 562 1HD1 LEU 75 HD11 LEU 75 -13.005 -4.648 2.300 563 2HD1 LEU 75 HD12 LEU 75 -14.347 -5.215 1.285 564 3HD1 LEU 75 HD13 LEU 75 -12.807 -6.093 1.297 565 1HD2 LEU 75 HD21 LEU 75 -12.732 -5.935 -1.133 566 2HD2 LEU 75 HD22 LEU 75 -14.162 -4.889 -1.276 567 3HD2 LEU 75 HD23 LEU 75 -12.603 -4.374 -1.939 568 H LEU 76 HN LEU 76 -14.490 -0.792 -2.317 569 HA LEU 76 HA LEU 76 -15.152 1.461 -0.531 570 1HB LEU 76 HB2 LEU 76 -15.497 1.651 -3.529 571 2HB LEU 76 HB3 LEU 76 -15.663 2.898 -2.297 572 HG LEU 76 HG LEU 76 -13.019 1.754 -3.309 573 1HD1 LEU 76 HD11 LEU 76 -14.225 3.200 -4.924 574 2HD1 LEU 76 HD12 LEU 76 -14.329 4.478 -3.697 575 3HD1 LEU 76 HD13 LEU 76 -12.747 3.959 -4.319 576 1HD2 LEU 76 HD21 LEU 76 -11.986 3.557 -2.001 577 2HD2 LEU 76 HD22 LEU 76 -13.572 3.964 -1.311 578 3HD2 LEU 76 HD23 LEU 76 -12.814 2.380 -0.976 579 H VAL 77 HN VAL 77 -17.147 0.953 0.265 580 HA VAL 77 HA VAL 77 -18.764 -1.058 -1.237 581 HB VAL 77 HB VAL 77 -19.494 -0.148 1.543 582 1HG1 VAL 77 HG11 VAL 77 -20.361 -2.402 1.702 583 2HG1 VAL 77 HG12 VAL 77 -20.999 -1.609 0.258 584 3HG1 VAL 77 HG13 VAL 77 -19.698 -2.809 0.102 585 1HG2 VAL 77 HG21 VAL 77 -17.134 -0.666 1.879 586 2HG2 VAL 77 HG22 VAL 77 -18.117 -1.992 2.499 587 3HG2 VAL 77 HG23 VAL 77 -17.287 -2.157 0.938 588 H LEU 78 HN LEU 78 -20.497 -0.362 -2.429 589 HA LEU 78 HA LEU 78 -21.503 2.392 -1.915 590 1HB LEU 78 HB2 LEU 78 -20.851 1.002 -4.547 591 2HB LEU 78 HB3 LEU 78 -22.015 2.308 -4.440 592 HG LEU 78 HG LEU 78 -20.134 3.675 -3.302 593 1HD1 LEU 78 HD11 LEU 78 -17.853 3.136 -4.087 594 2HD1 LEU 78 HD12 LEU 78 -18.473 1.912 -2.995 595 3HD1 LEU 78 HD13 LEU 78 -18.445 1.590 -4.738 596 1HD2 LEU 78 HD21 LEU 78 -19.397 4.538 -5.424 597 2HD2 LEU 78 HD22 LEU 78 -19.934 3.063 -6.260 598 3HD2 LEU 78 HD23 LEU 78 -21.115 4.161 -5.505 599 H LYS 79 HN LYS 79 -23.681 2.799 -2.476 600 HA LYS 79 HA LYS 79 -25.456 0.491 -2.968 601 1HB LYS 79 HB2 LYS 79 -25.818 2.581 -0.752 602 2HB LYS 79 HB3 LYS 79 -27.095 1.533 -1.377 603 1HG LYS 79 HG2 LYS 79 -25.672 -0.444 -0.741 604 2HG LYS 79 HG3 LYS 79 -24.556 0.645 0.039 605 1HD LYS 79 HD2 LYS 79 -26.089 -0.449 1.602 606 2HD LYS 79 HD3 LYS 79 -26.287 1.308 1.658 607 1HE LYS 79 HE2 LYS 79 -28.340 1.154 0.332 608 2HE LYS 79 HE3 LYS 79 -28.089 -0.579 0.080 609 1HZ LYS 79 HZ1 LYS 79 -28.346 -0.898 2.475 610 2HZ LYS 79 HZ2 LYS 79 -28.641 0.705 2.691 611 3HZ LYS 79 HZ3 LYS 79 -29.684 -0.205 1.829 612 H ASP 80 HN ASP 80 -26.775 1.047 -4.550 613 HA ASP 80 HA ASP 80 -27.780 2.187 -6.178 614 1HB ASP 80 HB2 ASP 80 -29.262 2.069 -4.176 615 2HB ASP 80 HB3 ASP 80 -28.807 3.718 -3.763 616 H GLY 81 HN GLY 81 -25.183 3.262 -6.022 617 1HA GLY 81 HA2 GLY 81 -24.372 4.889 -7.529 618 2HA GLY 81 HA3 GLY 81 -25.615 6.030 -6.999 619 H GLU 82 HN GLU 82 -24.500 4.966 -4.113 620 HA GLU 82 HA GLU 82 -22.270 6.895 -4.073 621 1HB GLU 82 HB2 GLU 82 -23.280 8.085 -2.317 622 2HB GLU 82 HB3 GLU 82 -24.528 7.830 -3.568 623 1HG GLU 82 HG2 GLU 82 -25.486 5.996 -2.224 624 2HG GLU 82 HG3 GLU 82 -24.268 6.274 -0.969 625 H VAL 83 HN VAL 83 -20.870 6.824 -2.274 626 HA VAL 83 HA VAL 83 -20.237 4.161 -1.239 627 HB VAL 83 HB VAL 83 -19.116 6.899 -0.481 628 1HG1 VAL 83 HG11 VAL 83 -17.078 5.609 0.092 629 2HG1 VAL 83 HG12 VAL 83 -18.453 5.093 1.065 630 3HG1 VAL 83 HG13 VAL 83 -17.920 4.097 -0.311 631 1HG2 VAL 83 HG21 VAL 83 -18.833 6.642 -2.925 632 2HG2 VAL 83 HG22 VAL 83 -17.287 6.455 -2.103 633 3HG2 VAL 83 HG23 VAL 83 -18.148 5.021 -2.683 634 H VAL 84 HN VAL 84 -20.526 3.346 0.720 635 HA VAL 84 HA VAL 84 -21.996 4.968 2.724 636 HB VAL 84 HB VAL 84 -23.309 3.017 3.304 637 1HG1 VAL 84 HG11 VAL 84 -23.689 3.666 0.354 638 2HG1 VAL 84 HG12 VAL 84 -24.919 3.118 1.509 639 3HG1 VAL 84 HG13 VAL 84 -24.189 4.714 1.698 640 1HG2 VAL 84 HG21 VAL 84 -23.483 1.026 1.969 641 2HG2 VAL 84 HG22 VAL 84 -22.307 1.632 0.785 642 3HG2 VAL 84 HG23 VAL 84 -21.801 1.207 2.439 643 H GLU 85 HN GLU 85 -19.421 2.589 1.917 644 HA GLU 85 HA GLU 85 -18.269 3.168 4.475 645 1HB GLU 85 HB2 GLU 85 -19.794 1.079 4.666 646 2HB GLU 85 HB3 GLU 85 -18.633 0.341 3.530 647 1HG GLU 85 HG2 GLU 85 -18.217 -0.337 5.693 648 2HG GLU 85 HG3 GLU 85 -16.898 0.549 4.924 649 H THR 86 HN THR 86 -16.092 2.114 4.423 650 HA THR 86 HA THR 86 -14.749 1.815 1.849 651 HB THR 86 HB THR 86 -14.177 4.272 3.579 652 HG1 THR 86 HG1 THR 86 -16.083 3.898 1.670 653 1HG2 THR 86 HG21 THR 86 -12.963 4.942 1.464 654 2HG2 THR 86 HG22 THR 86 -12.316 3.449 2.191 655 3HG2 THR 86 HG23 THR 86 -13.430 3.349 0.809 656 H SER 87 HN SER 87 -12.931 0.551 2.282 657 HA SER 87 HA SER 87 -11.699 0.553 4.968 658 1HB SER 87 HB2 SER 87 -12.828 -1.948 3.629 659 2HB SER 87 HB3 SER 87 -11.905 -1.889 5.140 660 HG SER 87 HG SER 87 -14.135 -1.995 5.546 661 H VAL 88 HN VAL 88 -9.541 -0.254 4.906 662 HA VAL 88 HA VAL 88 -8.466 -1.020 2.247 663 HB VAL 88 HB VAL 88 -7.234 1.084 4.081 664 1HG1 VAL 88 HG11 VAL 88 -5.745 1.406 2.050 665 2HG1 VAL 88 HG12 VAL 88 -5.485 -0.112 2.931 666 3HG1 VAL 88 HG13 VAL 88 -6.398 -0.098 1.397 667 1HG2 VAL 88 HG21 VAL 88 -7.661 2.692 2.247 668 2HG2 VAL 88 HG22 VAL 88 -8.572 1.448 1.376 669 3HG2 VAL 88 HG23 VAL 88 -9.167 2.080 2.928 670 H GLY 89 HN GLY 89 -7.428 -2.860 2.456 671 1HA GLY 89 HA2 GLY 89 -5.417 -3.881 3.552 672 2HA GLY 89 HA3 GLY 89 -6.227 -3.661 5.102 673 H PHE 90 HN PHE 90 -5.360 -6.201 4.084 674 HA PHE 90 HA PHE 90 -7.436 -7.659 2.813 675 1HB PHE 90 HB2 PHE 90 -5.099 -8.442 2.910 676 2HB PHE 90 HB3 PHE 90 -5.185 -8.564 4.656 677 HD1 PHE 90 HD1 PHE 90 -6.784 -9.939 1.524 678 HD2 PHE 90 HD2 PHE 90 -5.886 -10.577 5.699 679 HE1 PHE 90 HE1 PHE 90 -7.787 -12.206 1.405 680 HE2 PHE 90 HE2 PHE 90 -6.853 -12.854 5.554 681 HZ PHE 90 HZ PHE 90 -7.811 -13.670 3.408 682 H LYS 91 HN LYS 91 -8.992 -9.147 3.672 683 HA LYS 91 HA LYS 91 -9.124 -9.630 6.487 684 1HB LYS 91 HB2 LYS 91 -11.258 -8.842 7.035 685 2HB LYS 91 HB3 LYS 91 -10.309 -7.503 6.548 686 1HG LYS 91 HG2 LYS 91 -12.202 -8.809 4.562 687 2HG LYS 91 HG3 LYS 91 -12.827 -7.744 5.799 688 1HD LYS 91 HD2 LYS 91 -10.721 -6.863 3.771 689 2HD LYS 91 HD3 LYS 91 -12.459 -6.678 3.603 690 1HE LYS 91 HE2 LYS 91 -11.968 -4.621 4.416 691 2HE LYS 91 HE3 LYS 91 -12.416 -5.465 5.897 692 1HZ LYS 91 HZ1 LYS 91 -10.018 -5.723 6.351 693 2HZ LYS 91 HZ2 LYS 91 -9.638 -4.977 4.940 694 3HZ LYS 91 HZ3 LYS 91 -10.379 -4.148 6.148 695 HA PRO 92 HA PRO 92 -10.406 -13.381 4.682 696 1HB PRO 92 HB2 PRO 92 -11.570 -14.753 6.768 697 2HB PRO 92 HB3 PRO 92 -9.829 -14.355 6.693 698 1HG PRO 92 HG2 PRO 92 -12.026 -12.818 8.114 699 2HG PRO 92 HG3 PRO 92 -10.453 -13.371 8.781 700 1HD PRO 92 HD2 PRO 92 -10.763 -10.849 7.866 701 2HD PRO 92 HD3 PRO 92 -9.255 -11.748 7.543 702 H LYS 93 HN LYS 93 -12.405 -15.001 4.646 703 HA LYS 93 HA LYS 93 -14.204 -13.713 2.933 704 1HB LYS 93 HB2 LYS 93 -13.390 -16.311 3.518 705 2HB LYS 93 HB3 LYS 93 -15.038 -16.348 4.088 706 1HG LYS 93 HG2 LYS 93 -14.111 -15.535 1.312 707 2HG LYS 93 HG3 LYS 93 -14.694 -17.134 1.748 708 1HD LYS 93 HD2 LYS 93 -16.392 -14.608 1.871 709 2HD LYS 93 HD3 LYS 93 -16.285 -15.721 0.516 710 1HE LYS 93 HE2 LYS 93 -18.184 -16.487 1.484 711 2HE LYS 93 HE3 LYS 93 -17.005 -17.594 2.171 712 1HZ LYS 93 HZ1 LYS 93 -18.793 -16.454 3.594 713 2HZ LYS 93 HZ2 LYS 93 -17.295 -16.601 4.270 714 3HZ LYS 93 HZ3 LYS 93 -17.800 -15.163 3.646 715 H GLU 94 HN GLU 94 -14.579 -14.510 6.353 716 HA GLU 94 HA GLU 94 -17.384 -13.915 6.377 717 1HB GLU 94 HB2 GLU 94 -15.275 -14.410 8.516 718 2HB GLU 94 HB3 GLU 94 -16.940 -13.982 8.917 719 1HG GLU 94 HG2 GLU 94 -16.546 -16.397 9.007 720 2HG GLU 94 HG3 GLU 94 -17.821 -15.934 7.873 721 H ALA 95 HN ALA 95 -14.389 -12.197 7.315 722 HA ALA 95 HA ALA 95 -15.599 -9.854 8.400 723 1HB ALA 95 HB1 ALA 95 -13.387 -8.870 7.989 724 2HB ALA 95 HB2 ALA 95 -13.195 -10.516 8.640 725 3HB ALA 95 HB3 ALA 95 -12.974 -10.209 6.895 726 H LEU 96 HN LEU 96 -14.628 -10.800 5.127 727 HA LEU 96 HA LEU 96 -15.179 -8.416 3.767 728 1HB LEU 96 HB2 LEU 96 -14.239 -10.858 3.002 729 2HB LEU 96 HB3 LEU 96 -15.907 -11.085 2.526 730 HG LEU 96 HG LEU 96 -15.542 -8.645 1.411 731 1HD1 LEU 96 HD11 LEU 96 -12.736 -9.847 1.509 732 2HD1 LEU 96 HD12 LEU 96 -13.222 -8.366 0.651 733 3HD1 LEU 96 HD13 LEU 96 -13.278 -8.446 2.427 734 1HD2 LEU 96 HD21 LEU 96 -14.942 -11.402 0.379 735 2HD2 LEU 96 HD22 LEU 96 -16.180 -10.240 -0.101 736 3HD2 LEU 96 HD23 LEU 96 -14.502 -10.003 -0.617 737 H GLN 97 HN GLN 97 -17.280 -11.245 4.332 738 HA GLN 97 HA GLN 97 -19.519 -10.032 3.070 739 1HB GLN 97 HB2 GLN 97 -20.645 -11.875 3.408 740 2HB GLN 97 HB3 GLN 97 -18.988 -12.488 3.439 741 1HG GLN 97 HG2 GLN 97 -19.209 -12.602 5.935 742 2HG GLN 97 HG3 GLN 97 -20.935 -12.220 5.748 743 1HE2 GLN 97 HE22 GLN 97 -21.819 -13.760 3.605 744 2HE2 GLN 97 HE21 GLN 97 -21.217 -15.403 3.665 745 H GLU 98 HN GLU 98 -18.498 -10.143 6.518 746 HA GLU 98 HA GLU 98 -20.846 -8.971 7.548 747 1HB GLU 98 HB2 GLU 98 -19.136 -9.973 8.944 748 2HB GLU 98 HB3 GLU 98 -17.955 -8.743 8.469 749 1HG GLU 98 HG2 GLU 98 -19.274 -6.994 9.562 750 2HG GLU 98 HG3 GLU 98 -20.560 -8.149 9.932 751 H LEU 99 HN LEU 99 -17.911 -7.438 6.218 752 HA LEU 99 HA LEU 99 -18.527 -4.763 6.779 753 1HB LEU 99 HB2 LEU 99 -16.315 -5.380 6.199 754 2HB LEU 99 HB3 LEU 99 -16.831 -6.161 4.712 755 HG LEU 99 HG LEU 99 -17.326 -4.007 3.663 756 1HD1 LEU 99 HD11 LEU 99 -16.208 -2.740 6.213 757 2HD1 LEU 99 HD12 LEU 99 -16.588 -1.889 4.688 758 3HD1 LEU 99 HD13 LEU 99 -17.877 -2.606 5.637 759 1HD2 LEU 99 HD21 LEU 99 -14.996 -3.319 3.407 760 2HD2 LEU 99 HD22 LEU 99 -14.556 -4.174 4.913 761 3HD2 LEU 99 HD23 LEU 99 -15.120 -5.087 3.505 762 H VAL 100 HN VAL 100 -19.441 -6.735 3.939 763 HA VAL 100 HA VAL 100 -20.866 -4.362 2.865 764 HB VAL 100 HB VAL 100 -19.545 -5.621 1.348 765 1HG1 VAL 100 HG11 VAL 100 -19.830 -7.930 2.210 766 2HG1 VAL 100 HG12 VAL 100 -21.524 -7.929 1.685 767 3HG1 VAL 100 HG13 VAL 100 -20.212 -7.820 0.492 768 1HG2 VAL 100 HG21 VAL 100 -21.121 -5.589 -0.462 769 2HG2 VAL 100 HG22 VAL 100 -22.494 -5.882 0.626 770 3HG2 VAL 100 HG23 VAL 100 -21.630 -4.340 0.672 771 H ASN 101 HN ASN 101 -21.748 -7.496 4.344 772 HA ASN 101 HA ASN 101 -24.513 -7.441 3.871 773 1HB ASN 101 HB2 ASN 101 -23.391 -9.418 4.695 774 2HB ASN 101 HB3 ASN 101 -23.009 -8.605 6.221 775 1HD2 ASN 101 HD22 ASN 101 -24.667 -8.349 7.796 776 2HD2 ASN 101 HD21 ASN 101 -26.250 -9.057 7.610 777 H LYS 102 HN LYS 102 -22.624 -5.780 6.391 778 HA LYS 102 HA LYS 102 -24.882 -5.051 7.968 779 1HB LYS 102 HB2 LYS 102 -23.403 -3.716 9.241 780 2HB LYS 102 HB3 LYS 102 -22.462 -5.098 8.686 781 1HG LYS 102 HG2 LYS 102 -21.665 -3.557 6.783 782 2HG LYS 102 HG3 LYS 102 -22.350 -2.237 7.759 783 1HD LYS 102 HD2 LYS 102 -20.960 -3.047 9.721 784 2HD LYS 102 HD3 LYS 102 -20.265 -4.285 8.657 785 1HE LYS 102 HE2 LYS 102 -18.702 -2.535 8.711 786 2HE LYS 102 HE3 LYS 102 -19.507 -2.490 7.125 787 1HZ LYS 102 HZ1 LYS 102 -20.770 -0.617 7.824 788 2HZ LYS 102 HZ2 LYS 102 -20.231 -0.708 9.386 789 3HZ LYS 102 HZ3 LYS 102 -19.232 -0.253 8.170 790 H HIS 103 HN HIS 103 -24.108 -3.933 4.854 791 HA HIS 103 HA HIS 103 -25.956 -1.602 5.212 792 1HB HIS 103 HB2 HIS 103 -23.652 -1.885 3.239 793 2HB HIS 103 HB3 HIS 103 -24.776 -0.532 3.348 794 HD1 HIS 103 HD1 HIS 103 -24.603 0.983 5.679 795 HD2 HIS 103 HD2 HIS 103 -21.518 -1.745 4.783 796 HE1 HIS 103 HE1 HIS 103 -22.622 1.646 7.127 797 H LEU 104 HN LEU 104 -25.011 -4.400 3.266 798 HA LEU 104 HA LEU 104 -26.655 -4.096 0.965 799 1HB LEU 104 HB2 LEU 104 -24.831 -5.547 0.891 800 2HB LEU 104 HB3 LEU 104 -25.264 -6.290 2.419 801 HG LEU 104 HG LEU 104 -27.124 -7.484 1.447 802 1HD1 LEU 104 HD11 LEU 104 -27.623 -5.806 -0.436 803 2HD1 LEU 104 HD12 LEU 104 -26.202 -6.468 -1.277 804 3HD1 LEU 104 HD13 LEU 104 -27.592 -7.498 -0.915 805 1HD2 LEU 104 HD21 LEU 104 -25.737 -9.022 0.108 806 2HD2 LEU 104 HD22 LEU 104 -24.493 -7.770 -0.064 807 3HD2 LEU 104 HD23 LEU 104 -24.881 -8.441 1.536 808 1H MET 1 H1 MET 1 9.735 28.750 -9.349 809 2H MET 1 H2 MET 1 8.804 30.084 -9.480 810 3H MET 1 H3 MET 1 9.055 29.143 -10.795 811 HA MET 1 HA MET 1 6.846 28.790 -9.901 812 1HB MET 1 HB2 MET 1 8.747 26.426 -9.585 813 2HB MET 1 HB3 MET 1 6.993 26.304 -9.456 814 1HG MET 1 HG2 MET 1 8.521 27.212 -11.921 815 2HG MET 1 HG3 MET 1 7.742 25.654 -11.674 816 1HE MET 1 HE1 MET 1 5.533 27.243 -14.474 817 2HE MET 1 HE2 MET 1 7.290 27.414 -14.262 818 3HE MET 1 HE3 MET 1 6.506 25.840 -13.980 819 H GLU 2 HN GLU 2 5.654 29.172 -8.125 820 HA GLU 2 HA GLU 2 6.881 29.179 -5.463 821 1HB GLU 2 HB2 GLU 2 4.087 29.869 -6.468 822 2HB GLU 2 HB3 GLU 2 4.604 29.968 -4.776 823 1HG GLU 2 HG2 GLU 2 6.376 31.587 -5.405 824 2HG GLU 2 HG3 GLU 2 5.848 31.521 -7.087 825 H ASN 3 HN ASN 3 7.433 26.909 -5.544 826 HA ASN 3 HA ASN 3 7.351 25.018 -4.521 827 1HB ASN 3 HB2 ASN 3 4.412 25.233 -3.862 828 2HB ASN 3 HB3 ASN 3 5.602 24.134 -3.198 829 1HD2 ASN 3 HD22 ASN 3 7.336 25.105 -1.693 830 2HD2 ASN 3 HD21 ASN 3 7.032 26.668 -0.983 831 H LYS 4 HN LYS 4 7.531 23.327 -5.304 832 HA LYS 4 HA LYS 4 5.744 22.058 -7.285 833 1HB LYS 4 HB2 LYS 4 8.795 22.018 -7.095 834 2HB LYS 4 HB3 LYS 4 7.844 21.050 -8.236 835 1HG LYS 4 HG2 LYS 4 6.962 23.096 -9.285 836 2HG LYS 4 HG3 LYS 4 7.840 24.116 -8.139 837 1HD LYS 4 HD2 LYS 4 9.134 22.199 -10.092 838 2HD LYS 4 HD3 LYS 4 8.923 23.953 -10.317 839 1HE LYS 4 HE2 LYS 4 10.284 24.378 -8.297 840 2HE LYS 4 HE3 LYS 4 10.571 22.648 -8.108 841 1HZ LYS 4 HZ1 LYS 4 11.386 24.172 -10.518 842 2HZ LYS 4 HZ2 LYS 4 12.389 23.866 -9.270 843 3HZ LYS 4 HZ3 LYS 4 11.777 22.624 -10.158 844 H ILE 5 HN ILE 5 5.071 20.009 -6.486 845 HA ILE 5 HA ILE 5 6.021 19.581 -3.720 846 HB ILE 5 HB ILE 5 3.475 18.782 -5.130 847 1HG1 ILE 5 HG12 ILE 5 4.365 20.986 -3.279 848 2HG1 ILE 5 HG13 ILE 5 3.378 21.065 -4.728 849 1HG2 ILE 5 HG21 ILE 5 2.686 17.895 -2.998 850 2HG2 ILE 5 HG22 ILE 5 4.124 17.025 -3.504 851 3HG2 ILE 5 HG23 ILE 5 4.260 18.273 -2.233 852 1HD1 ILE 5 HD11 ILE 5 2.063 21.604 -2.800 853 2HD1 ILE 5 HD12 ILE 5 1.496 20.037 -3.440 854 3HD1 ILE 5 HD13 ILE 5 2.532 20.101 -1.983 855 H ILE 6 HN ILE 6 6.812 17.711 -2.963 856 HA ILE 6 HA ILE 6 7.229 15.458 -4.836 857 HB ILE 6 HB ILE 6 9.242 16.960 -4.856 858 1HG1 ILE 6 HG12 ILE 6 9.607 14.124 -3.828 859 2HG1 ILE 6 HG13 ILE 6 9.366 14.660 -5.495 860 1HG2 ILE 6 HG21 ILE 6 9.189 17.707 -2.485 861 2HG2 ILE 6 HG22 ILE 6 9.697 16.079 -1.979 862 3HG2 ILE 6 HG23 ILE 6 10.760 17.096 -2.974 863 1HD1 ILE 6 HD11 ILE 6 11.693 14.147 -5.195 864 2HD1 ILE 6 HD12 ILE 6 11.524 15.901 -5.410 865 3HD1 ILE 6 HD13 ILE 6 11.819 15.215 -3.792 866 H TYR 7 HN TYR 7 7.040 13.459 -3.781 867 HA TYR 7 HA TYR 7 6.141 13.615 -0.940 868 1HB TYR 7 HB2 TYR 7 4.447 13.554 -2.934 869 2HB TYR 7 HB3 TYR 7 4.911 11.877 -3.081 870 HD1 TYR 7 HD1 TYR 7 4.611 10.371 -0.834 871 HD2 TYR 7 HD2 TYR 7 2.809 14.256 -1.473 872 HE1 TYR 7 HE1 TYR 7 2.716 9.709 0.516 873 HE2 TYR 7 HE2 TYR 7 0.912 13.568 -0.023 874 HH TYR 7 HH TYR 7 -0.068 11.925 1.102 875 H PHE 8 HN PHE 8 6.947 11.950 0.346 876 HA PHE 8 HA PHE 8 8.579 9.853 -1.021 877 1HB PHE 8 HB2 PHE 8 8.720 10.792 1.852 878 2HB PHE 8 HB3 PHE 8 9.792 9.651 1.062 879 HD1 PHE 8 HD1 PHE 8 9.706 11.894 -1.528 880 HD2 PHE 8 HD2 PHE 8 10.927 11.779 2.614 881 HE1 PHE 8 HE1 PHE 8 11.233 13.766 -1.932 882 HE2 PHE 8 HE2 PHE 8 12.453 13.650 2.175 883 HZ PHE 8 HZ PHE 8 12.590 14.695 -0.061 884 H LEU 9 HN LEU 9 8.185 7.677 -0.550 885 HA LEU 9 HA LEU 9 5.968 7.035 1.350 886 1HB LEU 9 HB2 LEU 9 6.435 6.065 -1.497 887 2HB LEU 9 HB3 LEU 9 5.617 5.055 -0.311 888 HG LEU 9 HG LEU 9 4.662 7.782 -1.259 889 1HD1 LEU 9 HD11 LEU 9 4.490 5.917 -2.915 890 2HD1 LEU 9 HD12 LEU 9 3.599 4.963 -1.736 891 3HD1 LEU 9 HD13 LEU 9 2.893 6.468 -2.370 892 1HD2 LEU 9 HD21 LEU 9 3.393 5.804 0.694 893 2HD2 LEU 9 HD22 LEU 9 3.892 7.474 1.036 894 3HD2 LEU 9 HD23 LEU 9 2.536 7.173 -0.052 895 H SER 10 HN SER 10 6.694 5.696 2.912 896 HA SER 10 HA SER 10 8.559 3.584 2.281 897 1HB SER 10 HB2 SER 10 10.253 4.271 3.910 898 2HB SER 10 HB3 SER 10 10.165 5.393 2.556 899 HG SER 10 HG SER 10 8.894 6.769 3.929 900 H THR 11 HN THR 11 8.484 1.947 3.903 901 HA THR 11 HA THR 11 6.107 1.458 5.066 902 HB THR 11 HB THR 11 8.867 0.490 5.890 903 HG1 THR 11 HG1 THR 11 8.270 -1.203 4.432 904 1HG2 THR 11 HG21 THR 11 7.724 -1.528 6.732 905 2HG2 THR 11 HG22 THR 11 7.249 -0.111 7.654 906 3HG2 THR 11 HG23 THR 11 6.136 -0.763 6.431 907 H GLY 12 HN GLY 12 4.959 2.636 6.434 908 1HA GLY 12 HA2 GLY 12 4.264 3.508 8.445 909 2HA GLY 12 HA3 GLY 12 5.696 2.785 9.197 910 H ASN 13 HN ASN 13 6.452 4.864 6.602 911 HA ASN 13 HA ASN 13 7.936 6.580 6.547 912 1HB ASN 13 HB2 ASN 13 5.492 7.447 6.497 913 2HB ASN 13 HB3 ASN 13 5.853 8.127 8.092 914 1HD2 ASN 13 HD22 ASN 13 7.067 10.129 8.131 915 2HD2 ASN 13 HD21 ASN 13 7.715 10.831 6.685 916 H SER 14 HN SER 14 8.686 4.953 8.859 917 HA SER 14 HA SER 14 8.736 6.437 11.234 918 1HB SER 14 HB2 SER 14 10.397 4.539 11.832 919 2HB SER 14 HB3 SER 14 8.741 4.112 11.364 920 HG SER 14 HG SER 14 10.335 2.839 10.294 921 H ALA 15 HN ALA 15 11.449 5.890 8.929 922 HA ALA 15 HA ALA 15 12.999 7.929 10.480 923 1HB ALA 15 HB1 ALA 15 14.891 6.399 10.506 924 2HB ALA 15 HB2 ALA 15 13.456 5.498 11.060 925 3HB ALA 15 HB3 ALA 15 14.062 5.279 9.422 926 H ARG 16 HN ARG 16 13.624 5.956 7.501 927 HA ARG 16 HA ARG 16 15.464 7.814 6.491 928 1HB ARG 16 HB2 ARG 16 14.463 6.699 4.138 929 2HB ARG 16 HB3 ARG 16 15.823 6.155 5.090 930 1HG ARG 16 HG2 ARG 16 14.414 4.295 4.547 931 2HG ARG 16 HG3 ARG 16 14.428 4.571 6.292 932 1HD ARG 16 HD2 ARG 16 12.147 5.814 5.879 933 2HD ARG 16 HD3 ARG 16 12.210 5.048 4.293 934 HE ARG 16 HE ARG 16 12.784 2.979 5.981 935 1HH1 ARG 16 HH21 ARG 16 9.975 5.200 5.948 936 2HH1 ARG 16 HH22 ARG 16 9.050 4.102 6.948 937 1HH2 ARG 16 HH11 ARG 16 11.423 1.563 7.001 938 2HH2 ARG 16 HH12 ARG 16 9.878 2.125 7.642 939 H SER 17 HN SER 17 11.951 7.886 6.145 940 HA SER 17 HA SER 17 11.648 9.907 4.194 941 1HB SER 17 HB2 SER 17 9.545 10.228 5.684 942 2HB SER 17 HB3 SER 17 9.772 8.665 4.871 943 HG SER 17 HG SER 17 9.312 8.837 7.345 944 H GLN 18 HN GLN 18 11.734 10.072 7.745 945 HA GLN 18 HA GLN 18 11.616 12.808 8.214 946 1HB GLN 18 HB2 GLN 18 13.388 11.007 9.838 947 2HB GLN 18 HB3 GLN 18 12.459 12.383 10.350 948 1HG GLN 18 HG2 GLN 18 11.226 9.732 9.489 949 2HG GLN 18 HG3 GLN 18 11.597 10.170 11.134 950 1HE2 GLN 18 HE22 GLN 18 8.929 9.515 9.975 951 2HE2 GLN 18 HE21 GLN 18 7.948 10.911 10.343 952 H MET 19 HN MET 19 14.440 10.719 7.803 953 HA MET 19 HA MET 19 16.359 12.765 8.118 954 1HB MET 19 HB2 MET 19 16.617 10.221 8.351 955 2HB MET 19 HB3 MET 19 16.655 10.156 6.581 956 1HG MET 19 HG2 MET 19 18.556 12.055 7.009 957 2HG MET 19 HG3 MET 19 18.674 11.186 8.532 958 1HE MET 19 HE1 MET 19 18.502 8.523 8.512 959 2HE MET 19 HE2 MET 19 17.768 8.071 6.951 960 3HE MET 19 HE3 MET 19 19.415 7.534 7.313 961 H ALA 20 HN ALA 20 14.930 11.211 5.177 962 HA ALA 20 HA ALA 20 16.456 12.593 3.249 963 1HB ALA 20 HB1 ALA 20 15.209 10.608 2.672 964 2HB ALA 20 HB2 ALA 20 13.665 11.408 3.057 965 3HB ALA 20 HB3 ALA 20 14.647 11.961 1.683 966 H GLU 21 HN GLU 21 13.366 13.479 4.887 967 HA GLU 21 HA GLU 21 13.040 15.682 3.089 968 1HB GLU 21 HB2 GLU 21 11.104 16.284 4.262 969 2HB GLU 21 HB3 GLU 21 11.153 14.527 4.104 970 1HG GLU 21 HG2 GLU 21 11.816 14.316 6.451 971 2HG GLU 21 HG3 GLU 21 11.832 16.077 6.605 972 H GLY 22 HN GLY 22 14.790 15.326 6.151 973 1HA GLY 22 HA2 GLY 22 15.300 18.192 6.416 974 2HA GLY 22 HA3 GLY 22 16.148 16.872 7.220 975 H TRP 23 HN TRP 23 17.135 15.352 5.083 976 HA TRP 23 HA TRP 23 19.391 16.703 4.060 977 1HB TRP 23 HB2 TRP 23 17.858 14.224 3.238 978 2HB TRP 23 HB3 TRP 23 19.104 14.836 2.187 979 HD1 TRP 23 HD1 TRP 23 18.719 12.415 4.802 980 HE1 TRP 23 HE1 TRP 23 20.969 11.604 5.662 981 HE3 TRP 23 HE3 TRP 23 21.650 16.052 2.801 982 HZ2 TRP 23 HZ2 TRP 23 23.767 12.423 5.451 983 HZ3 TRP 23 HZ3 TRP 23 24.124 15.971 3.034 984 HH2 TRP 23 HH2 TRP 23 25.188 14.139 4.320 985 H ALA 24 HN ALA 24 16.118 16.385 2.731 986 HA ALA 24 HA ALA 24 16.758 17.516 0.183 987 1HB ALA 24 HB1 ALA 24 14.787 16.023 0.593 988 2HB ALA 24 HB2 ALA 24 14.066 17.267 1.632 989 3HB ALA 24 HB3 ALA 24 14.305 17.589 -0.083 990 H LYS 25 HN LYS 25 15.137 18.867 3.177 991 HA LYS 25 HA LYS 25 14.421 21.210 1.804 992 1HB LYS 25 HB2 LYS 25 13.400 20.186 3.905 993 2HB LYS 25 HB3 LYS 25 14.647 21.042 4.828 994 1HG LYS 25 HG2 LYS 25 13.797 23.193 3.997 995 2HG LYS 25 HG3 LYS 25 12.720 22.366 2.855 996 1HD LYS 25 HD2 LYS 25 11.528 21.317 4.800 997 2HD LYS 25 HD3 LYS 25 12.501 22.301 5.898 998 1HE LYS 25 HE2 LYS 25 10.646 23.372 3.706 999 2HE LYS 25 HE3 LYS 25 10.206 23.213 5.404 1000 1HZ LYS 25 HZ1 LYS 25 10.897 25.453 4.917 1001 2HZ LYS 25 HZ2 LYS 25 11.959 24.796 5.959 1002 3HZ LYS 25 HZ3 LYS 25 12.357 24.974 4.381 1003 H GLN 26 HN GLN 26 17.489 20.475 3.378 1004 HA GLN 26 HA GLN 26 18.418 23.163 3.487 1005 1HB GLN 26 HB2 GLN 26 20.702 22.153 3.336 1006 2HB GLN 26 HB3 GLN 26 19.696 21.504 4.636 1007 1HG GLN 26 HG2 GLN 26 19.420 19.446 3.630 1008 2HG GLN 26 HG3 GLN 26 19.568 20.082 2.002 1009 1HE2 GLN 26 HE22 GLN 26 20.773 18.052 1.835 1010 2HE2 GLN 26 HE21 GLN 26 22.517 18.115 2.114 1011 H TYR 27 HN TYR 27 17.652 21.316 0.666 1012 HA TYR 27 HA TYR 27 19.067 23.332 -1.038 1013 1HB TYR 27 HB2 TYR 27 19.055 20.319 -1.209 1014 2HB TYR 27 HB3 TYR 27 19.019 21.228 -2.699 1015 HD1 TYR 27 HD1 TYR 27 20.923 22.317 -3.608 1016 HD2 TYR 27 HD2 TYR 27 21.058 20.631 0.352 1017 HE1 TYR 27 HE1 TYR 27 23.381 22.602 -3.578 1018 HE2 TYR 27 HE2 TYR 27 23.512 20.942 0.417 1019 HH TYR 27 HH TYR 27 25.349 22.319 -2.352 1020 H LEU 28 HN LEU 28 16.299 21.115 -0.760 1021 HA LEU 28 HA LEU 28 14.870 22.229 -3.044 1022 1HB LEU 28 HB2 LEU 28 13.992 20.221 -0.913 1023 2HB LEU 28 HB3 LEU 28 13.035 20.747 -2.285 1024 HG LEU 28 HG LEU 28 15.510 19.011 -2.308 1025 1HD1 LEU 28 HD11 LEU 28 14.033 17.377 -3.330 1026 2HD1 LEU 28 HD12 LEU 28 13.197 18.008 -1.900 1027 3HD1 LEU 28 HD13 LEU 28 12.733 18.576 -3.504 1028 1HD2 LEU 28 HD21 LEU 28 15.722 20.576 -4.230 1029 2HD2 LEU 28 HD22 LEU 28 15.374 18.925 -4.758 1030 3HD2 LEU 28 HD23 LEU 28 14.085 20.144 -4.754 1031 H GLY 29 HN GLY 29 15.199 24.322 -2.189 1032 1HA GLY 29 HA2 GLY 29 14.090 25.405 0.212 1033 2HA GLY 29 HA3 GLY 29 14.518 26.300 -1.255 1034 H ASP 30 HN ASP 30 12.538 27.596 -0.595 1035 HA ASP 30 HA ASP 30 9.937 26.483 -0.657 1036 1HB ASP 30 HB2 ASP 30 10.544 28.656 0.374 1037 2HB ASP 30 HB3 ASP 30 10.741 29.347 -1.242 1038 H GLU 31 HN GLU 31 12.047 26.825 -3.247 1039 HA GLU 31 HA GLU 31 10.219 27.216 -5.448 1040 1HB GLU 31 HB2 GLU 31 12.591 27.469 -5.730 1041 2HB GLU 31 HB3 GLU 31 12.925 25.856 -5.085 1042 1HG GLU 31 HG2 GLU 31 11.873 24.807 -6.975 1043 2HG GLU 31 HG3 GLU 31 11.391 26.372 -7.659 1044 H TRP 32 HN TRP 32 10.674 24.702 -3.113 1045 HA TRP 32 HA TRP 32 9.058 22.717 -4.602 1046 1HB TRP 32 HB2 TRP 32 11.370 22.198 -2.734 1047 2HB TRP 32 HB3 TRP 32 10.464 20.996 -3.638 1048 HD1 TRP 32 HD1 TRP 32 13.137 23.663 -4.061 1049 HE1 TRP 32 HE1 TRP 32 14.430 23.272 -6.247 1050 HE3 TRP 32 HE3 TRP 32 10.186 20.010 -6.091 1051 HZ2 TRP 32 HZ2 TRP 32 14.212 21.598 -8.563 1052 HZ3 TRP 32 HZ3 TRP 32 10.728 19.058 -8.318 1053 HH2 TRP 32 HH2 TRP 32 12.732 19.832 -9.563 1054 H LYS 33 HN LYS 33 8.237 20.998 -2.923 1055 HA LYS 33 HA LYS 33 8.188 21.880 -0.171 1056 1HB LYS 33 HB2 LYS 33 6.110 22.899 -1.472 1057 2HB LYS 33 HB3 LYS 33 5.440 21.272 -1.347 1058 1HG LYS 33 HG2 LYS 33 6.528 22.779 1.065 1059 2HG LYS 33 HG3 LYS 33 4.909 23.103 0.445 1060 1HD LYS 33 HD2 LYS 33 4.089 20.964 0.995 1061 2HD LYS 33 HD3 LYS 33 5.696 20.252 1.075 1062 1HE LYS 33 HE2 LYS 33 6.181 21.758 3.070 1063 2HE LYS 33 HE3 LYS 33 4.464 22.180 3.078 1064 1HZ LYS 33 HZ1 LYS 33 5.009 20.341 4.585 1065 2HZ LYS 33 HZ2 LYS 33 3.960 19.846 3.440 1066 3HZ LYS 33 HZ3 LYS 33 5.549 19.425 3.336 1067 H VAL 34 HN VAL 34 8.390 20.024 1.072 1068 HA VAL 34 HA VAL 34 8.149 17.444 -0.340 1069 HB VAL 34 HB VAL 34 10.341 18.103 0.344 1070 1HG1 VAL 34 HG11 VAL 34 11.050 18.353 2.684 1071 2HG1 VAL 34 HG12 VAL 34 9.935 19.629 2.199 1072 3HG1 VAL 34 HG13 VAL 34 9.357 18.285 3.213 1073 1HG2 VAL 34 HG21 VAL 34 9.718 15.698 0.463 1074 2HG2 VAL 34 HG22 VAL 34 11.025 16.143 1.572 1075 3HG2 VAL 34 HG23 VAL 34 9.385 15.886 2.197 1076 H TYR 35 HN TYR 35 6.965 15.760 0.508 1077 HA TYR 35 HA TYR 35 5.778 16.005 3.197 1078 1HB TYR 35 HB2 TYR 35 4.119 16.737 1.368 1079 2HB TYR 35 HB3 TYR 35 4.201 15.095 0.753 1080 HD1 TYR 35 HD1 TYR 35 2.991 17.294 3.452 1081 HD2 TYR 35 HD2 TYR 35 3.192 13.215 2.067 1082 HE1 TYR 35 HE1 TYR 35 1.194 16.679 5.032 1083 HE2 TYR 35 HE2 TYR 35 1.375 12.591 3.633 1084 HH TYR 35 HH TYR 35 -0.183 14.978 5.823 1085 H SER 36 HN SER 36 5.251 13.782 4.021 1086 HA SER 36 HA SER 36 6.508 11.537 2.566 1087 1HB SER 36 HB2 SER 36 7.248 12.217 5.428 1088 2HB SER 36 HB3 SER 36 7.988 11.015 4.353 1089 HG SER 36 HG SER 36 8.810 13.387 4.855 1090 H ALA 37 HN ALA 37 5.455 9.581 3.087 1091 HA ALA 37 HA ALA 37 3.458 9.550 5.265 1092 1HB ALA 37 HB1 ALA 37 1.616 9.367 3.860 1093 2HB ALA 37 HB2 ALA 37 2.550 10.629 3.039 1094 3HB ALA 37 HB3 ALA 37 2.600 8.966 2.433 1095 H GLY 38 HN GLY 38 2.234 7.317 5.139 1096 1HA GLY 38 HA2 GLY 38 3.331 5.160 3.654 1097 2HA GLY 38 HA3 GLY 38 4.063 5.176 5.258 1098 H ILE 39 HN ILE 39 2.887 3.003 5.029 1099 HA ILE 39 HA ILE 39 0.212 2.615 4.873 1100 HB ILE 39 HB ILE 39 1.546 0.760 4.740 1101 1HG1 ILE 39 HG12 ILE 39 0.414 0.088 7.450 1102 2HG1 ILE 39 HG13 ILE 39 -0.695 0.572 6.182 1103 1HG2 ILE 39 HG21 ILE 39 2.679 1.162 7.525 1104 2HG2 ILE 39 HG22 ILE 39 2.975 -0.228 6.474 1105 3HG2 ILE 39 HG23 ILE 39 3.527 1.368 5.991 1106 1HD1 ILE 39 HD11 ILE 39 -0.554 -1.822 6.215 1107 2HD1 ILE 39 HD12 ILE 39 0.113 -1.200 4.701 1108 3HD1 ILE 39 HD13 ILE 39 1.205 -1.772 5.995 1109 H GLU 40 HN GLU 40 1.827 2.880 8.043 1110 HA GLU 40 HA GLU 40 -0.719 3.739 9.316 1111 1HB GLU 40 HB2 GLU 40 -0.156 2.311 11.252 1112 2HB GLU 40 HB3 GLU 40 -0.545 1.407 9.799 1113 1HG GLU 40 HG2 GLU 40 1.734 0.746 9.443 1114 2HG GLU 40 HG3 GLU 40 2.345 1.922 10.602 1115 H ALA 41 HN ALA 41 1.339 5.259 8.222 1116 HA ALA 41 HA ALA 41 3.522 5.867 9.914 1117 1HB ALA 41 HB1 ALA 41 3.656 6.178 7.544 1118 2HB ALA 41 HB2 ALA 41 2.176 7.146 7.516 1119 3HB ALA 41 HB3 ALA 41 3.641 7.828 8.234 1120 H HIS 42 HN HIS 42 3.992 7.584 11.108 1121 HA HIS 42 HA HIS 42 3.337 10.027 11.561 1122 1HB HIS 42 HB2 HIS 42 0.939 9.767 11.871 1123 2HB HIS 42 HB3 HIS 42 1.165 8.447 13.021 1124 HD1 HIS 42 HD1 HIS 42 2.418 9.319 15.442 1125 HD2 HIS 42 HD2 HIS 42 0.553 12.115 12.908 1126 HE1 HIS 42 HE1 HIS 42 1.994 11.397 16.856 1127 H GLY 43 HN GLY 43 5.387 10.080 12.430 1128 1HA GLY 43 HA2 GLY 43 6.030 9.078 15.011 1129 2HA GLY 43 HA3 GLY 43 6.571 7.945 13.751 1130 H LEU 44 HN LEU 44 8.566 8.892 15.076 1131 HA LEU 44 HA LEU 44 10.137 10.198 13.071 1132 1HB LEU 44 HB2 LEU 44 9.371 12.270 14.060 1133 2HB LEU 44 HB3 LEU 44 9.600 11.657 15.697 1134 HG LEU 44 HG LEU 44 12.038 11.695 15.436 1135 1HD1 LEU 44 HD11 LEU 44 13.064 12.718 13.393 1136 2HD1 LEU 44 HD12 LEU 44 12.339 11.146 13.090 1137 3HD1 LEU 44 HD13 LEU 44 11.488 12.637 12.598 1138 1HD2 LEU 44 HD21 LEU 44 10.887 13.747 16.172 1139 2HD2 LEU 44 HD22 LEU 44 12.359 14.117 15.262 1140 3HD2 LEU 44 HD23 LEU 44 10.777 14.294 14.488 1141 H ASN 45 HN ASN 45 11.415 8.299 13.126 1142 HA ASN 45 HA ASN 45 12.171 6.946 15.503 1143 1HB ASN 45 HB2 ASN 45 12.336 6.007 13.228 1144 2HB ASN 45 HB3 ASN 45 13.617 7.163 12.832 1145 1HD2 ASN 45 HD22 ASN 45 14.229 4.484 12.406 1146 2HD2 ASN 45 HD21 ASN 45 15.206 3.876 13.707 1147 HA PRO 46 HA PRO 46 14.919 10.213 17.002 1148 1HB PRO 46 HB2 PRO 46 16.169 8.881 19.082 1149 2HB PRO 46 HB3 PRO 46 14.543 9.623 19.168 1150 1HG PRO 46 HG2 PRO 46 15.248 6.731 18.615 1151 2HG PRO 46 HG3 PRO 46 14.008 7.377 19.740 1152 1HD PRO 46 HD2 PRO 46 13.341 6.482 17.279 1153 2HD PRO 46 HD3 PRO 46 12.557 7.941 17.951 1154 H ASN 47 HN ASN 47 16.010 6.954 16.035 1155 HA ASN 47 HA ASN 47 18.784 7.734 15.710 1156 1HB ASN 47 HB2 ASN 47 18.619 5.455 15.823 1157 2HB ASN 47 HB3 ASN 47 17.106 5.394 14.910 1158 1HD2 ASN 47 HD21 ASN 47 17.098 5.140 12.667 1159 2HD2 ASN 47 HD22 ASN 47 18.536 5.015 11.762 1160 H ALA 48 HN ALA 48 15.869 8.296 13.688 1161 HA ALA 48 HA ALA 48 17.408 8.945 11.294 1162 1HB ALA 48 HB1 ALA 48 15.345 10.014 10.509 1163 2HB ALA 48 HB2 ALA 48 14.957 8.458 11.274 1164 3HB ALA 48 HB3 ALA 48 14.640 9.980 12.123 1165 H VAL 49 HN VAL 49 16.191 10.612 14.210 1166 HA VAL 49 HA VAL 49 17.045 13.260 13.496 1167 HB VAL 49 HB VAL 49 16.959 12.190 16.346 1168 1HG1 VAL 49 HG11 VAL 49 18.032 14.390 16.087 1169 2HG1 VAL 49 HG12 VAL 49 16.611 14.993 15.206 1170 3HG1 VAL 49 HG13 VAL 49 16.479 14.532 16.915 1171 1HG2 VAL 49 HG21 VAL 49 14.671 13.449 14.793 1172 2HG2 VAL 49 HG22 VAL 49 14.757 11.733 15.234 1173 3HG2 VAL 49 HG23 VAL 49 14.652 12.963 16.495 1174 H LYS 50 HN LYS 50 18.728 10.674 15.420 1175 HA LYS 50 HA LYS 50 21.232 11.934 15.621 1176 1HB LYS 50 HB2 LYS 50 20.687 9.813 16.752 1177 2HB LYS 50 HB3 LYS 50 20.634 8.977 15.196 1178 1HG LYS 50 HG2 LYS 50 23.052 9.490 14.838 1179 2HG LYS 50 HG3 LYS 50 23.098 10.265 16.434 1180 1HD LYS 50 HD2 LYS 50 22.516 8.107 17.504 1181 2HD LYS 50 HD3 LYS 50 22.290 7.366 15.917 1182 1HE LYS 50 HE2 LYS 50 24.408 6.634 16.714 1183 2HE LYS 50 HE3 LYS 50 24.696 7.753 15.383 1184 1HZ LYS 50 HZ1 LYS 50 24.921 8.428 18.265 1185 2HZ LYS 50 HZ2 LYS 50 26.173 8.150 17.261 1186 3HZ LYS 50 HZ3 LYS 50 25.232 9.462 17.036 1187 H ALA 51 HN ALA 51 20.016 9.879 12.938 1188 HA ALA 51 HA ALA 51 22.196 9.812 11.320 1189 1HB ALA 51 HB1 ALA 51 19.334 10.019 10.394 1190 2HB ALA 51 HB2 ALA 51 20.714 9.380 9.482 1191 3HB ALA 51 HB3 ALA 51 20.163 8.556 10.958 1192 H MET 52 HN MET 52 19.894 12.563 11.729 1193 HA MET 52 HA MET 52 21.056 14.112 9.542 1194 1HB MET 52 HB2 MET 52 18.954 14.683 11.692 1195 2HB MET 52 HB3 MET 52 19.442 15.862 10.485 1196 1HG MET 52 HG2 MET 52 18.631 13.234 9.364 1197 2HG MET 52 HG3 MET 52 17.380 14.107 10.227 1198 1HE MET 52 HE1 MET 52 20.397 15.516 7.944 1199 2HE MET 52 HE2 MET 52 19.748 14.087 7.110 1200 3HE MET 52 HE3 MET 52 19.490 15.707 6.420 1201 H LYS 53 HN LYS 53 21.138 14.071 13.141 1202 HA LYS 53 HA LYS 53 22.613 16.492 13.402 1203 1HB LYS 53 HB2 LYS 53 22.619 13.995 15.167 1204 2HB LYS 53 HB3 LYS 53 23.299 15.544 15.647 1205 1HG LYS 53 HG2 LYS 53 20.367 15.219 14.900 1206 2HG LYS 53 HG3 LYS 53 20.973 14.951 16.530 1207 1HD LYS 53 HD2 LYS 53 21.684 17.266 16.711 1208 2HD LYS 53 HD3 LYS 53 21.274 17.574 15.003 1209 1HE LYS 53 HE2 LYS 53 18.927 17.101 15.404 1210 2HE LYS 53 HE3 LYS 53 19.245 16.580 17.060 1211 1HZ LYS 53 HZ1 LYS 53 18.345 18.879 16.713 1212 2HZ LYS 53 HZ2 LYS 53 19.653 18.777 17.711 1213 3HZ LYS 53 HZ3 LYS 53 19.824 19.335 16.180 1214 H GLU 54 HN GLU 54 23.662 13.197 12.549 1215 HA GLU 54 HA GLU 54 26.441 13.513 12.906 1216 1HB GLU 54 HB2 GLU 54 24.907 11.966 10.776 1217 2HB GLU 54 HB3 GLU 54 26.655 11.877 10.996 1218 1HG GLU 54 HG2 GLU 54 26.291 11.105 13.357 1219 2HG GLU 54 HG3 GLU 54 24.560 11.033 13.013 1220 H VAL 55 HN VAL 55 24.338 14.872 10.414 1221 HA VAL 55 HA VAL 55 26.694 16.084 9.064 1222 HB VAL 55 HB VAL 55 25.319 16.116 7.044 1223 1HG1 VAL 55 HG11 VAL 55 25.457 13.323 8.274 1224 2HG1 VAL 55 HG12 VAL 55 25.480 13.738 6.558 1225 3HG1 VAL 55 HG13 VAL 55 26.835 14.206 7.582 1226 1HG2 VAL 55 HG21 VAL 55 23.248 14.441 8.535 1227 2HG2 VAL 55 HG22 VAL 55 23.043 16.167 8.150 1228 3HG2 VAL 55 HG23 VAL 55 23.194 14.990 6.853 1229 H GLY 56 HN GLY 56 24.865 16.925 11.460 1230 1HA GLY 56 HA2 GLY 56 24.376 18.931 12.373 1231 2HA GLY 56 HA3 GLY 56 25.229 19.694 11.023 1232 H ILE 57 HN ILE 57 22.207 17.642 10.802 1233 HA ILE 57 HA ILE 57 20.697 20.156 10.168 1234 HB ILE 57 HB ILE 57 20.409 17.408 8.936 1235 1HG1 ILE 57 HG12 ILE 57 21.028 20.167 7.781 1236 2HG1 ILE 57 HG13 ILE 57 22.150 18.817 7.920 1237 1HG2 ILE 57 HG21 ILE 57 18.152 18.293 9.437 1238 2HG2 ILE 57 HG22 ILE 57 18.561 19.820 8.616 1239 3HG2 ILE 57 HG23 ILE 57 18.446 18.293 7.715 1240 1HD1 ILE 57 HD11 ILE 57 21.495 18.980 5.649 1241 2HD1 ILE 57 HD12 ILE 57 20.749 17.521 6.294 1242 3HD1 ILE 57 HD13 ILE 57 19.772 19.001 6.025 1243 H ASP 58 HN ASP 58 18.613 20.208 11.177 1244 HA ASP 58 HA ASP 58 18.283 18.308 13.461 1245 1HB ASP 58 HB2 ASP 58 18.867 20.483 14.358 1246 2HB ASP 58 HB3 ASP 58 17.679 21.283 13.317 1247 H ILE 59 HN ILE 59 16.352 17.395 13.651 1248 HA ILE 59 HA ILE 59 14.022 18.386 12.142 1249 HB ILE 59 HB ILE 59 13.440 16.149 11.409 1250 1HG1 ILE 59 HG12 ILE 59 16.296 15.232 12.063 1251 2HG1 ILE 59 HG13 ILE 59 14.926 14.923 13.125 1252 1HG2 ILE 59 HG21 ILE 59 16.208 16.881 10.321 1253 2HG2 ILE 59 HG22 ILE 59 14.901 16.049 9.455 1254 3HG2 ILE 59 HG23 ILE 59 14.718 17.750 9.912 1255 1HD1 ILE 59 HD11 ILE 59 15.296 12.971 11.746 1256 2HD1 ILE 59 HD12 ILE 59 13.754 13.743 11.334 1257 3HD1 ILE 59 HD13 ILE 59 15.154 13.930 10.260 1258 H SER 60 HN SER 60 15.064 18.105 15.090 1259 HA SER 60 HA SER 60 13.789 15.944 16.276 1260 1HB SER 60 HB2 SER 60 14.348 18.659 17.545 1261 2HB SER 60 HB3 SER 60 14.189 17.106 18.386 1262 HG SER 60 HG SER 60 16.230 18.003 16.619 1263 H ASN 61 HN ASN 61 12.210 18.698 14.985 1264 HA ASN 61 HA ASN 61 9.858 18.530 16.716 1265 1HB ASN 61 HB2 ASN 61 10.779 20.733 16.051 1266 2HB ASN 61 HB3 ASN 61 10.520 20.330 14.353 1267 1HD2 ASN 61 HD22 ASN 61 8.616 21.148 13.497 1268 2HD2 ASN 61 HD21 ASN 61 7.193 21.532 14.426 1269 H GLN 62 HN GLN 62 10.923 17.074 13.698 1270 HA GLN 62 HA GLN 62 8.716 17.326 12.138 1271 1HB GLN 62 HB2 GLN 62 10.854 15.215 12.219 1272 2HB GLN 62 HB3 GLN 62 9.507 15.145 11.067 1273 1HG GLN 62 HG2 GLN 62 9.982 17.503 10.376 1274 2HG GLN 62 HG3 GLN 62 11.416 17.485 11.402 1275 1HE2 GLN 62 HE22 GLN 62 12.163 18.108 9.139 1276 2HE2 GLN 62 HE21 GLN 62 12.741 16.784 8.120 1277 H THR 63 HN THR 63 7.059 16.121 11.499 1278 HA THR 63 HA THR 63 5.975 13.905 13.155 1279 HB THR 63 HB THR 63 3.741 15.000 12.833 1280 HG1 THR 63 HG1 THR 63 4.033 16.324 11.081 1281 1HG2 THR 63 HG21 THR 63 5.129 15.459 14.887 1282 2HG2 THR 63 HG22 THR 63 5.758 16.910 14.069 1283 3HG2 THR 63 HG23 THR 63 4.026 16.784 14.460 1284 H SER 64 HN SER 64 4.001 12.897 11.784 1285 HA SER 64 HA SER 64 4.225 13.117 8.913 1286 1HB SER 64 HB2 SER 64 4.845 10.393 10.139 1287 2HB SER 64 HB3 SER 64 4.758 10.811 8.422 1288 HG SER 64 HG SER 64 6.440 12.496 9.470 1289 H ASP 65 HN ASP 65 2.740 10.968 8.132 1290 HA ASP 65 HA ASP 65 0.396 10.519 9.737 1291 1HB ASP 65 HB2 ASP 65 0.093 12.916 8.876 1292 2HB ASP 65 HB3 ASP 65 0.167 12.245 7.240 1293 H ILE 66 HN ILE 66 -1.217 9.248 8.258 1294 HA ILE 66 HA ILE 66 0.140 7.274 6.702 1295 HB ILE 66 HB ILE 66 -2.238 6.628 6.122 1296 1HG1 ILE 66 HG12 ILE 66 -3.017 8.762 8.136 1297 2HG1 ILE 66 HG13 ILE 66 -3.207 8.932 6.387 1298 1HG2 ILE 66 HG21 ILE 66 -1.561 6.895 9.082 1299 2HG2 ILE 66 HG22 ILE 66 -2.634 5.681 8.341 1300 3HG2 ILE 66 HG23 ILE 66 -0.913 5.674 7.964 1301 1HD1 ILE 66 HD11 ILE 66 -4.696 6.915 6.409 1302 2HD1 ILE 66 HD12 ILE 66 -4.567 6.899 8.190 1303 3HD1 ILE 66 HD13 ILE 66 -5.307 8.281 7.370 1304 H ILE 67 HN ILE 67 -0.587 6.723 4.387 1305 HA ILE 67 HA ILE 67 0.006 8.721 2.596 1306 HB ILE 67 HB ILE 67 -0.514 7.389 0.881 1307 1HG1 ILE 67 HG12 ILE 67 -2.635 5.777 2.333 1308 2HG1 ILE 67 HG13 ILE 67 -2.984 7.167 1.303 1309 1HG2 ILE 67 HG21 ILE 67 1.090 6.301 2.446 1310 2HG2 ILE 67 HG22 ILE 67 -0.233 5.259 3.029 1311 3HG2 ILE 67 HG23 ILE 67 0.293 5.186 1.340 1312 1HD1 ILE 67 HD11 ILE 67 -1.850 6.049 -0.614 1313 2HD1 ILE 67 HD12 ILE 67 -1.756 4.570 0.367 1314 3HD1 ILE 67 HD13 ILE 67 -3.335 5.280 -0.062 1315 H ASP 68 HN ASP 68 -1.013 10.264 1.530 1316 HA ASP 68 HA ASP 68 -3.850 10.898 2.155 1317 1HB ASP 68 HB2 ASP 68 -2.375 11.931 3.873 1318 2HB ASP 68 HB3 ASP 68 -1.586 12.870 2.596 1319 H SER 69 HN SER 69 -4.502 10.577 0.181 1320 HA SER 69 HA SER 69 -3.442 11.118 -2.245 1321 1HB SER 69 HB2 SER 69 -6.328 11.511 -1.422 1322 2HB SER 69 HB3 SER 69 -5.732 10.942 -3.000 1323 HG SER 69 HG SER 69 -6.495 9.245 -1.514 1324 H ASP 70 HN ASP 70 -4.550 13.638 -0.000 1325 HA ASP 70 HA ASP 70 -5.437 15.405 -2.138 1326 1HB ASP 70 HB2 ASP 70 -6.465 15.531 0.086 1327 2HB ASP 70 HB3 ASP 70 -4.910 15.994 0.784 1328 H ILE 71 HN ILE 71 -2.456 14.650 -0.520 1329 HA ILE 71 HA ILE 71 -1.140 16.926 -1.898 1330 HB ILE 71 HB ILE 71 0.739 15.654 -0.302 1331 1HG1 ILE 71 HG12 ILE 71 -0.929 14.560 1.086 1332 2HG1 ILE 71 HG13 ILE 71 0.148 15.657 1.917 1333 1HG2 ILE 71 HG21 ILE 71 0.750 17.978 -0.886 1334 2HG2 ILE 71 HG22 ILE 71 -0.700 18.285 0.094 1335 3HG2 ILE 71 HG23 ILE 71 0.830 17.816 0.874 1336 1HD1 ILE 71 HD11 ILE 71 -2.038 15.850 2.872 1337 2HD1 ILE 71 HD12 ILE 71 -1.683 17.365 2.032 1338 3HD1 ILE 71 HD13 ILE 71 -2.783 16.166 1.309 1339 H LEU 72 HN LEU 72 -1.207 13.335 -1.640 1340 HA LEU 72 HA LEU 72 1.077 12.886 -3.258 1341 1HB LEU 72 HB2 LEU 72 -0.259 11.188 -1.907 1342 2HB LEU 72 HB3 LEU 72 -1.443 11.208 -3.199 1343 HG LEU 72 HG LEU 72 -0.061 9.255 -3.372 1344 1HD1 LEU 72 HD11 LEU 72 0.992 10.936 -5.640 1345 2HD1 LEU 72 HD12 LEU 72 0.655 9.211 -5.592 1346 3HD1 LEU 72 HD13 LEU 72 -0.697 10.355 -5.564 1347 1HD2 LEU 72 HD21 LEU 72 2.378 11.026 -3.531 1348 2HD2 LEU 72 HD22 LEU 72 1.868 9.988 -2.177 1349 3HD2 LEU 72 HD23 LEU 72 2.317 9.254 -3.703 1350 H ASN 73 HN ASN 73 -2.421 13.089 -4.236 1351 HA ASN 73 HA ASN 73 -1.971 12.647 -6.960 1352 1HB ASN 73 HB2 ASN 73 -4.164 13.164 -7.316 1353 2HB ASN 73 HB3 ASN 73 -4.240 12.852 -5.601 1354 1HD2 ASN 73 HD22 ASN 73 -4.278 14.830 -4.172 1355 2HD2 ASN 73 HD21 ASN 73 -4.823 16.372 -4.820 1356 H ASN 74 HN ASN 74 -1.512 15.556 -5.043 1357 HA ASN 74 HA ASN 74 -1.317 17.389 -7.297 1358 1HB ASN 74 HB2 ASN 74 -1.285 17.645 -4.276 1359 2HB ASN 74 HB3 ASN 74 -0.616 18.937 -5.241 1360 1HD2 ASN 74 HD22 ASN 74 -3.471 18.064 -3.765 1361 2HD2 ASN 74 HD21 ASN 74 -4.552 18.993 -4.785 1362 H ALA 75 HN ALA 75 0.866 15.235 -5.723 1363 HA ALA 75 HA ALA 75 3.208 16.870 -5.754 1364 1HB ALA 75 HB1 ALA 75 2.943 14.858 -4.336 1365 2HB ALA 75 HB2 ALA 75 2.998 13.834 -5.794 1366 3HB ALA 75 HB3 ALA 75 4.403 14.814 -5.338 1367 H ASP 76 HN ASP 76 5.034 16.523 -7.100 1368 HA ASP 76 HA ASP 76 4.412 16.023 -9.970 1369 1HB ASP 76 HB2 ASP 76 5.791 17.990 -9.383 1370 2HB ASP 76 HB3 ASP 76 6.969 16.936 -8.591 1371 H LEU 77 HN LEU 77 6.146 14.613 -7.191 1372 HA LEU 77 HA LEU 77 6.807 12.230 -8.771 1373 1HB LEU 77 HB2 LEU 77 8.713 14.179 -8.191 1374 2HB LEU 77 HB3 LEU 77 8.873 13.090 -6.819 1375 HG LEU 77 HG LEU 77 9.209 12.402 -9.720 1376 1HD1 LEU 77 HD11 LEU 77 11.069 13.664 -8.779 1377 2HD1 LEU 77 HD12 LEU 77 11.200 12.519 -7.428 1378 3HD1 LEU 77 HD13 LEU 77 11.564 11.987 -9.081 1379 1HD2 LEU 77 HD21 LEU 77 9.423 10.530 -7.347 1380 2HD2 LEU 77 HD22 LEU 77 8.345 10.394 -8.773 1381 3HD2 LEU 77 HD23 LEU 77 10.075 10.183 -8.959 1382 H VAL 78 HN VAL 78 6.656 10.350 -7.613 1383 HA VAL 78 HA VAL 78 6.408 10.447 -4.651 1384 HB VAL 78 HB VAL 78 5.354 8.218 -6.376 1385 1HG1 VAL 78 HG11 VAL 78 4.094 7.762 -4.286 1386 2HG1 VAL 78 HG12 VAL 78 5.835 7.742 -3.984 1387 3HG1 VAL 78 HG13 VAL 78 4.863 9.151 -3.503 1388 1HG2 VAL 78 HG21 VAL 78 3.084 9.206 -5.943 1389 2HG2 VAL 78 HG22 VAL 78 3.890 10.731 -5.467 1390 3HG2 VAL 78 HG23 VAL 78 4.067 10.068 -7.109 1391 H VAL 79 HN VAL 79 8.325 10.189 -3.901 1392 HA VAL 79 HA VAL 79 10.370 8.532 -5.229 1393 HB VAL 79 HB VAL 79 10.388 10.285 -2.737 1394 1HG1 VAL 79 HG11 VAL 79 12.804 10.217 -2.789 1395 2HG1 VAL 79 HG12 VAL 79 12.187 8.565 -2.688 1396 3HG1 VAL 79 HG13 VAL 79 12.792 9.194 -4.233 1397 1HG2 VAL 79 HG21 VAL 79 10.011 11.647 -4.772 1398 2HG2 VAL 79 HG22 VAL 79 11.587 11.953 -4.060 1399 3HG2 VAL 79 HG23 VAL 79 11.460 10.931 -5.512 1400 H THR 80 HN THR 80 9.691 6.380 -4.892 1401 HA THR 80 HA THR 80 8.824 5.494 -2.250 1402 HB THR 80 HB THR 80 9.934 3.936 -4.622 1403 HG1 THR 80 HG1 THR 80 7.838 5.268 -4.562 1404 1HG2 THR 80 HG21 THR 80 10.089 2.602 -2.563 1405 2HG2 THR 80 HG22 THR 80 8.415 3.032 -2.135 1406 3HG2 THR 80 HG23 THR 80 8.755 2.010 -3.564 1407 H LEU 81 HN LEU 81 10.139 5.292 -0.542 1408 HA LEU 81 HA LEU 81 13.086 5.541 -0.924 1409 1HB LEU 81 HB2 LEU 81 11.745 7.618 -0.301 1410 2HB LEU 81 HB3 LEU 81 11.302 6.795 1.186 1411 HG LEU 81 HG LEU 81 13.855 6.606 1.662 1412 1HD1 LEU 81 HD11 LEU 81 15.260 8.305 0.541 1413 2HD1 LEU 81 HD12 LEU 81 14.710 7.077 -0.604 1414 3HD1 LEU 81 HD13 LEU 81 13.936 8.676 -0.578 1415 1HD2 LEU 81 HD21 LEU 81 12.280 8.167 2.761 1416 2HD2 LEU 81 HD22 LEU 81 13.906 8.828 2.576 1417 3HD2 LEU 81 HD23 LEU 81 12.603 9.374 1.491 1418 H SER 82 HN SER 82 12.298 2.999 -0.800 1419 HA SER 82 HA SER 82 13.536 2.168 1.638 1420 1HB SER 82 HB2 SER 82 10.680 1.250 1.011 1421 2HB SER 82 HB3 SER 82 11.734 0.467 2.203 1422 HG SER 82 HG SER 82 11.624 3.153 2.536 1423 H GLY 83 HN GLY 83 13.420 -0.482 1.450 1424 1HA GLY 83 HA2 GLY 83 13.580 -1.405 -1.366 1425 2HA GLY 83 HA3 GLY 83 14.856 -1.828 -0.194 1426 H ASP 84 HN ASP 84 11.300 -1.444 0.092 1427 HA ASP 84 HA ASP 84 10.816 -4.159 1.068 1428 1HB ASP 84 HB2 ASP 84 11.682 -3.045 3.079 1429 2HB ASP 84 HB3 ASP 84 10.642 -1.649 2.791 1430 H ALA 85 HN ALA 85 8.401 -4.311 1.547 1431 HA ALA 85 HA ALA 85 6.795 -2.492 -0.195 1432 1HB ALA 85 HB1 ALA 85 5.752 -4.463 -1.215 1433 2HB ALA 85 HB2 ALA 85 7.505 -4.497 -1.471 1434 3HB ALA 85 HB3 ALA 85 6.765 -5.539 -0.231 1435 H ALA 86 HN ALA 86 7.099 -3.430 2.938 1436 HA ALA 86 HA ALA 86 4.490 -4.306 3.670 1437 1HB ALA 86 HB1 ALA 86 5.161 -3.408 5.939 1438 2HB ALA 86 HB2 ALA 86 6.377 -4.488 5.211 1439 3HB ALA 86 HB3 ALA 86 6.614 -2.738 5.187 1440 H ASP 87 HN ASP 87 5.529 -1.225 2.505 1441 HA ASP 87 HA ASP 87 3.969 0.486 4.051 1442 1HB ASP 87 HB2 ASP 87 6.050 0.954 2.682 1443 2HB ASP 87 HB3 ASP 87 4.992 1.103 1.279 1444 H LYS 88 HN LYS 88 2.134 -1.556 2.866 1445 HA LYS 88 HA LYS 88 -0.040 -1.662 2.252 1446 1HB LYS 88 HB2 LYS 88 -0.092 0.733 3.282 1447 2HB LYS 88 HB3 LYS 88 -0.185 1.294 1.619 1448 1HG LYS 88 HG2 LYS 88 -2.292 0.055 1.311 1449 2HG LYS 88 HG3 LYS 88 -2.185 -0.585 2.951 1450 1HD LYS 88 HD2 LYS 88 -2.128 2.422 2.418 1451 2HD LYS 88 HD3 LYS 88 -3.649 1.542 2.489 1452 1HE LYS 88 HE2 LYS 88 -3.212 0.743 4.736 1453 2HE LYS 88 HE3 LYS 88 -1.598 1.469 4.707 1454 1HZ LYS 88 HZ1 LYS 88 -2.933 2.932 5.901 1455 2HZ LYS 88 HZ2 LYS 88 -2.771 3.664 4.462 1456 3HZ LYS 88 HZ3 LYS 88 -4.176 2.900 4.825 1457 H CYS 89 HN CYS 89 2.304 -1.660 0.324 1458 HA CYS 89 HA CYS 89 2.852 -1.487 -1.880 1459 1HB CYS 89 HB2 CYS 89 0.227 -2.929 -2.265 1460 2HB CYS 89 HB3 CYS 89 1.701 -3.130 -3.199 1461 HA PRO 90 HA PRO 90 -0.515 1.766 -2.536 1462 1HB PRO 90 HB2 PRO 90 1.751 3.718 -2.851 1463 2HB PRO 90 HB3 PRO 90 0.187 3.933 -2.009 1464 1HG PRO 90 HG2 PRO 90 2.429 3.486 -0.547 1465 2HG PRO 90 HG3 PRO 90 0.915 2.626 -0.146 1466 1HD PRO 90 HD2 PRO 90 3.212 1.624 -1.883 1467 2HD PRO 90 HD3 PRO 90 2.504 0.831 -0.465 1468 H MET 91 HN MET 91 -1.367 2.061 -4.623 1469 HA MET 91 HA MET 91 0.457 1.264 -6.768 1470 1HB MET 91 HB2 MET 91 -1.573 1.033 -8.126 1471 2HB MET 91 HB3 MET 91 -1.537 0.071 -6.641 1472 1HG MET 91 HG2 MET 91 -3.688 0.938 -6.946 1473 2HG MET 91 HG3 MET 91 -2.997 1.696 -5.539 1474 1HE MET 91 HE1 MET 91 -4.966 3.007 -5.800 1475 2HE MET 91 HE2 MET 91 -5.518 4.103 -7.182 1476 3HE MET 91 HE3 MET 91 -5.451 2.314 -7.354 1477 H THR 92 HN THR 92 -0.212 4.313 -5.502 1478 HA THR 92 HA THR 92 0.169 6.392 -6.223 1479 HB THR 92 HB THR 92 2.225 6.599 -7.710 1480 HG1 THR 92 HG1 THR 92 1.860 4.442 -8.591 1481 1HG2 THR 92 HG21 THR 92 2.322 6.653 -5.233 1482 2HG2 THR 92 HG22 THR 92 2.476 4.887 -5.200 1483 3HG2 THR 92 HG23 THR 92 3.753 5.884 -5.945 1484 HA PRO 93 HA PRO 93 -2.563 6.332 -9.808 1485 1HB PRO 93 HB2 PRO 93 -3.695 8.824 -9.589 1486 2HB PRO 93 HB3 PRO 93 -4.149 7.412 -8.578 1487 1HG PRO 93 HG2 PRO 93 -2.273 9.653 -7.785 1488 2HG PRO 93 HG3 PRO 93 -3.640 8.907 -6.882 1489 1HD PRO 93 HD2 PRO 93 -1.078 8.084 -6.487 1490 2HD PRO 93 HD3 PRO 93 -2.433 6.921 -6.453 1491 HA PRO 94 HA PRO 94 0.635 7.552 -12.459 1492 1HB PRO 94 HB2 PRO 94 -0.489 7.381 -14.978 1493 2HB PRO 94 HB3 PRO 94 -0.130 5.985 -13.920 1494 1HG PRO 94 HG2 PRO 94 -2.764 7.473 -14.202 1495 2HG PRO 94 HG3 PRO 94 -2.476 5.702 -14.308 1496 1HD PRO 94 HD2 PRO 94 -3.306 6.825 -12.006 1497 2HD PRO 94 HD3 PRO 94 -2.044 5.540 -11.989 1498 H HIS 95 HN HIS 95 -1.819 9.905 -12.110 1499 HA HIS 95 HA HIS 95 -0.642 11.790 -14.014 1500 1HB HIS 95 HB2 HIS 95 -2.145 13.437 -12.827 1501 2HB HIS 95 HB3 HIS 95 -2.911 12.111 -13.675 1502 HD1 HIS 95 HD1 HIS 95 -4.766 10.922 -12.333 1503 HD2 HIS 95 HD2 HIS 95 -1.916 12.923 -9.965 1504 HE1 HIS 95 HE1 HIS 95 -5.566 10.727 -9.923 1505 H VAL 96 HN VAL 96 0.953 10.396 -11.700 1506 HA VAL 96 HA VAL 96 2.506 12.802 -10.981 1507 HB VAL 96 HB VAL 96 2.017 10.486 -9.052 1508 1HG1 VAL 96 HG11 VAL 96 4.063 11.767 -8.650 1509 2HG1 VAL 96 HG12 VAL 96 3.173 13.279 -8.735 1510 3HG1 VAL 96 HG13 VAL 96 2.881 12.156 -7.394 1511 1HG2 VAL 96 HG21 VAL 96 0.553 11.980 -7.729 1512 2HG2 VAL 96 HG22 VAL 96 0.549 13.155 -9.060 1513 3HG2 VAL 96 HG23 VAL 96 -0.167 11.531 -9.259 1514 H LYS 97 HN LYS 97 4.814 12.324 -11.052 1515 HA LYS 97 HA LYS 97 5.597 9.927 -12.536 1516 1HB LYS 97 HB2 LYS 97 6.587 12.298 -12.704 1517 2HB LYS 97 HB3 LYS 97 7.372 11.978 -11.162 1518 1HG LYS 97 HG2 LYS 97 7.770 9.764 -13.043 1519 2HG LYS 97 HG3 LYS 97 8.247 11.286 -13.793 1520 1HD LYS 97 HD2 LYS 97 9.141 10.351 -11.085 1521 2HD LYS 97 HD3 LYS 97 9.995 9.902 -12.551 1522 1HE LYS 97 HE2 LYS 97 9.656 12.809 -11.616 1523 2HE LYS 97 HE3 LYS 97 11.085 11.838 -11.324 1524 1HZ LYS 97 HZ1 LYS 97 11.600 13.009 -13.196 1525 2HZ LYS 97 HZ2 LYS 97 11.169 11.583 -13.844 1526 3HZ LYS 97 HZ3 LYS 97 10.124 12.845 -13.915 1527 H ARG 98 HN ARG 98 7.044 8.263 -11.562 1528 HA ARG 98 HA ARG 98 7.289 8.324 -8.633 1529 1HB ARG 98 HB2 ARG 98 5.194 6.990 -9.058 1530 2HB ARG 98 HB3 ARG 98 6.149 5.887 -10.062 1531 1HG ARG 98 HG2 ARG 98 7.644 5.502 -7.963 1532 2HG ARG 98 HG3 ARG 98 6.411 6.410 -7.063 1533 1HD ARG 98 HD2 ARG 98 4.734 4.765 -7.885 1534 2HD ARG 98 HD3 ARG 98 6.026 3.823 -8.632 1535 HE ARG 98 HE ARG 98 6.962 3.992 -6.128 1536 1HH1 ARG 98 HH11 ARG 98 3.606 3.301 -7.068 1537 2HH1 ARG 98 HH12 ARG 98 3.305 2.270 -5.720 1538 1HH2 ARG 98 HH21 ARG 98 6.514 2.885 -4.295 1539 2HH2 ARG 98 HH22 ARG 98 5.043 1.968 -4.097 1540 H GLU 99 HN GLU 99 9.173 7.378 -7.990 1541 HA GLU 99 HA GLU 99 10.613 5.542 -9.737 1542 1HB GLU 99 HB2 GLU 99 11.787 8.168 -8.742 1543 2HB GLU 99 HB3 GLU 99 12.756 6.808 -9.354 1544 1HG GLU 99 HG2 GLU 99 11.663 7.025 -11.562 1545 2HG GLU 99 HG3 GLU 99 10.735 8.409 -10.956 1546 H HIS 100 HN HIS 100 12.189 4.401 -8.395 1547 HA HIS 100 HA HIS 100 11.793 4.732 -5.480 1548 1HB HIS 100 HB2 HIS 100 12.540 2.335 -5.318 1549 2HB HIS 100 HB3 HIS 100 10.973 2.576 -6.074 1550 HD1 HIS 100 HD1 HIS 100 14.292 2.808 -8.052 1551 HD2 HIS 100 HD2 HIS 100 10.877 0.406 -7.533 1552 HE1 HIS 100 HE1 HIS 100 14.373 1.034 -9.895 1553 H TRP 101 HN TRP 101 13.486 5.128 -4.253 1554 HA TRP 101 HA TRP 101 16.203 5.203 -5.476 1555 1HB TRP 101 HB2 TRP 101 14.657 7.467 -4.166 1556 2HB TRP 101 HB3 TRP 101 16.376 7.522 -4.485 1557 HD1 TRP 101 HD1 TRP 101 13.121 8.249 -6.134 1558 HE1 TRP 101 HE1 TRP 101 13.504 9.098 -8.513 1559 HE3 TRP 101 HE3 TRP 101 17.918 6.606 -6.814 1560 HZ2 TRP 101 HZ2 TRP 101 15.571 9.004 -10.479 1561 HZ3 TRP 101 HZ3 TRP 101 19.036 6.912 -9.011 1562 HH2 TRP 101 HH2 TRP 101 17.885 8.125 -10.846 1563 H GLY 102 HN GLY 102 14.394 4.089 -2.863 1564 1HA GLY 102 HA2 GLY 102 16.322 4.670 -0.737 1565 2HA GLY 102 HA3 GLY 102 14.936 3.576 -0.657 1566 H PHE 103 HN PHE 103 15.259 1.703 -2.458 1567 HA PHE 103 HA PHE 103 16.160 -0.237 -2.996 1568 1HB PHE 103 HB2 PHE 103 18.892 1.063 -2.836 1569 2HB PHE 103 HB3 PHE 103 18.473 -0.412 -3.681 1570 HD1 PHE 103 HD1 PHE 103 16.691 -0.249 -5.597 1571 HD2 PHE 103 HD2 PHE 103 18.871 3.123 -4.014 1572 HE1 PHE 103 HE1 PHE 103 16.280 1.006 -7.696 1573 HE2 PHE 103 HE2 PHE 103 18.471 4.364 -6.123 1574 HZ PHE 103 HZ PHE 103 17.163 3.321 -7.962 1575 H ASP 104 HN ASP 104 16.620 0.970 0.049 1576 HA ASP 104 HA ASP 104 17.155 -1.577 1.313 1577 1HB ASP 104 HB2 ASP 104 19.460 -0.665 0.779 1578 2HB ASP 104 HB3 ASP 104 19.044 0.806 1.658 1579 H ASP 105 HN ASP 105 17.008 -0.999 3.826 1580 HA ASP 105 HA ASP 105 15.550 1.518 4.298 1581 1HB ASP 105 HB2 ASP 105 13.733 -0.004 3.908 1582 2HB ASP 105 HB3 ASP 105 14.356 -1.116 5.133 1583 HA PRO 106 HA PRO 106 18.856 0.913 7.328 1584 1HB PRO 106 HB2 PRO 106 19.118 3.435 8.186 1585 2HB PRO 106 HB3 PRO 106 19.619 2.912 6.591 1586 1HG PRO 106 HG2 PRO 106 16.985 4.239 7.335 1587 2HG PRO 106 HG3 PRO 106 18.133 4.736 6.062 1588 1HD PRO 106 HD2 PRO 106 15.975 3.141 5.561 1589 2HD PRO 106 HD3 PRO 106 17.505 2.857 4.696 1590 H ALA 107 HN ALA 107 15.760 2.413 8.217 1591 HA ALA 107 HA ALA 107 15.634 2.338 10.928 1592 1HB ALA 107 HB1 ALA 107 13.898 3.143 9.230 1593 2HB ALA 107 HB2 ALA 107 13.407 1.461 9.044 1594 3HB ALA 107 HB3 ALA 107 13.232 2.257 10.619 1595 H ARG 108 HN ARG 108 16.235 -0.240 9.107 1596 HA ARG 108 HA ARG 108 14.768 -2.280 10.797 1597 1HB ARG 108 HB2 ARG 108 15.892 -2.882 8.039 1598 2HB ARG 108 HB3 ARG 108 14.703 -3.791 8.958 1599 1HG ARG 108 HG2 ARG 108 14.288 -1.056 7.688 1600 2HG ARG 108 HG3 ARG 108 13.785 -2.570 6.974 1601 1HD ARG 108 HD2 ARG 108 12.749 -1.948 9.729 1602 2HD ARG 108 HD3 ARG 108 12.140 -0.967 8.412 1603 HE ARG 108 HE ARG 108 11.594 -3.798 8.869 1604 1HH1 ARG 108 HH11 ARG 108 11.477 -1.109 6.478 1605 2HH1 ARG 108 HH12 ARG 108 10.197 -1.889 5.567 1606 1HH2 ARG 108 HH21 ARG 108 9.881 -4.728 7.511 1607 2HH2 ARG 108 HH22 ARG 108 9.361 -3.830 6.105 1608 H ALA 109 HN ALA 109 17.746 -1.644 8.936 1609 HA ALA 109 HA ALA 109 19.734 -2.717 8.853 1610 1HB ALA 109 HB1 ALA 109 19.895 -0.894 10.562 1611 2HB ALA 109 HB2 ALA 109 19.661 -2.114 11.831 1612 3HB ALA 109 HB3 ALA 109 21.092 -2.176 10.773 1613 H GLN 110 HN GLN 110 21.254 -4.159 10.623 1614 HA GLN 110 HA GLN 110 20.060 -6.834 10.608 1615 1HB GLN 110 HB2 GLN 110 22.481 -6.664 10.384 1616 2HB GLN 110 HB3 GLN 110 22.586 -5.764 11.900 1617 1HG GLN 110 HG2 GLN 110 23.340 -8.062 12.178 1618 2HG GLN 110 HG3 GLN 110 21.990 -7.670 13.222 1619 1HE2 GLN 110 HE22 GLN 110 19.835 -8.580 12.704 1620 2HE2 GLN 110 HE21 GLN 110 19.757 -10.070 11.780 1621 H GLY 111 HN GLY 111 20.824 -4.323 13.058 1622 1HA GLY 111 HA2 GLY 111 18.683 -4.020 14.420 1623 2HA GLY 111 HA3 GLY 111 19.015 -5.714 14.930 1624 H THR 112 HN THR 112 21.977 -5.004 14.931 1625 HA THR 112 HA THR 112 22.048 -4.489 17.774 1626 HB THR 112 HB THR 112 24.463 -4.725 17.541 1627 HG1 THR 112 HG1 THR 112 25.301 -5.049 15.420 1628 1HG2 THR 112 HG21 THR 112 22.966 -6.764 17.378 1629 2HG2 THR 112 HG22 THR 112 23.184 -6.682 15.603 1630 3HG2 THR 112 HG23 THR 112 24.589 -6.939 16.663 1631 H GLU 113 HN GLU 113 23.568 -2.771 18.658 1632 HA GLU 113 HA GLU 113 22.601 -0.252 17.922 1633 1HB GLU 113 HB2 GLU 113 25.153 -1.040 19.423 1634 2HB GLU 113 HB3 GLU 113 24.447 0.591 19.435 1635 1HG GLU 113 HG2 GLU 113 22.339 -0.378 20.406 1636 2HG GLU 113 HG3 GLU 113 23.141 -1.948 20.503 1637 H GLU 114 HN GLU 114 25.568 -1.987 17.043 1638 HA GLU 114 HA GLU 114 26.810 0.203 15.672 1639 1HB GLU 114 HB2 GLU 114 28.298 -1.711 14.821 1640 2HB GLU 114 HB3 GLU 114 28.349 -1.320 16.553 1641 1HG GLU 114 HG2 GLU 114 26.795 -3.259 16.962 1642 2HG GLU 114 HG3 GLU 114 26.918 -3.632 15.224 1643 H GLU 115 HN GLU 115 24.726 -2.686 14.738 1644 HA GLU 115 HA GLU 115 25.344 -2.146 11.981 1645 1HB GLU 115 HB2 GLU 115 23.349 -3.974 13.285 1646 2HB GLU 115 HB3 GLU 115 23.545 -3.813 11.535 1647 1HG GLU 115 HG2 GLU 115 25.977 -4.386 13.277 1648 2HG GLU 115 HG3 GLU 115 24.887 -5.688 12.803 1649 H LYS 116 HN LYS 116 22.651 -1.252 14.180 1650 HA LYS 116 HA LYS 116 21.050 0.092 12.255 1651 1HB LYS 116 HB2 LYS 116 21.647 0.633 15.191 1652 2HB LYS 116 HB3 LYS 116 20.561 1.670 14.283 1653 1HG LYS 116 HG2 LYS 116 20.050 -1.318 14.330 1654 2HG LYS 116 HG3 LYS 116 19.652 -0.322 15.732 1655 1HD LYS 116 HD2 LYS 116 18.237 1.149 14.309 1656 2HD LYS 116 HD3 LYS 116 18.549 0.095 12.907 1657 1HE LYS 116 HE2 LYS 116 17.472 -1.777 13.970 1658 2HE LYS 116 HE3 LYS 116 17.485 -0.968 15.545 1659 1HZ LYS 116 HZ1 LYS 116 15.841 0.593 14.698 1660 2HZ LYS 116 HZ2 LYS 116 15.753 -0.205 13.261 1661 3HZ LYS 116 HZ3 LYS 116 15.297 -0.934 14.636 1662 H TRP 117 HN TRP 117 23.743 1.430 14.236 1663 HA TRP 117 HA TRP 117 23.666 3.944 12.923 1664 1HB TRP 117 HB2 TRP 117 24.834 3.373 15.094 1665 2HB TRP 117 HB3 TRP 117 26.122 2.633 14.155 1666 HD1 TRP 117 HD1 TRP 117 25.455 5.567 12.188 1667 HE1 TRP 117 HE1 TRP 117 26.898 7.560 12.820 1668 HE3 TRP 117 HE3 TRP 117 27.022 3.969 16.802 1669 HZ2 TRP 117 HZ2 TRP 117 28.518 8.369 15.024 1670 HZ3 TRP 117 HZ3 TRP 117 28.507 5.412 18.169 1671 HH2 TRP 117 HH2 TRP 117 29.274 7.615 17.298 1672 H ALA 118 HN ALA 118 25.524 0.986 12.161 1673 HA ALA 118 HA ALA 118 27.020 1.986 10.023 1674 1HB ALA 118 HB1 ALA 118 27.285 -0.426 9.447 1675 2HB ALA 118 HB2 ALA 118 27.369 -0.209 11.214 1676 3HB ALA 118 HB3 ALA 118 25.892 -0.818 10.479 1677 H PHE 119 HN PHE 119 23.743 0.521 9.951 1678 HA PHE 119 HA PHE 119 23.452 0.694 7.096 1679 1HB PHE 119 HB2 PHE 119 21.605 0.219 9.428 1680 2HB PHE 119 HB3 PHE 119 20.890 0.785 7.950 1681 HD1 PHE 119 HD1 PHE 119 23.508 -1.804 8.864 1682 HD2 PHE 119 HD2 PHE 119 20.002 -0.831 6.532 1683 HE1 PHE 119 HE1 PHE 119 23.478 -4.097 7.937 1684 HE2 PHE 119 HE2 PHE 119 19.982 -3.122 5.618 1685 HZ PHE 119 HZ PHE 119 21.715 -4.769 6.315 1686 H PHE 120 HN PHE 120 22.487 2.848 9.824 1687 HA PHE 120 HA PHE 120 21.271 4.760 8.098 1688 1HB PHE 120 HB2 PHE 120 22.071 4.715 11.006 1689 2HB PHE 120 HB3 PHE 120 21.774 6.274 10.243 1690 HD1 PHE 120 HD1 PHE 120 20.193 2.975 11.039 1691 HD2 PHE 120 HD2 PHE 120 19.669 6.902 9.391 1692 HE1 PHE 120 HE1 PHE 120 17.780 2.633 11.011 1693 HE2 PHE 120 HE2 PHE 120 17.210 6.503 9.187 1694 HZ PHE 120 HZ PHE 120 16.261 4.351 9.963 1695 H GLN 121 HN GLN 121 24.662 4.501 9.214 1696 HA GLN 121 HA GLN 121 25.527 6.979 8.191 1697 1HB GLN 121 HB2 GLN 121 26.800 5.512 9.704 1698 2HB GLN 121 HB3 GLN 121 27.003 4.316 8.412 1699 1HG GLN 121 HG2 GLN 121 28.233 5.955 7.054 1700 2HG GLN 121 HG3 GLN 121 27.968 7.194 8.303 1701 1HE2 GLN 121 HE22 GLN 121 28.715 6.385 10.645 1702 2HE2 GLN 121 HE21 GLN 121 30.293 5.642 10.681 1703 H ARG 122 HN ARG 122 25.378 3.715 6.631 1704 HA ARG 122 HA ARG 122 26.429 4.594 4.158 1705 1HB ARG 122 HB2 ARG 122 26.333 2.222 4.786 1706 2HB ARG 122 HB3 ARG 122 24.566 2.269 4.853 1707 1HG ARG 122 HG2 ARG 122 24.490 2.720 2.391 1708 2HG ARG 122 HG3 ARG 122 26.258 2.678 2.346 1709 1HD ARG 122 HD2 ARG 122 25.334 0.585 1.564 1710 2HD ARG 122 HD3 ARG 122 26.223 0.317 3.061 1711 HE ARG 122 HE ARG 122 23.250 0.345 2.689 1712 1HH1 ARG 122 HH11 ARG 122 26.000 -0.574 4.757 1713 2HH1 ARG 122 HH12 ARG 122 25.046 -1.543 5.814 1714 1HH2 ARG 122 HH21 ARG 122 21.980 -0.871 4.117 1715 2HH2 ARG 122 HH22 ARG 122 22.700 -1.708 5.447 1716 H VAL 123 HN VAL 123 22.992 4.102 5.202 1717 HA VAL 123 HA VAL 123 22.005 4.931 2.658 1718 HB VAL 123 HB VAL 123 20.560 4.670 5.316 1719 1HG1 VAL 123 HG11 VAL 123 19.216 6.063 3.879 1720 2HG1 VAL 123 HG12 VAL 123 19.530 5.030 2.463 1721 3HG1 VAL 123 HG13 VAL 123 18.517 4.452 3.787 1722 1HG2 VAL 123 HG21 VAL 123 19.775 2.492 4.375 1723 2HG2 VAL 123 HG22 VAL 123 20.757 2.763 2.925 1724 3HG2 VAL 123 HG23 VAL 123 21.528 2.507 4.498 1725 H ARG 124 HN ARG 124 22.612 6.873 5.699 1726 HA ARG 124 HA ARG 124 21.267 9.147 4.686 1727 1HB ARG 124 HB2 ARG 124 22.320 10.467 6.307 1728 2HB ARG 124 HB3 ARG 124 22.027 8.902 7.053 1729 1HG ARG 124 HG2 ARG 124 24.393 8.357 6.881 1730 2HG ARG 124 HG3 ARG 124 24.735 9.867 6.025 1731 1HD ARG 124 HD2 ARG 124 24.204 11.192 7.952 1732 2HD ARG 124 HD3 ARG 124 23.424 9.826 8.751 1733 HE ARG 124 HE ARG 124 25.322 9.290 9.709 1734 1HH1 ARG 124 HH11 ARG 124 26.324 10.937 6.698 1735 2HH1 ARG 124 HH12 ARG 124 27.997 10.928 7.100 1736 1HH2 ARG 124 HH21 ARG 124 27.515 9.367 10.265 1737 2HH2 ARG 124 HH22 ARG 124 28.700 9.975 9.150 1738 H ASP 125 HN ASP 125 24.638 8.063 4.159 1739 HA ASP 125 HA ASP 125 25.487 10.380 2.749 1740 1HB ASP 125 HB2 ASP 125 27.057 8.649 3.478 1741 2HB ASP 125 HB3 ASP 125 26.313 7.467 2.400 1742 H GLU 126 HN GLU 126 23.849 7.403 1.600 1743 HA GLU 126 HA GLU 126 23.870 8.154 -1.155 1744 1HB GLU 126 HB2 GLU 126 23.622 5.836 -0.177 1745 2HB GLU 126 HB3 GLU 126 21.943 6.237 0.232 1746 1HG GLU 126 HG2 GLU 126 21.516 6.752 -2.169 1747 2HG GLU 126 HG3 GLU 126 23.184 6.325 -2.558 1748 H ILE 127 HN ILE 127 21.271 8.370 1.351 1749 HA ILE 127 HA ILE 127 19.283 9.523 -0.293 1750 HB ILE 127 HB ILE 127 19.812 9.492 2.694 1751 1HG1 ILE 127 HG12 ILE 127 17.696 8.306 0.838 1752 2HG1 ILE 127 HG13 ILE 127 18.979 7.438 1.666 1753 1HG2 ILE 127 HG21 ILE 127 18.722 11.699 2.255 1754 2HG2 ILE 127 HG22 ILE 127 17.379 10.835 1.473 1755 3HG2 ILE 127 HG23 ILE 127 17.741 10.604 3.201 1756 1HD1 ILE 127 HD11 ILE 127 16.498 8.692 2.932 1757 2HD1 ILE 127 HD12 ILE 127 16.900 6.978 2.793 1758 3HD1 ILE 127 HD13 ILE 127 17.851 8.031 3.871 1759 H GLY 128 HN GLY 128 21.816 11.153 1.733 1760 1HA GLY 128 HA2 GLY 128 20.993 13.787 1.198 1761 2HA GLY 128 HA3 GLY 128 22.656 13.267 1.582 1762 H ASN 129 HN ASN 129 23.368 11.739 -0.639 1763 HA ASN 129 HA ASN 129 23.906 13.746 -2.566 1764 1HB ASN 129 HB2 ASN 129 25.393 11.818 -2.362 1765 2HB ASN 129 HB3 ASN 129 24.084 10.709 -2.792 1766 1HD2 ASN 129 HD22 ASN 129 23.631 10.366 -5.025 1767 2HD2 ASN 129 HD21 ASN 129 24.232 11.396 -6.307 1768 H ARG 130 HN ARG 130 21.479 11.108 -2.595 1769 HA ARG 130 HA ARG 130 20.621 11.660 -5.285 1770 1HB ARG 130 HB2 ARG 130 19.171 10.297 -2.968 1771 2HB ARG 130 HB3 ARG 130 18.525 10.419 -4.612 1772 1HG ARG 130 HG2 ARG 130 20.587 9.271 -5.475 1773 2HG ARG 130 HG3 ARG 130 21.107 9.004 -3.808 1774 1HD ARG 130 HD2 ARG 130 18.899 7.829 -3.393 1775 2HD ARG 130 HD3 ARG 130 18.571 7.946 -5.123 1776 HE ARG 130 HE ARG 130 20.146 5.998 -3.768 1777 1HH1 ARG 130 HH11 ARG 130 20.330 7.802 -6.852 1778 2HH1 ARG 130 HH12 ARG 130 21.296 6.590 -7.610 1779 1HH2 ARG 130 HH21 ARG 130 21.330 4.506 -4.717 1780 2HH2 ARG 130 HH22 ARG 130 21.864 4.607 -6.384 1781 H LEU 131 HN LEU 131 19.300 12.802 -2.115 1782 HA LEU 131 HA LEU 131 17.252 14.346 -3.371 1783 1HB LEU 131 HB2 LEU 131 18.491 14.295 -0.609 1784 2HB LEU 131 HB3 LEU 131 17.524 15.677 -1.060 1785 HG LEU 131 HG LEU 131 16.197 14.057 0.162 1786 1HD1 LEU 131 HD11 LEU 131 15.259 14.138 -2.732 1787 2HD1 LEU 131 HD12 LEU 131 14.271 13.978 -1.295 1788 3HD1 LEU 131 HD13 LEU 131 15.130 15.502 -1.615 1789 1HD2 LEU 131 HD21 LEU 131 16.571 12.123 -2.167 1790 2HD2 LEU 131 HD22 LEU 131 17.274 11.946 -0.548 1791 3HD2 LEU 131 HD23 LEU 131 15.521 11.901 -0.755 1792 H LYS 132 HN LYS 132 20.673 15.190 -2.538 1793 HA LYS 132 HA LYS 132 20.383 17.941 -3.267 1794 1HB LYS 132 HB2 LYS 132 22.265 16.964 -1.976 1795 2HB LYS 132 HB3 LYS 132 22.797 16.080 -3.416 1796 1HG LYS 132 HG2 LYS 132 23.145 18.254 -4.595 1797 2HG LYS 132 HG3 LYS 132 22.658 19.121 -3.128 1798 1HD LYS 132 HD2 LYS 132 24.971 17.144 -3.300 1799 2HD LYS 132 HD3 LYS 132 25.144 18.903 -3.482 1800 1HE LYS 132 HE2 LYS 132 24.139 19.172 -1.180 1801 2HE LYS 132 HE3 LYS 132 24.169 17.414 -1.001 1802 1HZ LYS 132 HZ1 LYS 132 26.120 18.422 -0.006 1803 2HZ LYS 132 HZ2 LYS 132 26.592 17.510 -1.270 1804 3HZ LYS 132 HZ3 LYS 132 26.547 19.140 -1.404 1805 H GLU 133 HN GLU 133 21.222 14.978 -5.237 1806 HA GLU 133 HA GLU 133 21.523 16.460 -7.639 1807 1HB GLU 133 HB2 GLU 133 20.893 13.546 -7.066 1808 2HB GLU 133 HB3 GLU 133 20.597 14.187 -8.702 1809 1HG GLU 133 HG2 GLU 133 22.843 14.962 -8.913 1810 2HG GLU 133 HG3 GLU 133 23.238 14.492 -7.247 1811 H PHE 134 HN PHE 134 18.462 15.226 -6.114 1812 HA PHE 134 HA PHE 134 16.890 15.726 -8.414 1813 1HB PHE 134 HB2 PHE 134 16.100 16.243 -5.509 1814 2HB PHE 134 HB3 PHE 134 14.990 16.135 -6.863 1815 HD1 PHE 134 HD1 PHE 134 14.208 14.662 -4.802 1816 HD2 PHE 134 HD2 PHE 134 17.314 13.620 -7.550 1817 HE1 PHE 134 HE1 PHE 134 13.818 12.241 -4.298 1818 HE2 PHE 134 HE2 PHE 134 16.949 11.191 -7.068 1819 HZ PHE 134 HZ PHE 134 15.198 10.506 -5.439 1820 H ALA 135 HN ALA 135 17.925 17.848 -5.857 1821 HA ALA 135 HA ALA 135 16.637 20.220 -6.678 1822 1HB ALA 135 HB1 ALA 135 17.893 19.808 -4.475 1823 2HB ALA 135 HB2 ALA 135 19.377 20.204 -5.360 1824 3HB ALA 135 HB3 ALA 135 18.085 21.410 -5.215 1825 H GLU 136 HN GLU 136 19.685 18.798 -7.834 1826 HA GLU 136 HA GLU 136 20.417 21.097 -9.424 1827 1HB GLU 136 HB2 GLU 136 21.570 18.283 -9.391 1828 2HB GLU 136 HB3 GLU 136 22.243 19.672 -10.247 1829 1HG GLU 136 HG2 GLU 136 22.419 20.839 -7.980 1830 2HG GLU 136 HG3 GLU 136 22.021 19.277 -7.252 1831 H THR 137 HN THR 137 19.263 17.840 -10.020 1832 HA THR 137 HA THR 137 19.318 17.974 -12.894 1833 HB THR 137 HB THR 137 18.595 15.623 -12.688 1834 HG1 THR 137 HG1 THR 137 18.576 15.999 -9.916 1835 1HG2 THR 137 HG21 THR 137 20.479 14.768 -11.369 1836 2HG2 THR 137 HG22 THR 137 20.952 16.065 -12.482 1837 3HG2 THR 137 HG23 THR 137 20.807 16.406 -10.756 1838 H GLY 138 HN GLY 138 16.864 18.574 -10.469 1839 1HA GLY 138 HA2 GLY 138 14.681 19.165 -10.620 1840 2HA GLY 138 HA3 GLY 138 14.785 19.244 -12.401 1841 H LYS 139 HN LYS 139 16.068 16.381 -11.033 1842 HA LYS 139 HA LYS 139 15.683 14.284 -11.479 1843 1HB LYS 139 HB2 LYS 139 14.549 14.952 -9.311 1844 2HB LYS 139 HB3 LYS 139 13.021 14.632 -10.171 1845 1HG LYS 139 HG2 LYS 139 13.964 12.797 -8.764 1846 2HG LYS 139 HG3 LYS 139 13.495 12.397 -10.404 1847 1HD LYS 139 HD2 LYS 139 16.398 12.915 -9.682 1848 2HD LYS 139 HD3 LYS 139 15.631 11.359 -9.362 1849 1HE LYS 139 HE2 LYS 139 16.393 12.581 -11.995 1850 2HE LYS 139 HE3 LYS 139 16.729 10.980 -11.352 1851 1HZ LYS 139 HZ1 LYS 139 14.137 11.968 -12.384 1852 2HZ LYS 139 HZ2 LYS 139 15.078 10.793 -13.053 1853 3HZ LYS 139 HZ3 LYS 139 14.289 10.515 -11.636 Start of MODEL 18 1 1H MET 1 H1 MET 1 -23.390 -10.561 -8.043 2 2H MET 1 H2 MET 1 -23.076 -12.071 -7.514 3 3H MET 1 H3 MET 1 -24.569 -11.409 -7.288 4 HA MET 1 HA MET 1 -24.797 -12.943 -9.005 5 1HB MET 1 HB2 MET 1 -24.576 -10.190 -10.307 6 2HB MET 1 HB3 MET 1 -25.399 -11.608 -10.958 7 1HG MET 1 HG2 MET 1 -27.134 -10.359 -10.036 8 2HG MET 1 HG3 MET 1 -26.829 -11.605 -8.830 9 1HE MET 1 HE1 MET 1 -27.824 -10.621 -6.713 10 2HE MET 1 HE2 MET 1 -27.831 -8.887 -6.330 11 3HE MET 1 HE3 MET 1 -28.624 -9.470 -7.811 12 H ALA 2 HN ALA 2 -22.100 -10.653 -9.953 13 HA ALA 2 HA ALA 2 -20.366 -12.907 -10.483 14 1HB ALA 2 HB1 ALA 2 -21.077 -10.909 -12.697 15 2HB ALA 2 HB2 ALA 2 -19.794 -12.133 -12.774 16 3HB ALA 2 HB3 ALA 2 -21.489 -12.639 -12.710 17 H ILE 3 HN ILE 3 -18.159 -11.994 -10.947 18 HA ILE 3 HA ILE 3 -17.660 -9.494 -9.489 19 HB ILE 3 HB ILE 3 -15.918 -11.811 -10.444 20 1HG1 ILE 3 HG12 ILE 3 -15.008 -11.571 -8.096 21 2HG1 ILE 3 HG13 ILE 3 -16.299 -10.416 -7.775 22 1HG2 ILE 3 HG21 ILE 3 -13.926 -10.484 -9.759 23 2HG2 ILE 3 HG22 ILE 3 -14.707 -9.785 -11.169 24 3HG2 ILE 3 HG23 ILE 3 -14.964 -9.044 -9.575 25 1HD1 ILE 3 HD11 ILE 3 -17.967 -12.207 -8.170 26 2HD1 ILE 3 HD12 ILE 3 -16.629 -13.351 -8.502 27 3HD1 ILE 3 HD13 ILE 3 -16.797 -12.590 -6.906 28 H VAL 4 HN VAL 4 -18.418 -7.894 -10.732 29 HA VAL 4 HA VAL 4 -18.139 -7.802 -13.628 30 HB VAL 4 HB VAL 4 -19.194 -5.811 -11.616 31 1HG1 VAL 4 HG11 VAL 4 -19.570 -5.913 -14.637 32 2HG1 VAL 4 HG12 VAL 4 -20.520 -4.899 -13.536 33 3HG1 VAL 4 HG13 VAL 4 -18.802 -4.606 -13.689 34 1HG2 VAL 4 HG21 VAL 4 -20.545 -7.829 -11.475 35 2HG2 VAL 4 HG22 VAL 4 -21.459 -6.650 -12.403 36 3HG2 VAL 4 HG23 VAL 4 -20.617 -7.959 -13.247 37 H LYS 5 HN LYS 5 -17.177 -5.662 -14.525 38 HA LYS 5 HA LYS 5 -14.736 -4.897 -13.067 39 1HB LYS 5 HB2 LYS 5 -14.064 -6.500 -14.729 40 2HB LYS 5 HB3 LYS 5 -14.925 -5.625 -16.006 41 1HG LYS 5 HG2 LYS 5 -13.413 -3.770 -15.898 42 2HG LYS 5 HG3 LYS 5 -12.687 -4.342 -14.381 43 1HD LYS 5 HD2 LYS 5 -11.660 -6.226 -15.476 44 2HD LYS 5 HD3 LYS 5 -12.543 -5.914 -16.989 45 1HE LYS 5 HE2 LYS 5 -11.365 -3.833 -17.345 46 2HE LYS 5 HE3 LYS 5 -10.607 -3.917 -15.745 47 1HZ LYS 5 HZ1 LYS 5 -10.096 -5.938 -17.839 48 2HZ LYS 5 HZ2 LYS 5 -9.175 -4.594 -17.621 49 3HZ LYS 5 HZ3 LYS 5 -9.267 -5.689 -16.418 50 H ALA 6 HN ALA 6 -14.610 -2.824 -12.770 51 HA ALA 6 HA ALA 6 -16.505 -0.903 -13.942 52 1HB ALA 6 HB1 ALA 6 -15.167 0.625 -12.347 53 2HB ALA 6 HB2 ALA 6 -16.178 -0.597 -11.604 54 3HB ALA 6 HB3 ALA 6 -14.428 -0.856 -11.727 55 H THR 7 HN THR 7 -15.457 1.229 -14.628 56 HA THR 7 HA THR 7 -12.669 1.143 -15.544 57 HB THR 7 HB THR 7 -13.210 2.196 -17.636 58 HG1 THR 7 HG1 THR 7 -15.155 2.869 -18.191 59 1HG2 THR 7 HG21 THR 7 -15.125 -0.125 -17.322 60 2HG2 THR 7 HG22 THR 7 -14.416 0.501 -18.838 61 3HG2 THR 7 HG23 THR 7 -13.366 -0.253 -17.617 62 H ASP 8 HN ASP 8 -12.580 3.612 -16.533 63 HA ASP 8 HA ASP 8 -12.288 5.530 -14.503 64 1HB ASP 8 HB2 ASP 8 -11.227 5.804 -16.607 65 2HB ASP 8 HB3 ASP 8 -12.747 5.657 -17.487 66 H GLN 9 HN GLN 9 -15.253 4.549 -16.161 67 HA GLN 9 HA GLN 9 -16.796 6.504 -14.583 68 1HB GLN 9 HB2 GLN 9 -16.921 6.059 -17.583 69 2HB GLN 9 HB3 GLN 9 -18.267 6.775 -16.685 70 1HG GLN 9 HG2 GLN 9 -17.015 8.696 -16.054 71 2HG GLN 9 HG3 GLN 9 -15.485 7.961 -16.486 72 1HE2 GLN 9 HE22 GLN 9 -14.594 8.602 -18.367 73 2HE2 GLN 9 HE21 GLN 9 -15.483 9.248 -19.745 74 H SER 10 HN SER 10 -16.707 3.390 -16.372 75 HA SER 10 HA SER 10 -19.374 2.682 -15.854 76 1HB SER 10 HB2 SER 10 -17.080 0.704 -15.989 77 2HB SER 10 HB3 SER 10 -18.787 0.426 -16.359 78 HG SER 10 HG SER 10 -16.821 1.841 -17.771 79 H PHE 11 HN PHE 11 -16.723 2.883 -13.549 80 HA PHE 11 HA PHE 11 -17.602 1.151 -11.502 81 1HB PHE 11 HB2 PHE 11 -15.574 2.420 -11.220 82 2HB PHE 11 HB3 PHE 11 -16.397 3.937 -11.500 83 HD1 PHE 11 HD1 PHE 11 -16.124 1.098 -9.007 84 HD2 PHE 11 HD2 PHE 11 -17.335 5.190 -9.733 85 HE1 PHE 11 HE1 PHE 11 -16.285 1.517 -6.568 86 HE2 PHE 11 HE2 PHE 11 -17.523 5.566 -7.293 87 HZ PHE 11 HZ PHE 11 -16.972 3.732 -5.705 88 H SER 12 HN SER 12 -18.680 4.579 -12.117 89 HA SER 12 HA SER 12 -20.587 4.509 -10.039 90 1HB SER 12 HB2 SER 12 -20.742 6.118 -12.638 91 2HB SER 12 HB3 SER 12 -21.398 6.579 -11.057 92 HG SER 12 HG SER 12 -19.413 7.648 -11.500 93 H ALA 13 HN ALA 13 -20.857 3.846 -13.552 94 HA ALA 13 HA ALA 13 -23.648 3.698 -13.586 95 1HB ALA 13 HB1 ALA 13 -22.203 3.928 -15.595 96 2HB ALA 13 HB2 ALA 13 -21.664 2.241 -15.394 97 3HB ALA 13 HB3 ALA 13 -23.363 2.592 -15.773 98 H GLU 14 HN GLU 14 -21.208 1.203 -12.900 99 HA GLU 14 HA GLU 14 -23.113 -0.924 -12.772 100 1HB GLU 14 HB2 GLU 14 -20.177 -0.757 -12.050 101 2HB GLU 14 HB3 GLU 14 -21.108 -2.245 -11.948 102 1HG GLU 14 HG2 GLU 14 -20.763 -0.620 -14.496 103 2HG GLU 14 HG3 GLU 14 -19.780 -2.016 -14.051 104 H THR 15 HN THR 15 -22.214 1.503 -10.465 105 HA THR 15 HA THR 15 -22.866 -0.258 -8.161 106 HB THR 15 HB THR 15 -21.561 1.406 -6.856 107 HG1 THR 15 HG1 THR 15 -20.602 2.378 -9.293 108 1HG2 THR 15 HG21 THR 15 -20.138 0.017 -9.155 109 2HG2 THR 15 HG22 THR 15 -19.279 0.977 -7.950 110 3HG2 THR 15 HG23 THR 15 -20.216 -0.444 -7.441 111 H SER 16 HN SER 16 -24.342 2.145 -10.010 112 HA SER 16 HA SER 16 -25.345 3.809 -7.901 113 1HB SER 16 HB2 SER 16 -26.157 3.485 -10.818 114 2HB SER 16 HB3 SER 16 -26.810 4.724 -9.733 115 HG SER 16 HG SER 16 -24.073 4.368 -10.448 116 H GLU 17 HN GLU 17 -26.245 0.630 -8.579 117 HA GLU 17 HA GLU 17 -28.834 1.011 -7.275 118 1HB GLU 17 HB2 GLU 17 -28.425 -0.451 -9.925 119 2HB GLU 17 HB3 GLU 17 -29.861 -0.634 -8.909 120 1HG GLU 17 HG2 GLU 17 -30.309 1.816 -9.139 121 2HG GLU 17 HG3 GLU 17 -28.939 1.943 -10.250 122 H GLY 18 HN GLY 18 -29.465 -0.813 -6.044 123 1HA GLY 18 HA2 GLY 18 -29.222 -2.733 -4.842 124 2HA GLY 18 HA3 GLY 18 -28.030 -3.323 -6.013 125 H VAL 19 HN VAL 19 -27.244 -4.057 -3.773 126 HA VAL 19 HA VAL 19 -25.353 -2.035 -2.673 127 HB VAL 19 HB VAL 19 -26.063 -4.725 -1.399 128 1HG1 VAL 19 HG11 VAL 19 -24.472 -2.301 -0.458 129 2HG1 VAL 19 HG12 VAL 19 -24.816 -3.754 0.500 130 3HG1 VAL 19 HG13 VAL 19 -23.781 -3.872 -0.918 131 1HG2 VAL 19 HG21 VAL 19 -28.033 -3.399 -1.259 132 2HG2 VAL 19 HG22 VAL 19 -27.211 -3.188 0.284 133 3HG2 VAL 19 HG23 VAL 19 -27.115 -1.924 -0.942 134 H VAL 20 HN VAL 20 -23.340 -2.067 -3.269 135 HA VAL 20 HA VAL 20 -22.409 -4.315 -4.941 136 HB VAL 20 HB VAL 20 -22.170 -1.401 -5.787 137 1HG1 VAL 20 HG11 VAL 20 -21.555 -2.456 -7.947 138 2HG1 VAL 20 HG12 VAL 20 -20.427 -2.895 -6.648 139 3HG1 VAL 20 HG13 VAL 20 -21.657 -4.057 -7.184 140 1HG2 VAL 20 HG21 VAL 20 -23.868 -2.072 -7.585 141 2HG2 VAL 20 HG22 VAL 20 -24.273 -3.458 -6.569 142 3HG2 VAL 20 HG23 VAL 20 -24.512 -1.809 -5.966 143 H LEU 21 HN LEU 21 -20.569 -4.959 -4.211 144 HA LEU 21 HA LEU 21 -18.808 -3.244 -2.529 145 1HB LEU 21 HB2 LEU 21 -19.519 -5.522 -1.840 146 2HB LEU 21 HB3 LEU 21 -18.744 -6.200 -3.270 147 HG LEU 21 HG LEU 21 -17.285 -4.708 -1.038 148 1HD1 LEU 21 HD11 LEU 21 -18.364 -6.735 -0.192 149 2HD1 LEU 21 HD12 LEU 21 -17.657 -7.697 -1.511 150 3HD1 LEU 21 HD13 LEU 21 -16.623 -6.974 -0.264 151 1HD2 LEU 21 HD21 LEU 21 -16.346 -6.243 -3.484 152 2HD2 LEU 21 HD22 LEU 21 -15.840 -4.646 -2.908 153 3HD2 LEU 21 HD23 LEU 21 -15.320 -6.084 -2.045 154 H ALA 22 HN ALA 22 -17.255 -2.027 -3.649 155 HA ALA 22 HA ALA 22 -16.322 -3.145 -6.203 156 1HB ALA 22 HB1 ALA 22 -15.487 -0.965 -6.773 157 2HB ALA 22 HB2 ALA 22 -17.167 -0.785 -6.246 158 3HB ALA 22 HB3 ALA 22 -15.820 -0.341 -5.148 159 H ASP 23 HN ASP 23 -14.218 -3.805 -6.394 160 HA ASP 23 HA ASP 23 -12.440 -3.589 -4.004 161 1HB ASP 23 HB2 ASP 23 -13.325 -5.796 -4.020 162 2HB ASP 23 HB3 ASP 23 -13.153 -5.932 -5.761 163 H PHE 24 HN PHE 24 -10.321 -3.202 -4.386 164 HA PHE 24 HA PHE 24 -9.592 -2.313 -7.147 165 1HB PHE 24 HB2 PHE 24 -9.120 -1.129 -4.394 166 2HB PHE 24 HB3 PHE 24 -8.232 -0.609 -5.796 167 HD1 PHE 24 HD1 PHE 24 -9.013 1.219 -7.011 168 HD2 PHE 24 HD2 PHE 24 -11.826 -1.051 -4.656 169 HE1 PHE 24 HE1 PHE 24 -10.868 2.743 -7.700 170 HE2 PHE 24 HE2 PHE 24 -13.640 0.466 -5.347 171 HZ PHE 24 HZ PHE 24 -13.167 2.368 -6.880 172 H TRP 25 HN TRP 25 -8.230 -3.791 -7.909 173 HA TRP 25 HA TRP 25 -6.239 -5.059 -6.103 174 1HB TRP 25 HB2 TRP 25 -6.627 -7.133 -7.016 175 2HB TRP 25 HB3 TRP 25 -8.248 -6.488 -6.823 176 HD1 TRP 25 HD1 TRP 25 -9.232 -5.319 -9.209 177 HE1 TRP 25 HE1 TRP 25 -8.875 -5.862 -11.648 178 HE3 TRP 25 HE3 TRP 25 -5.230 -8.464 -8.686 179 HZ2 TRP 25 HZ2 TRP 25 -6.789 -7.229 -13.238 180 HZ3 TRP 25 HZ3 TRP 25 -4.020 -9.288 -10.679 181 HH2 TRP 25 HH2 TRP 25 -4.786 -8.658 -12.958 182 H ALA 26 HN ALA 26 -4.126 -5.339 -7.128 183 HA ALA 26 HA ALA 26 -3.832 -5.093 -9.965 184 1HB ALA 26 HB1 ALA 26 -2.166 -3.068 -9.670 185 2HB ALA 26 HB2 ALA 26 -3.903 -2.775 -9.805 186 3HB ALA 26 HB3 ALA 26 -3.133 -2.757 -8.204 187 HA PRO 27 HA PRO 27 -0.260 -7.484 -9.200 188 1HB PRO 27 HB2 PRO 27 1.336 -5.677 -11.015 189 2HB PRO 27 HB3 PRO 27 1.167 -7.458 -11.066 190 1HG PRO 27 HG2 PRO 27 -0.211 -5.874 -12.800 191 2HG PRO 27 HG3 PRO 27 -1.027 -7.287 -12.039 192 1HD PRO 27 HD2 PRO 27 -1.188 -4.381 -11.285 193 2HD PRO 27 HD3 PRO 27 -2.481 -5.610 -11.418 194 H TRP 28 HN TRP 28 -0.083 -4.208 -8.162 195 HA TRP 28 HA TRP 28 2.587 -3.865 -7.358 196 1HB TRP 28 HB2 TRP 28 0.162 -2.853 -5.895 197 2HB TRP 28 HB3 TRP 28 1.788 -2.174 -5.912 198 HD1 TRP 28 HD1 TRP 28 -1.446 -1.827 -7.499 199 HE1 TRP 28 HE1 TRP 28 -1.436 -0.471 -9.669 200 HE3 TRP 28 HE3 TRP 28 3.601 -1.574 -8.169 201 HZ2 TRP 28 HZ2 TRP 28 0.569 0.551 -11.501 202 HZ3 TRP 28 HZ3 TRP 28 4.546 -0.388 -10.131 203 HH2 TRP 28 HH2 TRP 28 3.042 0.673 -11.805 204 H CYS 29 HN CYS 29 0.089 -5.932 -5.808 205 HA CYS 29 HA CYS 29 2.228 -7.087 -4.207 206 1HB CYS 29 HB2 CYS 29 1.028 -6.492 -1.986 207 2HB CYS 29 HB3 CYS 29 1.982 -5.263 -2.781 208 H GLY 30 HN GLY 30 1.639 -8.713 -2.756 209 1HA GLY 30 HA2 GLY 30 0.309 -10.850 -3.722 210 2HA GLY 30 HA3 GLY 30 0.611 -10.564 -2.013 211 HA PRO 31 HA PRO 31 -3.615 -10.051 -0.983 212 1HB PRO 31 HB2 PRO 31 -3.719 -7.052 -1.201 213 2HB PRO 31 HB3 PRO 31 -4.411 -8.125 0.065 214 1HG PRO 31 HG2 PRO 31 -2.049 -6.845 0.516 215 2HG PRO 31 HG3 PRO 31 -2.220 -8.575 0.961 216 1HD PRO 31 HD2 PRO 31 -0.932 -7.381 -1.495 217 2HD PRO 31 HD3 PRO 31 -0.341 -8.716 -0.458 218 H SER 32 HN SER 32 -2.876 -7.963 -3.867 219 HA SER 32 HA SER 32 -5.513 -8.014 -4.913 220 1HB SER 32 HB2 SER 32 -2.826 -8.051 -6.362 221 2HB SER 32 HB3 SER 32 -4.356 -7.438 -7.011 222 HG SER 32 HG SER 32 -2.686 -5.994 -5.936 223 H LYS 33 HN LYS 33 -3.267 -10.596 -4.619 224 HA LYS 33 HA LYS 33 -4.984 -12.277 -6.366 225 1HB LYS 33 HB2 LYS 33 -2.955 -13.785 -6.612 226 2HB LYS 33 HB3 LYS 33 -3.116 -12.360 -7.593 227 1HG LYS 33 HG2 LYS 33 -1.302 -12.472 -5.151 228 2HG LYS 33 HG3 LYS 33 -0.827 -12.936 -6.780 229 1HD LYS 33 HD2 LYS 33 -1.632 -10.547 -7.498 230 2HD LYS 33 HD3 LYS 33 -1.526 -10.174 -5.783 231 1HE LYS 33 HE2 LYS 33 0.525 -9.487 -6.737 232 2HE LYS 33 HE3 LYS 33 0.861 -10.925 -5.771 233 1HZ LYS 33 HZ1 LYS 33 0.562 -10.887 -8.727 234 2HZ LYS 33 HZ2 LYS 33 1.971 -10.998 -7.920 235 3HZ LYS 33 HZ3 LYS 33 0.898 -12.217 -7.834 236 H MET 34 HN MET 34 -5.135 -11.521 -3.433 237 HA MET 34 HA MET 34 -5.780 -14.304 -2.587 238 1HB MET 34 HB2 MET 34 -4.439 -12.176 -0.885 239 2HB MET 34 HB3 MET 34 -5.274 -13.587 -0.219 240 1HG MET 34 HG2 MET 34 -3.815 -15.103 -1.466 241 2HG MET 34 HG3 MET 34 -2.948 -13.742 -2.175 242 1HE MET 34 HE1 MET 34 -2.160 -11.710 -0.133 243 2HE MET 34 HE2 MET 34 -0.667 -12.408 0.533 244 3HE MET 34 HE3 MET 34 -1.023 -12.566 -1.203 245 H ILE 35 HN ILE 35 -6.462 -10.766 -2.221 246 HA ILE 35 HA ILE 35 -9.049 -11.129 -1.132 247 HB ILE 35 HB ILE 35 -7.498 -8.988 -1.414 248 1HG1 ILE 35 HG12 ILE 35 -9.731 -7.562 -1.279 249 2HG1 ILE 35 HG13 ILE 35 -10.509 -9.147 -1.217 250 1HG2 ILE 35 HG21 ILE 35 -8.203 -7.417 -3.089 251 2HG2 ILE 35 HG22 ILE 35 -7.562 -8.867 -3.871 252 3HG2 ILE 35 HG23 ILE 35 -9.322 -8.589 -3.804 253 1HD1 ILE 35 HD11 ILE 35 -9.979 -8.245 1.045 254 2HD1 ILE 35 HD12 ILE 35 -9.088 -9.752 0.737 255 3HD1 ILE 35 HD13 ILE 35 -8.252 -8.186 0.612 256 H ALA 36 HN ALA 36 -7.756 -11.166 -4.474 257 HA ALA 36 HA ALA 36 -10.201 -11.057 -5.805 258 1HB ALA 36 HB1 ALA 36 -8.108 -10.757 -7.012 259 2HB ALA 36 HB2 ALA 36 -7.620 -12.419 -6.699 260 3HB ALA 36 HB3 ALA 36 -9.015 -12.093 -7.744 261 HA PRO 37 HA PRO 37 -10.674 -15.838 -5.705 262 1HB PRO 37 HB2 PRO 37 -9.377 -16.994 -3.431 263 2HB PRO 37 HB3 PRO 37 -9.000 -17.261 -5.166 264 1HG PRO 37 HG2 PRO 37 -7.666 -15.516 -3.166 265 2HG PRO 37 HG3 PRO 37 -6.964 -16.264 -4.624 266 1HD PRO 37 HD2 PRO 37 -7.575 -13.578 -4.471 267 2HD PRO 37 HD3 PRO 37 -7.638 -14.505 -5.985 268 H VAL 38 HN VAL 38 -10.050 -14.065 -2.619 269 HA VAL 38 HA VAL 38 -12.217 -15.150 -1.163 270 HB VAL 38 HB VAL 38 -10.450 -12.753 -0.994 271 1HG1 VAL 38 HG11 VAL 38 -12.968 -13.039 0.640 272 2HG1 VAL 38 HG12 VAL 38 -11.573 -12.015 1.097 273 3HG1 VAL 38 HG13 VAL 38 -12.469 -11.707 -0.403 274 1HG2 VAL 38 HG21 VAL 38 -9.744 -14.980 -0.198 275 2HG2 VAL 38 HG22 VAL 38 -9.812 -13.775 1.108 276 3HG2 VAL 38 HG23 VAL 38 -11.101 -14.989 0.949 277 H LEU 39 HN LEU 39 -12.171 -12.426 -3.527 278 HA LEU 39 HA LEU 39 -14.928 -11.772 -3.017 279 1HB LEU 39 HB2 LEU 39 -13.007 -11.135 -5.285 280 2HB LEU 39 HB3 LEU 39 -14.726 -10.947 -5.555 281 HG LEU 39 HG LEU 39 -13.931 -8.826 -4.999 282 1HD1 LEU 39 HD11 LEU 39 -15.189 -9.776 -2.397 283 2HD1 LEU 39 HD12 LEU 39 -15.266 -8.180 -3.142 284 3HD1 LEU 39 HD13 LEU 39 -16.092 -9.552 -3.898 285 1HD2 LEU 39 HD21 LEU 39 -12.766 -8.232 -2.917 286 2HD2 LEU 39 HD22 LEU 39 -12.669 -9.953 -2.477 287 3HD2 LEU 39 HD23 LEU 39 -11.826 -9.340 -3.919 288 H GLU 40 HN GLU 40 -13.388 -13.969 -5.442 289 HA GLU 40 HA GLU 40 -15.879 -14.551 -6.697 290 1HB GLU 40 HB2 GLU 40 -13.340 -16.208 -6.621 291 2HB GLU 40 HB3 GLU 40 -14.749 -16.447 -7.691 292 1HG GLU 40 HG2 GLU 40 -14.407 -14.224 -8.684 293 2HG GLU 40 HG3 GLU 40 -12.996 -13.959 -7.665 294 H GLU 41 HN GLU 41 -14.166 -15.974 -3.907 295 HA GLU 41 HA GLU 41 -15.992 -18.106 -3.412 296 1HB GLU 41 HB2 GLU 41 -13.899 -16.689 -1.747 297 2HB GLU 41 HB3 GLU 41 -14.869 -17.990 -1.090 298 1HG GLU 41 HG2 GLU 41 -13.101 -18.242 -3.559 299 2HG GLU 41 HG3 GLU 41 -12.638 -18.727 -1.931 300 H LEU 42 HN LEU 42 -16.184 -14.692 -2.789 301 HA LEU 42 HA LEU 42 -18.244 -14.964 -0.688 302 1HB LEU 42 HB2 LEU 42 -16.574 -13.055 -0.728 303 2HB LEU 42 HB3 LEU 42 -17.141 -12.600 -2.322 304 HG LEU 42 HG LEU 42 -19.392 -12.060 -1.377 305 1HD1 LEU 42 HD11 LEU 42 -19.483 -11.742 1.081 306 2HD1 LEU 42 HD12 LEU 42 -19.314 -13.455 0.664 307 3HD1 LEU 42 HD13 LEU 42 -17.902 -12.537 1.242 308 1HD2 LEU 42 HD21 LEU 42 -17.040 -10.609 -0.077 309 2HD2 LEU 42 HD22 LEU 42 -17.637 -10.317 -1.722 310 3HD2 LEU 42 HD23 LEU 42 -18.672 -9.961 -0.330 311 H ASP 43 HN ASP 43 -17.987 -14.089 -4.159 312 HA ASP 43 HA ASP 43 -20.757 -13.461 -4.348 313 1HB ASP 43 HB2 ASP 43 -19.092 -12.610 -5.979 314 2HB ASP 43 HB3 ASP 43 -18.685 -14.257 -6.451 315 H GLN 44 HN GLN 44 -18.926 -16.452 -4.992 316 HA GLN 44 HA GLN 44 -21.220 -17.829 -5.981 317 1HB GLN 44 HB2 GLN 44 -19.903 -19.767 -6.003 318 2HB GLN 44 HB3 GLN 44 -18.839 -18.407 -6.381 319 1HG GLN 44 HG2 GLN 44 -18.121 -18.442 -3.930 320 2HG GLN 44 HG3 GLN 44 -19.024 -19.947 -3.751 321 1HE2 GLN 44 HE22 GLN 44 -16.462 -18.404 -5.750 322 2HE2 GLN 44 HE21 GLN 44 -15.546 -19.882 -6.038 323 H GLU 45 HN GLU 45 -20.606 -16.738 -2.767 324 HA GLU 45 HA GLU 45 -22.212 -18.856 -1.623 325 1HB GLU 45 HB2 GLU 45 -20.399 -18.808 -0.302 326 2HB GLU 45 HB3 GLU 45 -20.035 -17.107 -0.633 327 1HG GLU 45 HG2 GLU 45 -21.604 -16.300 0.841 328 2HG GLU 45 HG3 GLU 45 -22.446 -17.855 1.010 329 H MET 46 HN MET 46 -22.033 -15.307 -1.846 330 HA MET 46 HA MET 46 -24.930 -15.196 -1.140 331 1HB MET 46 HB2 MET 46 -24.373 -13.198 0.197 332 2HB MET 46 HB3 MET 46 -23.770 -14.725 0.838 333 1HG MET 46 HG2 MET 46 -21.521 -14.230 0.044 334 2HG MET 46 HG3 MET 46 -22.061 -12.767 -0.772 335 1HE MET 46 HE1 MET 46 -22.742 -10.290 1.999 336 2HE MET 46 HE2 MET 46 -22.655 -10.704 0.269 337 3HE MET 46 HE3 MET 46 -24.030 -11.302 1.228 338 H GLY 47 HN GLY 47 -23.173 -14.845 -3.734 339 1HA GLY 47 HA2 GLY 47 -23.696 -12.163 -4.566 340 2HA GLY 47 HA3 GLY 47 -23.368 -13.574 -5.618 341 H ASP 48 HN ASP 48 -25.892 -14.487 -3.832 342 HA ASP 48 HA ASP 48 -27.921 -13.930 -5.797 343 1HB ASP 48 HB2 ASP 48 -28.006 -15.992 -4.468 344 2HB ASP 48 HB3 ASP 48 -28.069 -15.055 -2.976 345 H LYS 49 HN LYS 49 -26.697 -12.344 -2.936 346 HA LYS 49 HA LYS 49 -28.929 -10.449 -2.974 347 1HB LYS 49 HB2 LYS 49 -26.892 -10.635 -0.767 348 2HB LYS 49 HB3 LYS 49 -28.545 -10.034 -0.721 349 1HG LYS 49 HG2 LYS 49 -28.892 -11.975 0.367 350 2HG LYS 49 HG3 LYS 49 -29.095 -12.619 -1.278 351 1HD LYS 49 HD2 LYS 49 -27.009 -13.712 -1.242 352 2HD LYS 49 HD3 LYS 49 -26.345 -12.554 -0.077 353 1HE LYS 49 HE2 LYS 49 -26.529 -14.603 1.051 354 2HE LYS 49 HE3 LYS 49 -27.680 -13.444 1.716 355 1HZ LYS 49 HZ1 LYS 49 -29.446 -14.575 0.459 356 2HZ LYS 49 HZ2 LYS 49 -28.377 -15.661 -0.144 357 3HZ LYS 49 HZ3 LYS 49 -28.696 -15.623 1.450 358 H LEU 50 HN LEU 50 -25.499 -10.815 -3.490 359 HA LEU 50 HA LEU 50 -25.011 -7.910 -3.290 360 1HB LEU 50 HB2 LEU 50 -23.922 -9.274 -1.573 361 2HB LEU 50 HB3 LEU 50 -23.267 -10.351 -2.811 362 HG LEU 50 HG LEU 50 -21.834 -8.527 -3.669 363 1HD1 LEU 50 HD11 LEU 50 -21.572 -6.460 -2.326 364 2HD1 LEU 50 HD12 LEU 50 -23.188 -6.558 -2.996 365 3HD1 LEU 50 HD13 LEU 50 -22.940 -6.957 -1.291 366 1HD2 LEU 50 HD21 LEU 50 -20.257 -8.517 -1.817 367 2HD2 LEU 50 HD22 LEU 50 -21.541 -9.022 -0.694 368 3HD2 LEU 50 HD23 LEU 50 -21.004 -10.115 -1.988 369 H LYS 51 HN LYS 51 -23.753 -6.909 -4.819 370 HA LYS 51 HA LYS 51 -22.919 -8.474 -7.232 371 1HB LYS 51 HB2 LYS 51 -24.721 -6.742 -7.622 372 2HB LYS 51 HB3 LYS 51 -23.605 -5.522 -6.996 373 1HG LYS 51 HG2 LYS 51 -22.017 -6.031 -8.857 374 2HG LYS 51 HG3 LYS 51 -23.166 -7.238 -9.482 375 1HD LYS 51 HD2 LYS 51 -24.879 -5.454 -9.728 376 2HD LYS 51 HD3 LYS 51 -23.732 -4.265 -9.073 377 1HE LYS 51 HE2 LYS 51 -22.176 -4.765 -10.981 378 2HE LYS 51 HE3 LYS 51 -23.388 -5.860 -11.655 379 1HZ LYS 51 HZ1 LYS 51 -24.910 -3.980 -11.828 380 2HZ LYS 51 HZ2 LYS 51 -23.800 -2.971 -11.139 381 3HZ LYS 51 HZ3 LYS 51 -23.511 -3.632 -12.616 382 H ILE 52 HN ILE 52 -20.714 -8.000 -7.943 383 HA ILE 52 HA ILE 52 -19.145 -6.310 -6.101 384 HB ILE 52 HB ILE 52 -18.575 -9.135 -7.028 385 1HG1 ILE 52 HG12 ILE 52 -17.954 -8.201 -4.245 386 2HG1 ILE 52 HG13 ILE 52 -19.651 -8.199 -4.640 387 1HG2 ILE 52 HG21 ILE 52 -16.547 -7.140 -5.921 388 2HG2 ILE 52 HG22 ILE 52 -16.279 -8.887 -6.078 389 3HG2 ILE 52 HG23 ILE 52 -16.522 -7.912 -7.522 390 1HD1 ILE 52 HD11 ILE 52 -19.634 -10.536 -5.268 391 2HD1 ILE 52 HD12 ILE 52 -17.876 -10.641 -4.990 392 3HD1 ILE 52 HD13 ILE 52 -18.989 -10.342 -3.634 393 H VAL 53 HN VAL 53 -17.544 -5.121 -7.175 394 HA VAL 53 HA VAL 53 -17.309 -5.496 -10.111 395 HB VAL 53 HB VAL 53 -17.557 -2.768 -8.773 396 1HG1 VAL 53 HG11 VAL 53 -16.263 -2.716 -10.800 397 2HG1 VAL 53 HG12 VAL 53 -17.524 -3.610 -11.691 398 3HG1 VAL 53 HG13 VAL 53 -17.844 -1.970 -11.089 399 1HG2 VAL 53 HG21 VAL 53 -19.798 -3.981 -8.754 400 2HG2 VAL 53 HG22 VAL 53 -19.757 -2.478 -9.673 401 3HG2 VAL 53 HG23 VAL 53 -19.715 -4.035 -10.513 402 H LYS 54 HN LYS 54 -15.110 -5.123 -10.818 403 HA LYS 54 HA LYS 54 -13.235 -4.325 -8.645 404 1HB LYS 54 HB2 LYS 54 -12.915 -6.440 -10.799 405 2HB LYS 54 HB3 LYS 54 -11.538 -5.732 -9.932 406 1HG LYS 54 HG2 LYS 54 -12.644 -6.302 -7.768 407 2HG LYS 54 HG3 LYS 54 -13.923 -7.134 -8.646 408 1HD LYS 54 HD2 LYS 54 -12.425 -8.751 -7.793 409 2HD LYS 54 HD3 LYS 54 -12.175 -8.711 -9.548 410 1HE LYS 54 HE2 LYS 54 -10.003 -8.034 -9.345 411 2HE LYS 54 HE3 LYS 54 -10.386 -6.830 -8.099 412 1HZ LYS 54 HZ1 LYS 54 -10.235 -9.684 -7.477 413 2HZ LYS 54 HZ2 LYS 54 -8.962 -8.641 -7.335 414 3HZ LYS 54 HZ3 LYS 54 -10.323 -8.363 -6.452 415 H ILE 55 HN ILE 55 -11.461 -3.071 -9.110 416 HA ILE 55 HA ILE 55 -11.479 -1.657 -11.724 417 HB ILE 55 HB ILE 55 -10.872 -0.721 -8.885 418 1HG1 ILE 55 HG12 ILE 55 -13.110 -0.218 -9.887 419 2HG1 ILE 55 HG13 ILE 55 -12.189 1.169 -9.335 420 1HG2 ILE 55 HG21 ILE 55 -9.711 0.531 -11.399 421 2HG2 ILE 55 HG22 ILE 55 -9.709 1.263 -9.774 422 3HG2 ILE 55 HG23 ILE 55 -8.835 -0.242 -10.094 423 1HD1 ILE 55 HD11 ILE 55 -11.564 1.774 -11.622 424 2HD1 ILE 55 HD12 ILE 55 -12.423 0.356 -12.258 425 3HD1 ILE 55 HD13 ILE 55 -13.307 1.670 -11.441 426 H ASP 56 HN ASP 56 -9.577 -1.911 -12.795 427 HA ASP 56 HA ASP 56 -7.558 -3.832 -11.730 428 1HB ASP 56 HB2 ASP 56 -8.265 -2.873 -14.541 429 2HB ASP 56 HB3 ASP 56 -6.764 -3.714 -14.153 430 H VAL 57 HN VAL 57 -6.632 -2.369 -10.337 431 HA VAL 57 HA VAL 57 -6.233 0.315 -10.885 432 HB VAL 57 HB VAL 57 -4.825 -1.068 -8.613 433 1HG1 VAL 57 HG11 VAL 57 -5.678 0.986 -7.463 434 2HG1 VAL 57 HG12 VAL 57 -4.587 1.354 -8.829 435 3HG1 VAL 57 HG13 VAL 57 -6.348 1.550 -8.993 436 1HG2 VAL 57 HG21 VAL 57 -7.287 -1.935 -8.715 437 2HG2 VAL 57 HG22 VAL 57 -6.657 -1.228 -7.246 438 3HG2 VAL 57 HG23 VAL 57 -7.721 -0.283 -8.288 439 H ASP 58 HN ASP 58 -5.026 -0.595 -12.948 440 HA ASP 58 HA ASP 58 -2.523 0.842 -12.903 441 1HB ASP 58 HB2 ASP 58 -1.598 -1.391 -12.374 442 2HB ASP 58 HB3 ASP 58 -2.600 -2.129 -13.630 443 H GLU 59 HN GLU 59 -5.038 -1.134 -14.658 444 HA GLU 59 HA GLU 59 -4.329 0.096 -17.210 445 1HB GLU 59 HB2 GLU 59 -4.805 -2.156 -17.463 446 2HB GLU 59 HB3 GLU 59 -6.003 -2.181 -16.159 447 1HG GLU 59 HG2 GLU 59 -7.630 -1.095 -17.424 448 2HG GLU 59 HG3 GLU 59 -6.504 -0.698 -18.737 449 H ASN 60 HN ASN 60 -6.882 0.062 -14.735 450 HA ASN 60 HA ASN 60 -7.981 2.529 -15.885 451 1HB ASN 60 HB2 ASN 60 -10.250 1.822 -15.756 452 2HB ASN 60 HB3 ASN 60 -9.326 0.794 -16.829 453 1HD2 ASN 60 HD22 ASN 60 -10.784 -0.929 -16.750 454 2HD2 ASN 60 HD21 ASN 60 -11.339 -1.660 -15.269 455 H GLN 61 HN GLN 61 -6.236 2.358 -13.828 456 HA GLN 61 HA GLN 61 -7.442 2.335 -11.267 457 1HB GLN 61 HB2 GLN 61 -5.322 3.128 -10.441 458 2HB GLN 61 HB3 GLN 61 -5.026 1.946 -11.710 459 1HG GLN 61 HG2 GLN 61 -4.569 3.789 -13.316 460 2HG GLN 61 HG3 GLN 61 -4.751 4.928 -11.979 461 1HE2 GLN 61 HE22 GLN 61 -3.341 3.958 -9.850 462 2HE2 GLN 61 HE21 GLN 61 -1.681 3.670 -10.272 463 H GLU 62 HN GLU 62 -7.734 4.605 -13.749 464 HA GLU 62 HA GLU 62 -7.496 7.141 -12.760 465 1HB GLU 62 HB2 GLU 62 -9.426 5.741 -14.639 466 2HB GLU 62 HB3 GLU 62 -9.641 7.454 -14.262 467 1HG GLU 62 HG2 GLU 62 -8.432 7.388 -16.276 468 2HG GLU 62 HG3 GLU 62 -7.313 7.915 -15.024 469 H THR 63 HN THR 63 -10.442 5.032 -12.371 470 HA THR 63 HA THR 63 -11.911 6.839 -10.832 471 HB THR 63 HB THR 63 -11.830 3.807 -10.869 472 HG1 THR 63 HG1 THR 63 -13.397 4.115 -12.469 473 1HG2 THR 63 HG21 THR 63 -13.097 4.555 -8.851 474 2HG2 THR 63 HG22 THR 63 -14.126 5.564 -9.899 475 3HG2 THR 63 HG23 THR 63 -14.107 3.788 -10.056 476 H ALA 64 HN ALA 64 -9.298 4.675 -9.859 477 HA ALA 64 HA ALA 64 -9.922 4.673 -7.039 478 1HB ALA 64 HB1 ALA 64 -7.911 3.400 -6.853 479 2HB ALA 64 HB2 ALA 64 -8.590 2.932 -8.425 480 3HB ALA 64 HB3 ALA 64 -7.250 4.058 -8.372 481 H GLY 65 HN GLY 65 -7.262 6.148 -8.938 482 1HA GLY 65 HA2 GLY 65 -6.320 8.077 -7.159 483 2HA GLY 65 HA3 GLY 65 -6.397 8.267 -8.926 484 H LYS 66 HN LYS 66 -9.126 8.401 -9.397 485 HA LYS 66 HA LYS 66 -9.725 11.104 -8.869 486 1HB LYS 66 HB2 LYS 66 -10.485 9.746 -10.770 487 2HB LYS 66 HB3 LYS 66 -11.533 8.800 -9.701 488 1HG LYS 66 HG2 LYS 66 -12.830 10.913 -9.234 489 2HG LYS 66 HG3 LYS 66 -11.824 11.735 -10.438 490 1HD LYS 66 HD2 LYS 66 -13.686 9.356 -10.897 491 2HD LYS 66 HD3 LYS 66 -13.943 11.020 -11.439 492 1HE LYS 66 HE2 LYS 66 -11.926 10.844 -12.903 493 2HE LYS 66 HE3 LYS 66 -11.693 9.174 -12.375 494 1HZ LYS 66 HZ1 LYS 66 -13.832 8.612 -13.389 495 2HZ LYS 66 HZ2 LYS 66 -14.013 10.167 -13.912 496 3HZ LYS 66 HZ3 LYS 66 -12.789 9.207 -14.460 497 H TYR 67 HN TYR 67 -10.767 8.105 -7.127 498 HA TYR 67 HA TYR 67 -12.589 9.586 -5.455 499 1HB TYR 67 HB2 TYR 67 -12.922 7.201 -6.044 500 2HB TYR 67 HB3 TYR 67 -11.462 6.781 -5.164 501 HD1 TYR 67 HD1 TYR 67 -11.463 6.722 -2.682 502 HD2 TYR 67 HD2 TYR 67 -14.954 8.010 -4.873 503 HE1 TYR 67 HE1 TYR 67 -12.793 6.606 -0.610 504 HE2 TYR 67 HE2 TYR 67 -16.295 7.909 -2.794 505 HH TYR 67 HH TYR 67 -14.882 6.951 0.371 506 H GLY 68 HN GLY 68 -9.230 8.510 -5.369 507 1HA GLY 68 HA2 GLY 68 -7.506 9.437 -3.997 508 2HA GLY 68 HA3 GLY 68 -8.710 9.911 -2.782 509 H VAL 69 HN VAL 69 -7.164 7.093 -4.400 510 HA VAL 69 HA VAL 69 -7.938 5.387 -2.033 511 HB VAL 69 HB VAL 69 -7.974 4.749 -4.997 512 1HG1 VAL 69 HG11 VAL 69 -6.604 2.973 -4.242 513 2HG1 VAL 69 HG12 VAL 69 -7.542 2.795 -2.759 514 3HG1 VAL 69 HG13 VAL 69 -8.245 2.332 -4.333 515 1HG2 VAL 69 HG21 VAL 69 -10.051 5.467 -4.019 516 2HG2 VAL 69 HG22 VAL 69 -10.136 3.764 -4.475 517 3HG2 VAL 69 HG23 VAL 69 -9.938 4.220 -2.763 518 H MET 70 HN MET 70 -5.697 5.304 -4.743 519 HA MET 70 HA MET 70 -3.531 4.971 -4.940 520 1HB MET 70 HB2 MET 70 -2.139 6.821 -3.987 521 2HB MET 70 HB3 MET 70 -3.490 7.145 -5.054 522 1HG MET 70 HG2 MET 70 -3.528 8.851 -3.519 523 2HG MET 70 HG3 MET 70 -4.915 7.836 -3.205 524 1HE MET 70 HE1 MET 70 -1.500 9.082 -2.183 525 2HE MET 70 HE2 MET 70 -1.175 8.392 -0.596 526 3HE MET 70 HE3 MET 70 -1.089 7.354 -2.046 527 H SER 71 HN SER 71 -4.730 3.286 -2.888 528 HA SER 71 HA SER 71 -2.223 2.009 -2.126 529 1HB SER 71 HB2 SER 71 -3.328 1.539 0.113 530 2HB SER 71 HB3 SER 71 -2.710 3.163 -0.200 531 HG SER 71 HG SER 71 -4.838 3.853 -0.645 532 H ILE 72 HN ILE 72 -2.636 -0.299 -1.417 533 HA ILE 72 HA ILE 72 -5.030 -1.482 -2.678 534 HB ILE 72 HB ILE 72 -2.152 -2.255 -3.149 535 1HG1 ILE 72 HG12 ILE 72 -2.771 -0.257 -4.500 536 2HG1 ILE 72 HG13 ILE 72 -2.285 -1.654 -5.422 537 1HG2 ILE 72 HG21 ILE 72 -2.943 -3.857 -4.846 538 2HG2 ILE 72 HG22 ILE 72 -3.429 -4.313 -3.217 539 3HG2 ILE 72 HG23 ILE 72 -4.609 -3.581 -4.328 540 1HD1 ILE 72 HD11 ILE 72 -4.629 -2.162 -6.015 541 2HD1 ILE 72 HD12 ILE 72 -5.184 -0.795 -5.015 542 3HD1 ILE 72 HD13 ILE 72 -4.184 -0.535 -6.460 543 HA PRO 73 HA PRO 73 -5.958 -3.453 -2.665 544 1HB PRO 73 HB2 PRO 73 -7.563 -5.189 -1.402 545 2HB PRO 73 HB3 PRO 73 -5.980 -5.726 -2.057 546 1HG PRO 73 HG2 PRO 73 -6.673 -4.945 0.780 547 2HG PRO 73 HG3 PRO 73 -5.780 -6.385 0.244 548 1HD PRO 73 HD2 PRO 73 -4.557 -4.043 1.115 549 2HD PRO 73 HD3 PRO 73 -3.797 -5.122 -0.083 550 H THR 74 HN THR 74 -7.818 -2.261 -2.815 551 HA THR 74 HA THR 74 -8.884 -1.081 -0.253 552 HB THR 74 HB THR 74 -8.566 0.296 -2.931 553 HG1 THR 74 HG1 THR 74 -6.730 0.686 -2.029 554 1HG2 THR 74 HG21 THR 74 -10.597 1.195 -2.066 555 2HG2 THR 74 HG22 THR 74 -10.007 1.144 -0.392 556 3HG2 THR 74 HG23 THR 74 -9.343 2.320 -1.526 557 H LEU 75 HN LEU 75 -11.060 -0.755 -0.024 558 HA LEU 75 HA LEU 75 -12.883 -2.095 -1.952 559 1HB LEU 75 HB2 LEU 75 -12.220 -2.980 0.727 560 2HB LEU 75 HB3 LEU 75 -13.816 -2.255 0.791 561 HG LEU 75 HG LEU 75 -14.448 -3.716 -1.212 562 1HD1 LEU 75 HD11 LEU 75 -12.154 -4.358 -1.922 563 2HD1 LEU 75 HD12 LEU 75 -11.890 -5.208 -0.391 564 3HD1 LEU 75 HD13 LEU 75 -13.109 -5.784 -1.536 565 1HD2 LEU 75 HD21 LEU 75 -14.807 -5.702 0.267 566 2HD2 LEU 75 HD22 LEU 75 -13.736 -4.960 1.472 567 3HD2 LEU 75 HD23 LEU 75 -15.262 -4.174 1.024 568 H LEU 76 HN LEU 76 -14.452 -0.731 -2.525 569 HA LEU 76 HA LEU 76 -15.229 1.466 -0.717 570 1HB LEU 76 HB2 LEU 76 -15.468 1.605 -3.748 571 2HB LEU 76 HB3 LEU 76 -15.863 2.846 -2.565 572 HG LEU 76 HG LEU 76 -13.084 1.917 -3.401 573 1HD1 LEU 76 HD11 LEU 76 -14.292 3.380 -4.993 574 2HD1 LEU 76 HD12 LEU 76 -14.509 4.591 -3.716 575 3HD1 LEU 76 HD13 LEU 76 -12.879 4.181 -4.289 576 1HD2 LEU 76 HD21 LEU 76 -13.835 4.079 -1.382 577 2HD2 LEU 76 HD22 LEU 76 -13.114 2.517 -0.951 578 3HD2 LEU 76 HD23 LEU 76 -12.194 3.674 -1.922 579 H VAL 77 HN VAL 77 -17.188 0.773 0.076 580 HA VAL 77 HA VAL 77 -18.701 -1.185 -1.590 581 HB VAL 77 HB VAL 77 -19.034 -0.805 1.391 582 1HG1 VAL 77 HG11 VAL 77 -19.565 -3.113 -0.516 583 2HG1 VAL 77 HG12 VAL 77 -19.890 -3.080 1.222 584 3HG1 VAL 77 HG13 VAL 77 -20.754 -1.961 0.145 585 1HG2 VAL 77 HG21 VAL 77 -17.006 -2.614 0.013 586 2HG2 VAL 77 HG22 VAL 77 -16.677 -1.349 1.220 587 3HG2 VAL 77 HG23 VAL 77 -17.548 -2.803 1.701 588 H LEU 78 HN LEU 78 -20.660 -0.585 -2.324 589 HA LEU 78 HA LEU 78 -21.659 2.089 -1.522 590 1HB LEU 78 HB2 LEU 78 -21.615 0.876 -4.319 591 2HB LEU 78 HB3 LEU 78 -22.279 2.432 -3.857 592 HG LEU 78 HG LEU 78 -19.727 2.725 -2.910 593 1HD1 LEU 78 HD11 LEU 78 -19.397 1.161 -5.504 594 2HD1 LEU 78 HD12 LEU 78 -18.117 1.858 -4.493 595 3HD1 LEU 78 HD13 LEU 78 -19.066 0.489 -3.908 596 1HD2 LEU 78 HD21 LEU 78 -20.645 3.325 -5.752 597 2HD2 LEU 78 HD22 LEU 78 -20.932 4.337 -4.322 598 3HD2 LEU 78 HD23 LEU 78 -19.283 4.087 -4.906 599 H LYS 79 HN LYS 79 -23.939 2.459 -1.901 600 HA LYS 79 HA LYS 79 -25.525 0.159 -2.673 601 1HB LYS 79 HB2 LYS 79 -27.105 0.264 -0.885 602 2HB LYS 79 HB3 LYS 79 -25.505 -0.165 -0.267 603 1HG LYS 79 HG2 LYS 79 -25.291 2.271 0.489 604 2HG LYS 79 HG3 LYS 79 -26.993 2.475 0.064 605 1HD LYS 79 HD2 LYS 79 -25.907 0.447 2.069 606 2HD LYS 79 HD3 LYS 79 -26.681 1.990 2.476 607 1HE LYS 79 HE2 LYS 79 -28.774 1.242 1.452 608 2HE LYS 79 HE3 LYS 79 -28.015 -0.271 0.932 609 1HZ LYS 79 HZ1 LYS 79 -27.803 -0.954 3.204 610 2HZ LYS 79 HZ2 LYS 79 -28.344 0.500 3.771 611 3HZ LYS 79 HZ3 LYS 79 -29.345 -0.496 2.963 612 H ASP 80 HN ASP 80 -27.008 0.780 -3.988 613 HA ASP 80 HA ASP 80 -28.216 2.038 -5.377 614 1HB ASP 80 HB2 ASP 80 -29.574 1.463 -3.377 615 2HB ASP 80 HB3 ASP 80 -29.262 3.071 -2.727 616 H GLY 81 HN GLY 81 -25.672 3.400 -5.042 617 1HA GLY 81 HA2 GLY 81 -25.466 5.433 -6.516 618 2HA GLY 81 HA3 GLY 81 -26.522 6.243 -5.356 619 H GLU 82 HN GLU 82 -24.944 4.824 -3.064 620 HA GLU 82 HA GLU 82 -22.758 6.817 -3.088 621 1HB GLU 82 HB2 GLU 82 -23.503 7.707 -1.043 622 2HB GLU 82 HB3 GLU 82 -24.948 7.535 -2.052 623 1HG GLU 82 HG2 GLU 82 -25.487 5.398 -0.834 624 2HG GLU 82 HG3 GLU 82 -24.103 5.664 0.219 625 H VAL 83 HN VAL 83 -21.029 6.498 -1.595 626 HA VAL 83 HA VAL 83 -20.342 3.723 -0.946 627 HB VAL 83 HB VAL 83 -18.992 6.340 -0.162 628 1HG1 VAL 83 HG11 VAL 83 -18.306 4.450 1.290 629 2HG1 VAL 83 HG12 VAL 83 -17.946 3.467 -0.145 630 3HG1 VAL 83 HG13 VAL 83 -16.990 4.914 0.218 631 1HG2 VAL 83 HG21 VAL 83 -17.375 5.849 -1.961 632 2HG2 VAL 83 HG22 VAL 83 -18.312 4.437 -2.454 633 3HG2 VAL 83 HG23 VAL 83 -18.987 6.072 -2.638 634 H VAL 84 HN VAL 84 -20.604 2.761 0.926 635 HA VAL 84 HA VAL 84 -21.923 4.178 3.184 636 HB VAL 84 HB VAL 84 -23.638 3.102 2.007 637 1HG1 VAL 84 HG11 VAL 84 -23.650 0.672 1.411 638 2HG1 VAL 84 HG12 VAL 84 -22.533 1.653 0.491 639 3HG1 VAL 84 HG13 VAL 84 -21.912 0.595 1.780 640 1HG2 VAL 84 HG21 VAL 84 -22.927 1.166 4.233 641 2HG2 VAL 84 HG22 VAL 84 -23.686 2.763 4.453 642 3HG2 VAL 84 HG23 VAL 84 -24.534 1.495 3.564 643 H GLU 85 HN GLU 85 -19.472 1.874 2.066 644 HA GLU 85 HA GLU 85 -18.297 2.085 4.699 645 1HB GLU 85 HB2 GLU 85 -19.110 -0.586 3.516 646 2HB GLU 85 HB3 GLU 85 -17.619 -0.475 4.427 647 1HG GLU 85 HG2 GLU 85 -20.378 0.235 5.498 648 2HG GLU 85 HG3 GLU 85 -19.544 -1.289 5.732 649 H THR 86 HN THR 86 -15.995 1.726 4.596 650 HA THR 86 HA THR 86 -14.764 1.595 1.904 651 HB THR 86 HB THR 86 -13.875 3.795 3.753 652 HG1 THR 86 HG1 THR 86 -16.063 4.242 3.662 653 1HG2 THR 86 HG21 THR 86 -13.332 4.878 1.628 654 2HG2 THR 86 HG22 THR 86 -12.701 3.219 1.628 655 3HG2 THR 86 HG23 THR 86 -14.212 3.596 0.756 656 H SER 87 HN SER 87 -12.747 0.517 2.117 657 HA SER 87 HA SER 87 -11.514 0.272 4.773 658 1HB SER 87 HB2 SER 87 -13.293 -1.486 4.702 659 2HB SER 87 HB3 SER 87 -12.557 -2.137 3.231 660 HG SER 87 HG SER 87 -11.534 -2.054 5.881 661 H VAL 88 HN VAL 88 -9.326 -0.369 4.601 662 HA VAL 88 HA VAL 88 -8.158 -0.404 1.870 663 HB VAL 88 HB VAL 88 -7.472 1.646 4.023 664 1HG1 VAL 88 HG11 VAL 88 -6.091 2.653 2.240 665 2HG1 VAL 88 HG12 VAL 88 -5.605 0.986 2.553 666 3HG1 VAL 88 HG13 VAL 88 -6.573 1.350 1.122 667 1HG2 VAL 88 HG21 VAL 88 -8.359 3.350 2.446 668 2HG2 VAL 88 HG22 VAL 88 -9.014 2.047 1.436 669 3HG2 VAL 88 HG23 VAL 88 -9.623 2.307 3.088 670 H GLY 89 HN GLY 89 -7.744 -2.616 2.429 671 1HA GLY 89 HA2 GLY 89 -5.311 -3.379 3.325 672 2HA GLY 89 HA3 GLY 89 -6.237 -3.346 4.834 673 H PHE 90 HN PHE 90 -5.182 -5.773 3.898 674 HA PHE 90 HA PHE 90 -7.072 -7.253 2.330 675 1HB PHE 90 HB2 PHE 90 -4.726 -7.917 2.430 676 2HB PHE 90 HB3 PHE 90 -4.811 -8.110 4.175 677 HD1 PHE 90 HD1 PHE 90 -5.481 -10.178 5.158 678 HD2 PHE 90 HD2 PHE 90 -6.193 -9.488 0.955 679 HE1 PHE 90 HE1 PHE 90 -6.253 -12.519 4.901 680 HE2 PHE 90 HE2 PHE 90 -6.994 -11.824 0.720 681 HZ PHE 90 HZ PHE 90 -7.014 -13.345 2.681 682 H LYS 91 HN LYS 91 -8.582 -8.859 3.035 683 HA LYS 91 HA LYS 91 -9.061 -9.205 5.920 684 1HB LYS 91 HB2 LYS 91 -11.138 -8.296 3.892 685 2HB LYS 91 HB3 LYS 91 -11.595 -9.281 5.229 686 1HG LYS 91 HG2 LYS 91 -12.125 -7.246 6.076 687 2HG LYS 91 HG3 LYS 91 -10.528 -7.491 6.772 688 1HD LYS 91 HD2 LYS 91 -10.785 -5.196 5.991 689 2HD LYS 91 HD3 LYS 91 -9.568 -6.009 5.015 690 1HE LYS 91 HE2 LYS 91 -11.445 -6.478 3.307 691 2HE LYS 91 HE3 LYS 91 -12.454 -5.381 4.263 692 1HZ LYS 91 HZ1 LYS 91 -10.825 -3.656 3.858 693 2HZ LYS 91 HZ2 LYS 91 -9.828 -4.678 3.049 694 3HZ LYS 91 HZ3 LYS 91 -11.281 -4.277 2.399 695 HA PRO 92 HA PRO 92 -9.634 -13.358 4.145 696 1HB PRO 92 HB2 PRO 92 -10.676 -14.684 6.295 697 2HB PRO 92 HB3 PRO 92 -8.960 -14.179 6.227 698 1HG PRO 92 HG2 PRO 92 -11.275 -12.728 7.550 699 2HG PRO 92 HG3 PRO 92 -9.683 -13.143 8.264 700 1HD PRO 92 HD2 PRO 92 -10.149 -10.681 7.205 701 2HD PRO 92 HD3 PRO 92 -8.569 -11.484 6.995 702 H LYS 93 HN LYS 93 -11.553 -14.898 3.918 703 HA LYS 93 HA LYS 93 -13.570 -13.575 2.577 704 1HB LYS 93 HB2 LYS 93 -12.771 -16.243 2.968 705 2HB LYS 93 HB3 LYS 93 -14.403 -16.241 3.607 706 1HG LYS 93 HG2 LYS 93 -13.532 -15.307 0.840 707 2HG LYS 93 HG3 LYS 93 -14.243 -16.865 1.200 708 1HD LYS 93 HD2 LYS 93 -15.653 -14.185 1.592 709 2HD LYS 93 HD3 LYS 93 -15.801 -15.201 0.175 710 1HE LYS 93 HE2 LYS 93 -16.592 -16.073 2.990 711 2HE LYS 93 HE3 LYS 93 -17.701 -15.398 1.801 712 1HZ LYS 93 HZ1 LYS 93 -17.856 -17.739 1.733 713 2HZ LYS 93 HZ2 LYS 93 -17.174 -17.288 0.331 714 3HZ LYS 93 HZ3 LYS 93 -16.244 -17.961 1.521 715 H GLU 94 HN GLU 94 -13.790 -14.868 5.917 716 HA GLU 94 HA GLU 94 -16.543 -14.255 6.166 717 1HB GLU 94 HB2 GLU 94 -14.379 -14.575 8.293 718 2HB GLU 94 HB3 GLU 94 -16.119 -14.470 8.628 719 1HG GLU 94 HG2 GLU 94 -16.507 -16.501 7.238 720 2HG GLU 94 HG3 GLU 94 -14.772 -16.636 6.946 721 H ALA 95 HN ALA 95 -13.610 -12.364 7.072 722 HA ALA 95 HA ALA 95 -15.030 -10.210 8.300 723 1HB ALA 95 HB1 ALA 95 -12.915 -8.938 7.851 724 2HB ALA 95 HB2 ALA 95 -12.637 -10.497 8.665 725 3HB ALA 95 HB3 ALA 95 -12.333 -10.332 6.921 726 H LEU 96 HN LEU 96 -14.118 -10.914 4.930 727 HA LEU 96 HA LEU 96 -14.940 -8.361 3.960 728 1HB LEU 96 HB2 LEU 96 -13.536 -10.388 2.804 729 2HB LEU 96 HB3 LEU 96 -15.134 -10.798 2.195 730 HG LEU 96 HG LEU 96 -15.325 -8.313 1.451 731 1HD1 LEU 96 HD11 LEU 96 -13.499 -7.357 2.827 732 2HD1 LEU 96 HD12 LEU 96 -12.335 -8.464 2.064 733 3HD1 LEU 96 HD13 LEU 96 -13.082 -7.180 1.111 734 1HD2 LEU 96 HD21 LEU 96 -12.999 -9.717 0.123 735 2HD2 LEU 96 HD22 LEU 96 -14.684 -10.249 -0.104 736 3HD2 LEU 96 HD23 LEU 96 -14.179 -8.619 -0.597 737 H GLN 97 HN GLN 97 -16.645 -11.505 4.128 738 HA GLN 97 HA GLN 97 -19.023 -10.498 2.926 739 1HB GLN 97 HB2 GLN 97 -19.871 -12.520 3.170 740 2HB GLN 97 HB3 GLN 97 -18.185 -12.968 3.357 741 1HG GLN 97 HG2 GLN 97 -18.514 -13.067 5.765 742 2HG GLN 97 HG3 GLN 97 -20.234 -12.644 5.552 743 1HE2 GLN 97 HE22 GLN 97 -21.285 -14.158 3.608 744 2HE2 GLN 97 HE21 GLN 97 -20.969 -15.868 3.852 745 H GLU 98 HN GLU 98 -17.872 -10.619 6.307 746 HA GLU 98 HA GLU 98 -20.274 -9.684 7.477 747 1HB GLU 98 HB2 GLU 98 -18.508 -10.694 8.785 748 2HB GLU 98 HB3 GLU 98 -17.388 -9.380 8.380 749 1HG GLU 98 HG2 GLU 98 -18.758 -7.772 9.604 750 2HG GLU 98 HG3 GLU 98 -19.998 -8.996 9.899 751 H LEU 99 HN LEU 99 -17.444 -7.900 6.207 752 HA LEU 99 HA LEU 99 -18.117 -5.326 7.026 753 1HB LEU 99 HB2 LEU 99 -15.950 -5.843 6.152 754 2HB LEU 99 HB3 LEU 99 -16.619 -6.368 4.610 755 HG LEU 99 HG LEU 99 -17.239 -4.090 4.006 756 1HD1 LEU 99 HD11 LEU 99 -16.143 -3.346 6.753 757 2HD1 LEU 99 HD12 LEU 99 -16.395 -2.180 5.434 758 3HD1 LEU 99 HD13 LEU 99 -17.777 -3.043 6.103 759 1HD2 LEU 99 HD21 LEU 99 -14.978 -4.992 3.536 760 2HD2 LEU 99 HD22 LEU 99 -14.994 -3.227 3.703 761 3HD2 LEU 99 HD23 LEU 99 -14.379 -4.243 5.034 762 H VAL 100 HN VAL 100 -19.148 -7.074 4.097 763 HA VAL 100 HA VAL 100 -20.662 -4.714 3.252 764 HB VAL 100 HB VAL 100 -19.486 -5.928 1.639 765 1HG1 VAL 100 HG11 VAL 100 -20.067 -8.140 0.816 766 2HG1 VAL 100 HG12 VAL 100 -19.664 -8.259 2.520 767 3HG1 VAL 100 HG13 VAL 100 -21.363 -8.305 2.019 768 1HG2 VAL 100 HG21 VAL 100 -21.604 -4.717 1.057 769 2HG2 VAL 100 HG22 VAL 100 -21.117 -5.975 -0.084 770 3HG2 VAL 100 HG23 VAL 100 -22.441 -6.279 1.064 771 H ASN 101 HN ASN 101 -21.405 -7.989 4.597 772 HA ASN 101 HA ASN 101 -24.204 -7.992 4.427 773 1HB ASN 101 HB2 ASN 101 -22.953 -9.952 5.062 774 2HB ASN 101 HB3 ASN 101 -22.381 -9.165 6.540 775 1HD2 ASN 101 HD22 ASN 101 -23.764 -9.067 8.360 776 2HD2 ASN 101 HD21 ASN 101 -25.349 -9.796 8.380 777 H LYS 102 HN LYS 102 -22.129 -6.229 6.664 778 HA LYS 102 HA LYS 102 -23.848 -5.498 8.744 779 1HB LYS 102 HB2 LYS 102 -21.516 -4.278 7.306 780 2HB LYS 102 HB3 LYS 102 -22.433 -3.204 8.349 781 1HG LYS 102 HG2 LYS 102 -21.872 -4.284 10.287 782 2HG LYS 102 HG3 LYS 102 -21.596 -5.847 9.509 783 1HD LYS 102 HD2 LYS 102 -19.544 -4.650 10.447 784 2HD LYS 102 HD3 LYS 102 -19.459 -5.298 8.820 785 1HE LYS 102 HE2 LYS 102 -18.407 -3.186 8.725 786 2HE LYS 102 HE3 LYS 102 -19.957 -3.045 7.893 787 1HZ LYS 102 HZ1 LYS 102 -19.327 -2.026 10.600 788 2HZ LYS 102 HZ2 LYS 102 -19.598 -1.146 9.237 789 3HZ LYS 102 HZ3 LYS 102 -20.826 -1.975 9.937 790 H HIS 103 HN HIS 103 -23.804 -4.246 5.400 791 HA HIS 103 HA HIS 103 -26.209 -2.583 6.078 792 1HB HIS 103 HB2 HIS 103 -25.233 -0.751 4.884 793 2HB HIS 103 HB3 HIS 103 -24.043 -1.338 6.053 794 HD1 HIS 103 HD1 HIS 103 -24.780 -1.696 2.267 795 HD2 HIS 103 HD2 HIS 103 -21.699 -2.178 5.089 796 HE1 HIS 103 HE1 HIS 103 -22.671 -2.202 0.958 797 H LEU 104 HN LEU 104 -25.038 -5.011 4.072 798 HA LEU 104 HA LEU 104 -26.428 -4.609 1.583 799 1HB LEU 104 HB2 LEU 104 -24.678 -6.121 1.616 800 2HB LEU 104 HB3 LEU 104 -25.208 -6.833 3.140 801 HG LEU 104 HG LEU 104 -27.022 -7.991 2.110 802 1HD1 LEU 104 HD11 LEU 104 -27.481 -6.364 0.201 803 2HD1 LEU 104 HD12 LEU 104 -25.975 -6.910 -0.564 804 3HD1 LEU 104 HD13 LEU 104 -27.327 -8.033 -0.332 805 1HD2 LEU 104 HD21 LEU 104 -25.674 -9.574 0.800 806 2HD2 LEU 104 HD22 LEU 104 -24.364 -8.376 0.686 807 3HD2 LEU 104 HD23 LEU 104 -24.844 -9.046 2.263 808 1H MET 1 H1 MET 1 10.686 29.423 -8.979 809 2H MET 1 H2 MET 1 10.455 27.813 -9.070 810 3H MET 1 H3 MET 1 10.405 28.736 -10.439 811 HA MET 1 HA MET 1 8.477 29.946 -9.542 812 1HB MET 1 HB2 MET 1 8.128 26.942 -9.944 813 2HB MET 1 HB3 MET 1 6.798 28.089 -9.793 814 1HG MET 1 HG2 MET 1 7.615 29.325 -11.772 815 2HG MET 1 HG3 MET 1 8.928 28.155 -11.962 816 1HE MET 1 HE1 MET 1 6.601 27.383 -15.018 817 2HE MET 1 HE2 MET 1 6.920 28.973 -14.291 818 3HE MET 1 HE3 MET 1 8.245 27.801 -14.487 819 H GLU 2 HN GLU 2 7.323 30.499 -7.730 820 HA GLU 2 HA GLU 2 8.081 29.379 -5.180 821 1HB GLU 2 HB2 GLU 2 7.468 31.752 -5.532 822 2HB GLU 2 HB3 GLU 2 5.816 31.277 -5.947 823 1HG GLU 2 HG2 GLU 2 5.525 30.315 -3.673 824 2HG GLU 2 HG3 GLU 2 7.190 30.734 -3.276 825 H ASN 3 HN ASN 3 7.318 27.593 -4.327 826 HA ASN 3 HA ASN 3 6.254 25.898 -3.675 827 1HB ASN 3 HB2 ASN 3 3.613 27.055 -4.512 828 2HB ASN 3 HB3 ASN 3 3.921 25.570 -3.591 829 1HD2 ASN 3 HD22 ASN 3 5.598 26.061 -1.587 830 2HD2 ASN 3 HD21 ASN 3 5.097 27.422 -0.626 831 H LYS 4 HN LYS 4 6.489 24.148 -4.371 832 HA LYS 4 HA LYS 4 5.398 23.004 -6.806 833 1HB LYS 4 HB2 LYS 4 8.385 22.795 -6.177 834 2HB LYS 4 HB3 LYS 4 7.551 22.222 -7.629 835 1HG LYS 4 HG2 LYS 4 7.024 24.683 -8.130 836 2HG LYS 4 HG3 LYS 4 8.103 25.101 -6.794 837 1HD LYS 4 HD2 LYS 4 8.782 23.909 -9.467 838 2HD LYS 4 HD3 LYS 4 9.329 25.418 -8.703 839 1HE LYS 4 HE2 LYS 4 10.509 23.946 -6.965 840 2HE LYS 4 HE3 LYS 4 10.182 22.584 -8.044 841 1HZ LYS 4 HZ1 LYS 4 11.410 23.792 -9.786 842 2HZ LYS 4 HZ2 LYS 4 11.703 25.039 -8.753 843 3HZ LYS 4 HZ3 LYS 4 12.363 23.564 -8.481 844 H ILE 5 HN ILE 5 5.152 20.607 -6.339 845 HA ILE 5 HA ILE 5 5.632 20.062 -3.441 846 HB ILE 5 HB ILE 5 3.222 19.405 -5.174 847 1HG1 ILE 5 HG12 ILE 5 3.762 21.369 -2.913 848 2HG1 ILE 5 HG13 ILE 5 3.114 21.698 -4.521 849 1HG2 ILE 5 HG21 ILE 5 3.723 18.743 -2.260 850 2HG2 ILE 5 HG22 ILE 5 2.259 18.325 -3.199 851 3HG2 ILE 5 HG23 ILE 5 3.773 17.552 -3.592 852 1HD1 ILE 5 HD11 ILE 5 1.335 21.901 -2.927 853 2HD1 ILE 5 HD12 ILE 5 1.047 20.410 -3.861 854 3HD1 ILE 5 HD13 ILE 5 1.716 20.324 -2.208 855 H ILE 6 HN ILE 6 6.228 18.053 -2.886 856 HA ILE 6 HA ILE 6 6.584 15.962 -4.896 857 HB ILE 6 HB ILE 6 8.638 17.304 -5.101 858 1HG1 ILE 6 HG12 ILE 6 9.135 14.562 -3.881 859 2HG1 ILE 6 HG13 ILE 6 8.654 14.890 -5.552 860 1HG2 ILE 6 HG21 ILE 6 8.733 18.175 -2.752 861 2HG2 ILE 6 HG22 ILE 6 9.278 16.568 -2.225 862 3HG2 ILE 6 HG23 ILE 6 10.265 17.549 -3.335 863 1HD1 ILE 6 HD11 ILE 6 10.711 16.220 -5.888 864 2HD1 ILE 6 HD12 ILE 6 11.271 15.771 -4.260 865 3HD1 ILE 6 HD13 ILE 6 11.044 14.526 -5.488 866 H TYR 7 HN TYR 7 6.625 13.895 -3.851 867 HA TYR 7 HA TYR 7 5.829 14.015 -0.968 868 1HB TYR 7 HB2 TYR 7 4.013 13.903 -2.855 869 2HB TYR 7 HB3 TYR 7 4.527 12.240 -3.044 870 HD1 TYR 7 HD1 TYR 7 2.771 14.690 -0.960 871 HD2 TYR 7 HD2 TYR 7 4.150 10.600 -1.116 872 HE1 TYR 7 HE1 TYR 7 1.166 14.066 0.823 873 HE2 TYR 7 HE2 TYR 7 2.374 9.950 0.456 874 HH TYR 7 HH TYR 7 0.222 12.348 2.028 875 H PHE 8 HN PHE 8 6.871 12.578 0.259 876 HA PHE 8 HA PHE 8 8.647 10.562 -1.028 877 1HB PHE 8 HB2 PHE 8 8.679 12.002 1.650 878 2HB PHE 8 HB3 PHE 8 9.719 10.658 1.268 879 HD1 PHE 8 HD1 PHE 8 11.326 12.517 2.123 880 HD2 PHE 8 HD2 PHE 8 9.400 12.650 -1.739 881 HE1 PHE 8 HE1 PHE 8 13.102 14.013 1.238 882 HE2 PHE 8 HE2 PHE 8 11.150 14.137 -2.572 883 HZ PHE 8 HZ PHE 8 12.990 14.845 -1.078 884 H LEU 9 HN LEU 9 8.297 8.368 -0.573 885 HA LEU 9 HA LEU 9 6.012 7.808 1.254 886 1HB LEU 9 HB2 LEU 9 5.524 8.130 -1.238 887 2HB LEU 9 HB3 LEU 9 6.401 6.637 -1.530 888 HG LEU 9 HG LEU 9 4.737 5.340 -0.359 889 1HD1 LEU 9 HD11 LEU 9 3.570 8.000 0.560 890 2HD1 LEU 9 HD12 LEU 9 2.699 6.450 0.658 891 3HD1 LEU 9 HD13 LEU 9 4.184 6.681 1.576 892 1HD2 LEU 9 HD21 LEU 9 2.662 6.083 -1.671 893 2HD2 LEU 9 HD22 LEU 9 3.528 7.547 -2.104 894 3HD2 LEU 9 HD23 LEU 9 4.143 5.973 -2.644 895 H SER 10 HN SER 10 6.575 6.419 2.760 896 HA SER 10 HA SER 10 8.755 4.461 2.244 897 1HB SER 10 HB2 SER 10 8.478 6.483 4.506 898 2HB SER 10 HB3 SER 10 9.721 5.241 4.430 899 HG SER 10 HG SER 10 9.747 7.660 3.380 900 H THR 11 HN THR 11 8.961 2.853 4.011 901 HA THR 11 HA THR 11 6.408 1.783 4.808 902 HB THR 11 HB THR 11 9.256 1.068 5.652 903 HG1 THR 11 HG1 THR 11 9.100 -0.409 3.980 904 1HG2 THR 11 HG21 THR 11 7.646 0.075 7.204 905 2HG2 THR 11 HG22 THR 11 6.617 -0.456 5.858 906 3HG2 THR 11 HG23 THR 11 8.226 -1.185 6.111 907 H GLY 12 HN GLY 12 5.217 2.649 6.346 908 1HA GLY 12 HA2 GLY 12 4.493 3.668 8.273 909 2HA GLY 12 HA3 GLY 12 5.749 2.676 9.027 910 H ASN 13 HN ASN 13 6.133 5.447 6.793 911 HA ASN 13 HA ASN 13 8.373 6.436 7.643 912 1HB ASN 13 HB2 ASN 13 7.252 7.575 5.820 913 2HB ASN 13 HB3 ASN 13 6.114 8.322 6.941 914 1HD2 ASN 13 HD22 ASN 13 6.702 10.470 7.357 915 2HD2 ASN 13 HD21 ASN 13 8.348 11.012 7.544 916 H SER 14 HN SER 14 9.076 6.397 9.586 917 HA SER 14 HA SER 14 8.304 8.667 11.324 918 1HB SER 14 HB2 SER 14 9.195 5.899 12.253 919 2HB SER 14 HB3 SER 14 8.742 7.264 13.284 920 HG SER 14 HG SER 14 7.082 5.827 11.464 921 H ALA 15 HN ALA 15 10.518 7.607 9.171 922 HA ALA 15 HA ALA 15 12.828 8.740 10.493 923 1HB ALA 15 HB1 ALA 15 12.763 5.740 9.846 924 2HB ALA 15 HB2 ALA 15 14.199 6.655 10.343 925 3HB ALA 15 HB3 ALA 15 12.838 6.454 11.462 926 H ARG 16 HN ARG 16 11.980 6.474 7.780 927 HA ARG 16 HA ARG 16 14.182 7.118 6.214 928 1HB ARG 16 HB2 ARG 16 11.664 5.651 5.865 929 2HB ARG 16 HB3 ARG 16 12.030 6.546 4.401 930 1HG ARG 16 HG2 ARG 16 13.970 4.644 5.739 931 2HG ARG 16 HG3 ARG 16 12.899 4.225 4.414 932 1HD ARG 16 HD2 ARG 16 13.966 6.161 3.107 933 2HD ARG 16 HD3 ARG 16 15.199 6.186 4.383 934 HE ARG 16 HE ARG 16 14.994 3.524 3.537 935 1HH1 ARG 16 HH11 ARG 16 15.689 6.502 1.740 936 2HH1 ARG 16 HH12 ARG 16 16.978 5.774 0.808 937 1HH2 ARG 16 HH21 ARG 16 16.585 2.605 2.277 938 2HH2 ARG 16 HH22 ARG 16 17.453 3.538 1.059 939 H SER 17 HN SER 17 10.865 8.567 5.865 940 HA SER 17 HA SER 17 11.895 10.404 3.883 941 1HB SER 17 HB2 SER 17 9.298 10.676 5.357 942 2HB SER 17 HB3 SER 17 9.720 11.268 3.747 943 HG SER 17 HG SER 17 8.432 9.366 3.658 944 H GLN 18 HN GLN 18 11.523 10.476 7.434 945 HA GLN 18 HA GLN 18 11.629 13.272 7.889 946 1HB GLN 18 HB2 GLN 18 13.012 11.027 9.437 947 2HB GLN 18 HB3 GLN 18 12.933 12.668 9.966 948 1HG GLN 18 HG2 GLN 18 10.564 10.804 9.651 949 2HG GLN 18 HG3 GLN 18 11.377 11.262 11.154 950 1HE2 GLN 18 HE22 GLN 18 8.593 11.792 11.051 951 2HE2 GLN 18 HE21 GLN 18 8.269 13.432 10.500 952 H MET 19 HN MET 19 14.247 10.904 7.505 953 HA MET 19 HA MET 19 16.347 12.788 7.812 954 1HB MET 19 HB2 MET 19 16.376 10.221 8.086 955 2HB MET 19 HB3 MET 19 16.423 10.123 6.321 956 1HG MET 19 HG2 MET 19 18.482 11.781 6.619 957 2HG MET 19 HG3 MET 19 18.483 11.161 8.257 958 1HE MET 19 HE1 MET 19 17.392 7.903 6.955 959 2HE MET 19 HE2 MET 19 18.976 7.236 7.438 960 3HE MET 19 HE3 MET 19 18.142 8.353 8.528 961 H ALA 20 HN ALA 20 14.714 11.310 4.977 962 HA ALA 20 HA ALA 20 16.325 12.417 2.958 963 1HB ALA 20 HB1 ALA 20 14.665 10.543 2.707 964 2HB ALA 20 HB2 ALA 20 13.364 11.734 2.819 965 3HB ALA 20 HB3 ALA 20 14.512 11.806 1.467 966 H GLU 21 HN GLU 21 13.314 13.751 4.506 967 HA GLU 21 HA GLU 21 13.202 15.867 2.599 968 1HB GLU 21 HB2 GLU 21 11.295 16.638 3.728 969 2HB GLU 21 HB3 GLU 21 11.249 14.873 3.799 970 1HG GLU 21 HG2 GLU 21 12.119 14.992 6.131 971 2HG GLU 21 HG3 GLU 21 12.084 16.752 6.034 972 H GLY 22 HN GLY 22 14.739 15.581 5.812 973 1HA GLY 22 HA2 GLY 22 15.432 18.392 5.985 974 2HA GLY 22 HA3 GLY 22 16.186 17.055 6.852 975 H TRP 23 HN TRP 23 17.098 15.432 4.702 976 HA TRP 23 HA TRP 23 19.408 16.700 3.659 977 1HB TRP 23 HB2 TRP 23 17.874 14.184 3.082 978 2HB TRP 23 HB3 TRP 23 18.901 14.773 1.797 979 HD1 TRP 23 HD1 TRP 23 19.038 12.749 4.819 980 HE1 TRP 23 HE1 TRP 23 21.437 12.056 5.356 981 HE3 TRP 23 HE3 TRP 23 21.477 15.900 1.637 982 HZ2 TRP 23 HZ2 TRP 23 24.103 12.795 4.516 983 HZ3 TRP 23 HZ3 TRP 23 23.958 15.805 1.438 984 HH2 TRP 23 HH2 TRP 23 25.276 14.279 2.886 985 H ALA 24 HN ALA 24 16.128 16.355 2.267 986 HA ALA 24 HA ALA 24 16.783 17.103 -0.299 987 1HB ALA 24 HB1 ALA 24 14.514 16.188 0.436 988 2HB ALA 24 HB2 ALA 24 14.120 17.781 1.118 989 3HB ALA 24 HB3 ALA 24 14.387 17.611 -0.610 990 H LYS 25 HN LYS 25 15.524 19.240 2.351 991 HA LYS 25 HA LYS 25 15.526 21.448 0.565 992 1HB LYS 25 HB2 LYS 25 14.911 21.102 3.482 993 2HB LYS 25 HB3 LYS 25 15.294 22.738 2.918 994 1HG LYS 25 HG2 LYS 25 13.637 22.507 1.077 995 2HG LYS 25 HG3 LYS 25 13.161 20.921 1.711 996 1HD LYS 25 HD2 LYS 25 12.383 21.913 3.777 997 2HD LYS 25 HD3 LYS 25 13.039 23.496 3.347 998 1HE LYS 25 HE2 LYS 25 10.893 22.071 1.685 999 2HE LYS 25 HE3 LYS 25 10.494 23.176 2.994 1000 1HZ LYS 25 HZ1 LYS 25 11.538 24.955 1.823 1001 2HZ LYS 25 HZ2 LYS 25 12.097 23.975 0.620 1002 3HZ LYS 25 HZ3 LYS 25 10.505 24.198 0.785 1003 H GLN 26 HN GLN 26 18.207 20.145 2.425 1004 HA GLN 26 HA GLN 26 19.619 22.617 2.382 1005 1HB GLN 26 HB2 GLN 26 21.468 21.526 3.166 1006 2HB GLN 26 HB3 GLN 26 20.139 20.626 3.837 1007 1HG GLN 26 HG2 GLN 26 20.921 18.717 2.974 1008 2HG GLN 26 HG3 GLN 26 20.818 19.335 1.348 1009 1HE2 GLN 26 HE22 GLN 26 22.870 17.527 2.580 1010 2HE2 GLN 26 HE21 GLN 26 24.391 18.323 2.265 1011 H TYR 27 HN TYR 27 18.731 20.535 -0.210 1012 HA TYR 27 HA TYR 27 20.700 21.886 -1.988 1013 1HB TYR 27 HB2 TYR 27 20.021 18.998 -1.651 1014 2HB TYR 27 HB3 TYR 27 20.083 19.556 -3.305 1015 HD1 TYR 27 HD1 TYR 27 22.114 20.667 -4.245 1016 HD2 TYR 27 HD2 TYR 27 22.097 18.688 -0.417 1017 HE1 TYR 27 HE1 TYR 27 24.592 20.635 -4.261 1018 HE2 TYR 27 HE2 TYR 27 24.574 18.710 -0.385 1019 HH TYR 27 HH TYR 27 26.528 20.038 -3.093 1020 H LEU 28 HN LEU 28 17.304 21.127 -1.481 1021 HA LEU 28 HA LEU 28 16.549 21.814 -4.231 1022 1HB LEU 28 HB2 LEU 28 15.139 20.788 -1.774 1023 2HB LEU 28 HB3 LEU 28 14.196 21.696 -2.928 1024 HG LEU 28 HG LEU 28 14.824 20.210 -4.763 1025 1HD1 LEU 28 HD11 LEU 28 17.020 19.453 -4.004 1026 2HD1 LEU 28 HD12 LEU 28 16.285 18.565 -2.657 1027 3HD1 LEU 28 HD13 LEU 28 15.989 18.080 -4.343 1028 1HD2 LEU 28 HD21 LEU 28 13.677 18.818 -2.308 1029 2HD2 LEU 28 HD22 LEU 28 12.787 19.723 -3.536 1030 3HD2 LEU 28 HD23 LEU 28 13.562 18.204 -3.971 1031 H GLY 29 HN GLY 29 14.491 23.296 -1.840 1032 1HA GLY 29 HA2 GLY 29 15.781 25.597 -1.097 1033 2HA GLY 29 HA3 GLY 29 15.207 25.946 -2.736 1034 H ASP 30 HN ASP 30 14.108 27.581 -1.309 1035 HA ASP 30 HA ASP 30 11.794 26.977 0.227 1036 1HB ASP 30 HB2 ASP 30 12.988 29.121 0.306 1037 2HB ASP 30 HB3 ASP 30 12.564 29.439 -1.379 1038 H GLU 31 HN GLU 31 12.387 26.959 -3.208 1039 HA GLU 31 HA GLU 31 9.810 27.348 -4.296 1040 1HB GLU 31 HB2 GLU 31 12.001 25.386 -5.134 1041 2HB GLU 31 HB3 GLU 31 10.585 25.826 -6.100 1042 1HG GLU 31 HG2 GLU 31 11.375 28.209 -6.070 1043 2HG GLU 31 HG3 GLU 31 12.859 27.641 -5.266 1044 H TRP 32 HN TRP 32 11.254 24.479 -2.747 1045 HA TRP 32 HA TRP 32 8.990 22.844 -3.650 1046 1HB TRP 32 HB2 TRP 32 11.632 22.215 -2.291 1047 2HB TRP 32 HB3 TRP 32 10.414 21.006 -2.664 1048 HD1 TRP 32 HD1 TRP 32 13.157 23.028 -4.328 1049 HE1 TRP 32 HE1 TRP 32 13.571 22.048 -6.652 1050 HE3 TRP 32 HE3 TRP 32 8.927 20.154 -4.787 1051 HZ2 TRP 32 HZ2 TRP 32 12.173 20.420 -8.555 1052 HZ3 TRP 32 HZ3 TRP 32 8.447 18.982 -6.919 1053 HH2 TRP 32 HH2 TRP 32 10.055 19.101 -8.809 1054 H LYS 33 HN LYS 33 7.722 21.623 -2.378 1055 HA LYS 33 HA LYS 33 7.767 21.951 0.590 1056 1HB LYS 33 HB2 LYS 33 5.423 21.815 -1.360 1057 2HB LYS 33 HB3 LYS 33 5.247 21.375 0.327 1058 1HG LYS 33 HG2 LYS 33 6.503 24.039 -0.388 1059 2HG LYS 33 HG3 LYS 33 4.744 23.858 -0.430 1060 1HD LYS 33 HD2 LYS 33 6.485 23.302 2.015 1061 2HD LYS 33 HD3 LYS 33 5.640 24.821 1.691 1062 1HE LYS 33 HE2 LYS 33 3.461 23.606 1.659 1063 2HE LYS 33 HE3 LYS 33 4.298 22.100 2.049 1064 1HZ LYS 33 HZ1 LYS 33 3.383 23.137 4.019 1065 2HZ LYS 33 HZ2 LYS 33 5.006 23.114 4.141 1066 3HZ LYS 33 HZ3 LYS 33 4.229 24.506 3.779 1067 H VAL 34 HN VAL 34 8.653 20.138 1.268 1068 HA VAL 34 HA VAL 34 8.427 17.685 -0.370 1069 HB VAL 34 HB VAL 34 10.392 18.352 1.886 1070 1HG1 VAL 34 HG11 VAL 34 10.303 16.131 -0.188 1071 2HG1 VAL 34 HG12 VAL 34 11.619 16.430 0.969 1072 3HG1 VAL 34 HG13 VAL 34 10.017 15.941 1.548 1073 1HG2 VAL 34 HG21 VAL 34 12.056 18.663 0.110 1074 2HG2 VAL 34 HG22 VAL 34 10.798 18.502 -1.127 1075 3HG2 VAL 34 HG23 VAL 34 10.787 19.878 -0.007 1076 H TYR 35 HN TYR 35 6.650 16.603 0.170 1077 HA TYR 35 HA TYR 35 5.712 16.501 3.003 1078 1HB TYR 35 HB2 TYR 35 4.444 15.749 0.350 1079 2HB TYR 35 HB3 TYR 35 3.754 15.290 1.899 1080 HD1 TYR 35 HD1 TYR 35 2.689 16.917 3.383 1081 HD2 TYR 35 HD2 TYR 35 4.510 18.137 -0.325 1082 HE1 TYR 35 HE1 TYR 35 1.546 19.102 3.557 1083 HE2 TYR 35 HE2 TYR 35 3.296 20.306 -0.211 1084 HH TYR 35 HH TYR 35 1.153 21.168 2.539 1085 H SER 36 HN SER 36 5.143 14.330 3.848 1086 HA SER 36 HA SER 36 6.725 12.088 2.765 1087 1HB SER 36 HB2 SER 36 7.682 11.975 5.179 1088 2HB SER 36 HB3 SER 36 8.383 13.135 4.034 1089 HG SER 36 HG SER 36 8.125 14.237 5.839 1090 H ALA 37 HN ALA 37 5.747 10.126 3.184 1091 HA ALA 37 HA ALA 37 3.797 9.887 5.372 1092 1HB ALA 37 HB1 ALA 37 2.596 10.955 3.446 1093 2HB ALA 37 HB2 ALA 37 3.094 9.580 2.428 1094 3HB ALA 37 HB3 ALA 37 1.994 9.335 3.807 1095 H GLY 38 HN GLY 38 2.638 7.669 5.106 1096 1HA GLY 38 HA2 GLY 38 3.803 5.518 3.680 1097 2HA GLY 38 HA3 GLY 38 4.478 5.571 5.318 1098 H ILE 39 HN ILE 39 3.209 3.382 4.946 1099 HA ILE 39 HA ILE 39 0.478 3.106 4.977 1100 HB ILE 39 HB ILE 39 1.769 1.233 4.661 1101 1HG1 ILE 39 HG12 ILE 39 0.734 0.669 7.449 1102 2HG1 ILE 39 HG13 ILE 39 -0.375 1.085 6.144 1103 1HG2 ILE 39 HG21 ILE 39 3.232 0.192 6.476 1104 2HG2 ILE 39 HG22 ILE 39 3.863 1.629 5.681 1105 3HG2 ILE 39 HG23 ILE 39 3.170 1.729 7.307 1106 1HD1 ILE 39 HD11 ILE 39 0.475 -0.789 4.779 1107 2HD1 ILE 39 HD12 ILE 39 1.503 -1.298 6.143 1108 3HD1 ILE 39 HD13 ILE 39 -0.263 -1.310 6.304 1109 H GLU 40 HN GLU 40 2.465 3.336 7.941 1110 HA GLU 40 HA GLU 40 0.092 4.134 9.542 1111 1HB GLU 40 HB2 GLU 40 0.894 2.648 11.342 1112 2HB GLU 40 HB3 GLU 40 0.343 1.788 9.916 1113 1HG GLU 40 HG2 GLU 40 2.552 1.131 9.286 1114 2HG GLU 40 HG3 GLU 40 3.306 2.310 10.355 1115 H ALA 41 HN ALA 41 2.026 5.695 8.272 1116 HA ALA 41 HA ALA 41 4.311 6.467 9.805 1117 1HB ALA 41 HB1 ALA 41 2.622 7.671 7.575 1118 2HB ALA 41 HB2 ALA 41 4.155 8.379 8.115 1119 3HB ALA 41 HB3 ALA 41 4.114 6.747 7.395 1120 H HIS 42 HN HIS 42 4.626 8.185 11.111 1121 HA HIS 42 HA HIS 42 3.792 10.530 11.589 1122 1HB HIS 42 HB2 HIS 42 1.393 10.128 11.741 1123 2HB HIS 42 HB3 HIS 42 1.629 8.907 13.000 1124 HD1 HIS 42 HD1 HIS 42 2.054 12.721 12.460 1125 HD2 HIS 42 HD2 HIS 42 1.646 9.818 15.484 1126 HE1 HIS 42 HE1 HIS 42 1.792 14.002 14.658 1127 H GLY 43 HN GLY 43 5.930 10.337 12.288 1128 1HA GLY 43 HA2 GLY 43 6.382 9.858 15.062 1129 2HA GLY 43 HA3 GLY 43 6.950 8.504 14.053 1130 H LEU 44 HN LEU 44 8.707 10.133 15.538 1131 HA LEU 44 HA LEU 44 10.409 11.277 13.419 1132 1HB LEU 44 HB2 LEU 44 9.215 13.218 14.383 1133 2HB LEU 44 HB3 LEU 44 9.669 12.709 16.009 1134 HG LEU 44 HG LEU 44 12.098 13.052 15.402 1135 1HD1 LEU 44 HD11 LEU 44 12.589 14.433 13.382 1136 2HD1 LEU 44 HD12 LEU 44 12.058 12.797 12.985 1137 3HD1 LEU 44 HD13 LEU 44 10.928 14.167 12.824 1138 1HD2 LEU 44 HD21 LEU 44 10.827 14.802 16.566 1139 2HD2 LEU 44 HD22 LEU 44 12.027 15.493 15.464 1140 3HD2 LEU 44 HD23 LEU 44 10.314 15.479 15.006 1141 H ASN 45 HN ASN 45 11.313 9.165 13.695 1142 HA ASN 45 HA ASN 45 12.087 8.045 16.183 1143 1HB ASN 45 HB2 ASN 45 11.755 6.847 14.012 1144 2HB ASN 45 HB3 ASN 45 13.243 7.578 13.405 1145 1HD2 ASN 45 HD22 ASN 45 12.655 4.697 13.671 1146 2HD2 ASN 45 HD21 ASN 45 13.831 4.066 14.788 1147 HA PRO 46 HA PRO 46 15.586 10.780 16.915 1148 1HB PRO 46 HB2 PRO 46 16.993 9.268 18.780 1149 2HB PRO 46 HB3 PRO 46 15.601 10.336 19.135 1150 1HG PRO 46 HG2 PRO 46 15.591 7.345 18.662 1151 2HG PRO 46 HG3 PRO 46 14.753 8.270 19.951 1152 1HD PRO 46 HD2 PRO 46 13.431 7.460 17.751 1153 2HD PRO 46 HD3 PRO 46 13.127 9.089 18.420 1154 H ASN 47 HN ASN 47 15.881 7.447 15.690 1155 HA ASN 47 HA ASN 47 18.656 7.579 15.037 1156 1HB ASN 47 HB2 ASN 47 18.329 5.656 13.996 1157 2HB ASN 47 HB3 ASN 47 16.809 5.600 14.863 1158 1HD2 ASN 47 HD22 ASN 47 18.383 5.724 11.779 1159 2HD2 ASN 47 HD21 ASN 47 16.916 5.717 10.806 1160 H ALA 48 HN ALA 48 15.724 8.845 13.374 1161 HA ALA 48 HA ALA 48 17.205 9.546 10.974 1162 1HB ALA 48 HB1 ALA 48 15.107 10.670 10.323 1163 2HB ALA 48 HB2 ALA 48 14.850 9.012 10.900 1164 3HB ALA 48 HB3 ALA 48 14.426 10.397 11.941 1165 H VAL 49 HN VAL 49 16.197 11.125 13.968 1166 HA VAL 49 HA VAL 49 17.108 13.771 13.288 1167 HB VAL 49 HB VAL 49 17.101 12.497 16.059 1168 1HG1 VAL 49 HG11 VAL 49 16.823 14.828 16.838 1169 2HG1 VAL 49 HG12 VAL 49 18.327 14.643 15.929 1170 3HG1 VAL 49 HG13 VAL 49 16.918 15.412 15.164 1171 1HG2 VAL 49 HG21 VAL 49 14.833 12.275 15.080 1172 2HG2 VAL 49 HG22 VAL 49 14.858 13.485 16.360 1173 3HG2 VAL 49 HG23 VAL 49 14.838 13.996 14.664 1174 H LYS 50 HN LYS 50 18.766 11.022 14.960 1175 HA LYS 50 HA LYS 50 21.311 12.242 15.151 1176 1HB LYS 50 HB2 LYS 50 20.635 10.237 16.390 1177 2HB LYS 50 HB3 LYS 50 20.553 9.295 14.893 1178 1HG LYS 50 HG2 LYS 50 22.960 9.511 14.554 1179 2HG LYS 50 HG3 LYS 50 23.093 10.634 15.923 1180 1HD LYS 50 HD2 LYS 50 22.396 8.869 17.481 1181 2HD LYS 50 HD3 LYS 50 22.170 7.728 16.134 1182 1HE LYS 50 HE2 LYS 50 24.542 7.834 15.574 1183 2HE LYS 50 HE3 LYS 50 24.813 9.114 16.763 1184 1HZ LYS 50 HZ1 LYS 50 24.008 6.340 17.428 1185 2HZ LYS 50 HZ2 LYS 50 25.504 6.974 17.613 1186 3HZ LYS 50 HZ3 LYS 50 24.267 7.535 18.514 1187 H ALA 51 HN ALA 51 19.964 10.187 12.538 1188 HA ALA 51 HA ALA 51 22.178 10.106 10.858 1189 1HB ALA 51 HB1 ALA 51 19.219 10.242 10.176 1190 2HB ALA 51 HB2 ALA 51 20.525 9.718 9.079 1191 3HB ALA 51 HB3 ALA 51 20.157 8.779 10.536 1192 H MET 52 HN MET 52 19.815 12.815 11.305 1193 HA MET 52 HA MET 52 20.928 14.330 9.089 1194 1HB MET 52 HB2 MET 52 19.001 15.003 11.354 1195 2HB MET 52 HB3 MET 52 19.475 16.158 10.117 1196 1HG MET 52 HG2 MET 52 18.409 13.510 9.178 1197 2HG MET 52 HG3 MET 52 17.301 14.639 9.929 1198 1HE MET 52 HE1 MET 52 19.541 15.541 5.970 1199 2HE MET 52 HE2 MET 52 20.434 15.623 7.498 1200 3HE MET 52 HE3 MET 52 19.765 14.067 6.943 1201 H LYS 53 HN LYS 53 21.299 14.263 12.671 1202 HA LYS 53 HA LYS 53 23.037 16.514 12.769 1203 1HB LYS 53 HB2 LYS 53 23.000 14.074 14.609 1204 2HB LYS 53 HB3 LYS 53 23.786 15.602 14.972 1205 1HG LYS 53 HG2 LYS 53 20.792 15.296 14.549 1206 2HG LYS 53 HG3 LYS 53 21.581 15.228 16.114 1207 1HD LYS 53 HD2 LYS 53 22.250 17.541 15.967 1208 2HD LYS 53 HD3 LYS 53 21.717 17.650 14.269 1209 1HE LYS 53 HE2 LYS 53 19.410 17.238 14.878 1210 2HE LYS 53 HE3 LYS 53 19.840 16.910 16.559 1211 1HZ LYS 53 HZ1 LYS 53 20.348 19.542 15.328 1212 2HZ LYS 53 HZ2 LYS 53 18.912 19.168 16.023 1213 3HZ LYS 53 HZ3 LYS 53 20.294 19.167 16.921 1214 H GLU 54 HN GLU 54 23.729 13.120 11.854 1215 HA GLU 54 HA GLU 54 26.526 13.195 11.995 1216 1HB GLU 54 HB2 GLU 54 24.815 11.931 9.816 1217 2HB GLU 54 HB3 GLU 54 26.542 11.694 10.004 1218 1HG GLU 54 HG2 GLU 54 26.098 10.760 12.324 1219 2HG GLU 54 HG3 GLU 54 24.381 10.731 11.897 1220 H VAL 55 HN VAL 55 24.415 14.847 9.679 1221 HA VAL 55 HA VAL 55 26.802 16.088 8.405 1222 HB VAL 55 HB VAL 55 25.347 16.402 6.422 1223 1HG1 VAL 55 HG11 VAL 55 26.959 14.515 6.671 1224 2HG1 VAL 55 HG12 VAL 55 25.636 13.491 7.265 1225 3HG1 VAL 55 HG13 VAL 55 25.601 14.146 5.612 1226 1HG2 VAL 55 HG21 VAL 55 23.279 15.171 6.139 1227 2HG2 VAL 55 HG22 VAL 55 23.389 14.474 7.765 1228 3HG2 VAL 55 HG23 VAL 55 23.109 16.216 7.552 1229 H GLY 56 HN GLY 56 25.124 16.789 10.895 1230 1HA GLY 56 HA2 GLY 56 24.609 18.700 11.979 1231 2HA GLY 56 HA3 GLY 56 25.523 19.554 10.728 1232 H ILE 57 HN ILE 57 22.456 17.665 10.201 1233 HA ILE 57 HA ILE 57 21.079 20.270 9.640 1234 HB ILE 57 HB ILE 57 20.563 17.503 8.511 1235 1HG1 ILE 57 HG12 ILE 57 21.405 20.138 7.216 1236 2HG1 ILE 57 HG13 ILE 57 22.425 18.722 7.444 1237 1HG2 ILE 57 HG21 ILE 57 18.390 18.612 8.963 1238 2HG2 ILE 57 HG22 ILE 57 18.934 20.055 8.072 1239 3HG2 ILE 57 HG23 ILE 57 18.682 18.508 7.244 1240 1HD1 ILE 57 HD11 ILE 57 20.927 17.432 5.891 1241 2HD1 ILE 57 HD12 ILE 57 20.077 18.959 5.523 1242 3HD1 ILE 57 HD13 ILE 57 21.798 18.788 5.162 1243 H ASP 58 HN ASP 58 18.976 20.446 10.640 1244 HA ASP 58 HA ASP 58 18.605 18.670 13.015 1245 1HB ASP 58 HB2 ASP 58 19.338 20.866 13.782 1246 2HB ASP 58 HB3 ASP 58 18.132 21.666 12.761 1247 H ILE 59 HN ILE 59 16.609 17.893 13.309 1248 HA ILE 59 HA ILE 59 14.344 18.910 11.709 1249 HB ILE 59 HB ILE 59 13.648 16.691 11.082 1250 1HG1 ILE 59 HG12 ILE 59 16.352 15.550 11.938 1251 2HG1 ILE 59 HG13 ILE 59 14.935 15.486 12.980 1252 1HG2 ILE 59 HG21 ILE 59 15.202 16.311 9.244 1253 2HG2 ILE 59 HG22 ILE 59 15.131 18.051 9.558 1254 3HG2 ILE 59 HG23 ILE 59 16.521 17.110 10.124 1255 1HD1 ILE 59 HD11 ILE 59 15.119 14.227 10.217 1256 2HD1 ILE 59 HD12 ILE 59 15.079 13.399 11.784 1257 3HD1 ILE 59 HD13 ILE 59 13.663 14.305 11.229 1258 H SER 60 HN SER 60 15.311 18.855 14.662 1259 HA SER 60 HA SER 60 13.796 16.929 16.017 1260 1HB SER 60 HB2 SER 60 14.900 19.564 17.076 1261 2HB SER 60 HB3 SER 60 14.516 18.117 18.028 1262 HG SER 60 HG SER 60 16.601 18.577 16.173 1263 H ASN 61 HN ASN 61 12.203 18.877 14.245 1264 HA ASN 61 HA ASN 61 9.921 19.331 16.018 1265 1HB ASN 61 HB2 ASN 61 11.114 21.482 15.879 1266 2HB ASN 61 HB3 ASN 61 11.174 21.366 14.123 1267 1HD2 ASN 61 HD22 ASN 61 9.496 22.297 12.968 1268 2HD2 ASN 61 HD21 ASN 61 8.012 22.874 13.678 1269 H GLN 62 HN GLN 62 11.144 17.900 13.177 1270 HA GLN 62 HA GLN 62 9.101 18.490 11.292 1271 1HB GLN 62 HB2 GLN 62 11.146 16.284 11.462 1272 2HB GLN 62 HB3 GLN 62 9.897 16.379 10.201 1273 1HG GLN 62 HG2 GLN 62 10.648 18.665 9.607 1274 2HG GLN 62 HG3 GLN 62 11.985 18.504 10.751 1275 1HE2 GLN 62 HE22 GLN 62 11.630 15.391 9.405 1276 2HE2 GLN 62 HE21 GLN 62 12.841 15.573 8.147 1277 H THR 63 HN THR 63 7.492 17.078 10.552 1278 HA THR 63 HA THR 63 6.217 15.300 12.569 1279 HB THR 63 HB THR 63 4.089 16.222 11.555 1280 HG1 THR 63 HG1 THR 63 4.236 18.009 10.252 1281 1HG2 THR 63 HG21 THR 63 4.168 18.354 12.749 1282 2HG2 THR 63 HG22 THR 63 5.066 17.140 13.676 1283 3HG2 THR 63 HG23 THR 63 5.946 18.350 12.715 1284 H SER 64 HN SER 64 4.363 13.977 11.300 1285 HA SER 64 HA SER 64 4.901 13.237 8.593 1286 1HB SER 64 HB2 SER 64 6.687 11.911 9.561 1287 2HB SER 64 HB3 SER 64 5.622 11.287 10.817 1288 HG SER 64 HG SER 64 5.769 9.724 9.267 1289 H ASP 65 HN ASP 65 3.277 11.297 8.154 1290 HA ASP 65 HA ASP 65 0.914 11.070 9.740 1291 1HB ASP 65 HB2 ASP 65 0.635 13.447 8.932 1292 2HB ASP 65 HB3 ASP 65 0.741 12.857 7.271 1293 H ILE 66 HN ILE 66 -0.759 9.769 8.398 1294 HA ILE 66 HA ILE 66 0.542 7.758 6.820 1295 HB ILE 66 HB ILE 66 -1.848 7.032 6.443 1296 1HG1 ILE 66 HG12 ILE 66 -2.536 9.222 8.432 1297 2HG1 ILE 66 HG13 ILE 66 -2.873 9.305 6.698 1298 1HG2 ILE 66 HG21 ILE 66 -0.995 7.422 9.343 1299 2HG2 ILE 66 HG22 ILE 66 -2.043 6.135 8.699 1300 3HG2 ILE 66 HG23 ILE 66 -0.344 6.197 8.233 1301 1HD1 ILE 66 HD11 ILE 66 -4.014 7.316 8.691 1302 2HD1 ILE 66 HD12 ILE 66 -4.865 8.635 7.874 1303 3HD1 ILE 66 HD13 ILE 66 -4.283 7.245 6.929 1304 H ILE 67 HN ILE 67 -0.276 7.111 4.619 1305 HA ILE 67 HA ILE 67 0.163 9.022 2.698 1306 HB ILE 67 HB ILE 67 -0.310 7.519 1.114 1307 1HG1 ILE 67 HG12 ILE 67 -2.515 6.168 2.711 1308 2HG1 ILE 67 HG13 ILE 67 -2.761 7.376 1.451 1309 1HG2 ILE 67 HG21 ILE 67 1.253 6.515 2.761 1310 2HG2 ILE 67 HG22 ILE 67 -0.107 5.546 3.398 1311 3HG2 ILE 67 HG23 ILE 67 0.436 5.346 1.724 1312 1HD1 ILE 67 HD11 ILE 67 -1.570 5.802 -0.181 1313 2HD1 ILE 67 HD12 ILE 67 -1.774 4.560 1.075 1314 3HD1 ILE 67 HD13 ILE 67 -3.188 5.389 0.351 1315 H ASP 68 HN ASP 68 -0.984 10.478 1.566 1316 HA ASP 68 HA ASP 68 -3.892 10.830 2.067 1317 1HB ASP 68 HB2 ASP 68 -2.625 12.094 3.793 1318 2HB ASP 68 HB3 ASP 68 -1.882 13.057 2.510 1319 H SER 69 HN SER 69 -4.550 10.486 0.126 1320 HA SER 69 HA SER 69 -3.473 10.927 -2.334 1321 1HB SER 69 HB2 SER 69 -6.368 11.555 -1.763 1322 2HB SER 69 HB3 SER 69 -5.684 10.639 -3.117 1323 HG SER 69 HG SER 69 -5.164 8.998 -1.450 1324 H ASP 70 HN ASP 70 -4.730 13.478 -0.196 1325 HA ASP 70 HA ASP 70 -5.625 15.155 -2.381 1326 1HB ASP 70 HB2 ASP 70 -6.705 15.257 -0.184 1327 2HB ASP 70 HB3 ASP 70 -5.200 15.823 0.543 1328 H ILE 71 HN ILE 71 -2.631 14.603 -0.725 1329 HA ILE 71 HA ILE 71 -1.441 16.970 -2.073 1330 HB ILE 71 HB ILE 71 0.445 15.818 -0.371 1331 1HG1 ILE 71 HG12 ILE 71 -1.242 14.733 0.982 1332 2HG1 ILE 71 HG13 ILE 71 -0.235 15.899 1.819 1333 1HG2 ILE 71 HG21 ILE 71 0.393 18.140 -1.035 1334 2HG2 ILE 71 HG22 ILE 71 -1.115 18.411 -0.134 1335 3HG2 ILE 71 HG23 ILE 71 0.392 18.034 0.729 1336 1HD1 ILE 71 HD11 ILE 71 -3.126 16.396 1.004 1337 2HD1 ILE 71 HD12 ILE 71 -2.542 15.988 2.615 1338 3HD1 ILE 71 HD13 ILE 71 -2.077 17.531 1.882 1339 H LEU 72 HN LEU 72 -1.104 13.388 -1.582 1340 HA LEU 72 HA LEU 72 1.223 13.160 -3.161 1341 1HB LEU 72 HB2 LEU 72 0.420 11.331 -1.792 1342 2HB LEU 72 HB3 LEU 72 -1.030 11.151 -2.781 1343 HG LEU 72 HG LEU 72 1.576 11.038 -4.260 1344 1HD1 LEU 72 HD11 LEU 72 2.309 9.759 -2.390 1345 2HD1 LEU 72 HD12 LEU 72 0.829 8.799 -2.354 1346 3HD1 LEU 72 HD13 LEU 72 1.965 8.644 -3.703 1347 1HD2 LEU 72 HD21 LEU 72 0.514 9.195 -5.457 1348 2HD2 LEU 72 HD22 LEU 72 -0.862 9.201 -4.338 1349 3HD2 LEU 72 HD23 LEU 72 -0.581 10.572 -5.424 1350 H ASN 73 HN ASN 73 -2.252 12.975 -4.245 1351 HA ASN 73 HA ASN 73 -1.529 12.479 -6.947 1352 1HB ASN 73 HB2 ASN 73 -3.712 12.444 -7.430 1353 2HB ASN 73 HB3 ASN 73 -3.899 12.323 -5.693 1354 1HD2 ASN 73 HD22 ASN 73 -4.296 14.485 -4.529 1355 2HD2 ASN 73 HD21 ASN 73 -5.123 15.763 -5.405 1356 H ASN 74 HN ASN 74 -1.560 15.450 -5.093 1357 HA ASN 74 HA ASN 74 -1.627 17.203 -7.419 1358 1HB ASN 74 HB2 ASN 74 -1.738 17.552 -4.428 1359 2HB ASN 74 HB3 ASN 74 -1.100 18.886 -5.357 1360 1HD2 ASN 74 HD22 ASN 74 -3.914 17.906 -4.022 1361 2HD2 ASN 74 HD21 ASN 74 -5.030 18.687 -5.127 1362 H ALA 75 HN ALA 75 0.859 15.472 -5.781 1363 HA ALA 75 HA ALA 75 2.903 17.436 -5.826 1364 1HB ALA 75 HB1 ALA 75 4.402 15.565 -5.431 1365 2HB ALA 75 HB2 ALA 75 2.943 15.376 -4.447 1366 3HB ALA 75 HB3 ALA 75 3.160 14.399 -5.916 1367 H ASP 76 HN ASP 76 4.915 17.168 -7.129 1368 HA ASP 76 HA ASP 76 4.339 16.916 -10.029 1369 1HB ASP 76 HB2 ASP 76 5.790 18.745 -9.222 1370 2HB ASP 76 HB3 ASP 76 6.903 17.565 -8.521 1371 H LEU 77 HN LEU 77 5.983 15.197 -7.383 1372 HA LEU 77 HA LEU 77 6.346 12.813 -9.020 1373 1HB LEU 77 HB2 LEU 77 8.392 13.940 -9.529 1374 2HB LEU 77 HB3 LEU 77 8.550 14.553 -7.892 1375 HG LEU 77 HG LEU 77 9.083 12.295 -7.065 1376 1HD1 LEU 77 HD11 LEU 77 9.219 10.394 -8.233 1377 2HD1 LEU 77 HD12 LEU 77 8.001 11.163 -9.271 1378 3HD1 LEU 77 HD13 LEU 77 9.721 11.172 -9.719 1379 1HD2 LEU 77 HD21 LEU 77 11.360 12.225 -7.995 1380 2HD2 LEU 77 HD22 LEU 77 10.846 13.272 -9.339 1381 3HD2 LEU 77 HD23 LEU 77 10.842 13.889 -7.682 1382 H VAL 78 HN VAL 78 6.323 10.970 -7.838 1383 HA VAL 78 HA VAL 78 6.225 11.076 -4.867 1384 HB VAL 78 HB VAL 78 5.135 8.986 -6.756 1385 1HG1 VAL 78 HG11 VAL 78 4.085 8.091 -4.686 1386 2HG1 VAL 78 HG12 VAL 78 5.840 8.066 -4.552 1387 3HG1 VAL 78 HG13 VAL 78 4.911 9.331 -3.720 1388 1HG2 VAL 78 HG21 VAL 78 3.807 11.050 -6.888 1389 2HG2 VAL 78 HG22 VAL 78 2.922 9.825 -5.979 1390 3HG2 VAL 78 HG23 VAL 78 3.741 11.162 -5.128 1391 H VAL 79 HN VAL 79 8.198 10.916 -4.155 1392 HA VAL 79 HA VAL 79 10.239 9.174 -5.394 1393 HB VAL 79 HB VAL 79 10.221 11.010 -2.962 1394 1HG1 VAL 79 HG11 VAL 79 12.642 9.642 -4.177 1395 2HG1 VAL 79 HG12 VAL 79 12.619 10.745 -2.794 1396 3HG1 VAL 79 HG13 VAL 79 11.863 9.155 -2.663 1397 1HG2 VAL 79 HG21 VAL 79 11.770 12.420 -4.327 1398 2HG2 VAL 79 HG22 VAL 79 11.486 11.344 -5.710 1399 3HG2 VAL 79 HG23 VAL 79 10.151 12.300 -5.021 1400 H THR 80 HN THR 80 9.565 7.051 -5.048 1401 HA THR 80 HA THR 80 8.613 6.242 -2.369 1402 HB THR 80 HB THR 80 9.350 4.707 -4.902 1403 HG1 THR 80 HG1 THR 80 7.409 6.187 -4.580 1404 1HG2 THR 80 HG21 THR 80 8.140 2.815 -3.833 1405 2HG2 THR 80 HG22 THR 80 9.611 3.237 -2.954 1406 3HG2 THR 80 HG23 THR 80 8.033 3.768 -2.321 1407 H LEU 81 HN LEU 81 10.063 5.578 -0.728 1408 HA LEU 81 HA LEU 81 12.801 4.858 -1.450 1409 1HB LEU 81 HB2 LEU 81 13.961 6.565 -0.410 1410 2HB LEU 81 HB3 LEU 81 12.822 7.301 -1.515 1411 HG LEU 81 HG LEU 81 12.676 7.347 1.528 1412 1HD1 LEU 81 HD11 LEU 81 14.360 8.817 0.556 1413 2HD1 LEU 81 HD12 LEU 81 13.161 9.502 -0.557 1414 3HD1 LEU 81 HD13 LEU 81 12.985 9.747 1.185 1415 1HD2 LEU 81 HD21 LEU 81 10.370 7.290 0.539 1416 2HD2 LEU 81 HD22 LEU 81 10.773 8.775 1.365 1417 3HD2 LEU 81 HD23 LEU 81 10.791 8.732 -0.418 1418 H SER 82 HN SER 82 11.788 2.908 -0.633 1419 HA SER 82 HA SER 82 12.890 2.312 1.854 1420 1HB SER 82 HB2 SER 82 9.826 2.303 1.840 1421 2HB SER 82 HB3 SER 82 10.803 1.400 3.006 1422 HG SER 82 HG SER 82 11.364 4.103 2.697 1423 H GLY 83 HN GLY 83 10.341 1.552 -0.503 1424 1HA GLY 83 HA2 GLY 83 11.070 -0.785 -1.720 1425 2HA GLY 83 HA3 GLY 83 10.295 -1.285 -0.195 1426 H ASP 84 HN ASP 84 8.650 -2.082 -1.989 1427 HA ASP 84 HA ASP 84 6.471 -0.092 -2.118 1428 1HB ASP 84 HB2 ASP 84 7.568 0.204 -4.268 1429 2HB ASP 84 HB3 ASP 84 7.518 -1.534 -4.574 1430 H ALA 85 HN ALA 85 6.030 -1.558 -0.304 1431 HA ALA 85 HA ALA 85 4.306 -3.743 -0.948 1432 1HB ALA 85 HB1 ALA 85 6.341 -5.058 -1.238 1433 2HB ALA 85 HB2 ALA 85 6.993 -4.489 0.310 1434 3HB ALA 85 HB3 ALA 85 5.555 -5.537 0.275 1435 H ALA 86 HN ALA 86 6.449 -3.328 1.933 1436 HA ALA 86 HA ALA 86 4.292 -3.524 3.741 1437 1HB ALA 86 HB1 ALA 86 5.899 -2.743 5.468 1438 2HB ALA 86 HB2 ALA 86 6.599 -4.006 4.435 1439 3HB ALA 86 HB3 ALA 86 7.051 -2.302 4.193 1440 H ASP 87 HN ASP 87 5.594 -0.720 2.093 1441 HA ASP 87 HA ASP 87 4.310 1.324 3.630 1442 1HB ASP 87 HB2 ASP 87 5.068 2.799 1.961 1443 2HB ASP 87 HB3 ASP 87 6.341 1.602 2.182 1444 H LYS 88 HN LYS 88 2.698 -1.051 2.324 1445 HA LYS 88 HA LYS 88 0.569 -1.417 1.866 1446 1HB LYS 88 HB2 LYS 88 0.158 0.816 3.195 1447 2HB LYS 88 HB3 LYS 88 -0.182 1.495 1.606 1448 1HG LYS 88 HG2 LYS 88 -1.868 -0.370 1.270 1449 2HG LYS 88 HG3 LYS 88 -1.563 -0.907 2.914 1450 1HD LYS 88 HD2 LYS 88 -2.402 1.957 2.317 1451 2HD LYS 88 HD3 LYS 88 -3.573 0.652 2.312 1452 1HE LYS 88 HE2 LYS 88 -1.797 1.288 4.698 1453 2HE LYS 88 HE3 LYS 88 -3.398 1.987 4.460 1454 1HZ LYS 88 HZ1 LYS 88 -3.463 0.045 5.903 1455 2HZ LYS 88 HZ2 LYS 88 -4.381 -0.204 4.589 1456 3HZ LYS 88 HZ3 LYS 88 -2.911 -0.927 4.718 1457 H CYS 89 HN CYS 89 2.620 -1.254 -0.070 1458 HA CYS 89 HA CYS 89 3.084 -0.881 -2.309 1459 1HB CYS 89 HB2 CYS 89 1.485 -2.479 -3.638 1460 2HB CYS 89 HB3 CYS 89 2.559 -3.096 -2.415 1461 HA PRO 90 HA PRO 90 -0.286 2.391 -2.763 1462 1HB PRO 90 HB2 PRO 90 2.131 4.076 -3.407 1463 2HB PRO 90 HB3 PRO 90 0.650 4.527 -2.511 1464 1HG PRO 90 HG2 PRO 90 2.918 3.935 -1.128 1465 2HG PRO 90 HG3 PRO 90 1.350 3.262 -0.582 1466 1HD PRO 90 HD2 PRO 90 3.467 1.955 -2.333 1467 2HD PRO 90 HD3 PRO 90 2.714 1.335 -0.843 1468 H MET 91 HN MET 91 -1.320 2.622 -4.752 1469 HA MET 91 HA MET 91 0.205 1.534 -7.016 1470 1HB MET 91 HB2 MET 91 -1.997 1.415 -8.138 1471 2HB MET 91 HB3 MET 91 -1.840 0.525 -6.619 1472 1HG MET 91 HG2 MET 91 -3.909 1.526 -6.565 1473 2HG MET 91 HG3 MET 91 -2.958 2.435 -5.452 1474 1HE MET 91 HE1 MET 91 -4.940 3.630 -5.647 1475 2HE MET 91 HE2 MET 91 -5.531 4.829 -6.908 1476 3HE MET 91 HE3 MET 91 -5.706 3.060 -7.110 1477 H THR 92 HN THR 92 -0.017 4.597 -5.879 1478 HA THR 92 HA THR 92 0.268 6.652 -6.688 1479 HB THR 92 HB THR 92 2.195 6.736 -8.391 1480 HG1 THR 92 HG1 THR 92 1.844 4.516 -9.052 1481 1HG2 THR 92 HG21 THR 92 2.322 7.039 -5.898 1482 2HG2 THR 92 HG22 THR 92 2.557 5.289 -5.722 1483 3HG2 THR 92 HG23 THR 92 3.757 6.284 -6.573 1484 HA PRO 93 HA PRO 93 -2.886 6.479 -9.858 1485 1HB PRO 93 HB2 PRO 93 -4.194 8.817 -9.306 1486 2HB PRO 93 HB3 PRO 93 -4.300 7.388 -8.221 1487 1HG PRO 93 HG2 PRO 93 -2.559 9.834 -7.867 1488 2HG PRO 93 HG3 PRO 93 -3.570 8.954 -6.669 1489 1HD PRO 93 HD2 PRO 93 -0.847 8.542 -7.065 1490 2HD PRO 93 HD3 PRO 93 -1.927 7.283 -6.411 1491 HA PRO 94 HA PRO 94 -0.540 8.336 -12.991 1492 1HB PRO 94 HB2 PRO 94 -2.378 8.839 -15.045 1493 2HB PRO 94 HB3 PRO 94 -1.708 7.245 -14.592 1494 1HG PRO 94 HG2 PRO 94 -4.320 8.499 -13.694 1495 2HG PRO 94 HG3 PRO 94 -4.037 6.835 -14.310 1496 1HD PRO 94 HD2 PRO 94 -4.189 7.273 -11.667 1497 2HD PRO 94 HD3 PRO 94 -2.902 6.198 -12.318 1498 H HIS 95 HN HIS 95 -2.495 10.395 -11.270 1499 HA HIS 95 HA HIS 95 -2.193 12.854 -12.743 1500 1HB HIS 95 HB2 HIS 95 -2.529 12.315 -9.764 1501 2HB HIS 95 HB3 HIS 95 -2.607 13.897 -10.525 1502 HD1 HIS 95 HD1 HIS 95 -5.100 13.768 -9.194 1503 HD2 HIS 95 HD2 HIS 95 -4.526 11.576 -12.752 1504 HE1 HIS 95 HE1 HIS 95 -7.417 13.177 -10.064 1505 H VAL 96 HN VAL 96 0.077 10.796 -11.021 1506 HA VAL 96 HA VAL 96 2.059 13.017 -10.939 1507 HB VAL 96 HB VAL 96 2.875 11.349 -8.942 1508 1HG1 VAL 96 HG11 VAL 96 2.181 13.053 -7.414 1509 2HG1 VAL 96 HG12 VAL 96 2.802 13.753 -8.902 1510 3HG1 VAL 96 HG13 VAL 96 1.040 13.723 -8.609 1511 1HG2 VAL 96 HG21 VAL 96 1.064 10.918 -7.374 1512 2HG2 VAL 96 HG22 VAL 96 -0.144 11.361 -8.590 1513 3HG2 VAL 96 HG23 VAL 96 0.908 9.939 -8.833 1514 H LYS 97 HN LYS 97 4.222 12.514 -11.084 1515 HA LYS 97 HA LYS 97 4.953 10.123 -12.646 1516 1HB LYS 97 HB2 LYS 97 5.791 12.510 -13.058 1517 2HB LYS 97 HB3 LYS 97 6.681 12.399 -11.542 1518 1HG LYS 97 HG2 LYS 97 7.097 10.163 -13.488 1519 2HG LYS 97 HG3 LYS 97 7.631 11.743 -14.039 1520 1HD LYS 97 HD2 LYS 97 8.486 10.508 -11.424 1521 2HD LYS 97 HD3 LYS 97 9.362 10.279 -12.931 1522 1HE LYS 97 HE2 LYS 97 8.970 12.900 -11.425 1523 2HE LYS 97 HE3 LYS 97 10.483 12.006 -11.656 1524 1HZ LYS 97 HZ1 LYS 97 10.213 12.458 -14.075 1525 2HZ LYS 97 HZ2 LYS 97 9.004 13.516 -13.711 1526 3HZ LYS 97 HZ3 LYS 97 10.534 13.741 -13.132 1527 H ARG 98 HN ARG 98 6.578 8.611 -11.684 1528 HA ARG 98 HA ARG 98 7.010 8.872 -8.768 1529 1HB ARG 98 HB2 ARG 98 4.981 7.410 -9.123 1530 2HB ARG 98 HB3 ARG 98 5.994 6.325 -10.088 1531 1HG ARG 98 HG2 ARG 98 7.485 6.170 -7.903 1532 2HG ARG 98 HG3 ARG 98 6.093 6.910 -7.104 1533 1HD ARG 98 HD2 ARG 98 4.720 5.021 -8.202 1534 2HD ARG 98 HD3 ARG 98 6.247 4.276 -8.657 1535 HE ARG 98 HE ARG 98 6.652 4.643 -6.024 1536 1HH1 ARG 98 HH21 ARG 98 3.651 3.453 -7.490 1537 2HH1 ARG 98 HH22 ARG 98 3.333 2.349 -6.206 1538 1HH2 ARG 98 HH11 ARG 98 6.156 3.311 -4.328 1539 2HH2 ARG 98 HH12 ARG 98 4.963 2.033 -4.498 1540 H GLU 99 HN GLU 99 8.951 7.930 -8.117 1541 HA GLU 99 HA GLU 99 10.449 6.215 -9.928 1542 1HB GLU 99 HB2 GLU 99 11.458 8.927 -8.970 1543 2HB GLU 99 HB3 GLU 99 12.564 7.617 -9.384 1544 1HG GLU 99 HG2 GLU 99 10.614 9.009 -11.249 1545 2HG GLU 99 HG3 GLU 99 12.351 9.226 -11.193 1546 H HIS 100 HN HIS 100 11.870 4.923 -8.665 1547 HA HIS 100 HA HIS 100 11.446 5.064 -5.735 1548 1HB HIS 100 HB2 HIS 100 12.140 2.646 -5.799 1549 2HB HIS 100 HB3 HIS 100 10.572 3.038 -6.484 1550 HD1 HIS 100 HD1 HIS 100 13.816 3.356 -8.569 1551 HD2 HIS 100 HD2 HIS 100 10.388 0.960 -8.095 1552 HE1 HIS 100 HE1 HIS 100 13.777 1.752 -10.561 1553 H TRP 101 HN TRP 101 13.145 5.411 -4.467 1554 HA TRP 101 HA TRP 101 15.869 5.592 -5.687 1555 1HB TRP 101 HB2 TRP 101 14.495 7.514 -3.773 1556 2HB TRP 101 HB3 TRP 101 16.140 7.651 -4.334 1557 HD1 TRP 101 HD1 TRP 101 12.585 7.733 -5.831 1558 HE1 TRP 101 HE1 TRP 101 12.474 9.541 -7.633 1559 HE3 TRP 101 HE3 TRP 101 17.532 9.122 -5.988 1560 HZ2 TRP 101 HZ2 TRP 101 14.196 11.526 -8.762 1561 HZ3 TRP 101 HZ3 TRP 101 18.259 10.949 -7.466 1562 HH2 TRP 101 HH2 TRP 101 16.609 12.178 -8.854 1563 H GLY 102 HN GLY 102 14.082 3.998 -3.252 1564 1HA GLY 102 HA2 GLY 102 16.532 3.321 -1.812 1565 2HA GLY 102 HA3 GLY 102 15.311 4.167 -0.848 1566 H PHE 103 HN PHE 103 16.330 1.408 -0.699 1567 HA PHE 103 HA PHE 103 13.858 -0.206 -0.995 1568 1HB PHE 103 HB2 PHE 103 16.599 -1.058 -1.993 1569 2HB PHE 103 HB3 PHE 103 15.084 -1.926 -2.176 1570 HD1 PHE 103 HD1 PHE 103 17.270 0.645 -3.555 1571 HD2 PHE 103 HD2 PHE 103 13.284 -1.002 -3.724 1572 HE1 PHE 103 HE1 PHE 103 16.897 1.773 -5.732 1573 HE2 PHE 103 HE2 PHE 103 12.923 0.115 -5.914 1574 HZ PHE 103 HZ PHE 103 14.730 1.502 -6.917 1575 H ASP 104 HN ASP 104 15.264 0.936 1.364 1576 HA ASP 104 HA ASP 104 15.755 -1.382 3.033 1577 1HB ASP 104 HB2 ASP 104 17.993 -1.054 1.978 1578 2HB ASP 104 HB3 ASP 104 17.972 0.643 2.459 1579 H ASP 105 HN ASP 105 16.022 -0.430 5.393 1580 HA ASP 105 HA ASP 105 14.902 2.294 5.666 1581 1HB ASP 105 HB2 ASP 105 12.928 1.000 5.288 1582 2HB ASP 105 HB3 ASP 105 13.419 -0.220 6.451 1583 HA PRO 106 HA PRO 106 17.970 1.565 8.760 1584 1HB PRO 106 HB2 PRO 106 18.193 4.013 9.893 1585 2HB PRO 106 HB3 PRO 106 18.698 3.677 8.214 1586 1HG PRO 106 HG2 PRO 106 16.105 4.923 9.178 1587 2HG PRO 106 HG3 PRO 106 17.172 5.473 7.846 1588 1HD PRO 106 HD2 PRO 106 14.929 3.917 7.498 1589 2HD PRO 106 HD3 PRO 106 16.330 3.827 6.396 1590 H ALA 107 HN ALA 107 14.676 2.568 9.687 1591 HA ALA 107 HA ALA 107 15.036 2.326 12.506 1592 1HB ALA 107 HB1 ALA 107 12.530 2.010 10.797 1593 2HB ALA 107 HB2 ALA 107 12.576 2.280 12.548 1594 3HB ALA 107 HB3 ALA 107 13.150 3.548 11.445 1595 H ARG 108 HN ARG 108 15.361 0.025 10.111 1596 HA ARG 108 HA ARG 108 14.197 -2.231 11.695 1597 1HB ARG 108 HB2 ARG 108 15.287 -2.381 8.890 1598 2HB ARG 108 HB3 ARG 108 14.187 -3.501 9.685 1599 1HG ARG 108 HG2 ARG 108 13.559 -0.682 8.728 1600 2HG ARG 108 HG3 ARG 108 13.048 -2.167 7.944 1601 1HD ARG 108 HD2 ARG 108 11.400 -2.618 9.570 1602 2HD ARG 108 HD3 ARG 108 12.173 -1.553 10.777 1603 HE ARG 108 HE ARG 108 11.422 -0.056 8.450 1604 1HH1 ARG 108 HH21 ARG 108 9.907 -1.434 11.360 1605 2HH1 ARG 108 HH22 ARG 108 8.721 -0.185 11.455 1606 1HH2 ARG 108 HH11 ARG 108 10.008 1.495 8.555 1607 2HH2 ARG 108 HH12 ARG 108 8.748 1.573 9.768 1608 H ALA 109 HN ALA 109 16.982 -0.682 11.793 1609 HA ALA 109 HA ALA 109 19.107 -2.231 11.207 1610 1HB ALA 109 HB1 ALA 109 20.275 -1.189 13.048 1611 2HB ALA 109 HB2 ALA 109 19.167 0.016 12.347 1612 3HB ALA 109 HB3 ALA 109 18.750 -0.805 13.871 1613 H GLN 110 HN GLN 110 20.384 -3.762 12.164 1614 HA GLN 110 HA GLN 110 18.942 -5.974 13.013 1615 1HB GLN 110 HB2 GLN 110 21.228 -5.969 11.892 1616 2HB GLN 110 HB3 GLN 110 21.950 -5.625 13.473 1617 1HG GLN 110 HG2 GLN 110 20.048 -7.910 13.487 1618 2HG GLN 110 HG3 GLN 110 21.418 -8.143 12.406 1619 1HE2 GLN 110 HE22 GLN 110 20.464 -7.601 15.808 1620 2HE2 GLN 110 HE21 GLN 110 21.953 -8.221 16.493 1621 H GLY 111 HN GLY 111 20.754 -3.617 14.943 1622 1HA GLY 111 HA2 GLY 111 19.462 -3.106 16.962 1623 2HA GLY 111 HA3 GLY 111 19.583 -4.846 17.370 1624 H THR 112 HN THR 112 22.477 -4.687 16.362 1625 HA THR 112 HA THR 112 23.601 -4.341 19.019 1626 HB THR 112 HB THR 112 25.728 -4.925 18.016 1627 HG1 THR 112 HG1 THR 112 25.832 -5.239 15.754 1628 1HG2 THR 112 HG21 THR 112 25.215 -7.090 17.147 1629 2HG2 THR 112 HG22 THR 112 23.950 -6.701 18.343 1630 3HG2 THR 112 HG23 THR 112 23.611 -6.558 16.591 1631 H GLU 113 HN GLU 113 25.475 -2.849 19.410 1632 HA GLU 113 HA GLU 113 24.633 -0.239 19.017 1633 1HB GLU 113 HB2 GLU 113 27.454 -1.290 19.587 1634 2HB GLU 113 HB3 GLU 113 26.920 0.381 19.882 1635 1HG GLU 113 HG2 GLU 113 25.162 -0.518 21.449 1636 2HG GLU 113 HG3 GLU 113 25.844 -2.132 21.230 1637 H GLU 114 HN GLU 114 26.933 -2.180 17.168 1638 HA GLU 114 HA GLU 114 27.784 -0.048 15.439 1639 1HB GLU 114 HB2 GLU 114 28.692 -2.065 14.104 1640 2HB GLU 114 HB3 GLU 114 29.417 -1.694 15.680 1641 1HG GLU 114 HG2 GLU 114 28.006 -3.515 16.692 1642 2HG GLU 114 HG3 GLU 114 27.423 -3.886 15.054 1643 H GLU 115 HN GLU 115 25.292 -2.760 15.250 1644 HA GLU 115 HA GLU 115 24.989 -2.197 12.448 1645 1HB GLU 115 HB2 GLU 115 23.400 -3.885 14.368 1646 2HB GLU 115 HB3 GLU 115 22.986 -3.704 12.663 1647 1HG GLU 115 HG2 GLU 115 25.805 -4.536 13.467 1648 2HG GLU 115 HG3 GLU 115 24.497 -5.715 13.366 1649 H LYS 116 HN LYS 116 23.430 -1.019 15.405 1650 HA LYS 116 HA LYS 116 21.279 0.358 14.136 1651 1HB LYS 116 HB2 LYS 116 22.875 1.058 16.648 1652 2HB LYS 116 HB3 LYS 116 21.397 1.868 16.170 1653 1HG LYS 116 HG2 LYS 116 20.932 -1.023 16.303 1654 2HG LYS 116 HG3 LYS 116 21.735 -0.457 17.765 1655 1HD LYS 116 HD2 LYS 116 19.491 -0.364 18.294 1656 2HD LYS 116 HD3 LYS 116 19.946 1.317 17.997 1657 1HE LYS 116 HE2 LYS 116 18.976 1.120 15.683 1658 2HE LYS 116 HE3 LYS 116 18.535 -0.557 16.036 1659 1HZ LYS 116 HZ1 LYS 116 16.659 0.935 16.375 1660 2HZ LYS 116 HZ2 LYS 116 17.071 0.246 17.789 1661 3HZ LYS 116 HZ3 LYS 116 17.472 1.799 17.495 1662 H TRP 117 HN TRP 117 24.507 1.649 15.070 1663 HA TRP 117 HA TRP 117 23.989 4.102 13.705 1664 1HB TRP 117 HB2 TRP 117 25.829 3.538 15.454 1665 2HB TRP 117 HB3 TRP 117 26.793 3.014 14.081 1666 HD1 TRP 117 HD1 TRP 117 26.002 5.482 12.116 1667 HE1 TRP 117 HE1 TRP 117 26.869 7.816 12.556 1668 HE3 TRP 117 HE3 TRP 117 27.231 4.910 17.057 1669 HZ2 TRP 117 HZ2 TRP 117 27.910 9.281 14.783 1670 HZ3 TRP 117 HZ3 TRP 117 28.184 6.825 18.321 1671 HH2 TRP 117 HH2 TRP 117 28.517 9.025 17.206 1672 H ALA 118 HN ALA 118 25.481 1.019 12.615 1673 HA ALA 118 HA ALA 118 26.364 1.953 10.121 1674 1HB ALA 118 HB1 ALA 118 27.047 -0.222 11.165 1675 2HB ALA 118 HB2 ALA 118 25.403 -0.831 10.918 1676 3HB ALA 118 HB3 ALA 118 26.426 -0.461 9.515 1677 H PHE 119 HN PHE 119 23.130 0.606 10.999 1678 HA PHE 119 HA PHE 119 22.200 0.633 8.279 1679 1HB PHE 119 HB2 PHE 119 20.958 0.374 10.982 1680 2HB PHE 119 HB3 PHE 119 19.920 0.966 9.714 1681 HD1 PHE 119 HD1 PHE 119 18.643 -0.581 8.526 1682 HD2 PHE 119 HD2 PHE 119 22.439 -1.832 10.160 1683 HE1 PHE 119 HE1 PHE 119 18.188 -2.901 7.818 1684 HE2 PHE 119 HE2 PHE 119 21.967 -4.159 9.462 1685 HZ PHE 119 HZ PHE 119 19.836 -4.705 8.295 1686 H PHE 120 HN PHE 120 22.016 3.031 10.984 1687 HA PHE 120 HA PHE 120 20.407 4.862 9.499 1688 1HB PHE 120 HB2 PHE 120 22.412 5.833 11.519 1689 2HB PHE 120 HB3 PHE 120 20.832 6.483 11.108 1690 HD1 PHE 120 HD1 PHE 120 21.957 6.129 13.856 1691 HD2 PHE 120 HD2 PHE 120 19.518 3.447 11.504 1692 HE1 PHE 120 HE1 PHE 120 21.082 5.085 15.926 1693 HE2 PHE 120 HE2 PHE 120 18.638 2.437 13.557 1694 HZ PHE 120 HZ PHE 120 19.412 3.257 15.791 1695 H GLN 121 HN GLN 121 23.975 4.578 9.866 1696 HA GLN 121 HA GLN 121 24.602 6.882 8.359 1697 1HB GLN 121 HB2 GLN 121 26.079 5.857 9.962 1698 2HB GLN 121 HB3 GLN 121 26.208 4.373 9.001 1699 1HG GLN 121 HG2 GLN 121 27.379 5.502 7.238 1700 2HG GLN 121 HG3 GLN 121 27.010 7.095 7.919 1701 1HE2 GLN 121 HE22 GLN 121 27.761 7.339 10.388 1702 2HE2 GLN 121 HE21 GLN 121 29.393 6.768 10.689 1703 H ARG 122 HN ARG 122 24.290 3.406 7.387 1704 HA ARG 122 HA ARG 122 25.223 3.753 4.759 1705 1HB ARG 122 HB2 ARG 122 24.796 1.527 5.799 1706 2HB ARG 122 HB3 ARG 122 23.059 1.858 5.840 1707 1HG ARG 122 HG2 ARG 122 23.116 1.994 3.287 1708 2HG ARG 122 HG3 ARG 122 24.807 1.470 3.377 1709 1HD ARG 122 HD2 ARG 122 23.999 -0.577 4.632 1710 2HD ARG 122 HD3 ARG 122 22.338 -0.045 4.336 1711 HE ARG 122 HE ARG 122 24.354 -0.931 2.331 1712 1HH1 ARG 122 HH21 ARG 122 20.858 -0.354 3.025 1713 2HH1 ARG 122 HH22 ARG 122 20.409 -0.705 1.398 1714 1HH2 ARG 122 HH11 ARG 122 23.648 -1.510 0.259 1715 2HH2 ARG 122 HH12 ARG 122 21.980 -1.469 -0.156 1716 H VAL 123 HN VAL 123 21.873 3.967 6.104 1717 HA VAL 123 HA VAL 123 20.736 4.743 3.595 1718 HB VAL 123 HB VAL 123 19.699 5.046 6.436 1719 1HG1 VAL 123 HG11 VAL 123 18.289 5.399 3.748 1720 2HG1 VAL 123 HG12 VAL 123 17.464 5.318 5.319 1721 3HG1 VAL 123 HG13 VAL 123 18.551 6.658 4.968 1722 1HG2 VAL 123 HG21 VAL 123 18.324 3.058 5.790 1723 2HG2 VAL 123 HG22 VAL 123 19.117 3.020 4.207 1724 3HG2 VAL 123 HG23 VAL 123 20.036 2.684 5.684 1725 H ARG 124 HN ARG 124 22.098 6.719 6.332 1726 HA ARG 124 HA ARG 124 21.372 9.227 5.311 1727 1HB ARG 124 HB2 ARG 124 22.274 8.955 7.517 1728 2HB ARG 124 HB3 ARG 124 23.789 8.312 6.914 1729 1HG ARG 124 HG2 ARG 124 23.027 11.088 6.059 1730 2HG ARG 124 HG3 ARG 124 23.499 10.844 7.733 1731 1HD ARG 124 HD2 ARG 124 25.255 9.908 5.439 1732 2HD ARG 124 HD3 ARG 124 25.352 11.524 6.149 1733 HE ARG 124 HE ARG 124 25.442 9.577 8.237 1734 1HH1 ARG 124 HH11 ARG 124 27.491 10.869 5.617 1735 2HH1 ARG 124 HH12 ARG 124 28.971 10.613 6.459 1736 1HH2 ARG 124 HH21 ARG 124 27.425 9.243 9.363 1737 2HH2 ARG 124 HH22 ARG 124 28.934 9.665 8.621 1738 H ASP 125 HN ASP 125 24.265 7.287 4.449 1739 HA ASP 125 HA ASP 125 25.340 9.230 2.659 1740 1HB ASP 125 HB2 ASP 125 26.662 7.349 3.485 1741 2HB ASP 125 HB3 ASP 125 25.588 6.194 2.693 1742 H GLU 126 HN GLU 126 23.097 6.481 2.118 1743 HA GLU 126 HA GLU 126 22.883 6.787 -0.707 1744 1HB GLU 126 HB2 GLU 126 22.302 4.743 0.538 1745 2HB GLU 126 HB3 GLU 126 20.980 5.568 1.345 1746 1HG GLU 126 HG2 GLU 126 20.650 5.855 -1.537 1747 2HG GLU 126 HG3 GLU 126 20.986 4.173 -1.160 1748 H ILE 127 HN ILE 127 20.527 7.771 1.846 1749 HA ILE 127 HA ILE 127 18.709 9.003 0.141 1750 HB ILE 127 HB ILE 127 18.898 8.389 2.842 1751 1HG1 ILE 127 HG12 ILE 127 16.569 9.844 1.597 1752 2HG1 ILE 127 HG13 ILE 127 16.984 8.195 1.158 1753 1HG2 ILE 127 HG21 ILE 127 19.722 10.597 3.368 1754 2HG2 ILE 127 HG22 ILE 127 18.333 11.325 2.516 1755 3HG2 ILE 127 HG23 ILE 127 18.091 10.391 4.013 1756 1HD1 ILE 127 HD11 ILE 127 16.800 7.474 3.536 1757 2HD1 ILE 127 HD12 ILE 127 16.290 9.092 4.001 1758 3HD1 ILE 127 HD13 ILE 127 15.284 8.121 2.898 1759 H GLY 128 HN GLY 128 21.536 10.484 1.731 1760 1HA GLY 128 HA2 GLY 128 20.889 13.145 0.856 1761 2HA GLY 128 HA3 GLY 128 22.499 12.544 1.359 1762 H ASN 129 HN ASN 129 22.982 10.538 -0.631 1763 HA ASN 129 HA ASN 129 23.688 12.102 -2.895 1764 1HB ASN 129 HB2 ASN 129 24.962 10.129 -2.658 1765 2HB ASN 129 HB3 ASN 129 23.532 9.120 -2.413 1766 1HD2 ASN 129 HD22 ASN 129 24.882 11.329 -4.995 1767 2HD2 ASN 129 HD21 ASN 129 24.246 10.382 -6.320 1768 H ARG 130 HN ARG 130 20.931 9.907 -2.332 1769 HA ARG 130 HA ARG 130 19.800 10.098 -4.936 1770 1HB ARG 130 HB2 ARG 130 18.401 9.747 -2.249 1771 2HB ARG 130 HB3 ARG 130 17.630 9.493 -3.791 1772 1HG ARG 130 HG2 ARG 130 19.945 7.844 -2.688 1773 2HG ARG 130 HG3 ARG 130 18.259 7.418 -2.632 1774 1HD ARG 130 HD2 ARG 130 19.282 6.124 -4.325 1775 2HD ARG 130 HD3 ARG 130 18.268 7.301 -5.146 1776 HE ARG 130 HE ARG 130 21.197 7.782 -4.737 1777 1HH1 ARG 130 HH11 ARG 130 18.601 7.148 -7.120 1778 2HH1 ARG 130 HH12 ARG 130 19.539 7.734 -8.442 1779 1HH2 ARG 130 HH21 ARG 130 22.381 8.465 -6.450 1780 2HH2 ARG 130 HH22 ARG 130 21.697 8.666 -8.036 1781 H LEU 131 HN LEU 131 19.083 12.148 -2.020 1782 HA LEU 131 HA LEU 131 17.330 13.774 -3.581 1783 1HB LEU 131 HB2 LEU 131 18.288 13.727 -0.787 1784 2HB LEU 131 HB3 LEU 131 18.207 15.362 -1.399 1785 HG LEU 131 HG LEU 131 16.126 14.797 -0.361 1786 1HD1 LEU 131 HD11 LEU 131 14.665 15.631 -2.032 1787 2HD1 LEU 131 HD12 LEU 131 16.244 16.168 -2.576 1788 3HD1 LEU 131 HD13 LEU 131 15.468 14.763 -3.332 1789 1HD2 LEU 131 HD21 LEU 131 15.831 12.499 -2.341 1790 2HD2 LEU 131 HD22 LEU 131 16.223 12.351 -0.615 1791 3HD2 LEU 131 HD23 LEU 131 14.656 12.999 -1.113 1792 H LYS 132 HN LYS 132 20.816 14.109 -2.833 1793 HA LYS 132 HA LYS 132 21.120 16.717 -3.905 1794 1HB LYS 132 HB2 LYS 132 22.716 15.432 -2.493 1795 2HB LYS 132 HB3 LYS 132 23.055 14.360 -3.865 1796 1HG LYS 132 HG2 LYS 132 23.897 16.352 -5.134 1797 2HG LYS 132 HG3 LYS 132 23.602 17.357 -3.705 1798 1HD LYS 132 HD2 LYS 132 25.438 14.933 -3.845 1799 2HD LYS 132 HD3 LYS 132 25.966 16.632 -3.898 1800 1HE LYS 132 HE2 LYS 132 25.023 16.947 -1.607 1801 2HE LYS 132 HE3 LYS 132 24.627 15.224 -1.550 1802 1HZ LYS 132 HZ1 LYS 132 26.745 15.674 -0.478 1803 2HZ LYS 132 HZ2 LYS 132 27.008 14.754 -1.795 1804 3HZ LYS 132 HZ3 LYS 132 27.358 16.350 -1.827 1805 H GLU 133 HN GLU 133 21.202 13.429 -5.495 1806 HA GLU 133 HA GLU 133 21.633 14.572 -8.070 1807 1HB GLU 133 HB2 GLU 133 20.690 11.862 -7.141 1808 2HB GLU 133 HB3 GLU 133 20.333 12.360 -8.824 1809 1HG GLU 133 HG2 GLU 133 22.594 12.768 -9.336 1810 2HG GLU 133 HG3 GLU 133 23.103 12.664 -7.643 1811 H PHE 134 HN PHE 134 18.491 13.885 -6.301 1812 HA PHE 134 HA PHE 134 16.910 14.574 -8.574 1813 1HB PHE 134 HB2 PHE 134 15.926 13.606 -6.551 1814 2HB PHE 134 HB3 PHE 134 16.315 15.072 -5.644 1815 HD1 PHE 134 HD1 PHE 134 14.529 14.022 -8.804 1816 HD2 PHE 134 HD2 PHE 134 14.669 16.761 -5.484 1817 HE1 PHE 134 HE1 PHE 134 12.520 15.184 -9.672 1818 HE2 PHE 134 HE2 PHE 134 12.673 17.942 -6.373 1819 HZ PHE 134 HZ PHE 134 11.598 17.150 -8.471 1820 H ALA 135 HN ALA 135 18.496 16.704 -6.201 1821 HA ALA 135 HA ALA 135 17.395 19.130 -7.137 1822 1HB ALA 135 HB1 ALA 135 18.767 18.700 -5.020 1823 2HB ALA 135 HB2 ALA 135 20.208 18.819 -6.051 1824 3HB ALA 135 HB3 ALA 135 19.097 20.207 -5.896 1825 H GLU 136 HN GLU 136 19.966 17.116 -8.444 1826 HA GLU 136 HA GLU 136 21.087 19.141 -10.195 1827 1HB GLU 136 HB2 GLU 136 21.721 16.219 -9.697 1828 2HB GLU 136 HB3 GLU 136 22.582 17.197 -10.870 1829 1HG GLU 136 HG2 GLU 136 22.428 18.028 -7.950 1830 2HG GLU 136 HG3 GLU 136 23.592 16.844 -8.518 1831 H THR 137 HN THR 137 19.385 16.085 -10.396 1832 HA THR 137 HA THR 137 19.360 15.914 -13.276 1833 HB THR 137 HB THR 137 18.100 13.743 -12.732 1834 HG1 THR 137 HG1 THR 137 18.439 14.437 -10.063 1835 1HG2 THR 137 HG21 THR 137 20.623 14.333 -11.123 1836 2HG2 THR 137 HG22 THR 137 19.927 12.719 -11.412 1837 3HG2 THR 137 HG23 THR 137 20.518 13.701 -12.767 1838 H GLY 138 HN GLY 138 17.178 17.117 -10.760 1839 1HA GLY 138 HA2 GLY 138 15.045 17.874 -10.742 1840 2HA GLY 138 HA3 GLY 138 15.342 18.517 -12.382 1841 H LYS 139 HN LYS 139 15.403 15.193 -11.076 1842 HA LYS 139 HA LYS 139 14.748 13.932 -13.330 1843 1HB LYS 139 HB2 LYS 139 15.389 12.960 -11.069 1844 2HB LYS 139 HB3 LYS 139 13.648 12.864 -10.719 1845 1HG LYS 139 HG2 LYS 139 13.231 11.288 -12.348 1846 2HG LYS 139 HG3 LYS 139 14.609 11.752 -13.354 1847 1HD LYS 139 HD2 LYS 139 14.847 10.311 -10.696 1848 2HD LYS 139 HD3 LYS 139 14.888 9.520 -12.263 1849 1HE LYS 139 HE2 LYS 139 16.904 11.637 -11.386 1850 2HE LYS 139 HE3 LYS 139 17.133 9.902 -11.184 1851 1HZ LYS 139 HZ1 LYS 139 16.798 11.253 -13.802 1852 2HZ LYS 139 HZ2 LYS 139 18.194 10.663 -13.195 1853 3HZ LYS 139 HZ3 LYS 139 16.991 9.643 -13.588 Start of MODEL 19 1 1H MET 1 H1 MET 1 -24.122 -12.066 -7.327 2 2H MET 1 H2 MET 1 -22.968 -11.067 -7.920 3 3H MET 1 H3 MET 1 -22.537 -12.551 -7.405 4 HA MET 1 HA MET 1 -24.067 -13.504 -9.098 5 1HB MET 1 HB2 MET 1 -25.242 -11.353 -9.559 6 2HB MET 1 HB3 MET 1 -23.778 -10.722 -10.309 7 1HG MET 1 HG2 MET 1 -25.360 -11.560 -11.985 8 2HG MET 1 HG3 MET 1 -23.850 -12.455 -12.024 9 1HE MET 1 HE1 MET 1 -27.929 -14.110 -10.527 10 2HE MET 1 HE2 MET 1 -27.065 -12.870 -9.599 11 3HE MET 1 HE3 MET 1 -27.673 -12.500 -11.231 12 H ALA 2 HN ALA 2 -21.397 -11.079 -9.805 13 HA ALA 2 HA ALA 2 -19.490 -13.222 -10.191 14 1HB ALA 2 HB1 ALA 2 -20.253 -11.369 -12.511 15 2HB ALA 2 HB2 ALA 2 -18.892 -12.509 -12.493 16 3HB ALA 2 HB3 ALA 2 -20.552 -13.122 -12.463 17 H ILE 3 HN ILE 3 -17.338 -12.163 -10.679 18 HA ILE 3 HA ILE 3 -17.047 -9.594 -9.289 19 HB ILE 3 HB ILE 3 -15.128 -11.806 -10.130 20 1HG1 ILE 3 HG12 ILE 3 -14.259 -11.369 -7.788 21 2HG1 ILE 3 HG13 ILE 3 -15.640 -10.303 -7.539 22 1HG2 ILE 3 HG21 ILE 3 -14.048 -9.757 -10.959 23 2HG2 ILE 3 HG22 ILE 3 -14.378 -8.934 -9.419 24 3HG2 ILE 3 HG23 ILE 3 -13.239 -10.305 -9.500 25 1HD1 ILE 3 HD11 ILE 3 -15.970 -12.471 -6.574 26 2HD1 ILE 3 HD12 ILE 3 -17.156 -12.234 -7.860 27 3HD1 ILE 3 HD13 ILE 3 -15.733 -13.287 -8.132 28 H VAL 4 HN VAL 4 -17.846 -8.061 -10.573 29 HA VAL 4 HA VAL 4 -17.576 -8.053 -13.465 30 HB VAL 4 HB VAL 4 -18.743 -6.049 -11.525 31 1HG1 VAL 4 HG11 VAL 4 -18.430 -4.911 -13.653 32 2HG1 VAL 4 HG12 VAL 4 -19.126 -6.299 -14.538 33 3HG1 VAL 4 HG13 VAL 4 -20.126 -5.296 -13.470 34 1HG2 VAL 4 HG21 VAL 4 -20.044 -8.333 -13.077 35 2HG2 VAL 4 HG22 VAL 4 -19.963 -8.155 -11.311 36 3HG2 VAL 4 HG23 VAL 4 -20.952 -7.054 -12.254 37 H LYS 5 HN LYS 5 -16.762 -5.936 -14.467 38 HA LYS 5 HA LYS 5 -14.239 -5.081 -13.198 39 1HB LYS 5 HB2 LYS 5 -13.794 -6.688 -14.997 40 2HB LYS 5 HB3 LYS 5 -14.792 -5.760 -16.113 41 1HG LYS 5 HG2 LYS 5 -12.460 -5.386 -16.573 42 2HG LYS 5 HG3 LYS 5 -13.195 -3.880 -16.029 43 1HD LYS 5 HD2 LYS 5 -12.204 -4.154 -13.794 44 2HD LYS 5 HD3 LYS 5 -11.542 -5.732 -14.236 45 1HE LYS 5 HE2 LYS 5 -10.847 -3.080 -15.585 46 2HE LYS 5 HE3 LYS 5 -9.892 -3.826 -14.297 47 1HZ LYS 5 HZ1 LYS 5 -10.371 -5.048 -16.954 48 2HZ LYS 5 HZ2 LYS 5 -8.991 -4.318 -16.478 49 3HZ LYS 5 HZ3 LYS 5 -9.472 -5.709 -15.753 50 H ALA 6 HN ALA 6 -14.414 -3.008 -12.684 51 HA ALA 6 HA ALA 6 -16.374 -1.193 -13.916 52 1HB ALA 6 HB1 ALA 6 -16.192 -0.884 -11.601 53 2HB ALA 6 HB2 ALA 6 -14.423 -1.033 -11.621 54 3HB ALA 6 HB3 ALA 6 -15.228 0.405 -12.271 55 H THR 7 HN THR 7 -15.404 1.069 -14.419 56 HA THR 7 HA THR 7 -12.680 1.421 -15.062 57 HB THR 7 HB THR 7 -13.215 0.205 -17.102 58 HG1 THR 7 HG1 THR 7 -11.786 1.743 -17.449 59 1HG2 THR 7 HG21 THR 7 -15.423 2.240 -17.558 60 2HG2 THR 7 HG22 THR 7 -14.765 1.162 -18.808 61 3HG2 THR 7 HG23 THR 7 -15.566 0.467 -17.401 62 H ASP 8 HN ASP 8 -12.793 3.746 -16.354 63 HA ASP 8 HA ASP 8 -12.934 5.604 -14.450 64 1HB ASP 8 HB2 ASP 8 -11.890 5.995 -16.555 65 2HB ASP 8 HB3 ASP 8 -13.433 5.928 -17.409 66 H GLN 9 HN GLN 9 -15.838 4.812 -16.376 67 HA GLN 9 HA GLN 9 -17.416 6.549 -14.572 68 1HB GLN 9 HB2 GLN 9 -17.567 6.320 -17.592 69 2HB GLN 9 HB3 GLN 9 -18.875 7.011 -16.620 70 1HG GLN 9 HG2 GLN 9 -17.534 8.832 -15.862 71 2HG GLN 9 HG3 GLN 9 -16.041 8.063 -16.362 72 1HE2 GLN 9 HE22 GLN 9 -15.123 8.946 -18.123 73 2HE2 GLN 9 HE21 GLN 9 -15.989 9.690 -19.464 74 H SER 10 HN SER 10 -17.309 3.590 -16.601 75 HA SER 10 HA SER 10 -19.846 2.648 -15.940 76 1HB SER 10 HB2 SER 10 -17.406 0.899 -16.285 77 2HB SER 10 HB3 SER 10 -19.094 0.517 -16.664 78 HG SER 10 HG SER 10 -17.987 1.096 -18.558 79 H PHE 11 HN PHE 11 -17.006 2.869 -13.793 80 HA PHE 11 HA PHE 11 -17.705 1.015 -11.792 81 1HB PHE 11 HB2 PHE 11 -15.726 2.304 -11.438 82 2HB PHE 11 HB3 PHE 11 -16.550 3.810 -11.743 83 HD1 PHE 11 HD1 PHE 11 -17.437 5.112 -10.033 84 HD2 PHE 11 HD2 PHE 11 -16.368 0.994 -9.153 85 HE1 PHE 11 HE1 PHE 11 -17.775 5.534 -7.620 86 HE2 PHE 11 HE2 PHE 11 -16.711 1.467 -6.754 87 HZ PHE 11 HZ PHE 11 -17.413 3.705 -5.977 88 H SER 12 HN SER 12 -19.031 4.377 -12.264 89 HA SER 12 HA SER 12 -20.812 4.168 -10.066 90 1HB SER 12 HB2 SER 12 -21.224 5.784 -12.628 91 2HB SER 12 HB3 SER 12 -21.818 6.175 -11.008 92 HG SER 12 HG SER 12 -19.948 7.399 -11.546 93 H ALA 13 HN ALA 13 -21.214 3.520 -13.581 94 HA ALA 13 HA ALA 13 -23.987 3.160 -13.447 95 1HB ALA 13 HB1 ALA 13 -23.763 2.114 -15.667 96 2HB ALA 13 HB2 ALA 13 -22.693 3.529 -15.536 97 3HB ALA 13 HB3 ALA 13 -22.022 1.882 -15.405 98 H GLU 14 HN GLU 14 -21.325 0.840 -13.014 99 HA GLU 14 HA GLU 14 -22.974 -1.462 -12.794 100 1HB GLU 14 HB2 GLU 14 -20.091 -0.942 -12.020 101 2HB GLU 14 HB3 GLU 14 -20.846 -2.525 -11.883 102 1HG GLU 14 HG2 GLU 14 -20.619 -0.953 -14.473 103 2HG GLU 14 HG3 GLU 14 -19.505 -2.222 -13.956 104 H THR 15 HN THR 15 -22.315 1.080 -10.510 105 HA THR 15 HA THR 15 -22.897 -0.683 -8.193 106 HB THR 15 HB THR 15 -21.679 1.050 -6.889 107 HG1 THR 15 HG1 THR 15 -20.722 2.048 -9.316 108 1HG2 THR 15 HG21 THR 15 -19.366 0.714 -7.900 109 2HG2 THR 15 HG22 THR 15 -20.252 -0.765 -7.488 110 3HG2 THR 15 HG23 THR 15 -20.124 -0.233 -9.180 111 H SER 16 HN SER 16 -24.490 1.490 -10.152 112 HA SER 16 HA SER 16 -25.645 3.249 -8.224 113 1HB SER 16 HB2 SER 16 -26.434 2.569 -11.069 114 2HB SER 16 HB3 SER 16 -27.192 3.839 -10.086 115 HG SER 16 HG SER 16 -24.408 3.704 -10.674 116 H GLU 17 HN GLU 17 -26.337 -0.061 -8.692 117 HA GLU 17 HA GLU 17 -28.947 0.269 -7.395 118 1HB GLU 17 HB2 GLU 17 -28.464 -1.287 -9.978 119 2HB GLU 17 HB3 GLU 17 -29.901 -1.477 -8.965 120 1HG GLU 17 HG2 GLU 17 -30.425 0.949 -9.296 121 2HG GLU 17 HG3 GLU 17 -29.055 1.070 -10.407 122 H GLY 18 HN GLY 18 -29.514 -1.436 -6.053 123 1HA GLY 18 HA2 GLY 18 -29.268 -3.240 -4.720 124 2HA GLY 18 HA3 GLY 18 -28.127 -3.952 -5.879 125 H VAL 19 HN VAL 19 -27.257 -4.557 -3.644 126 HA VAL 19 HA VAL 19 -25.378 -2.488 -2.627 127 HB VAL 19 HB VAL 19 -25.904 -5.252 -1.450 128 1HG1 VAL 19 HG11 VAL 19 -24.634 -4.329 0.466 129 2HG1 VAL 19 HG12 VAL 19 -23.645 -4.345 -0.988 130 3HG1 VAL 19 HG13 VAL 19 -24.356 -2.827 -0.418 131 1HG2 VAL 19 HG21 VAL 19 -27.896 -4.240 -0.964 132 2HG2 VAL 19 HG22 VAL 19 -26.941 -3.582 0.376 133 3HG2 VAL 19 HG23 VAL 19 -27.252 -2.605 -1.052 134 H VAL 20 HN VAL 20 -23.317 -2.476 -3.185 135 HA VAL 20 HA VAL 20 -22.319 -4.630 -4.923 136 HB VAL 20 HB VAL 20 -22.262 -1.709 -5.782 137 1HG1 VAL 20 HG11 VAL 20 -20.434 -3.084 -6.627 138 2HG1 VAL 20 HG12 VAL 20 -21.571 -4.340 -7.154 139 3HG1 VAL 20 HG13 VAL 20 -21.576 -2.748 -7.942 140 1HG2 VAL 20 HG21 VAL 20 -23.906 -2.474 -7.577 141 2HG2 VAL 20 HG22 VAL 20 -24.199 -3.914 -6.601 142 3HG2 VAL 20 HG23 VAL 20 -24.580 -2.306 -5.959 143 H LEU 21 HN LEU 21 -20.460 -5.177 -4.195 144 HA LEU 21 HA LEU 21 -18.773 -3.466 -2.481 145 1HB LEU 21 HB2 LEU 21 -19.190 -5.971 -2.158 146 2HB LEU 21 HB3 LEU 21 -18.355 -6.239 -3.685 147 HG LEU 21 HG LEU 21 -16.290 -5.209 -2.683 148 1HD1 LEU 21 HD11 LEU 21 -18.020 -5.211 -0.164 149 2HD1 LEU 21 HD12 LEU 21 -16.260 -5.075 -0.148 150 3HD1 LEU 21 HD13 LEU 21 -17.218 -3.818 -0.932 151 1HD2 LEU 21 HD21 LEU 21 -15.737 -7.179 -1.366 152 2HD2 LEU 21 HD22 LEU 21 -17.459 -7.568 -1.144 153 3HD2 LEU 21 HD23 LEU 21 -16.705 -7.655 -2.753 154 H ALA 22 HN ALA 22 -16.876 -2.382 -3.328 155 HA ALA 22 HA ALA 22 -16.115 -3.033 -6.107 156 1HB ALA 22 HB1 ALA 22 -17.473 -0.966 -6.144 157 2HB ALA 22 HB2 ALA 22 -16.307 -0.217 -5.025 158 3HB ALA 22 HB3 ALA 22 -15.803 -0.702 -6.660 159 H ASP 23 HN ASP 23 -14.116 -3.764 -6.100 160 HA ASP 23 HA ASP 23 -12.270 -3.055 -3.858 161 1HB ASP 23 HB2 ASP 23 -12.891 -5.333 -3.739 162 2HB ASP 23 HB3 ASP 23 -12.698 -5.570 -5.466 163 H PHE 24 HN PHE 24 -10.117 -2.693 -4.311 164 HA PHE 24 HA PHE 24 -9.478 -1.869 -7.111 165 1HB PHE 24 HB2 PHE 24 -9.098 -0.475 -4.456 166 2HB PHE 24 HB3 PHE 24 -8.296 0.029 -5.915 167 HD1 PHE 24 HD1 PHE 24 -11.828 -0.620 -4.637 168 HD2 PHE 24 HD2 PHE 24 -9.270 1.724 -7.180 169 HE1 PHE 24 HE1 PHE 24 -13.770 0.710 -5.349 170 HE2 PHE 24 HE2 PHE 24 -11.233 3.106 -7.852 171 HZ PHE 24 HZ PHE 24 -13.483 2.597 -6.945 172 H TRP 25 HN TRP 25 -7.890 -3.166 -7.763 173 HA TRP 25 HA TRP 25 -5.897 -4.255 -5.842 174 1HB TRP 25 HB2 TRP 25 -6.161 -6.394 -6.652 175 2HB TRP 25 HB3 TRP 25 -7.821 -5.841 -6.526 176 HD1 TRP 25 HD1 TRP 25 -8.789 -4.820 -9.005 177 HE1 TRP 25 HE1 TRP 25 -8.389 -5.570 -11.384 178 HE3 TRP 25 HE3 TRP 25 -4.703 -7.777 -8.175 179 HZ2 TRP 25 HZ2 TRP 25 -6.312 -7.105 -12.830 180 HZ3 TRP 25 HZ3 TRP 25 -3.504 -8.826 -10.067 181 HH2 TRP 25 HH2 TRP 25 -4.300 -8.488 -12.398 182 H ALA 26 HN ALA 26 -3.755 -4.623 -6.958 183 HA ALA 26 HA ALA 26 -3.526 -4.579 -9.775 184 1HB ALA 26 HB1 ALA 26 -1.976 -2.452 -9.820 185 2HB ALA 26 HB2 ALA 26 -3.716 -2.212 -9.846 186 3HB ALA 26 HB3 ALA 26 -2.824 -2.036 -8.322 187 HA PRO 27 HA PRO 27 0.043 -6.777 -8.917 188 1HB PRO 27 HB2 PRO 27 1.691 -4.958 -10.681 189 2HB PRO 27 HB3 PRO 27 1.627 -6.750 -10.661 190 1HG PRO 27 HG2 PRO 27 0.225 -5.368 -12.524 191 2HG PRO 27 HG3 PRO 27 -0.567 -6.745 -11.676 192 1HD PRO 27 HD2 PRO 27 -0.834 -3.798 -11.151 193 2HD PRO 27 HD3 PRO 27 -2.093 -5.067 -11.219 194 H TRP 28 HN TRP 28 0.444 -3.355 -8.187 195 HA TRP 28 HA TRP 28 3.007 -3.187 -7.167 196 1HB TRP 28 HB2 TRP 28 0.670 -1.868 -5.798 197 2HB TRP 28 HB3 TRP 28 2.309 -1.283 -5.958 198 HD1 TRP 28 HD1 TRP 28 -0.993 -1.444 -7.686 199 HE1 TRP 28 HE1 TRP 28 -1.146 0.294 -9.572 200 HE3 TRP 28 HE3 TRP 28 3.895 -0.004 -7.750 201 HZ2 TRP 28 HZ2 TRP 28 0.677 2.102 -10.918 202 HZ3 TRP 28 HZ3 TRP 28 4.660 1.771 -9.305 203 HH2 TRP 28 HH2 TRP 28 3.062 2.833 -10.887 204 H CYS 29 HN CYS 29 0.274 -4.830 -5.554 205 HA CYS 29 HA CYS 29 2.031 -5.133 -3.164 206 1HB CYS 29 HB2 CYS 29 -0.219 -3.479 -3.354 207 2HB CYS 29 HB3 CYS 29 -0.857 -4.910 -2.594 208 H GLY 30 HN GLY 30 1.439 -6.805 -1.666 209 1HA GLY 30 HA2 GLY 30 0.951 -9.343 -2.893 210 2HA GLY 30 HA3 GLY 30 1.091 -8.996 -1.165 211 HA PRO 31 HA PRO 31 -3.299 -9.070 -0.402 212 1HB PRO 31 HB2 PRO 31 -3.622 -6.090 -0.766 213 2HB PRO 31 HB3 PRO 31 -4.403 -7.165 0.447 214 1HG PRO 31 HG2 PRO 31 -2.198 -5.736 1.144 215 2HG PRO 31 HG3 PRO 31 -2.297 -7.468 1.603 216 1HD PRO 31 HD2 PRO 31 -0.789 -6.208 -0.680 217 2HD PRO 31 HD3 PRO 31 -0.273 -7.522 0.416 218 H SER 32 HN SER 32 -2.520 -7.066 -3.304 219 HA SER 32 HA SER 32 -4.998 -7.253 -4.590 220 1HB SER 32 HB2 SER 32 -2.279 -7.495 -5.937 221 2HB SER 32 HB3 SER 32 -3.722 -6.664 -6.536 222 HG SER 32 HG SER 32 -2.076 -5.292 -5.706 223 H LYS 33 HN LYS 33 -2.726 -9.799 -3.954 224 HA LYS 33 HA LYS 33 -4.230 -11.574 -5.817 225 1HB LYS 33 HB2 LYS 33 -1.515 -12.237 -4.695 226 2HB LYS 33 HB3 LYS 33 -2.454 -13.037 -5.957 227 1HG LYS 33 HG2 LYS 33 -0.923 -11.954 -7.251 228 2HG LYS 33 HG3 LYS 33 -2.229 -10.764 -7.264 229 1HD LYS 33 HD2 LYS 33 -1.062 -9.511 -5.451 230 2HD LYS 33 HD3 LYS 33 0.199 -10.749 -5.408 231 1HE LYS 33 HE2 LYS 33 0.726 -10.218 -7.822 232 2HE LYS 33 HE3 LYS 33 -0.459 -8.906 -7.748 233 1HZ LYS 33 HZ1 LYS 33 2.032 -9.121 -6.158 234 2HZ LYS 33 HZ2 LYS 33 1.714 -7.996 -7.301 235 3HZ LYS 33 HZ3 LYS 33 0.884 -7.979 -5.893 236 H MET 34 HN MET 34 -4.649 -10.657 -2.813 237 HA MET 34 HA MET 34 -5.252 -13.409 -1.802 238 1HB MET 34 HB2 MET 34 -4.423 -11.022 -0.114 239 2HB MET 34 HB3 MET 34 -4.894 -12.626 0.463 240 1HG MET 34 HG2 MET 34 -2.977 -13.590 -0.864 241 2HG MET 34 HG3 MET 34 -2.430 -11.944 -1.180 242 1HE MET 34 HE1 MET 34 -1.368 -10.693 2.397 243 2HE MET 34 HE2 MET 34 -1.471 -10.302 0.667 244 3HE MET 34 HE3 MET 34 -2.956 -10.438 1.646 245 H ILE 35 HN ILE 35 -6.163 -9.891 -1.652 246 HA ILE 35 HA ILE 35 -8.809 -10.364 -0.770 247 HB ILE 35 HB ILE 35 -7.334 -8.162 -1.007 248 1HG1 ILE 35 HG12 ILE 35 -9.646 -6.851 -1.029 249 2HG1 ILE 35 HG13 ILE 35 -10.346 -8.471 -0.983 250 1HG2 ILE 35 HG21 ILE 35 -7.222 -8.101 -3.444 251 2HG2 ILE 35 HG22 ILE 35 -8.996 -7.936 -3.532 252 3HG2 ILE 35 HG23 ILE 35 -8.016 -6.676 -2.768 253 1HD1 ILE 35 HD11 ILE 35 -9.961 -7.474 1.287 254 2HD1 ILE 35 HD12 ILE 35 -9.051 -8.984 1.065 255 3HD1 ILE 35 HD13 ILE 35 -8.220 -7.412 0.943 256 H ALA 36 HN ALA 36 -7.259 -10.461 -3.966 257 HA ALA 36 HA ALA 36 -9.531 -10.550 -5.572 258 1HB ALA 36 HB1 ALA 36 -7.428 -10.185 -6.598 259 2HB ALA 36 HB2 ALA 36 -6.722 -11.678 -5.990 260 3HB ALA 36 HB3 ALA 36 -7.995 -11.746 -7.225 261 HA PRO 37 HA PRO 37 -9.772 -15.347 -5.236 262 1HB PRO 37 HB2 PRO 37 -8.458 -16.362 -2.900 263 2HB PRO 37 HB3 PRO 37 -8.024 -16.654 -4.620 264 1HG PRO 37 HG2 PRO 37 -6.846 -14.780 -2.636 265 2HG PRO 37 HG3 PRO 37 -6.072 -15.516 -4.066 266 1HD PRO 37 HD2 PRO 37 -6.859 -12.870 -3.978 267 2HD PRO 37 HD3 PRO 37 -6.819 -13.832 -5.474 268 H VAL 38 HN VAL 38 -9.328 -13.498 -2.149 269 HA VAL 38 HA VAL 38 -11.388 -14.768 -0.718 270 HB VAL 38 HB VAL 38 -9.983 -12.122 -0.604 271 1HG1 VAL 38 HG11 VAL 38 -11.194 -11.531 1.504 272 2HG1 VAL 38 HG12 VAL 38 -12.115 -11.311 0.012 273 3HG1 VAL 38 HG13 VAL 38 -12.444 -12.720 1.035 274 1HG2 VAL 38 HG21 VAL 38 -10.332 -14.368 1.416 275 2HG2 VAL 38 HG22 VAL 38 -8.993 -14.246 0.256 276 3HG2 VAL 38 HG23 VAL 38 -9.191 -13.004 1.513 277 H LEU 39 HN LEU 39 -11.585 -12.097 -3.116 278 HA LEU 39 HA LEU 39 -14.402 -11.727 -2.617 279 1HB LEU 39 HB2 LEU 39 -12.383 -10.610 -4.493 280 2HB LEU 39 HB3 LEU 39 -14.009 -10.752 -5.171 281 HG LEU 39 HG LEU 39 -14.987 -9.410 -3.488 282 1HD1 LEU 39 HD11 LEU 39 -12.385 -9.534 -1.946 283 2HD1 LEU 39 HD12 LEU 39 -13.661 -8.345 -1.621 284 3HD1 LEU 39 HD13 LEU 39 -14.009 -10.064 -1.421 285 1HD2 LEU 39 HD21 LEU 39 -12.353 -8.057 -4.137 286 2HD2 LEU 39 HD22 LEU 39 -13.678 -8.256 -5.303 287 3HD2 LEU 39 HD23 LEU 39 -13.945 -7.304 -3.839 288 H GLU 40 HN GLU 40 -12.621 -13.713 -5.051 289 HA GLU 40 HA GLU 40 -15.037 -14.491 -6.355 290 1HB GLU 40 HB2 GLU 40 -12.390 -15.964 -6.192 291 2HB GLU 40 HB3 GLU 40 -13.750 -16.306 -7.298 292 1HG GLU 40 HG2 GLU 40 -13.520 -14.073 -8.305 293 2HG GLU 40 HG3 GLU 40 -12.152 -13.719 -7.255 294 H GLU 41 HN GLU 41 -13.312 -15.707 -3.458 295 HA GLU 41 HA GLU 41 -15.027 -17.949 -3.022 296 1HB GLU 41 HB2 GLU 41 -13.024 -16.501 -1.286 297 2HB GLU 41 HB3 GLU 41 -13.934 -17.902 -0.733 298 1HG GLU 41 HG2 GLU 41 -12.113 -17.893 -3.177 299 2HG GLU 41 HG3 GLU 41 -11.645 -18.456 -1.576 300 H LEU 42 HN LEU 42 -15.278 -14.548 -2.363 301 HA LEU 42 HA LEU 42 -17.437 -14.845 -0.404 302 1HB LEU 42 HB2 LEU 42 -15.809 -12.896 -0.368 303 2HB LEU 42 HB3 LEU 42 -16.365 -12.425 -1.959 304 HG LEU 42 HG LEU 42 -18.663 -12.039 -1.039 305 1HD1 LEU 42 HD11 LEU 42 -18.504 -13.465 1.037 306 2HD1 LEU 42 HD12 LEU 42 -17.236 -12.379 1.644 307 3HD1 LEU 42 HD13 LEU 42 -18.906 -11.793 1.419 308 1HD2 LEU 42 HD21 LEU 42 -18.016 -9.938 0.124 309 2HD2 LEU 42 HD22 LEU 42 -16.343 -10.541 0.230 310 3HD2 LEU 42 HD23 LEU 42 -17.070 -10.200 -1.348 311 H ASP 43 HN ASP 43 -17.143 -14.037 -3.939 312 HA ASP 43 HA ASP 43 -19.925 -13.445 -4.050 313 1HB ASP 43 HB2 ASP 43 -18.455 -12.553 -5.783 314 2HB ASP 43 HB3 ASP 43 -17.893 -14.170 -6.205 315 H GLN 44 HN GLN 44 -18.126 -16.478 -4.563 316 HA GLN 44 HA GLN 44 -20.400 -17.907 -5.528 317 1HB GLN 44 HB2 GLN 44 -19.112 -19.887 -5.228 318 2HB GLN 44 HB3 GLN 44 -18.045 -18.590 -5.787 319 1HG GLN 44 HG2 GLN 44 -17.364 -18.236 -3.373 320 2HG GLN 44 HG3 GLN 44 -18.278 -19.684 -2.948 321 1HE2 GLN 44 HE22 GLN 44 -15.665 -18.505 -5.126 322 2HE2 GLN 44 HE21 GLN 44 -14.636 -19.903 -4.840 323 H GLU 45 HN GLU 45 -19.992 -16.514 -2.460 324 HA GLU 45 HA GLU 45 -21.682 -18.449 -1.097 325 1HB GLU 45 HB2 GLU 45 -19.752 -18.346 0.133 326 2HB GLU 45 HB3 GLU 45 -19.363 -16.738 -0.410 327 1HG GLU 45 HG2 GLU 45 -19.695 -16.391 1.779 328 2HG GLU 45 HG3 GLU 45 -21.203 -15.860 1.084 329 H MET 46 HN MET 46 -21.151 -14.995 -1.676 330 HA MET 46 HA MET 46 -23.809 -14.240 -0.559 331 1HB MET 46 HB2 MET 46 -21.655 -12.440 -1.818 332 2HB MET 46 HB3 MET 46 -22.905 -11.948 -0.690 333 1HG MET 46 HG2 MET 46 -20.570 -13.779 -0.179 334 2HG MET 46 HG3 MET 46 -20.587 -12.051 0.138 335 1HE MET 46 HE1 MET 46 -23.065 -11.528 2.978 336 2HE MET 46 HE2 MET 46 -21.995 -10.862 1.712 337 3HE MET 46 HE3 MET 46 -23.550 -11.672 1.261 338 H GLY 47 HN GLY 47 -22.359 -14.716 -3.578 339 1HA GLY 47 HA2 GLY 47 -23.360 -12.570 -5.007 340 2HA GLY 47 HA3 GLY 47 -23.016 -14.177 -5.734 341 H ASP 48 HN ASP 48 -25.204 -14.809 -3.556 342 HA ASP 48 HA ASP 48 -27.535 -14.916 -5.217 343 1HB ASP 48 HB2 ASP 48 -27.008 -16.659 -3.557 344 2HB ASP 48 HB3 ASP 48 -26.846 -15.441 -2.296 345 H LYS 49 HN LYS 49 -26.198 -12.672 -2.879 346 HA LYS 49 HA LYS 49 -28.684 -11.130 -2.873 347 1HB LYS 49 HB2 LYS 49 -26.512 -11.075 -0.773 348 2HB LYS 49 HB3 LYS 49 -28.213 -10.629 -0.620 349 1HG LYS 49 HG2 LYS 49 -28.457 -12.563 0.432 350 2HG LYS 49 HG3 LYS 49 -28.405 -13.329 -1.159 351 1HD LYS 49 HD2 LYS 49 -26.086 -13.942 -0.897 352 2HD LYS 49 HD3 LYS 49 -25.878 -12.805 0.444 353 1HE LYS 49 HE2 LYS 49 -26.011 -14.792 1.587 354 2HE LYS 49 HE3 LYS 49 -27.642 -14.125 1.711 355 1HZ LYS 49 HZ1 LYS 49 -27.821 -16.414 1.191 356 2HZ LYS 49 HZ2 LYS 49 -28.244 -15.643 -0.191 357 3HZ LYS 49 HZ3 LYS 49 -26.759 -16.341 -0.036 358 H LEU 50 HN LEU 50 -25.270 -11.153 -3.537 359 HA LEU 50 HA LEU 50 -25.019 -8.210 -3.417 360 1HB LEU 50 HB2 LEU 50 -24.167 -9.618 -1.538 361 2HB LEU 50 HB3 LEU 50 -23.134 -10.477 -2.650 362 HG LEU 50 HG LEU 50 -22.222 -8.757 -1.020 363 1HD1 LEU 50 HD11 LEU 50 -20.369 -8.154 -2.513 364 2HD1 LEU 50 HD12 LEU 50 -20.805 -9.869 -2.534 365 3HD1 LEU 50 HD13 LEU 50 -21.297 -8.827 -3.873 366 1HD2 LEU 50 HD21 LEU 50 -23.737 -6.869 -1.641 367 2HD2 LEU 50 HD22 LEU 50 -22.023 -6.445 -1.741 368 3HD2 LEU 50 HD23 LEU 50 -22.905 -6.763 -3.208 369 H LYS 51 HN LYS 51 -23.432 -7.259 -4.790 370 HA LYS 51 HA LYS 51 -22.482 -8.879 -7.118 371 1HB LYS 51 HB2 LYS 51 -24.359 -7.294 -7.654 372 2HB LYS 51 HB3 LYS 51 -23.375 -5.972 -7.014 373 1HG LYS 51 HG2 LYS 51 -21.676 -6.382 -8.801 374 2HG LYS 51 HG3 LYS 51 -22.704 -7.685 -9.448 375 1HD LYS 51 HD2 LYS 51 -24.541 -6.041 -9.777 376 2HD LYS 51 HD3 LYS 51 -23.515 -4.761 -9.096 377 1HE LYS 51 HE2 LYS 51 -21.854 -5.163 -10.940 378 2HE LYS 51 HE3 LYS 51 -22.964 -6.341 -11.649 379 1HZ LYS 51 HZ1 LYS 51 -23.584 -3.485 -11.166 380 2HZ LYS 51 HZ2 LYS 51 -23.196 -4.133 -12.625 381 3HZ LYS 51 HZ3 LYS 51 -24.600 -4.569 -11.890 382 H ILE 52 HN ILE 52 -20.287 -8.313 -7.831 383 HA ILE 52 HA ILE 52 -18.781 -6.584 -5.965 384 HB ILE 52 HB ILE 52 -17.964 -9.331 -7.028 385 1HG1 ILE 52 HG12 ILE 52 -18.897 -8.389 -4.305 386 2HG1 ILE 52 HG13 ILE 52 -19.578 -9.675 -5.310 387 1HG2 ILE 52 HG21 ILE 52 -16.069 -7.791 -6.888 388 2HG2 ILE 52 HG22 ILE 52 -16.514 -7.347 -5.223 389 3HG2 ILE 52 HG23 ILE 52 -15.957 -8.994 -5.614 390 1HD1 ILE 52 HD11 ILE 52 -17.358 -10.927 -4.881 391 2HD1 ILE 52 HD12 ILE 52 -17.124 -9.741 -3.589 392 3HD1 ILE 52 HD13 ILE 52 -18.545 -10.781 -3.551 393 H VAL 53 HN VAL 53 -17.245 -5.338 -7.026 394 HA VAL 53 HA VAL 53 -16.863 -5.745 -9.933 395 HB VAL 53 HB VAL 53 -17.245 -2.990 -8.696 396 1HG1 VAL 53 HG11 VAL 53 -17.404 -3.996 -11.556 397 2HG1 VAL 53 HG12 VAL 53 -17.707 -2.334 -11.006 398 3HG1 VAL 53 HG13 VAL 53 -16.094 -3.045 -10.812 399 1HG2 VAL 53 HG21 VAL 53 -19.524 -2.865 -9.554 400 2HG2 VAL 53 HG22 VAL 53 -19.465 -4.561 -10.081 401 3HG2 VAL 53 HG23 VAL 53 -19.406 -4.155 -8.364 402 H LYS 54 HN LYS 54 -14.693 -5.261 -10.559 403 HA LYS 54 HA LYS 54 -12.923 -4.256 -8.378 404 1HB LYS 54 HB2 LYS 54 -12.377 -6.393 -10.454 405 2HB LYS 54 HB3 LYS 54 -11.090 -5.557 -9.572 406 1HG LYS 54 HG2 LYS 54 -12.110 -6.249 -7.412 407 2HG LYS 54 HG3 LYS 54 -13.357 -7.135 -8.287 408 1HD LYS 54 HD2 LYS 54 -11.791 -8.777 -7.651 409 2HD LYS 54 HD3 LYS 54 -11.464 -8.469 -9.364 410 1HE LYS 54 HE2 LYS 54 -9.705 -6.701 -8.273 411 2HE LYS 54 HE3 LYS 54 -9.838 -7.753 -6.897 412 1HZ LYS 54 HZ1 LYS 54 -9.233 -9.630 -8.414 413 2HZ LYS 54 HZ2 LYS 54 -9.017 -8.568 -9.636 414 3HZ LYS 54 HZ3 LYS 54 -8.056 -8.489 -8.325 415 H ILE 55 HN ILE 55 -11.177 -2.922 -8.940 416 HA ILE 55 HA ILE 55 -11.190 -1.647 -11.616 417 HB ILE 55 HB ILE 55 -10.968 -0.470 -8.794 418 1HG1 ILE 55 HG12 ILE 55 -13.153 -0.307 -9.973 419 2HG1 ILE 55 HG13 ILE 55 -12.443 1.203 -9.442 420 1HG2 ILE 55 HG21 ILE 55 -9.698 0.678 -11.297 421 2HG2 ILE 55 HG22 ILE 55 -10.014 1.606 -9.805 422 3HG2 ILE 55 HG23 ILE 55 -8.932 0.209 -9.785 423 1HD1 ILE 55 HD11 ILE 55 -11.665 1.724 -11.724 424 2HD1 ILE 55 HD12 ILE 55 -12.385 0.211 -12.317 425 3HD1 ILE 55 HD13 ILE 55 -13.403 1.507 -11.636 426 H ASP 56 HN ASP 56 -9.194 -1.959 -12.561 427 HA ASP 56 HA ASP 56 -6.977 -3.183 -11.015 428 1HB ASP 56 HB2 ASP 56 -7.442 -4.095 -13.237 429 2HB ASP 56 HB3 ASP 56 -7.243 -2.503 -13.967 430 H VAL 57 HN VAL 57 -5.993 -1.605 -9.764 431 HA VAL 57 HA VAL 57 -5.968 1.112 -10.668 432 HB VAL 57 HB VAL 57 -5.000 1.735 -8.614 433 1HG1 VAL 57 HG11 VAL 57 -6.916 1.288 -7.222 434 2HG1 VAL 57 HG12 VAL 57 -7.411 1.557 -8.898 435 3HG1 VAL 57 HG13 VAL 57 -7.369 -0.105 -8.231 436 1HG2 VAL 57 HG21 VAL 57 -5.064 -1.195 -7.835 437 2HG2 VAL 57 HG22 VAL 57 -3.653 -0.106 -7.899 438 3HG2 VAL 57 HG23 VAL 57 -4.918 0.136 -6.685 439 H ASP 58 HN ASP 58 -4.657 -0.137 -12.543 440 HA ASP 58 HA ASP 58 -2.320 1.620 -12.593 441 1HB ASP 58 HB2 ASP 58 -1.209 -0.440 -11.834 442 2HB ASP 58 HB3 ASP 58 -2.047 -1.390 -13.065 443 H GLU 59 HN GLU 59 -4.332 -0.907 -14.343 444 HA GLU 59 HA GLU 59 -3.871 0.306 -16.926 445 1HB GLU 59 HB2 GLU 59 -4.069 -2.073 -16.815 446 2HB GLU 59 HB3 GLU 59 -5.363 -1.989 -15.614 447 1HG GLU 59 HG2 GLU 59 -6.848 -1.025 -17.254 448 2HG GLU 59 HG3 GLU 59 -5.658 -1.370 -18.529 449 H ASN 60 HN ASN 60 -6.340 0.170 -14.391 450 HA ASN 60 HA ASN 60 -8.124 2.057 -15.842 451 1HB ASN 60 HB2 ASN 60 -8.541 -0.761 -14.927 452 2HB ASN 60 HB3 ASN 60 -9.813 0.327 -14.418 453 1HD2 ASN 60 HD21 ASN 60 -8.895 -1.692 -17.005 454 2HD2 ASN 60 HD22 ASN 60 -9.943 -0.950 -18.189 455 H GLN 61 HN GLN 61 -6.163 2.651 -13.882 456 HA GLN 61 HA GLN 61 -7.391 2.766 -11.331 457 1HB GLN 61 HB2 GLN 61 -5.389 3.737 -10.539 458 2HB GLN 61 HB3 GLN 61 -4.932 2.638 -11.839 459 1HG GLN 61 HG2 GLN 61 -4.763 4.591 -13.396 460 2HG GLN 61 HG3 GLN 61 -4.974 5.641 -11.994 461 1HE2 GLN 61 HE22 GLN 61 -3.414 4.760 -9.968 462 2HE2 GLN 61 HE21 GLN 61 -1.759 4.565 -10.458 463 H GLU 62 HN GLU 62 -8.092 4.575 -13.988 464 HA GLU 62 HA GLU 62 -8.035 7.283 -13.310 465 1HB GLU 62 HB2 GLU 62 -9.704 5.509 -15.100 466 2HB GLU 62 HB3 GLU 62 -10.069 7.248 -14.984 467 1HG GLU 62 HG2 GLU 62 -7.718 7.764 -15.629 468 2HG GLU 62 HG3 GLU 62 -7.382 6.039 -15.781 469 H THR 63 HN THR 63 -10.741 4.905 -12.749 470 HA THR 63 HA THR 63 -12.507 6.620 -11.419 471 HB THR 63 HB THR 63 -11.836 3.710 -10.840 472 HG1 THR 63 HG1 THR 63 -13.679 3.473 -12.349 473 1HG2 THR 63 HG21 THR 63 -13.307 4.651 -9.066 474 2HG2 THR 63 HG22 THR 63 -14.460 5.165 -10.321 475 3HG2 THR 63 HG23 THR 63 -14.110 3.438 -10.036 476 H ALA 64 HN ALA 64 -9.673 4.858 -10.211 477 HA ALA 64 HA ALA 64 -10.301 5.170 -7.449 478 1HB ALA 64 HB1 ALA 64 -8.171 4.107 -7.101 479 2HB ALA 64 HB2 ALA 64 -8.890 3.375 -8.546 480 3HB ALA 64 HB3 ALA 64 -7.593 4.545 -8.722 481 H GLY 65 HN GLY 65 -7.534 6.510 -9.292 482 1HA GLY 65 HA2 GLY 65 -6.723 8.596 -7.720 483 2HA GLY 65 HA3 GLY 65 -6.738 8.664 -9.498 484 H LYS 66 HN LYS 66 -9.467 8.826 -10.104 485 HA LYS 66 HA LYS 66 -10.043 11.553 -9.584 486 1HB LYS 66 HB2 LYS 66 -10.819 10.346 -11.556 487 2HB LYS 66 HB3 LYS 66 -11.807 9.274 -10.545 488 1HG LYS 66 HG2 LYS 66 -13.271 11.132 -9.915 489 2HG LYS 66 HG3 LYS 66 -12.200 12.291 -10.722 490 1HD LYS 66 HD2 LYS 66 -14.147 11.845 -12.099 491 2HD LYS 66 HD3 LYS 66 -12.679 11.247 -12.896 492 1HE LYS 66 HE2 LYS 66 -13.265 8.934 -11.931 493 2HE LYS 66 HE3 LYS 66 -14.822 9.625 -11.450 494 1HZ LYS 66 HZ1 LYS 66 -14.989 8.530 -13.558 495 2HZ LYS 66 HZ2 LYS 66 -15.145 10.148 -13.856 496 3HZ LYS 66 HZ3 LYS 66 -13.742 9.317 -14.193 497 H TYR 67 HN TYR 67 -11.307 8.543 -8.007 498 HA TYR 67 HA TYR 67 -13.240 9.950 -6.474 499 1HB TYR 67 HB2 TYR 67 -13.135 7.442 -7.112 500 2HB TYR 67 HB3 TYR 67 -12.045 7.241 -5.759 501 HD1 TYR 67 HD1 TYR 67 -15.471 8.065 -6.876 502 HD2 TYR 67 HD2 TYR 67 -12.970 7.306 -3.440 503 HE1 TYR 67 HE1 TYR 67 -17.490 7.767 -5.483 504 HE2 TYR 67 HE2 TYR 67 -14.986 6.996 -2.038 505 HH TYR 67 HH TYR 67 -18.315 7.314 -3.364 506 H GLY 68 HN GLY 68 -9.811 9.525 -6.174 507 1HA GLY 68 HA2 GLY 68 -8.333 10.501 -4.640 508 2HA GLY 68 HA3 GLY 68 -9.675 10.844 -3.522 509 H VAL 69 HN VAL 69 -7.901 8.133 -5.106 510 HA VAL 69 HA VAL 69 -7.984 6.427 -2.757 511 HB VAL 69 HB VAL 69 -9.217 5.628 -5.451 512 1HG1 VAL 69 HG11 VAL 69 -9.259 3.317 -4.652 513 2HG1 VAL 69 HG12 VAL 69 -7.613 3.912 -4.884 514 3HG1 VAL 69 HG13 VAL 69 -8.266 3.805 -3.246 515 1HG2 VAL 69 HG21 VAL 69 -10.358 5.326 -2.667 516 2HG2 VAL 69 HG22 VAL 69 -10.838 6.543 -3.866 517 3HG2 VAL 69 HG23 VAL 69 -11.112 4.831 -4.208 518 H MET 70 HN MET 70 -5.910 5.684 -2.735 519 HA MET 70 HA MET 70 -4.311 5.706 -5.224 520 1HB MET 70 HB2 MET 70 -3.455 7.135 -2.725 521 2HB MET 70 HB3 MET 70 -2.609 7.114 -4.273 522 1HG MET 70 HG2 MET 70 -4.577 8.407 -5.240 523 2HG MET 70 HG3 MET 70 -5.206 8.547 -3.599 524 1HE MET 70 HE1 MET 70 -2.130 8.778 -2.194 525 2HE MET 70 HE2 MET 70 -2.310 10.497 -1.780 526 3HE MET 70 HE3 MET 70 -3.694 9.403 -1.603 527 H SER 71 HN SER 71 -5.425 3.723 -3.048 528 HA SER 71 HA SER 71 -2.870 2.647 -2.080 529 1HB SER 71 HB2 SER 71 -4.498 2.126 -0.064 530 2HB SER 71 HB3 SER 71 -3.773 3.732 -0.254 531 HG SER 71 HG SER 71 -6.436 2.950 -0.905 532 H ILE 72 HN ILE 72 -2.915 0.363 -1.382 533 HA ILE 72 HA ILE 72 -5.025 -1.175 -2.747 534 HB ILE 72 HB ILE 72 -2.428 -2.544 -2.481 535 1HG1 ILE 72 HG12 ILE 72 -1.542 -0.360 -3.109 536 2HG1 ILE 72 HG13 ILE 72 -1.221 -1.634 -4.255 537 1HG2 ILE 72 HG21 ILE 72 -4.154 -3.706 -3.602 538 2HG2 ILE 72 HG22 ILE 72 -4.507 -2.320 -4.676 539 3HG2 ILE 72 HG23 ILE 72 -2.991 -3.224 -4.835 540 1HD1 ILE 72 HD11 ILE 72 -1.858 0.670 -5.125 541 2HD1 ILE 72 HD12 ILE 72 -2.623 -0.745 -5.886 542 3HD1 ILE 72 HD13 ILE 72 -3.533 0.269 -4.747 543 HA PRO 73 HA PRO 73 -6.177 -2.856 -2.521 544 1HB PRO 73 HB2 PRO 73 -7.903 -4.521 -1.319 545 2HB PRO 73 HB3 PRO 73 -6.286 -5.092 -1.841 546 1HG PRO 73 HG2 PRO 73 -7.205 -4.335 0.929 547 2HG PRO 73 HG3 PRO 73 -6.178 -5.705 0.439 548 1HD PRO 73 HD2 PRO 73 -5.243 -3.221 1.400 549 2HD PRO 73 HD3 PRO 73 -4.263 -4.354 0.444 550 H THR 74 HN THR 74 -7.796 -1.277 -2.815 551 HA THR 74 HA THR 74 -8.964 -0.067 -0.323 552 HB THR 74 HB THR 74 -8.916 1.067 -3.132 553 HG1 THR 74 HG1 THR 74 -7.009 1.374 -2.227 554 1HG2 THR 74 HG21 THR 74 -10.971 1.814 -2.293 555 2HG2 THR 74 HG22 THR 74 -10.386 1.919 -0.626 556 3HG2 THR 74 HG23 THR 74 -9.852 3.101 -1.825 557 H LEU 75 HN LEU 75 -11.086 -0.325 0.117 558 HA LEU 75 HA LEU 75 -12.802 -1.950 -1.720 559 1HB LEU 75 HB2 LEU 75 -11.494 -3.235 0.124 560 2HB LEU 75 HB3 LEU 75 -12.433 -2.306 1.283 561 HG LEU 75 HG LEU 75 -14.538 -3.242 0.100 562 1HD1 LEU 75 HD11 LEU 75 -14.128 -5.434 -1.096 563 2HD1 LEU 75 HD12 LEU 75 -13.517 -4.034 -1.979 564 3HD1 LEU 75 HD13 LEU 75 -12.390 -5.092 -1.089 565 1HD2 LEU 75 HD21 LEU 75 -14.443 -5.304 1.388 566 2HD2 LEU 75 HD22 LEU 75 -12.667 -5.257 1.422 567 3HD2 LEU 75 HD23 LEU 75 -13.632 -4.030 2.293 568 H LEU 76 HN LEU 76 -14.057 -0.352 -2.343 569 HA LEU 76 HA LEU 76 -15.338 1.418 -0.380 570 1HB LEU 76 HB2 LEU 76 -15.921 1.200 -3.343 571 2HB LEU 76 HB3 LEU 76 -16.407 2.471 -2.218 572 HG LEU 76 HG LEU 76 -13.636 2.034 -3.430 573 1HD1 LEU 76 HD11 LEU 76 -14.050 4.223 -4.424 574 2HD1 LEU 76 HD12 LEU 76 -15.279 3.049 -4.907 575 3HD1 LEU 76 HD13 LEU 76 -15.664 4.279 -3.682 576 1HD2 LEU 76 HD21 LEU 76 -14.488 4.175 -1.452 577 2HD2 LEU 76 HD22 LEU 76 -13.432 2.791 -1.052 578 3HD2 LEU 76 HD23 LEU 76 -12.900 4.007 -2.224 579 H VAL 77 HN VAL 77 -17.300 0.754 0.434 580 HA VAL 77 HA VAL 77 -18.719 -1.525 -0.896 581 HB VAL 77 HB VAL 77 -19.167 -0.774 2.002 582 1HG1 VAL 77 HG11 VAL 77 -20.815 -2.192 0.907 583 2HG1 VAL 77 HG12 VAL 77 -19.537 -3.344 0.448 584 3HG1 VAL 77 HG13 VAL 77 -19.934 -3.068 2.162 585 1HG2 VAL 77 HG21 VAL 77 -17.016 -2.687 1.023 586 2HG2 VAL 77 HG22 VAL 77 -16.773 -1.212 1.975 587 3HG2 VAL 77 HG23 VAL 77 -17.625 -2.581 2.687 588 H LEU 78 HN LEU 78 -20.588 -0.931 -1.903 589 HA LEU 78 HA LEU 78 -21.774 1.722 -1.228 590 1HB LEU 78 HB2 LEU 78 -21.374 0.541 -4.010 591 2HB LEU 78 HB3 LEU 78 -22.112 2.073 -3.607 592 HG LEU 78 HG LEU 78 -19.622 2.364 -2.417 593 1HD1 LEU 78 HD11 LEU 78 -19.227 0.824 -5.027 594 2HD1 LEU 78 HD12 LEU 78 -17.967 1.692 -4.137 595 3HD1 LEU 78 HD13 LEU 78 -18.750 0.278 -3.409 596 1HD2 LEU 78 HD21 LEU 78 -19.084 3.875 -4.220 597 2HD2 LEU 78 HD22 LEU 78 -20.312 3.127 -5.278 598 3HD2 LEU 78 HD23 LEU 78 -20.795 4.027 -3.822 599 H LYS 79 HN LYS 79 -24.009 1.952 -1.891 600 HA LYS 79 HA LYS 79 -25.369 -0.351 -2.918 601 1HB LYS 79 HB2 LYS 79 -27.151 -0.376 -1.194 602 2HB LYS 79 HB3 LYS 79 -25.592 -0.986 -0.628 603 1HG LYS 79 HG2 LYS 79 -25.181 1.232 0.467 604 2HG LYS 79 HG3 LYS 79 -26.835 1.705 0.061 605 1HD LYS 79 HD2 LYS 79 -26.058 -0.751 1.713 606 2HD LYS 79 HD3 LYS 79 -26.561 0.800 2.400 607 1HE LYS 79 HE2 LYS 79 -28.744 0.634 1.308 608 2HE LYS 79 HE3 LYS 79 -28.281 -0.903 0.560 609 1HZ LYS 79 HZ1 LYS 79 -29.574 -1.304 2.533 610 2HZ LYS 79 HZ2 LYS 79 -28.048 -1.837 2.806 611 3HZ LYS 79 HZ3 LYS 79 -28.569 -0.428 3.469 612 H ASP 80 HN ASP 80 -27.168 0.238 -4.006 613 HA ASP 80 HA ASP 80 -28.363 1.539 -5.337 614 1HB ASP 80 HB2 ASP 80 -29.655 1.442 -3.222 615 2HB ASP 80 HB3 ASP 80 -28.983 3.000 -2.748 616 H GLY 81 HN GLY 81 -25.594 2.409 -5.208 617 1HA GLY 81 HA2 GLY 81 -24.510 3.884 -6.548 618 2HA GLY 81 HA3 GLY 81 -25.914 4.968 -6.577 619 H GLU 82 HN GLU 82 -24.935 4.143 -3.372 620 HA GLU 82 HA GLU 82 -23.015 6.361 -3.228 621 1HB GLU 82 HB2 GLU 82 -24.094 7.299 -1.391 622 2HB GLU 82 HB3 GLU 82 -25.379 6.912 -2.565 623 1HG GLU 82 HG2 GLU 82 -25.973 4.914 -1.258 624 2HG GLU 82 HG3 GLU 82 -24.708 5.295 -0.081 625 H VAL 83 HN VAL 83 -21.473 6.230 -1.526 626 HA VAL 83 HA VAL 83 -20.725 3.489 -0.767 627 HB VAL 83 HB VAL 83 -19.133 5.221 -1.643 628 1HG1 VAL 83 HG11 VAL 83 -18.206 6.904 -0.153 629 2HG1 VAL 83 HG12 VAL 83 -19.931 7.211 -0.391 630 3HG1 VAL 83 HG13 VAL 83 -19.357 6.475 1.123 631 1HG2 VAL 83 HG21 VAL 83 -17.302 4.600 -0.162 632 2HG2 VAL 83 HG22 VAL 83 -18.451 4.041 1.066 633 3HG2 VAL 83 HG23 VAL 83 -18.347 3.220 -0.515 634 H VAL 84 HN VAL 84 -20.795 2.642 1.172 635 HA VAL 84 HA VAL 84 -22.059 4.158 3.397 636 HB VAL 84 HB VAL 84 -23.247 2.030 3.961 637 1HG1 VAL 84 HG11 VAL 84 -25.105 2.489 2.493 638 2HG1 VAL 84 HG12 VAL 84 -24.306 4.013 2.862 639 3HG1 VAL 84 HG13 VAL 84 -24.044 3.243 1.284 640 1HG2 VAL 84 HG21 VAL 84 -22.606 1.184 1.096 641 2HG2 VAL 84 HG22 VAL 84 -21.932 0.430 2.559 642 3HG2 VAL 84 HG23 VAL 84 -23.670 0.356 2.235 643 H GLU 85 HN GLU 85 -19.523 1.988 2.317 644 HA GLU 85 HA GLU 85 -18.248 2.501 4.835 645 1HB GLU 85 HB2 GLU 85 -19.161 -0.221 4.119 646 2HB GLU 85 HB3 GLU 85 -17.411 -0.160 4.341 647 1HG GLU 85 HG2 GLU 85 -19.436 0.912 6.301 648 2HG GLU 85 HG3 GLU 85 -18.739 -0.720 6.358 649 H THR 86 HN THR 86 -15.967 2.273 4.710 650 HA THR 86 HA THR 86 -14.787 2.040 2.017 651 HB THR 86 HB THR 86 -14.100 4.513 3.616 652 HG1 THR 86 HG1 THR 86 -16.311 4.749 3.432 653 1HG2 THR 86 HG21 THR 86 -12.821 3.766 1.613 654 2HG2 THR 86 HG22 THR 86 -14.348 3.832 0.687 655 3HG2 THR 86 HG23 THR 86 -13.623 5.331 1.332 656 H SER 87 HN SER 87 -13.152 0.634 2.408 657 HA SER 87 HA SER 87 -11.586 0.876 4.933 658 1HB SER 87 HB2 SER 87 -12.652 -1.694 3.689 659 2HB SER 87 HB3 SER 87 -11.651 -1.562 5.148 660 HG SER 87 HG SER 87 -13.374 -0.408 6.128 661 H VAL 88 HN VAL 88 -9.418 0.260 4.714 662 HA VAL 88 HA VAL 88 -8.423 -0.285 1.980 663 HB VAL 88 HB VAL 88 -7.527 2.057 3.715 664 1HG1 VAL 88 HG11 VAL 88 -5.692 1.013 2.399 665 2HG1 VAL 88 HG12 VAL 88 -6.677 1.137 0.924 666 3HG1 VAL 88 HG13 VAL 88 -6.129 2.610 1.758 667 1HG2 VAL 88 HG21 VAL 88 -8.318 3.496 1.862 668 2HG2 VAL 88 HG22 VAL 88 -9.035 2.073 1.086 669 3HG2 VAL 88 HG23 VAL 88 -9.647 2.650 2.654 670 H GLY 89 HN GLY 89 -7.738 -2.302 2.526 671 1HA GLY 89 HA2 GLY 89 -5.353 -2.928 3.632 672 2HA GLY 89 HA3 GLY 89 -6.367 -2.849 5.079 673 H PHE 90 HN PHE 90 -5.097 -5.261 4.086 674 HA PHE 90 HA PHE 90 -6.955 -6.859 2.633 675 1HB PHE 90 HB2 PHE 90 -4.596 -7.468 2.746 676 2HB PHE 90 HB3 PHE 90 -4.676 -7.616 4.497 677 HD1 PHE 90 HD1 PHE 90 -5.094 -9.731 5.466 678 HD2 PHE 90 HD2 PHE 90 -6.282 -9.025 1.375 679 HE1 PHE 90 HE1 PHE 90 -5.869 -12.079 5.282 680 HE2 PHE 90 HE2 PHE 90 -7.113 -11.361 1.227 681 HZ PHE 90 HZ PHE 90 -6.883 -12.895 3.162 682 H LYS 91 HN LYS 91 -8.487 -8.376 3.341 683 HA LYS 91 HA LYS 91 -8.918 -8.748 6.227 684 1HB LYS 91 HB2 LYS 91 -10.945 -7.582 4.319 685 2HB LYS 91 HB3 LYS 91 -11.495 -8.889 5.327 686 1HG LYS 91 HG2 LYS 91 -12.091 -7.125 6.620 687 2HG LYS 91 HG3 LYS 91 -10.566 -7.596 7.343 688 1HD LYS 91 HD2 LYS 91 -10.648 -5.244 7.305 689 2HD LYS 91 HD3 LYS 91 -9.467 -5.668 6.083 690 1HE LYS 91 HE2 LYS 91 -12.386 -5.189 5.355 691 2HE LYS 91 HE3 LYS 91 -11.311 -3.825 5.671 692 1HZ LYS 91 HZ1 LYS 91 -9.828 -4.651 3.903 693 2HZ LYS 91 HZ2 LYS 91 -10.881 -5.847 3.547 694 3HZ LYS 91 HZ3 LYS 91 -11.309 -4.282 3.333 695 HA PRO 92 HA PRO 92 -9.239 -12.893 4.405 696 1HB PRO 92 HB2 PRO 92 -10.157 -14.309 6.557 697 2HB PRO 92 HB3 PRO 92 -8.473 -13.715 6.440 698 1HG PRO 92 HG2 PRO 92 -10.811 -12.412 7.870 699 2HG PRO 92 HG3 PRO 92 -9.169 -12.743 8.514 700 1HD PRO 92 HD2 PRO 92 -9.832 -10.302 7.514 701 2HD PRO 92 HD3 PRO 92 -8.211 -10.998 7.236 702 H LYS 93 HN LYS 93 -11.022 -14.503 4.090 703 HA LYS 93 HA LYS 93 -13.249 -13.438 2.870 704 1HB LYS 93 HB2 LYS 93 -12.531 -15.634 2.342 705 2HB LYS 93 HB3 LYS 93 -12.581 -16.153 4.022 706 1HG LYS 93 HG2 LYS 93 -14.309 -17.247 2.831 707 2HG LYS 93 HG3 LYS 93 -15.018 -16.163 4.017 708 1HD LYS 93 HD2 LYS 93 -15.443 -14.504 2.130 709 2HD LYS 93 HD3 LYS 93 -14.895 -15.736 0.981 710 1HE LYS 93 HE2 LYS 93 -17.102 -16.157 3.070 711 2HE LYS 93 HE3 LYS 93 -17.438 -15.614 1.429 712 1HZ LYS 93 HZ1 LYS 93 -16.649 -17.663 0.558 713 2HZ LYS 93 HZ2 LYS 93 -16.072 -18.181 2.015 714 3HZ LYS 93 HZ3 LYS 93 -17.674 -18.049 1.773 715 H GLU 94 HN GLU 94 -13.195 -14.686 6.268 716 HA GLU 94 HA GLU 94 -15.979 -14.275 6.564 717 1HB GLU 94 HB2 GLU 94 -13.787 -14.422 8.673 718 2HB GLU 94 HB3 GLU 94 -15.528 -14.429 9.013 719 1HG GLU 94 HG2 GLU 94 -15.787 -16.495 7.645 720 2HG GLU 94 HG3 GLU 94 -14.049 -16.516 7.344 721 H ALA 95 HN ALA 95 -13.185 -12.172 7.430 722 HA ALA 95 HA ALA 95 -14.768 -10.145 8.681 723 1HB ALA 95 HB1 ALA 95 -12.326 -10.362 9.035 724 2HB ALA 95 HB2 ALA 95 -12.052 -9.949 7.323 725 3HB ALA 95 HB3 ALA 95 -12.755 -8.751 8.430 726 H LEU 96 HN LEU 96 -13.740 -10.764 5.339 727 HA LEU 96 HA LEU 96 -14.668 -8.330 4.223 728 1HB LEU 96 HB2 LEU 96 -13.329 -10.545 3.250 729 2HB LEU 96 HB3 LEU 96 -14.920 -10.836 2.598 730 HG LEU 96 HG LEU 96 -13.755 -9.693 0.932 731 1HD1 LEU 96 HD11 LEU 96 -15.236 -7.392 2.294 732 2HD1 LEU 96 HD12 LEU 96 -14.821 -7.551 0.586 733 3HD1 LEU 96 HD13 LEU 96 -16.015 -8.637 1.315 734 1HD2 LEU 96 HD21 LEU 96 -12.418 -7.687 1.231 735 2HD2 LEU 96 HD22 LEU 96 -12.857 -7.610 2.956 736 3HD2 LEU 96 HD23 LEU 96 -11.860 -8.951 2.337 737 H GLN 97 HN GLN 97 -16.235 -11.551 4.490 738 HA GLN 97 HA GLN 97 -18.631 -10.657 3.297 739 1HB GLN 97 HB2 GLN 97 -19.521 -12.695 3.552 740 2HB GLN 97 HB3 GLN 97 -17.801 -13.080 3.597 741 1HG GLN 97 HG2 GLN 97 -17.912 -13.295 6.014 742 2HG GLN 97 HG3 GLN 97 -19.660 -12.974 5.963 743 1HE2 GLN 97 HE22 GLN 97 -20.968 -14.494 4.480 744 2HE2 GLN 97 HE21 GLN 97 -20.449 -16.158 4.324 745 H GLU 98 HN GLU 98 -17.599 -10.703 6.711 746 HA GLU 98 HA GLU 98 -20.055 -9.827 7.799 747 1HB GLU 98 HB2 GLU 98 -18.159 -10.642 9.135 748 2HB GLU 98 HB3 GLU 98 -17.221 -9.196 8.707 749 1HG GLU 98 HG2 GLU 98 -18.775 -7.761 9.869 750 2HG GLU 98 HG3 GLU 98 -19.882 -9.106 10.171 751 H LEU 99 HN LEU 99 -17.293 -7.922 6.534 752 HA LEU 99 HA LEU 99 -18.263 -5.389 7.232 753 1HB LEU 99 HB2 LEU 99 -15.949 -5.828 6.594 754 2HB LEU 99 HB3 LEU 99 -16.451 -6.273 4.963 755 HG LEU 99 HG LEU 99 -17.190 -3.951 4.525 756 1HD1 LEU 99 HD11 LEU 99 -16.486 -2.139 6.094 757 2HD1 LEU 99 HD12 LEU 99 -17.783 -3.143 6.748 758 3HD1 LEU 99 HD13 LEU 99 -16.107 -3.370 7.317 759 1HD2 LEU 99 HD21 LEU 99 -14.884 -4.772 4.051 760 2HD2 LEU 99 HD22 LEU 99 -14.976 -3.021 4.323 761 3HD2 LEU 99 HD23 LEU 99 -14.354 -4.086 5.605 762 H VAL 100 HN VAL 100 -18.859 -7.283 4.276 763 HA VAL 100 HA VAL 100 -20.455 -5.084 3.151 764 HB VAL 100 HB VAL 100 -19.096 -6.446 1.741 765 1HG1 VAL 100 HG11 VAL 100 -19.362 -8.689 2.704 766 2HG1 VAL 100 HG12 VAL 100 -21.066 -8.727 2.208 767 3HG1 VAL 100 HG13 VAL 100 -19.778 -8.688 0.988 768 1HG2 VAL 100 HG21 VAL 100 -21.061 -5.217 0.862 769 2HG2 VAL 100 HG22 VAL 100 -20.557 -6.612 -0.100 770 3HG2 VAL 100 HG23 VAL 100 -21.999 -6.723 0.946 771 H ASN 101 HN ASN 101 -21.146 -8.244 4.775 772 HA ASN 101 HA ASN 101 -23.944 -8.290 4.521 773 1HB ASN 101 HB2 ASN 101 -22.710 -10.164 5.388 774 2HB ASN 101 HB3 ASN 101 -22.173 -9.228 6.788 775 1HD2 ASN 101 HD22 ASN 101 -23.665 -8.798 8.502 776 2HD2 ASN 101 HD21 ASN 101 -25.217 -9.587 8.591 777 H LYS 102 HN LYS 102 -21.936 -6.321 6.667 778 HA LYS 102 HA LYS 102 -23.933 -5.420 8.473 779 1HB LYS 102 HB2 LYS 102 -21.294 -4.341 7.472 780 2HB LYS 102 HB3 LYS 102 -22.287 -3.358 8.547 781 1HG LYS 102 HG2 LYS 102 -22.146 -4.835 10.334 782 2HG LYS 102 HG3 LYS 102 -21.709 -6.218 9.341 783 1HD LYS 102 HD2 LYS 102 -19.913 -5.181 10.859 784 2HD LYS 102 HD3 LYS 102 -19.470 -5.629 9.212 785 1HE LYS 102 HE2 LYS 102 -19.466 -3.402 8.439 786 2HE LYS 102 HE3 LYS 102 -20.298 -2.798 9.885 787 1HZ LYS 102 HZ1 LYS 102 -17.929 -2.298 9.933 788 2HZ LYS 102 HZ2 LYS 102 -18.321 -3.274 11.174 789 3HZ LYS 102 HZ3 LYS 102 -17.536 -3.884 9.878 790 H HIS 103 HN HIS 103 -23.613 -4.638 5.090 791 HA HIS 103 HA HIS 103 -25.661 -2.477 5.423 792 1HB HIS 103 HB2 HIS 103 -23.371 -2.466 3.423 793 2HB HIS 103 HB3 HIS 103 -24.573 -1.199 3.691 794 HD1 HIS 103 HD1 HIS 103 -24.328 0.145 6.134 795 HD2 HIS 103 HD2 HIS 103 -21.305 -2.596 5.087 796 HE1 HIS 103 HE1 HIS 103 -22.434 0.500 7.795 797 H LEU 104 HN LEU 104 -24.611 -5.300 3.709 798 HA LEU 104 HA LEU 104 -26.365 -5.269 1.421 799 1HB LEU 104 HB2 LEU 104 -24.406 -6.634 1.427 800 2HB LEU 104 HB3 LEU 104 -24.791 -7.263 3.019 801 HG LEU 104 HG LEU 104 -26.680 -8.528 2.185 802 1HD1 LEU 104 HD11 LEU 104 -27.093 -8.715 -0.234 803 2HD1 LEU 104 HD12 LEU 104 -27.296 -7.041 0.243 804 3HD1 LEU 104 HD13 LEU 104 -25.808 -7.546 -0.586 805 1HD2 LEU 104 HD21 LEU 104 -24.069 -8.960 0.695 806 2HD2 LEU 104 HD22 LEU 104 -24.491 -9.532 2.322 807 3HD2 LEU 104 HD23 LEU 104 -25.356 -10.173 0.924 808 1H MET 1 H1 MET 1 10.007 26.681 -11.860 809 2H MET 1 H2 MET 1 10.279 28.291 -11.808 810 3H MET 1 H3 MET 1 9.220 27.683 -12.902 811 HA MET 1 HA MET 1 8.066 28.740 -11.099 812 1HB MET 1 HB2 MET 1 6.557 26.957 -10.428 813 2HB MET 1 HB3 MET 1 6.858 26.925 -12.152 814 1HG MET 1 HG2 MET 1 8.171 25.056 -10.136 815 2HG MET 1 HG3 MET 1 6.708 24.689 -11.019 816 1HE MET 1 HE1 MET 1 6.542 23.850 -13.422 817 2HE MET 1 HE2 MET 1 7.071 25.447 -13.997 818 3HE MET 1 HE3 MET 1 7.842 23.977 -14.626 819 H GLU 2 HN GLU 2 8.092 29.333 -8.955 820 HA GLU 2 HA GLU 2 10.442 28.403 -7.482 821 1HB GLU 2 HB2 GLU 2 8.508 30.713 -7.017 822 2HB GLU 2 HB3 GLU 2 9.982 30.419 -6.080 823 1HG GLU 2 HG2 GLU 2 11.347 30.643 -8.142 824 2HG GLU 2 HG3 GLU 2 9.891 31.026 -9.062 825 H ASN 3 HN ASN 3 8.189 26.594 -7.585 826 HA ASN 3 HA ASN 3 8.170 25.619 -4.992 827 1HB ASN 3 HB2 ASN 3 5.560 26.871 -5.857 828 2HB ASN 3 HB3 ASN 3 5.574 25.193 -5.268 829 1HD2 ASN 3 HD22 ASN 3 7.770 27.659 -3.869 830 2HD2 ASN 3 HD21 ASN 3 6.996 27.603 -2.299 831 H LYS 4 HN LYS 4 8.189 23.675 -5.376 832 HA LYS 4 HA LYS 4 7.147 22.221 -7.710 833 1HB LYS 4 HB2 LYS 4 10.018 22.112 -6.646 834 2HB LYS 4 HB3 LYS 4 9.343 20.951 -7.789 835 1HG LYS 4 HG2 LYS 4 9.150 22.665 -9.510 836 2HG LYS 4 HG3 LYS 4 9.663 23.930 -8.367 837 1HD LYS 4 HD2 LYS 4 11.816 22.815 -8.030 838 2HD LYS 4 HD3 LYS 4 11.374 21.519 -9.139 839 1HE LYS 4 HE2 LYS 4 11.512 24.466 -9.937 840 2HE LYS 4 HE3 LYS 4 12.901 23.376 -10.022 841 1HZ LYS 4 HZ1 LYS 4 11.832 23.470 -12.147 842 2HZ LYS 4 HZ2 LYS 4 11.637 21.970 -11.554 843 3HZ LYS 4 HZ3 LYS 4 10.382 23.026 -11.543 844 H ILE 5 HN ILE 5 5.956 20.546 -6.754 845 HA ILE 5 HA ILE 5 6.560 20.005 -3.895 846 HB ILE 5 HB ILE 5 4.035 19.564 -5.515 847 1HG1 ILE 5 HG12 ILE 5 5.069 21.719 -3.711 848 2HG1 ILE 5 HG13 ILE 5 4.031 21.823 -5.117 849 1HG2 ILE 5 HG21 ILE 5 3.035 18.786 -3.406 850 2HG2 ILE 5 HG22 ILE 5 4.399 17.767 -3.815 851 3HG2 ILE 5 HG23 ILE 5 4.603 19.020 -2.575 852 1HD1 ILE 5 HD11 ILE 5 3.226 20.966 -2.310 853 2HD1 ILE 5 HD12 ILE 5 2.853 22.505 -3.107 854 3HD1 ILE 5 HD13 ILE 5 2.126 20.990 -3.710 855 H ILE 6 HN ILE 6 7.298 18.148 -3.279 856 HA ILE 6 HA ILE 6 7.327 15.820 -5.111 857 HB ILE 6 HB ILE 6 9.421 16.946 -5.525 858 1HG1 ILE 6 HG12 ILE 6 9.815 14.417 -3.884 859 2HG1 ILE 6 HG13 ILE 6 9.367 14.514 -5.572 860 1HG2 ILE 6 HG21 ILE 6 11.143 17.317 -3.792 861 2HG2 ILE 6 HG22 ILE 6 9.701 18.272 -3.507 862 3HG2 ILE 6 HG23 ILE 6 9.982 16.812 -2.545 863 1HD1 ILE 6 HD11 ILE 6 11.556 15.664 -6.061 864 2HD1 ILE 6 HD12 ILE 6 12.045 15.315 -4.383 865 3HD1 ILE 6 HD13 ILE 6 11.694 13.989 -5.502 866 H TYR 7 HN TYR 7 7.087 13.893 -4.042 867 HA TYR 7 HA TYR 7 6.393 14.096 -1.142 868 1HB TYR 7 HB2 TYR 7 4.610 14.096 -3.109 869 2HB TYR 7 HB3 TYR 7 4.970 12.393 -3.206 870 HD1 TYR 7 HD1 TYR 7 4.073 10.853 -1.473 871 HD2 TYR 7 HD2 TYR 7 3.612 15.129 -1.127 872 HE1 TYR 7 HE1 TYR 7 2.217 10.529 0.116 873 HE2 TYR 7 HE2 TYR 7 1.857 14.802 0.585 874 HH TYR 7 HH TYR 7 0.494 13.264 1.671 875 H PHE 8 HN PHE 8 7.006 12.316 0.120 876 HA PHE 8 HA PHE 8 8.608 10.184 -1.221 877 1HB PHE 8 HB2 PHE 8 9.147 11.796 1.288 878 2HB PHE 8 HB3 PHE 8 9.952 10.274 0.926 879 HD1 PHE 8 HD1 PHE 8 11.742 10.121 -0.653 880 HD2 PHE 8 HD2 PHE 8 9.474 13.772 -0.319 881 HE1 PHE 8 HE1 PHE 8 13.319 11.239 -2.196 882 HE2 PHE 8 HE2 PHE 8 11.056 14.868 -1.900 883 HZ PHE 8 HZ PHE 8 12.933 13.592 -2.876 884 H LEU 9 HN LEU 9 7.516 8.321 -1.089 885 HA LEU 9 HA LEU 9 5.606 7.874 1.158 886 1HB LEU 9 HB2 LEU 9 6.057 6.712 -1.620 887 2HB LEU 9 HB3 LEU 9 5.225 5.753 -0.397 888 HG LEU 9 HG LEU 9 4.309 8.458 -1.437 889 1HD1 LEU 9 HD11 LEU 9 4.146 6.638 -3.086 890 2HD1 LEU 9 HD12 LEU 9 3.363 5.596 -1.901 891 3HD1 LEU 9 HD13 LEU 9 2.527 7.049 -2.494 892 1HD2 LEU 9 HD21 LEU 9 2.168 7.872 -0.231 893 2HD2 LEU 9 HD22 LEU 9 3.030 6.537 0.566 894 3HD2 LEU 9 HD23 LEU 9 3.518 8.216 0.855 895 H SER 10 HN SER 10 6.222 6.560 2.854 896 HA SER 10 HA SER 10 7.748 4.180 2.191 897 1HB SER 10 HB2 SER 10 9.485 4.507 3.811 898 2HB SER 10 HB3 SER 10 9.571 5.769 2.585 899 HG SER 10 HG SER 10 8.978 7.236 4.004 900 H THR 11 HN THR 11 7.808 2.617 4.024 901 HA THR 11 HA THR 11 5.364 2.171 5.185 902 HB THR 11 HB THR 11 8.153 1.303 6.043 903 HG1 THR 11 HG1 THR 11 7.492 -0.539 4.804 904 1HG2 THR 11 HG21 THR 11 7.023 -0.642 7.096 905 2HG2 THR 11 HG22 THR 11 6.617 0.865 7.911 906 3HG2 THR 11 HG23 THR 11 5.437 0.128 6.804 907 H GLY 12 HN GLY 12 4.234 3.272 6.601 908 1HA GLY 12 HA2 GLY 12 3.569 4.723 8.206 909 2HA GLY 12 HA3 GLY 12 4.733 3.833 9.194 910 H ASN 13 HN ASN 13 6.026 5.772 6.570 911 HA ASN 13 HA ASN 13 7.754 7.197 6.665 912 1HB ASN 13 HB2 ASN 13 5.781 8.714 6.635 913 2HB ASN 13 HB3 ASN 13 5.897 8.838 8.403 914 1HD2 ASN 13 HD22 ASN 13 6.130 11.220 7.881 915 2HD2 ASN 13 HD21 ASN 13 7.771 11.749 7.692 916 H SER 14 HN SER 14 7.885 5.067 8.686 917 HA SER 14 HA SER 14 8.725 6.305 11.149 918 1HB SER 14 HB2 SER 14 8.980 3.861 11.813 919 2HB SER 14 HB3 SER 14 7.379 4.376 11.273 920 HG SER 14 HG SER 14 7.943 2.420 10.316 921 H ALA 15 HN ALA 15 10.464 6.688 8.662 922 HA ALA 15 HA ALA 15 12.767 7.113 9.994 923 1HB ALA 15 HB1 ALA 15 13.398 4.805 10.258 924 2HB ALA 15 HB2 ALA 15 13.054 4.428 8.565 925 3HB ALA 15 HB3 ALA 15 14.419 5.481 9.008 926 H ARG 16 HN ARG 16 12.364 5.520 6.817 927 HA ARG 16 HA ARG 16 14.292 6.961 5.521 928 1HB ARG 16 HB2 ARG 16 11.811 5.962 4.075 929 2HB ARG 16 HB3 ARG 16 13.403 6.279 3.424 930 1HG ARG 16 HG2 ARG 16 13.762 4.125 3.578 931 2HG ARG 16 HG3 ARG 16 14.092 4.407 5.282 932 1HD ARG 16 HD2 ARG 16 11.280 3.814 4.268 933 2HD ARG 16 HD3 ARG 16 12.431 2.532 4.484 934 HE ARG 16 HE ARG 16 12.526 2.851 6.793 935 1HH1 ARG 16 HH11 ARG 16 9.876 5.008 5.620 936 2HH1 ARG 16 HH12 ARG 16 8.807 4.344 6.807 937 1HH2 ARG 16 HH21 ARG 16 11.099 2.122 8.239 938 2HH2 ARG 16 HH22 ARG 16 9.603 2.973 8.541 939 H SER 17 HN SER 17 10.754 7.889 5.237 940 HA SER 17 HA SER 17 11.588 9.960 3.456 941 1HB SER 17 HB2 SER 17 8.894 9.746 4.774 942 2HB SER 17 HB3 SER 17 9.345 10.710 3.369 943 HG SER 17 HG SER 17 8.444 8.871 2.644 944 H GLN 18 HN GLN 18 10.927 10.036 6.975 945 HA GLN 18 HA GLN 18 11.235 12.724 7.546 946 1HB GLN 18 HB2 GLN 18 12.785 10.613 9.056 947 2HB GLN 18 HB3 GLN 18 12.138 12.105 9.673 948 1HG GLN 18 HG2 GLN 18 10.547 9.643 8.862 949 2HG GLN 18 HG3 GLN 18 10.921 10.159 10.489 950 1HE2 GLN 18 HE22 GLN 18 8.476 9.980 10.712 951 2HE2 GLN 18 HE21 GLN 18 7.560 11.423 10.276 952 H MET 19 HN MET 19 13.789 10.356 7.001 953 HA MET 19 HA MET 19 15.978 12.123 7.448 954 1HB MET 19 HB2 MET 19 15.825 9.551 7.624 955 2HB MET 19 HB3 MET 19 15.866 9.503 5.857 956 1HG MET 19 HG2 MET 19 18.061 10.833 6.082 957 2HG MET 19 HG3 MET 19 18.022 10.351 7.783 958 1HE MET 19 HE1 MET 19 17.847 7.728 8.495 959 2HE MET 19 HE2 MET 19 16.733 7.144 7.225 960 3HE MET 19 HE3 MET 19 18.348 6.414 7.408 961 H ALA 20 HN ALA 20 14.355 10.888 4.478 962 HA ALA 20 HA ALA 20 16.031 12.167 2.573 963 1HB ALA 20 HB1 ALA 20 14.044 11.857 1.062 964 2HB ALA 20 HB2 ALA 20 14.643 10.386 1.852 965 3HB ALA 20 HB3 ALA 20 13.161 11.198 2.443 966 H GLU 21 HN GLU 21 12.933 13.278 4.121 967 HA GLU 21 HA GLU 21 12.926 15.616 2.515 968 1HB GLU 21 HB2 GLU 21 11.084 16.380 3.712 969 2HB GLU 21 HB3 GLU 21 10.894 14.646 3.486 970 1HG GLU 21 HG2 GLU 21 11.123 14.200 5.822 971 2HG GLU 21 HG3 GLU 21 11.949 15.733 6.080 972 H GLY 22 HN GLY 22 14.460 14.918 5.616 973 1HA GLY 22 HA2 GLY 22 15.276 17.623 6.230 974 2HA GLY 22 HA3 GLY 22 16.016 16.116 6.810 975 H TRP 23 HN TRP 23 16.904 14.844 4.572 976 HA TRP 23 HA TRP 23 19.257 16.174 3.764 977 1HB TRP 23 HB2 TRP 23 17.706 13.754 2.865 978 2HB TRP 23 HB3 TRP 23 18.847 14.432 1.710 979 HD1 TRP 23 HD1 TRP 23 18.707 12.331 4.732 980 HE1 TRP 23 HE1 TRP 23 21.022 11.753 5.589 981 HE3 TRP 23 HE3 TRP 23 21.437 15.434 1.732 982 HZ2 TRP 23 HZ2 TRP 23 23.770 12.499 5.013 983 HZ3 TRP 23 HZ3 TRP 23 23.925 15.414 1.847 984 HH2 TRP 23 HH2 TRP 23 25.096 13.971 3.492 985 H ALA 24 HN ALA 24 16.066 16.013 2.200 986 HA ALA 24 HA ALA 24 16.852 17.065 -0.245 987 1HB ALA 24 HB1 ALA 24 14.459 17.563 -0.591 988 2HB ALA 24 HB2 ALA 24 14.596 16.014 0.262 989 3HB ALA 24 HB3 ALA 24 14.143 17.481 1.146 990 H LYS 25 HN LYS 25 15.532 18.797 2.681 991 HA LYS 25 HA LYS 25 15.322 21.209 1.249 992 1HB LYS 25 HB2 LYS 25 14.543 20.286 3.829 993 2HB LYS 25 HB3 LYS 25 15.570 21.683 4.132 994 1HG LYS 25 HG2 LYS 25 13.319 22.493 3.898 995 2HG LYS 25 HG3 LYS 25 14.208 22.974 2.446 996 1HD LYS 25 HD2 LYS 25 13.218 20.853 1.336 997 2HD LYS 25 HD3 LYS 25 12.224 20.692 2.774 998 1HE LYS 25 HE2 LYS 25 10.959 21.801 0.957 999 2HE LYS 25 HE3 LYS 25 11.167 22.909 2.305 1000 1HZ LYS 25 HZ1 LYS 25 11.615 23.789 -0.015 1001 2HZ LYS 25 HZ2 LYS 25 12.781 24.102 1.093 1002 3HZ LYS 25 HZ3 LYS 25 13.005 22.936 -0.032 1003 H GLN 26 HN GLN 26 18.170 19.907 2.755 1004 HA GLN 26 HA GLN 26 19.477 22.441 2.885 1005 1HB GLN 26 HB2 GLN 26 21.456 21.365 3.416 1006 2HB GLN 26 HB3 GLN 26 20.175 20.498 4.223 1007 1HG GLN 26 HG2 GLN 26 20.684 18.562 3.224 1008 2HG GLN 26 HG3 GLN 26 20.667 19.262 1.621 1009 1HE2 GLN 26 HE22 GLN 26 22.508 17.224 2.747 1010 2HE2 GLN 26 HE21 GLN 26 24.108 17.885 2.517 1011 H TYR 27 HN TYR 27 18.579 20.662 0.129 1012 HA TYR 27 HA TYR 27 20.413 22.306 -1.566 1013 1HB TYR 27 HB2 TYR 27 19.749 19.350 -1.710 1014 2HB TYR 27 HB3 TYR 27 20.031 20.251 -3.179 1015 HD1 TYR 27 HD1 TYR 27 22.167 21.318 -3.712 1016 HD2 TYR 27 HD2 TYR 27 21.676 18.707 -0.316 1017 HE1 TYR 27 HE1 TYR 27 24.630 21.102 -3.528 1018 HE2 TYR 27 HE2 TYR 27 24.129 18.542 -0.077 1019 HH TYR 27 HH TYR 27 26.407 20.162 -2.335 1020 H LEU 28 HN LEU 28 17.318 20.563 -1.343 1021 HA LEU 28 HA LEU 28 16.115 21.900 -3.635 1022 1HB LEU 28 HB2 LEU 28 15.155 19.771 -1.668 1023 2HB LEU 28 HB3 LEU 28 14.050 20.640 -2.698 1024 HG LEU 28 HG LEU 28 15.286 19.890 -4.715 1025 1HD1 LEU 28 HD11 LEU 28 16.805 17.937 -4.507 1026 2HD1 LEU 28 HD12 LEU 28 17.455 19.450 -3.895 1027 3HD1 LEU 28 HD13 LEU 28 16.870 18.212 -2.751 1028 1HD2 LEU 28 HD21 LEU 28 14.369 17.655 -4.740 1029 2HD2 LEU 28 HD22 LEU 28 14.288 17.617 -2.961 1030 3HD2 LEU 28 HD23 LEU 28 13.264 18.736 -3.892 1031 H GLY 29 HN GLY 29 16.655 23.893 -2.682 1032 1HA GLY 29 HA2 GLY 29 15.887 24.962 -0.203 1033 2HA GLY 29 HA3 GLY 29 16.294 25.883 -1.656 1034 H ASP 30 HN ASP 30 14.697 27.453 -0.880 1035 HA ASP 30 HA ASP 30 11.986 26.972 -0.378 1036 1HB ASP 30 HB2 ASP 30 13.173 29.059 0.126 1037 2HB ASP 30 HB3 ASP 30 13.327 29.409 -1.597 1038 H GLU 31 HN GLU 31 13.623 26.964 -3.420 1039 HA GLU 31 HA GLU 31 11.542 27.316 -5.300 1040 1HB GLU 31 HB2 GLU 31 13.879 27.339 -5.865 1041 2HB GLU 31 HB3 GLU 31 14.124 25.703 -5.250 1042 1HG GLU 31 HG2 GLU 31 12.906 24.730 -7.057 1043 2HG GLU 31 HG3 GLU 31 12.304 26.307 -7.602 1044 H TRP 32 HN TRP 32 11.993 24.726 -2.987 1045 HA TRP 32 HA TRP 32 9.985 23.044 -4.413 1046 1HB TRP 32 HB2 TRP 32 12.301 22.114 -2.702 1047 2HB TRP 32 HB3 TRP 32 11.122 21.089 -3.494 1048 HD1 TRP 32 HD1 TRP 32 14.070 23.381 -4.341 1049 HE1 TRP 32 HE1 TRP 32 15.373 22.306 -6.270 1050 HE3 TRP 32 HE3 TRP 32 10.790 19.649 -5.587 1051 HZ2 TRP 32 HZ2 TRP 32 14.973 20.252 -8.224 1052 HZ3 TRP 32 HZ3 TRP 32 11.295 18.126 -7.480 1053 HH2 TRP 32 HH2 TRP 32 13.379 18.409 -8.803 1054 H LYS 33 HN LYS 33 8.759 21.659 -3.020 1055 HA LYS 33 HA LYS 33 8.777 22.247 -0.116 1056 1HB LYS 33 HB2 LYS 33 6.312 21.965 -1.889 1057 2HB LYS 33 HB3 LYS 33 6.278 21.955 -0.133 1058 1HG LYS 33 HG2 LYS 33 7.386 24.281 -1.746 1059 2HG LYS 33 HG3 LYS 33 5.693 24.159 -1.281 1060 1HD LYS 33 HD2 LYS 33 8.036 24.274 0.672 1061 2HD LYS 33 HD3 LYS 33 7.027 25.641 0.190 1062 1HE LYS 33 HE2 LYS 33 5.009 24.458 1.066 1063 2HE LYS 33 HE3 LYS 33 6.035 23.135 1.625 1064 1HZ LYS 33 HZ1 LYS 33 6.204 25.941 2.569 1065 2HZ LYS 33 HZ2 LYS 33 5.563 24.697 3.399 1066 3HZ LYS 33 HZ3 LYS 33 7.162 24.721 3.088 1067 H VAL 34 HN VAL 34 8.584 20.350 1.056 1068 HA VAL 34 HA VAL 34 8.662 17.834 -0.538 1069 HB VAL 34 HB VAL 34 10.585 18.547 1.721 1070 1HG1 VAL 34 HG11 VAL 34 11.824 16.568 0.812 1071 2HG1 VAL 34 HG12 VAL 34 10.220 16.141 1.429 1072 3HG1 VAL 34 HG13 VAL 34 10.485 16.289 -0.313 1073 1HG2 VAL 34 HG21 VAL 34 11.145 20.019 -0.182 1074 2HG2 VAL 34 HG22 VAL 34 12.352 18.765 0.011 1075 3HG2 VAL 34 HG23 VAL 34 11.140 18.626 -1.279 1076 H TYR 35 HN TYR 35 7.575 16.155 0.394 1077 HA TYR 35 HA TYR 35 6.509 16.449 3.155 1078 1HB TYR 35 HB2 TYR 35 4.908 15.839 0.643 1079 2HB TYR 35 HB3 TYR 35 4.281 15.770 2.281 1080 HD1 TYR 35 HD1 TYR 35 3.814 17.841 3.558 1081 HD2 TYR 35 HD2 TYR 35 5.305 17.973 -0.490 1082 HE1 TYR 35 HE1 TYR 35 3.181 20.229 3.412 1083 HE2 TYR 35 HE2 TYR 35 4.666 20.363 -0.643 1084 HH TYR 35 HH TYR 35 3.125 22.137 2.069 1085 H SER 36 HN SER 36 5.713 14.427 3.997 1086 HA SER 36 HA SER 36 6.859 11.981 2.762 1087 1HB SER 36 HB2 SER 36 7.199 13.005 5.618 1088 2HB SER 36 HB3 SER 36 7.754 11.447 5.002 1089 HG SER 36 HG SER 36 8.754 13.986 4.721 1090 H ALA 37 HN ALA 37 5.619 10.120 3.192 1091 HA ALA 37 HA ALA 37 3.382 10.242 5.103 1092 1HB ALA 37 HB1 ALA 37 1.737 9.845 3.279 1093 2HB ALA 37 HB2 ALA 37 2.504 11.431 3.141 1094 3HB ALA 37 HB3 ALA 37 3.028 10.095 2.087 1095 H GLY 38 HN GLY 38 2.019 8.153 4.788 1096 1HA GLY 38 HA2 GLY 38 3.049 5.847 3.507 1097 2HA GLY 38 HA3 GLY 38 3.626 5.890 5.181 1098 H ILE 39 HN ILE 39 2.265 3.856 5.004 1099 HA ILE 39 HA ILE 39 -0.397 3.692 4.650 1100 HB ILE 39 HB ILE 39 0.793 1.727 4.741 1101 1HG1 ILE 39 HG12 ILE 39 -0.491 1.337 7.437 1102 2HG1 ILE 39 HG13 ILE 39 -1.523 1.801 6.099 1103 1HG2 ILE 39 HG21 ILE 39 1.865 2.424 7.491 1104 2HG2 ILE 39 HG22 ILE 39 2.004 0.832 6.754 1105 3HG2 ILE 39 HG23 ILE 39 2.753 2.210 5.962 1106 1HD1 ILE 39 HD11 ILE 39 0.230 -0.668 6.161 1107 2HD1 ILE 39 HD12 ILE 39 -1.538 -0.592 6.262 1108 3HD1 ILE 39 HD13 ILE 39 -0.728 -0.116 4.758 1109 H GLU 40 HN GLU 40 1.022 4.069 7.903 1110 HA GLU 40 HA GLU 40 -1.469 5.308 8.940 1111 1HB GLU 40 HB2 GLU 40 -1.292 3.935 10.963 1112 2HB GLU 40 HB3 GLU 40 -1.630 2.983 9.526 1113 1HG GLU 40 HG2 GLU 40 0.668 2.162 9.436 1114 2HG GLU 40 HG3 GLU 40 1.154 3.229 10.748 1115 H ALA 41 HN ALA 41 0.866 6.455 7.924 1116 HA ALA 41 HA ALA 41 3.035 6.764 9.673 1117 1HB ALA 41 HB1 ALA 41 1.990 8.318 7.279 1118 2HB ALA 41 HB2 ALA 41 3.577 8.626 8.006 1119 3HB ALA 41 HB3 ALA 41 3.218 7.042 7.272 1120 H HIS 42 HN HIS 42 3.444 7.997 11.286 1121 HA HIS 42 HA HIS 42 2.905 10.769 11.374 1122 1HB HIS 42 HB2 HIS 42 1.538 10.945 13.402 1123 2HB HIS 42 HB3 HIS 42 0.645 10.100 12.169 1124 HD1 HIS 42 HD1 HIS 42 2.472 9.371 15.495 1125 HD2 HIS 42 HD2 HIS 42 -0.205 7.647 12.741 1126 HE1 HIS 42 HE1 HIS 42 1.572 7.259 16.601 1127 H GLY 43 HN GLY 43 4.951 8.329 11.919 1128 1HA GLY 43 HA2 GLY 43 5.761 8.975 14.703 1129 2HA GLY 43 HA3 GLY 43 6.144 7.521 13.791 1130 H LEU 44 HN LEU 44 7.232 10.628 14.703 1131 HA LEU 44 HA LEU 44 9.407 10.734 12.728 1132 1HB LEU 44 HB2 LEU 44 8.531 12.841 13.583 1133 2HB LEU 44 HB3 LEU 44 8.876 12.351 15.248 1134 HG LEU 44 HG LEU 44 11.299 12.337 14.781 1135 1HD1 LEU 44 HD11 LEU 44 12.145 13.269 12.611 1136 2HD1 LEU 44 HD12 LEU 44 11.418 11.671 12.451 1137 3HD1 LEU 44 HD13 LEU 44 10.509 13.117 11.942 1138 1HD2 LEU 44 HD21 LEU 44 11.611 14.727 14.491 1139 2HD2 LEU 44 HD22 LEU 44 9.966 14.900 13.840 1140 3HD2 LEU 44 HD23 LEU 44 10.216 14.412 15.529 1141 H ASN 45 HN ASN 45 10.273 8.641 12.984 1142 HA ASN 45 HA ASN 45 10.895 7.434 15.456 1143 1HB ASN 45 HB2 ASN 45 10.717 6.287 13.291 1144 2HB ASN 45 HB3 ASN 45 12.233 7.024 12.750 1145 1HD2 ASN 45 HD22 ASN 45 12.022 4.313 12.647 1146 2HD2 ASN 45 HD21 ASN 45 12.954 3.544 13.921 1147 HA PRO 46 HA PRO 46 14.359 10.094 16.568 1148 1HB PRO 46 HB2 PRO 46 15.474 8.578 18.613 1149 2HB PRO 46 HB3 PRO 46 14.080 9.688 18.777 1150 1HG PRO 46 HG2 PRO 46 14.042 6.692 18.342 1151 2HG PRO 46 HG3 PRO 46 13.083 7.657 19.511 1152 1HD PRO 46 HD2 PRO 46 12.012 6.856 17.178 1153 2HD PRO 46 HD3 PRO 46 11.680 8.502 17.788 1154 H ASN 47 HN ASN 47 14.683 6.738 15.427 1155 HA ASN 47 HA ASN 47 17.517 6.713 15.126 1156 1HB ASN 47 HB2 ASN 47 17.094 4.725 14.214 1157 2HB ASN 47 HB3 ASN 47 15.428 4.927 14.653 1158 1HD2 ASN 47 HD22 ASN 47 17.673 4.619 12.091 1159 2HD2 ASN 47 HD21 ASN 47 16.570 4.919 10.750 1160 H ALA 48 HN ALA 48 14.870 8.099 13.105 1161 HA ALA 48 HA ALA 48 16.679 8.742 10.950 1162 1HB ALA 48 HB1 ALA 48 13.860 9.742 11.574 1163 2HB ALA 48 HB2 ALA 48 14.742 10.035 10.059 1164 3HB ALA 48 HB3 ALA 48 14.313 8.381 10.518 1165 H VAL 49 HN VAL 49 15.329 10.370 13.797 1166 HA VAL 49 HA VAL 49 16.361 12.990 13.270 1167 HB VAL 49 HB VAL 49 16.048 11.708 16.010 1168 1HG1 VAL 49 HG11 VAL 49 16.016 14.632 15.131 1169 2HG1 VAL 49 HG12 VAL 49 15.724 14.039 16.778 1170 3HG1 VAL 49 HG13 VAL 49 17.315 13.829 16.041 1171 1HG2 VAL 49 HG21 VAL 49 13.803 12.708 16.088 1172 2HG2 VAL 49 HG22 VAL 49 13.974 13.293 14.426 1173 3HG2 VAL 49 HG23 VAL 49 13.891 11.558 14.756 1174 H LYS 50 HN LYS 50 17.823 10.200 15.030 1175 HA LYS 50 HA LYS 50 20.373 11.354 15.434 1176 1HB LYS 50 HB2 LYS 50 19.643 9.329 16.565 1177 2HB LYS 50 HB3 LYS 50 19.541 8.445 15.038 1178 1HG LYS 50 HG2 LYS 50 21.949 8.582 14.721 1179 2HG LYS 50 HG3 LYS 50 22.116 9.624 16.153 1180 1HD LYS 50 HD2 LYS 50 21.325 7.762 17.596 1181 2HD LYS 50 HD3 LYS 50 21.060 6.767 16.164 1182 1HE LYS 50 HE2 LYS 50 23.120 6.045 17.126 1183 2HE LYS 50 HE3 LYS 50 23.508 6.899 15.632 1184 1HZ LYS 50 HZ1 LYS 50 24.974 7.532 17.444 1185 2HZ LYS 50 HZ2 LYS 50 24.103 8.837 16.993 1186 3HZ LYS 50 HZ3 LYS 50 23.724 8.033 18.368 1187 H ALA 51 HN ALA 51 19.168 9.388 12.665 1188 HA ALA 51 HA ALA 51 21.464 9.280 11.149 1189 1HB ALA 51 HB1 ALA 51 18.634 9.645 10.103 1190 2HB ALA 51 HB2 ALA 51 20.012 8.960 9.225 1191 3HB ALA 51 HB3 ALA 51 19.346 8.109 10.639 1192 H MET 52 HN MET 52 19.242 12.116 11.503 1193 HA MET 52 HA MET 52 20.639 13.555 9.353 1194 1HB MET 52 HB2 MET 52 18.250 14.273 11.116 1195 2HB MET 52 HB3 MET 52 18.894 15.263 9.804 1196 1HG MET 52 HG2 MET 52 17.564 12.560 9.570 1197 2HG MET 52 HG3 MET 52 17.031 14.099 8.913 1198 1HE MET 52 HE1 MET 52 19.482 14.749 6.015 1199 2HE MET 52 HE2 MET 52 18.209 15.357 7.101 1200 3HE MET 52 HE3 MET 52 19.895 15.166 7.687 1201 H LYS 53 HN LYS 53 20.442 13.541 12.916 1202 HA LYS 53 HA LYS 53 22.013 15.913 13.271 1203 1HB LYS 53 HB2 LYS 53 21.779 13.389 14.976 1204 2HB LYS 53 HB3 LYS 53 22.595 14.853 15.507 1205 1HG LYS 53 HG2 LYS 53 19.666 14.865 14.680 1206 2HG LYS 53 HG3 LYS 53 20.186 14.449 16.311 1207 1HD LYS 53 HD2 LYS 53 21.152 16.664 16.626 1208 2HD LYS 53 HD3 LYS 53 20.802 17.098 14.932 1209 1HE LYS 53 HE2 LYS 53 18.398 16.814 15.307 1210 2HE LYS 53 HE3 LYS 53 18.669 16.250 16.955 1211 1HZ LYS 53 HZ1 LYS 53 19.262 18.393 17.631 1212 2HZ LYS 53 HZ2 LYS 53 19.514 18.950 16.113 1213 3HZ LYS 53 HZ3 LYS 53 17.988 18.636 16.613 1214 H GLU 54 HN GLU 54 22.912 12.629 12.204 1215 HA GLU 54 HA GLU 54 25.690 12.777 12.719 1216 1HB GLU 54 HB2 GLU 54 24.236 11.513 10.360 1217 2HB GLU 54 HB3 GLU 54 25.961 11.371 10.649 1218 1HG GLU 54 HG2 GLU 54 25.438 10.332 12.903 1219 2HG GLU 54 HG3 GLU 54 23.754 10.219 12.370 1220 H VAL 55 HN VAL 55 23.737 14.365 10.237 1221 HA VAL 55 HA VAL 55 26.167 15.666 9.118 1222 HB VAL 55 HB VAL 55 24.805 15.940 7.055 1223 1HG1 VAL 55 HG11 VAL 55 25.188 13.697 6.271 1224 2HG1 VAL 55 HG12 VAL 55 26.466 14.103 7.411 1225 3HG1 VAL 55 HG13 VAL 55 25.140 13.034 7.919 1226 1HG2 VAL 55 HG21 VAL 55 22.800 14.630 6.671 1227 2HG2 VAL 55 HG22 VAL 55 22.851 13.941 8.301 1228 3HG2 VAL 55 HG23 VAL 55 22.516 15.672 8.068 1229 H GLY 56 HN GLY 56 24.288 16.324 11.499 1230 1HA GLY 56 HA2 GLY 56 23.669 18.225 12.553 1231 2HA GLY 56 HA3 GLY 56 24.699 19.088 11.401 1232 H ILE 57 HN ILE 57 21.634 17.210 10.744 1233 HA ILE 57 HA ILE 57 20.352 19.822 9.984 1234 HB ILE 57 HB ILE 57 19.901 17.092 8.736 1235 1HG1 ILE 57 HG12 ILE 57 21.058 19.669 7.580 1236 2HG1 ILE 57 HG13 ILE 57 21.959 18.198 7.932 1237 1HG2 ILE 57 HG21 ILE 57 18.219 18.199 7.303 1238 2HG2 ILE 57 HG22 ILE 57 17.778 18.416 8.988 1239 3HG2 ILE 57 HG23 ILE 57 18.527 19.753 8.094 1240 1HD1 ILE 57 HD11 ILE 57 20.626 16.978 6.207 1241 2HD1 ILE 57 HD12 ILE 57 19.855 18.521 5.761 1242 3HD1 ILE 57 HD13 ILE 57 21.599 18.311 5.573 1243 H ASP 58 HN ASP 58 19.159 20.321 11.768 1244 HA ASP 58 HA ASP 58 18.151 18.261 13.561 1245 1HB ASP 58 HB2 ASP 58 18.448 20.491 14.498 1246 2HB ASP 58 HB3 ASP 58 17.355 21.190 13.286 1247 H ILE 59 HN ILE 59 16.317 17.127 13.362 1248 HA ILE 59 HA ILE 59 14.166 18.221 11.641 1249 HB ILE 59 HB ILE 59 13.527 16.128 10.882 1250 1HG1 ILE 59 HG12 ILE 59 16.036 14.813 12.006 1251 2HG1 ILE 59 HG13 ILE 59 14.450 14.714 12.773 1252 1HG2 ILE 59 HG21 ILE 59 15.193 17.486 9.594 1253 2HG2 ILE 59 HG22 ILE 59 16.504 16.511 10.294 1254 3HG2 ILE 59 HG23 ILE 59 15.316 15.758 9.211 1255 1HD1 ILE 59 HD11 ILE 59 15.152 13.626 10.020 1256 2HD1 ILE 59 HD12 ILE 59 14.736 12.713 11.478 1257 3HD1 ILE 59 HD13 ILE 59 13.512 13.709 10.685 1258 H SER 60 HN SER 60 14.912 17.900 14.740 1259 HA SER 60 HA SER 60 12.794 16.342 15.762 1260 1HB SER 60 HB2 SER 60 13.868 18.883 17.053 1261 2HB SER 60 HB3 SER 60 13.265 17.422 17.854 1262 HG SER 60 HG SER 60 15.694 17.911 16.488 1263 H ASN 61 HN ASN 61 12.843 19.311 14.105 1264 HA ASN 61 HA ASN 61 10.358 20.461 14.982 1265 1HB ASN 61 HB2 ASN 61 10.803 22.082 13.183 1266 2HB ASN 61 HB3 ASN 61 12.221 21.855 14.194 1267 1HD2 ASN 61 HD22 ASN 61 14.145 20.874 13.281 1268 2HD2 ASN 61 HD21 ASN 61 14.268 20.530 11.578 1269 H GLN 62 HN GLN 62 11.065 17.837 12.728 1270 HA GLN 62 HA GLN 62 9.216 18.420 10.742 1271 1HB GLN 62 HB2 GLN 62 10.472 15.864 11.721 1272 2HB GLN 62 HB3 GLN 62 9.240 15.846 10.453 1273 1HG GLN 62 HG2 GLN 62 10.507 17.524 9.149 1274 2HG GLN 62 HG3 GLN 62 11.774 17.517 10.371 1275 1HE2 GLN 62 HE21 GLN 62 12.991 16.975 8.346 1276 2HE2 GLN 62 HE22 GLN 62 13.144 15.257 7.917 1277 H THR 63 HN THR 63 7.315 17.353 10.195 1278 HA THR 63 HA THR 63 5.489 16.366 12.324 1279 HB THR 63 HB THR 63 3.680 17.519 11.042 1280 HG1 THR 63 HG1 THR 63 4.211 18.919 9.410 1281 1HG2 THR 63 HG21 THR 63 4.192 19.800 11.769 1282 2HG2 THR 63 HG22 THR 63 4.825 18.662 12.973 1283 3HG2 THR 63 HG23 THR 63 5.933 19.430 11.811 1284 H SER 64 HN SER 64 3.591 15.056 11.122 1285 HA SER 64 HA SER 64 4.347 13.760 8.634 1286 1HB SER 64 HB2 SER 64 4.532 12.317 11.311 1287 2HB SER 64 HB3 SER 64 4.344 11.459 9.764 1288 HG SER 64 HG SER 64 6.299 13.414 9.858 1289 H ASP 65 HN ASP 65 2.726 12.061 8.048 1290 HA ASP 65 HA ASP 65 0.122 11.962 9.231 1291 1HB ASP 65 HB2 ASP 65 0.183 14.328 8.218 1292 2HB ASP 65 HB3 ASP 65 0.477 13.561 6.652 1293 H ILE 66 HN ILE 66 -1.345 10.731 7.647 1294 HA ILE 66 HA ILE 66 0.061 8.596 6.291 1295 HB ILE 66 HB ILE 66 -2.310 7.954 5.691 1296 1HG1 ILE 66 HG12 ILE 66 -3.135 10.198 7.565 1297 2HG1 ILE 66 HG13 ILE 66 -3.199 10.346 5.803 1298 1HG2 ILE 66 HG21 ILE 66 -2.832 7.227 7.974 1299 2HG2 ILE 66 HG22 ILE 66 -1.117 7.088 7.596 1300 3HG2 ILE 66 HG23 ILE 66 -1.683 8.423 8.633 1301 1HD1 ILE 66 HD11 ILE 66 -4.741 8.371 7.523 1302 2HD1 ILE 66 HD12 ILE 66 -5.383 9.764 6.638 1303 3HD1 ILE 66 HD13 ILE 66 -4.738 8.371 5.739 1304 H ILE 67 HN ILE 67 -0.790 7.987 3.986 1305 HA ILE 67 HA ILE 67 -0.111 9.897 2.086 1306 HB ILE 67 HB ILE 67 -0.730 8.483 0.473 1307 1HG1 ILE 67 HG12 ILE 67 -3.077 7.312 2.003 1308 2HG1 ILE 67 HG13 ILE 67 -3.174 8.596 0.797 1309 1HG2 ILE 67 HG21 ILE 67 -0.734 6.425 2.726 1310 2HG2 ILE 67 HG22 ILE 67 -0.231 6.200 1.047 1311 3HG2 ILE 67 HG23 ILE 67 0.718 7.244 2.101 1312 1HD1 ILE 67 HD11 ILE 67 -3.810 6.746 -0.412 1313 2HD1 ILE 67 HD12 ILE 67 -2.125 6.999 -0.880 1314 3HD1 ILE 67 HD13 ILE 67 -2.524 5.708 0.269 1315 H ASP 68 HN ASP 68 -1.110 11.613 1.180 1316 HA ASP 68 HA ASP 68 -4.018 12.062 1.650 1317 1HB ASP 68 HB2 ASP 68 -2.807 13.149 3.498 1318 2HB ASP 68 HB3 ASP 68 -1.880 14.098 2.333 1319 H SER 69 HN SER 69 -4.652 11.917 -0.349 1320 HA SER 69 HA SER 69 -3.563 12.568 -2.723 1321 1HB SER 69 HB2 SER 69 -6.426 13.153 -1.953 1322 2HB SER 69 HB3 SER 69 -5.822 12.529 -3.506 1323 HG SER 69 HG SER 69 -6.807 10.932 -2.089 1324 H ASP 70 HN ASP 70 -4.666 14.964 -0.333 1325 HA ASP 70 HA ASP 70 -5.169 17.106 -2.186 1326 1HB ASP 70 HB2 ASP 70 -5.990 16.996 0.190 1327 2HB ASP 70 HB3 ASP 70 -4.317 17.251 0.721 1328 H ILE 71 HN ILE 71 -2.267 15.628 -1.097 1329 HA ILE 71 HA ILE 71 -0.666 17.882 -2.206 1330 HB ILE 71 HB ILE 71 0.181 16.092 0.044 1331 1HG1 ILE 71 HG12 ILE 71 -0.082 18.687 1.153 1332 2HG1 ILE 71 HG13 ILE 71 -1.553 18.495 0.207 1333 1HG2 ILE 71 HG21 ILE 71 2.046 17.099 -1.189 1334 2HG2 ILE 71 HG22 ILE 71 1.367 18.718 -0.908 1335 3HG2 ILE 71 HG23 ILE 71 1.918 17.726 0.463 1336 1HD1 ILE 71 HD11 ILE 71 -1.841 17.662 2.486 1337 2HD1 ILE 71 HD12 ILE 71 -1.964 16.318 1.318 1338 3HD1 ILE 71 HD13 ILE 71 -0.458 16.558 2.257 1339 H LEU 72 HN LEU 72 -0.918 14.283 -1.633 1340 HA LEU 72 HA LEU 72 1.369 13.665 -3.211 1341 1HB LEU 72 HB2 LEU 72 0.194 12.115 -1.631 1342 2HB LEU 72 HB3 LEU 72 -1.094 11.920 -2.810 1343 HG LEU 72 HG LEU 72 1.836 11.326 -3.430 1344 1HD1 LEU 72 HD11 LEU 72 1.614 9.092 -2.860 1345 2HD1 LEU 72 HD12 LEU 72 0.798 9.896 -1.514 1346 3HD1 LEU 72 HD13 LEU 72 -0.148 9.139 -2.804 1347 1HD2 LEU 72 HD21 LEU 72 0.654 9.681 -5.102 1348 2HD2 LEU 72 HD22 LEU 72 -0.770 10.696 -4.861 1349 3HD2 LEU 72 HD23 LEU 72 0.727 11.381 -5.524 1350 H ASN 73 HN ASN 73 -2.150 13.525 -4.148 1351 HA ASN 73 HA ASN 73 -1.582 13.120 -6.907 1352 1HB ASN 73 HB2 ASN 73 -3.751 12.658 -6.921 1353 2HB ASN 73 HB3 ASN 73 -3.959 13.236 -5.298 1354 1HD2 ASN 73 HD21 ASN 73 -4.427 15.618 -5.030 1355 2HD2 ASN 73 HD22 ASN 73 -5.308 16.432 -6.314 1356 H ASN 74 HN ASN 74 -1.555 15.950 -4.926 1357 HA ASN 74 HA ASN 74 -1.720 17.925 -7.002 1358 1HB ASN 74 HB2 ASN 74 -2.119 17.892 -4.333 1359 2HB ASN 74 HB3 ASN 74 -0.474 18.522 -4.338 1360 1HD2 ASN 74 HD22 ASN 74 -3.019 19.734 -3.496 1361 2HD2 ASN 74 HD21 ASN 74 -3.207 21.204 -4.445 1362 H ALA 75 HN ALA 75 0.912 16.109 -5.493 1363 HA ALA 75 HA ALA 75 3.061 17.776 -5.978 1364 1HB ALA 75 HB1 ALA 75 3.064 15.738 -4.515 1365 2HB ALA 75 HB2 ALA 75 3.065 14.720 -5.970 1366 3HB ALA 75 HB3 ALA 75 4.438 15.779 -5.624 1367 H ASP 76 HN ASP 76 4.938 17.243 -7.390 1368 HA ASP 76 HA ASP 76 4.120 16.781 -10.215 1369 1HB ASP 76 HB2 ASP 76 5.615 18.704 -9.662 1370 2HB ASP 76 HB3 ASP 76 6.819 17.560 -9.047 1371 H LEU 77 HN LEU 77 5.872 15.254 -7.501 1372 HA LEU 77 HA LEU 77 6.379 12.875 -9.127 1373 1HB LEU 77 HB2 LEU 77 8.317 14.740 -8.954 1374 2HB LEU 77 HB3 LEU 77 8.582 13.974 -7.408 1375 HG LEU 77 HG LEU 77 8.790 12.793 -10.143 1376 1HD1 LEU 77 HD11 LEU 77 10.822 13.224 -7.960 1377 2HD1 LEU 77 HD12 LEU 77 11.165 12.458 -9.538 1378 3HD1 LEU 77 HD13 LEU 77 10.667 14.156 -9.462 1379 1HD2 LEU 77 HD21 LEU 77 9.643 10.685 -9.250 1380 2HD2 LEU 77 HD22 LEU 77 9.070 11.175 -7.636 1381 3HD2 LEU 77 HD23 LEU 77 7.936 10.947 -9.013 1382 H VAL 78 HN VAL 78 6.173 10.999 -7.917 1383 HA VAL 78 HA VAL 78 6.283 11.159 -4.943 1384 HB VAL 78 HB VAL 78 4.867 8.984 -6.442 1385 1HG1 VAL 78 HG11 VAL 78 3.805 8.726 -4.174 1386 2HG1 VAL 78 HG12 VAL 78 5.556 8.479 -4.120 1387 3HG1 VAL 78 HG13 VAL 78 4.852 10.007 -3.559 1388 1HG2 VAL 78 HG21 VAL 78 2.760 10.119 -5.802 1389 2HG2 VAL 78 HG22 VAL 78 3.686 11.595 -5.413 1390 3HG2 VAL 78 HG23 VAL 78 3.653 10.930 -7.068 1391 H VAL 79 HN VAL 79 8.224 10.705 -4.342 1392 HA VAL 79 HA VAL 79 9.853 8.702 -5.752 1393 HB VAL 79 HB VAL 79 10.333 10.503 -3.344 1394 1HG1 VAL 79 HG11 VAL 79 11.994 8.259 -4.529 1395 2HG1 VAL 79 HG12 VAL 79 12.768 9.613 -3.685 1396 3HG1 VAL 79 HG13 VAL 79 11.610 8.577 -2.840 1397 1HG2 VAL 79 HG21 VAL 79 10.381 11.691 -5.494 1398 2HG2 VAL 79 HG22 VAL 79 12.010 11.556 -4.836 1399 3HG2 VAL 79 HG23 VAL 79 11.504 10.485 -6.163 1400 H THR 80 HN THR 80 9.354 6.602 -5.299 1401 HA THR 80 HA THR 80 8.106 5.931 -2.700 1402 HB THR 80 HB THR 80 9.135 4.071 -4.887 1403 HG1 THR 80 HG1 THR 80 7.286 5.748 -5.139 1404 1HG2 THR 80 HG21 THR 80 8.810 2.937 -2.717 1405 2HG2 THR 80 HG22 THR 80 7.190 3.658 -2.573 1406 3HG2 THR 80 HG23 THR 80 7.542 2.469 -3.861 1407 H LEU 81 HN LEU 81 9.332 5.444 -0.916 1408 HA LEU 81 HA LEU 81 12.283 5.317 -1.248 1409 1HB LEU 81 HB2 LEU 81 11.229 7.594 -0.710 1410 2HB LEU 81 HB3 LEU 81 10.743 6.890 0.823 1411 HG LEU 81 HG LEU 81 13.302 6.269 1.078 1412 1HD1 LEU 81 HD11 LEU 81 14.838 7.813 -0.064 1413 2HD1 LEU 81 HD12 LEU 81 14.005 6.788 -1.237 1414 3HD1 LEU 81 HD13 LEU 81 13.500 8.474 -1.022 1415 1HD2 LEU 81 HD21 LEU 81 11.997 7.961 2.357 1416 2HD2 LEU 81 HD22 LEU 81 13.708 8.375 2.149 1417 3HD2 LEU 81 HD23 LEU 81 12.455 9.186 1.176 1418 H SER 82 HN SER 82 11.252 2.889 -1.014 1419 HA SER 82 HA SER 82 12.327 2.072 1.522 1420 1HB SER 82 HB2 SER 82 9.430 1.377 0.797 1421 2HB SER 82 HB3 SER 82 10.357 0.588 2.085 1422 HG SER 82 HG SER 82 10.399 3.316 2.189 1423 H GLY 83 HN GLY 83 12.355 -0.410 1.542 1424 1HA GLY 83 HA2 GLY 83 12.298 -1.697 -1.142 1425 2HA GLY 83 HA3 GLY 83 13.646 -1.973 -0.007 1426 H ASP 84 HN ASP 84 10.124 -1.522 0.420 1427 HA ASP 84 HA ASP 84 9.665 -4.055 1.799 1428 1HB ASP 84 HB2 ASP 84 10.682 -2.711 3.574 1429 2HB ASP 84 HB3 ASP 84 9.693 -1.316 3.141 1430 H ALA 85 HN ALA 85 7.276 -4.120 2.364 1431 HA ALA 85 HA ALA 85 5.679 -2.540 0.381 1432 1HB ALA 85 HB1 ALA 85 5.505 -5.517 1.005 1433 2HB ALA 85 HB2 ALA 85 4.506 -4.625 -0.160 1434 3HB ALA 85 HB3 ALA 85 6.246 -4.800 -0.448 1435 H ALA 86 HN ALA 86 6.017 -2.951 3.664 1436 HA ALA 86 HA ALA 86 3.261 -3.255 4.460 1437 1HB ALA 86 HB1 ALA 86 5.053 -3.679 6.044 1438 2HB ALA 86 HB2 ALA 86 5.683 -2.039 5.840 1439 3HB ALA 86 HB3 ALA 86 4.107 -2.289 6.619 1440 H ASP 87 HN ASP 87 4.984 -0.674 2.952 1441 HA ASP 87 HA ASP 87 3.716 1.613 3.927 1442 1HB ASP 87 HB2 ASP 87 4.800 2.743 2.231 1443 2HB ASP 87 HB3 ASP 87 5.833 1.341 2.464 1444 H LYS 88 HN LYS 88 1.965 -0.743 2.371 1445 HA LYS 88 HA LYS 88 -0.230 -0.771 1.757 1446 1HB LYS 88 HB2 LYS 88 -0.391 1.534 2.947 1447 2HB LYS 88 HB3 LYS 88 -0.334 2.222 1.329 1448 1HG LYS 88 HG2 LYS 88 -2.414 1.022 0.754 1449 2HG LYS 88 HG3 LYS 88 -2.457 0.294 2.365 1450 1HD LYS 88 HD2 LYS 88 -2.399 3.315 1.886 1451 2HD LYS 88 HD3 LYS 88 -3.893 2.394 1.979 1452 1HE LYS 88 HE2 LYS 88 -3.417 1.665 4.254 1453 2HE LYS 88 HE3 LYS 88 -1.853 2.479 4.196 1454 1HZ LYS 88 HZ1 LYS 88 -3.156 4.598 3.864 1455 2HZ LYS 88 HZ2 LYS 88 -4.516 3.765 4.231 1456 3HZ LYS 88 HZ3 LYS 88 -3.310 3.919 5.331 1457 H CYS 89 HN CYS 89 2.389 -0.203 0.034 1458 HA CYS 89 HA CYS 89 3.058 0.264 -2.022 1459 1HB CYS 89 HB2 CYS 89 0.918 -1.620 -2.977 1460 2HB CYS 89 HB3 CYS 89 2.548 -1.421 -3.581 1461 HA PRO 90 HA PRO 90 -0.834 2.911 -2.723 1462 1HB PRO 90 HB2 PRO 90 1.213 5.119 -2.833 1463 2HB PRO 90 HB3 PRO 90 -0.427 5.181 -2.134 1464 1HG PRO 90 HG2 PRO 90 1.658 4.921 -0.463 1465 2HG PRO 90 HG3 PRO 90 0.227 3.869 -0.242 1466 1HD PRO 90 HD2 PRO 90 2.818 3.212 -1.684 1467 2HD PRO 90 HD3 PRO 90 1.984 2.284 -0.418 1468 H MET 91 HN MET 91 -1.637 3.292 -4.822 1469 HA MET 91 HA MET 91 0.258 2.667 -6.928 1470 1HB MET 91 HB2 MET 91 -1.788 2.568 -8.384 1471 2HB MET 91 HB3 MET 91 -1.661 1.432 -7.071 1472 1HG MET 91 HG2 MET 91 -3.826 2.149 -6.958 1473 2HG MET 91 HG3 MET 91 -3.105 3.086 -5.696 1474 1HE MET 91 HE1 MET 91 -5.974 5.045 -7.259 1475 2HE MET 91 HE2 MET 91 -5.761 3.286 -7.453 1476 3HE MET 91 HE3 MET 91 -5.280 3.995 -5.920 1477 H THR 92 HN THR 92 -0.488 5.681 -5.657 1478 HA THR 92 HA THR 92 -0.146 7.767 -6.382 1479 HB THR 92 HB THR 92 1.923 8.128 -7.645 1480 HG1 THR 92 HG1 THR 92 1.622 6.201 -8.950 1481 1HG2 THR 92 HG21 THR 92 2.133 5.957 -5.505 1482 2HG2 THR 92 HG22 THR 92 3.435 7.031 -6.037 1483 3HG2 THR 92 HG23 THR 92 2.010 7.696 -5.212 1484 HA PRO 93 HA PRO 93 -2.971 7.385 -9.877 1485 1HB PRO 93 HB2 PRO 93 -4.339 9.774 -9.628 1486 2HB PRO 93 HB3 PRO 93 -4.622 8.348 -8.570 1487 1HG PRO 93 HG2 PRO 93 -2.820 10.704 -7.989 1488 2HG PRO 93 HG3 PRO 93 -4.120 10.001 -6.963 1489 1HD PRO 93 HD2 PRO 93 -1.550 9.294 -6.606 1490 2HD PRO 93 HD3 PRO 93 -2.820 8.029 -6.548 1491 HA PRO 94 HA PRO 94 -0.371 8.938 -12.922 1492 1HB PRO 94 HB2 PRO 94 -1.990 9.220 -15.173 1493 2HB PRO 94 HB3 PRO 94 -1.457 7.673 -14.456 1494 1HG PRO 94 HG2 PRO 94 -4.057 9.160 -13.960 1495 2HG PRO 94 HG3 PRO 94 -3.831 7.426 -14.374 1496 1HD PRO 94 HD2 PRO 94 -4.166 8.160 -11.811 1497 2HD PRO 94 HD3 PRO 94 -2.904 6.953 -12.231 1498 H HIS 95 HN HIS 95 -2.278 11.239 -11.555 1499 HA HIS 95 HA HIS 95 -1.791 13.474 -13.335 1500 1HB HIS 95 HB2 HIS 95 -2.318 13.441 -10.336 1501 2HB HIS 95 HB3 HIS 95 -2.466 14.825 -11.409 1502 HD1 HIS 95 HD1 HIS 95 -4.933 13.916 -9.662 1503 HD2 HIS 95 HD2 HIS 95 -4.165 12.793 -13.655 1504 HE1 HIS 95 HE1 HIS 95 -7.166 13.208 -10.656 1505 H VAL 96 HN VAL 96 0.328 11.501 -11.527 1506 HA VAL 96 HA VAL 96 2.293 13.695 -11.084 1507 HB VAL 96 HB VAL 96 1.919 11.311 -9.235 1508 1HG1 VAL 96 HG11 VAL 96 3.947 12.597 -8.900 1509 2HG1 VAL 96 HG12 VAL 96 3.044 14.112 -8.917 1510 3HG1 VAL 96 HG13 VAL 96 2.845 12.986 -7.572 1511 1HG2 VAL 96 HG21 VAL 96 -0.311 12.340 -9.188 1512 2HG2 VAL 96 HG22 VAL 96 0.563 12.651 -7.707 1513 3HG2 VAL 96 HG23 VAL 96 0.426 13.945 -8.921 1514 H LYS 97 HN LYS 97 4.536 13.083 -11.281 1515 HA LYS 97 HA LYS 97 5.172 10.709 -12.894 1516 1HB LYS 97 HB2 LYS 97 6.230 13.036 -13.069 1517 2HB LYS 97 HB3 LYS 97 7.026 12.695 -11.538 1518 1HG LYS 97 HG2 LYS 97 7.365 10.453 -13.371 1519 2HG LYS 97 HG3 LYS 97 7.814 11.950 -14.198 1520 1HD LYS 97 HD2 LYS 97 8.815 10.989 -11.548 1521 2HD LYS 97 HD3 LYS 97 9.649 10.665 -13.063 1522 1HE LYS 97 HE2 LYS 97 9.190 13.464 -11.895 1523 2HE LYS 97 HE3 LYS 97 10.704 12.567 -11.787 1524 1HZ LYS 97 HZ1 LYS 97 10.882 12.703 -14.198 1525 2HZ LYS 97 HZ2 LYS 97 9.480 13.557 -14.291 1526 3HZ LYS 97 HZ3 LYS 97 10.764 14.182 -13.481 1527 H ARG 98 HN ARG 98 6.653 8.998 -11.983 1528 HA ARG 98 HA ARG 98 6.975 8.980 -9.073 1529 1HB ARG 98 HB2 ARG 98 4.682 7.981 -9.449 1530 2HB ARG 98 HB3 ARG 98 5.448 6.739 -10.446 1531 1HG ARG 98 HG2 ARG 98 6.947 6.547 -8.104 1532 2HG ARG 98 HG3 ARG 98 5.413 7.117 -7.474 1533 1HD ARG 98 HD2 ARG 98 4.333 5.197 -8.814 1534 2HD ARG 98 HD3 ARG 98 5.959 4.644 -9.191 1535 HE ARG 98 HE ARG 98 6.369 4.475 -6.726 1536 1HH1 ARG 98 HH11 ARG 98 2.974 4.458 -7.750 1537 2HH1 ARG 98 HH12 ARG 98 2.472 3.510 -6.390 1538 1HH2 ARG 98 HH21 ARG 98 5.613 3.568 -4.858 1539 2HH2 ARG 98 HH22 ARG 98 3.955 3.024 -4.711 1540 H GLU 99 HN GLU 99 8.781 7.839 -8.524 1541 HA GLU 99 HA GLU 99 9.798 5.701 -10.191 1542 1HB GLU 99 HB2 GLU 99 11.349 8.270 -9.691 1543 2HB GLU 99 HB3 GLU 99 12.165 6.737 -10.009 1544 1HG GLU 99 HG2 GLU 99 10.364 8.293 -11.896 1545 2HG GLU 99 HG3 GLU 99 12.104 8.124 -11.985 1546 H HIS 100 HN HIS 100 10.950 4.280 -8.825 1547 HA HIS 100 HA HIS 100 10.850 4.824 -5.933 1548 1HB HIS 100 HB2 HIS 100 11.755 2.479 -5.782 1549 2HB HIS 100 HB3 HIS 100 10.146 2.641 -6.466 1550 HD1 HIS 100 HD1 HIS 100 13.365 2.997 -8.593 1551 HD2 HIS 100 HD2 HIS 100 10.086 0.451 -7.900 1552 HE1 HIS 100 HE1 HIS 100 13.456 1.196 -10.408 1553 H TRP 101 HN TRP 101 12.579 5.374 -4.749 1554 HA TRP 101 HA TRP 101 15.298 5.177 -5.949 1555 1HB TRP 101 HB2 TRP 101 14.187 7.607 -4.509 1556 2HB TRP 101 HB3 TRP 101 15.857 7.376 -4.972 1557 HD1 TRP 101 HD1 TRP 101 12.418 8.006 -6.600 1558 HE1 TRP 101 HE1 TRP 101 12.748 9.032 -8.892 1559 HE3 TRP 101 HE3 TRP 101 17.496 7.429 -7.008 1560 HZ2 TRP 101 HZ2 TRP 101 14.836 9.032 -10.899 1561 HZ3 TRP 101 HZ3 TRP 101 18.615 7.877 -9.174 1562 HH2 TRP 101 HH2 TRP 101 17.296 8.644 -11.136 1563 H GLY 102 HN GLY 102 13.226 4.484 -3.302 1564 1HA GLY 102 HA2 GLY 102 15.431 4.208 -1.352 1565 2HA GLY 102 HA3 GLY 102 13.753 3.712 -1.129 1566 H PHE 103 HN PHE 103 15.744 1.993 -0.397 1567 HA PHE 103 HA PHE 103 15.407 -0.280 -2.254 1568 1HB PHE 103 HB2 PHE 103 17.815 -0.667 -2.384 1569 2HB PHE 103 HB3 PHE 103 17.422 0.907 -3.042 1570 HD1 PHE 103 HD1 PHE 103 17.924 3.011 -1.686 1571 HD2 PHE 103 HD2 PHE 103 19.285 -0.904 -0.474 1572 HE1 PHE 103 HE1 PHE 103 19.511 4.051 -0.102 1573 HE2 PHE 103 HE2 PHE 103 20.914 0.149 1.073 1574 HZ PHE 103 HZ PHE 103 21.040 2.623 1.254 1575 H ASP 104 HN ASP 104 15.439 0.879 0.951 1576 HA ASP 104 HA ASP 104 15.488 -1.736 2.160 1577 1HB ASP 104 HB2 ASP 104 17.953 -1.199 1.837 1578 2HB ASP 104 HB3 ASP 104 17.716 0.249 2.813 1579 H ASP 105 HN ASP 105 15.468 -1.197 4.715 1580 HA ASP 105 HA ASP 105 14.306 1.454 5.303 1581 1HB ASP 105 HB2 ASP 105 12.341 0.137 5.097 1582 2HB ASP 105 HB3 ASP 105 13.036 -1.190 6.021 1583 HA PRO 106 HA PRO 106 17.669 0.570 8.167 1584 1HB PRO 106 HB2 PRO 106 18.058 3.062 9.204 1585 2HB PRO 106 HB3 PRO 106 18.537 2.603 7.545 1586 1HG PRO 106 HG2 PRO 106 16.072 4.081 8.451 1587 2HG PRO 106 HG3 PRO 106 17.133 4.445 7.052 1588 1HD PRO 106 HD2 PRO 106 14.747 3.031 6.895 1589 2HD PRO 106 HD3 PRO 106 16.094 2.808 5.738 1590 H ALA 107 HN ALA 107 14.438 1.724 9.113 1591 HA ALA 107 HA ALA 107 14.782 1.539 11.929 1592 1HB ALA 107 HB1 ALA 107 12.282 1.070 10.245 1593 2HB ALA 107 HB2 ALA 107 12.337 1.467 11.971 1594 3HB ALA 107 HB3 ALA 107 12.860 2.664 10.773 1595 H ARG 108 HN ARG 108 15.158 -0.843 9.611 1596 HA ARG 108 HA ARG 108 14.005 -3.073 11.230 1597 1HB ARG 108 HB2 ARG 108 15.186 -3.235 8.449 1598 2HB ARG 108 HB3 ARG 108 14.138 -4.408 9.236 1599 1HG ARG 108 HG2 ARG 108 13.326 -1.621 8.329 1600 2HG ARG 108 HG3 ARG 108 13.020 -3.088 7.427 1601 1HD ARG 108 HD2 ARG 108 11.968 -3.188 10.197 1602 2HD ARG 108 HD3 ARG 108 11.305 -1.857 9.269 1603 HE ARG 108 HE ARG 108 10.929 -4.733 8.797 1604 1HH1 ARG 108 HH11 ARG 108 10.431 -1.424 7.483 1605 2HH1 ARG 108 HH12 ARG 108 9.186 -1.959 6.376 1606 1HH2 ARG 108 HH21 ARG 108 9.372 -5.368 7.204 1607 2HH2 ARG 108 HH22 ARG 108 8.736 -4.204 6.085 1608 H ALA 109 HN ALA 109 16.769 -1.449 11.328 1609 HA ALA 109 HA ALA 109 18.935 -3.003 10.893 1610 1HB ALA 109 HB1 ALA 109 18.917 -0.712 11.938 1611 2HB ALA 109 HB2 ALA 109 18.432 -1.470 13.473 1612 3HB ALA 109 HB3 ALA 109 20.002 -1.869 12.745 1613 H GLN 110 HN GLN 110 20.116 -4.544 11.947 1614 HA GLN 110 HA GLN 110 18.720 -6.756 12.822 1615 1HB GLN 110 HB2 GLN 110 20.996 -6.929 11.937 1616 2HB GLN 110 HB3 GLN 110 21.636 -6.015 13.308 1617 1HG GLN 110 HG2 GLN 110 22.160 -8.383 13.503 1618 2HG GLN 110 HG3 GLN 110 21.199 -7.809 14.849 1619 1HE2 GLN 110 HE22 GLN 110 18.905 -8.462 14.986 1620 2HE2 GLN 110 HE21 GLN 110 18.405 -9.948 14.195 1621 H GLY 111 HN GLY 111 20.391 -4.311 14.820 1622 1HA GLY 111 HA2 GLY 111 18.745 -3.724 16.624 1623 2HA GLY 111 HA3 GLY 111 18.968 -5.430 17.159 1624 H THR 112 HN THR 112 21.907 -5.076 16.383 1625 HA THR 112 HA THR 112 22.793 -4.515 19.080 1626 HB THR 112 HB THR 112 25.022 -4.973 18.218 1627 HG1 THR 112 HG1 THR 112 25.253 -5.387 15.973 1628 1HG2 THR 112 HG21 THR 112 23.374 -6.876 18.527 1629 2HG2 THR 112 HG22 THR 112 23.119 -6.836 16.755 1630 3HG2 THR 112 HG23 THR 112 24.729 -7.204 17.416 1631 H GLU 113 HN GLU 113 24.543 -2.869 19.484 1632 HA GLU 113 HA GLU 113 23.547 -0.340 18.880 1633 1HB GLU 113 HB2 GLU 113 26.370 -1.184 19.724 1634 2HB GLU 113 HB3 GLU 113 25.731 0.470 19.862 1635 1HG GLU 113 HG2 GLU 113 23.908 -0.423 21.355 1636 2HG GLU 113 HG3 GLU 113 24.687 -2.006 21.299 1637 H GLU 114 HN GLU 114 26.137 -2.242 17.403 1638 HA GLU 114 HA GLU 114 27.052 -0.199 15.620 1639 1HB GLU 114 HB2 GLU 114 28.179 -2.238 14.516 1640 2HB GLU 114 HB3 GLU 114 28.701 -1.779 16.150 1641 1HG GLU 114 HG2 GLU 114 27.213 -3.601 17.056 1642 2HG GLU 114 HG3 GLU 114 26.860 -4.050 15.369 1643 H GLU 115 HN GLU 115 24.680 -3.019 15.341 1644 HA GLU 115 HA GLU 115 24.651 -2.600 12.488 1645 1HB GLU 115 HB2 GLU 115 22.920 -4.241 14.326 1646 2HB GLU 115 HB3 GLU 115 22.690 -4.159 12.577 1647 1HG GLU 115 HG2 GLU 115 25.437 -4.840 13.699 1648 2HG GLU 115 HG3 GLU 115 24.182 -6.077 13.587 1649 H LYS 116 HN LYS 116 22.716 -1.446 15.238 1650 HA LYS 116 HA LYS 116 20.712 -0.076 13.746 1651 1HB LYS 116 HB2 LYS 116 22.050 0.395 16.446 1652 2HB LYS 116 HB3 LYS 116 20.828 1.502 15.844 1653 1HG LYS 116 HG2 LYS 116 20.155 -1.440 15.936 1654 2HG LYS 116 HG3 LYS 116 20.183 -0.503 17.443 1655 1HD LYS 116 HD2 LYS 116 18.565 1.080 16.615 1656 2HD LYS 116 HD3 LYS 116 18.684 0.437 14.970 1657 1HE LYS 116 HE2 LYS 116 16.640 -0.276 15.831 1658 2HE LYS 116 HE3 LYS 116 17.697 -1.692 15.744 1659 1HZ LYS 116 HZ1 LYS 116 16.468 -1.626 17.839 1660 2HZ LYS 116 HZ2 LYS 116 18.057 -1.458 18.167 1661 3HZ LYS 116 HZ3 LYS 116 17.061 -0.162 18.214 1662 H TRP 117 HN TRP 117 23.805 1.239 15.017 1663 HA TRP 117 HA TRP 117 23.402 3.696 13.658 1664 1HB TRP 117 HB2 TRP 117 25.051 3.059 15.571 1665 2HB TRP 117 HB3 TRP 117 26.160 2.598 14.287 1666 HD1 TRP 117 HD1 TRP 117 25.520 5.166 12.374 1667 HE1 TRP 117 HE1 TRP 117 26.349 7.457 13.007 1668 HE3 TRP 117 HE3 TRP 117 26.275 4.354 17.386 1669 HZ2 TRP 117 HZ2 TRP 117 27.329 8.770 15.358 1670 HZ3 TRP 117 HZ3 TRP 117 27.201 6.169 18.800 1671 HH2 TRP 117 HH2 TRP 117 27.748 8.387 17.807 1672 H ALA 118 HN ALA 118 25.027 0.679 12.626 1673 HA ALA 118 HA ALA 118 26.106 1.679 10.228 1674 1HB ALA 118 HB1 ALA 118 25.199 -1.136 11.027 1675 2HB ALA 118 HB2 ALA 118 26.264 -0.773 9.645 1676 3HB ALA 118 HB3 ALA 118 26.800 -0.459 11.314 1677 H PHE 119 HN PHE 119 22.874 0.200 10.835 1678 HA PHE 119 HA PHE 119 22.152 0.182 8.049 1679 1HB PHE 119 HB2 PHE 119 20.663 -0.079 10.644 1680 2HB PHE 119 HB3 PHE 119 19.746 0.354 9.226 1681 HD1 PHE 119 HD1 PHE 119 18.583 -1.408 8.268 1682 HD2 PHE 119 HD2 PHE 119 22.514 -2.172 9.885 1683 HE1 PHE 119 HE1 PHE 119 18.373 -3.791 7.667 1684 HE2 PHE 119 HE2 PHE 119 22.285 -4.560 9.298 1685 HZ PHE 119 HZ PHE 119 20.213 -5.384 8.192 1686 H PHE 120 HN PHE 120 21.684 2.547 10.738 1687 HA PHE 120 HA PHE 120 20.141 4.389 9.222 1688 1HB PHE 120 HB2 PHE 120 22.130 5.212 11.356 1689 2HB PHE 120 HB3 PHE 120 20.664 6.036 10.863 1690 HD1 PHE 120 HD1 PHE 120 21.383 5.684 13.639 1691 HD2 PHE 120 HD2 PHE 120 19.184 2.987 11.078 1692 HE1 PHE 120 HE1 PHE 120 20.279 4.671 15.620 1693 HE2 PHE 120 HE2 PHE 120 18.085 2.009 13.044 1694 HZ PHE 120 HZ PHE 120 18.618 2.870 15.326 1695 H GLN 121 HN GLN 121 23.702 4.272 9.829 1696 HA GLN 121 HA GLN 121 24.301 6.609 8.431 1697 1HB GLN 121 HB2 GLN 121 25.691 5.525 10.114 1698 2HB GLN 121 HB3 GLN 121 26.016 4.159 9.036 1699 1HG GLN 121 HG2 GLN 121 27.253 5.568 7.508 1700 2HG GLN 121 HG3 GLN 121 26.727 7.033 8.351 1701 1HE2 GLN 121 HE22 GLN 121 27.327 7.169 10.789 1702 2HE2 GLN 121 HE21 GLN 121 28.924 6.575 11.203 1703 H ARG 122 HN ARG 122 24.414 3.170 7.260 1704 HA ARG 122 HA ARG 122 25.520 3.900 4.754 1705 1HB ARG 122 HB2 ARG 122 25.607 1.611 5.661 1706 2HB ARG 122 HB3 ARG 122 23.847 1.454 5.518 1707 1HG ARG 122 HG2 ARG 122 23.991 1.628 3.068 1708 2HG ARG 122 HG3 ARG 122 25.736 1.941 3.166 1709 1HD ARG 122 HD2 ARG 122 26.071 -0.313 4.163 1710 2HD ARG 122 HD3 ARG 122 24.329 -0.597 4.094 1711 HE ARG 122 HE ARG 122 24.423 -0.979 1.837 1712 1HH1 ARG 122 HH11 ARG 122 27.597 0.240 2.872 1713 2HH1 ARG 122 HH12 ARG 122 28.380 -0.126 1.381 1714 1HH2 ARG 122 HH21 ARG 122 25.468 -1.468 -0.145 1715 2HH2 ARG 122 HH22 ARG 122 27.140 -1.125 -0.368 1716 H VAL 123 HN VAL 123 22.076 3.305 5.739 1717 HA VAL 123 HA VAL 123 21.076 3.833 3.109 1718 HB VAL 123 HB VAL 123 19.675 3.976 5.803 1719 1HG1 VAL 123 HG11 VAL 123 18.382 5.239 4.160 1720 2HG1 VAL 123 HG12 VAL 123 18.547 3.938 2.962 1721 3HG1 VAL 123 HG13 VAL 123 17.584 3.691 4.431 1722 1HG2 VAL 123 HG21 VAL 123 18.802 1.738 5.166 1723 2HG2 VAL 123 HG22 VAL 123 19.750 1.782 3.665 1724 3HG2 VAL 123 HG23 VAL 123 20.564 1.701 5.237 1725 H ARG 124 HN ARG 124 21.669 5.993 5.950 1726 HA ARG 124 HA ARG 124 20.557 8.317 4.850 1727 1HB ARG 124 HB2 ARG 124 21.241 8.094 7.177 1728 2HB ARG 124 HB3 ARG 124 22.931 7.916 6.703 1729 1HG ARG 124 HG2 ARG 124 22.225 10.397 5.624 1730 2HG ARG 124 HG3 ARG 124 21.289 10.328 7.117 1731 1HD ARG 124 HD2 ARG 124 23.358 11.341 7.675 1732 2HD ARG 124 HD3 ARG 124 23.464 9.687 8.280 1733 HE ARG 124 HE ARG 124 24.529 10.276 5.565 1734 1HH1 ARG 124 HH11 ARG 124 25.282 9.351 8.911 1735 2HH1 ARG 124 HH12 ARG 124 26.998 9.478 8.690 1736 1HH2 ARG 124 HH21 ARG 124 26.809 10.221 5.227 1737 2HH2 ARG 124 HH22 ARG 124 27.864 9.817 6.518 1738 H ASP 125 HN ASP 125 23.922 7.074 4.460 1739 HA ASP 125 HA ASP 125 24.895 9.280 2.984 1740 1HB ASP 125 HB2 ASP 125 26.349 7.512 3.857 1741 2HB ASP 125 HB3 ASP 125 25.615 6.328 2.774 1742 H GLU 126 HN GLU 126 23.202 6.321 1.851 1743 HA GLU 126 HA GLU 126 23.374 7.109 -0.912 1744 1HB GLU 126 HB2 GLU 126 23.240 4.763 -0.015 1745 2HB GLU 126 HB3 GLU 126 21.560 5.061 0.423 1746 1HG GLU 126 HG2 GLU 126 21.740 3.858 -1.717 1747 2HG GLU 126 HG3 GLU 126 20.982 5.431 -1.928 1748 H ILE 127 HN ILE 127 20.802 7.418 1.582 1749 HA ILE 127 HA ILE 127 18.760 8.477 -0.085 1750 HB ILE 127 HB ILE 127 19.356 8.369 2.845 1751 1HG1 ILE 127 HG12 ILE 127 16.949 7.817 1.062 1752 2HG1 ILE 127 HG13 ILE 127 18.067 6.630 1.730 1753 1HG2 ILE 127 HG21 ILE 127 17.322 10.361 1.841 1754 2HG2 ILE 127 HG22 ILE 127 17.588 9.854 3.540 1755 3HG2 ILE 127 HG23 ILE 127 18.839 10.734 2.707 1756 1HD1 ILE 127 HD11 ILE 127 17.198 7.239 4.042 1757 2HD1 ILE 127 HD12 ILE 127 15.976 8.256 3.244 1758 3HD1 ILE 127 HD13 ILE 127 15.999 6.512 2.953 1759 H GLY 128 HN GLY 128 21.396 10.172 1.723 1760 1HA GLY 128 HA2 GLY 128 20.603 12.774 0.874 1761 2HA GLY 128 HA3 GLY 128 22.225 12.282 1.443 1762 H ASN 129 HN ASN 129 22.956 10.432 -0.567 1763 HA ASN 129 HA ASN 129 23.797 12.069 -2.708 1764 1HB ASN 129 HB2 ASN 129 24.951 9.970 -2.295 1765 2HB ASN 129 HB3 ASN 129 23.449 9.053 -2.385 1766 1HD2 ASN 129 HD22 ASN 129 23.322 7.781 -4.239 1767 2HD2 ASN 129 HD21 ASN 129 23.922 8.313 -5.788 1768 H ARG 130 HN ARG 130 21.058 9.770 -2.597 1769 HA ARG 130 HA ARG 130 20.263 10.343 -5.293 1770 1HB ARG 130 HB2 ARG 130 18.753 9.107 -2.949 1771 2HB ARG 130 HB3 ARG 130 18.074 9.251 -4.588 1772 1HG ARG 130 HG2 ARG 130 19.938 7.985 -5.543 1773 2HG ARG 130 HG3 ARG 130 20.750 7.928 -3.982 1774 1HD ARG 130 HD2 ARG 130 18.831 6.556 -3.093 1775 2HD ARG 130 HD3 ARG 130 18.209 6.479 -4.761 1776 HE ARG 130 HE ARG 130 21.040 5.795 -4.382 1777 1HH1 ARG 130 HH11 ARG 130 17.801 4.345 -4.255 1778 2HH1 ARG 130 HH12 ARG 130 18.334 2.781 -4.783 1779 1HH2 ARG 130 HH21 ARG 130 21.742 3.751 -5.087 1780 2HH2 ARG 130 HH22 ARG 130 20.653 2.418 -5.170 1781 H LEU 131 HN LEU 131 19.207 11.801 -2.159 1782 HA LEU 131 HA LEU 131 17.309 13.513 -3.397 1783 1HB LEU 131 HB2 LEU 131 18.612 13.355 -0.716 1784 2HB LEU 131 HB3 LEU 131 18.063 14.948 -1.188 1785 HG LEU 131 HG LEU 131 16.338 13.791 0.063 1786 1HD1 LEU 131 HD11 LEU 131 15.777 15.403 -1.843 1787 2HD1 LEU 131 HD12 LEU 131 15.331 13.976 -2.796 1788 3HD1 LEU 131 HD13 LEU 131 14.494 14.327 -1.276 1789 1HD2 LEU 131 HD21 LEU 131 15.136 11.845 -0.839 1790 2HD2 LEU 131 HD22 LEU 131 16.277 11.723 -2.179 1791 3HD2 LEU 131 HD23 LEU 131 16.826 11.459 -0.510 1792 H LYS 132 HN LYS 132 20.818 14.015 -2.792 1793 HA LYS 132 HA LYS 132 20.854 16.757 -3.478 1794 1HB LYS 132 HB2 LYS 132 22.622 15.453 -2.339 1795 2HB LYS 132 HB3 LYS 132 22.962 14.591 -3.850 1796 1HG LYS 132 HG2 LYS 132 23.583 16.776 -4.910 1797 2HG LYS 132 HG3 LYS 132 23.316 17.581 -3.355 1798 1HD LYS 132 HD2 LYS 132 25.273 15.309 -3.887 1799 2HD LYS 132 HD3 LYS 132 25.703 17.035 -3.792 1800 1HE LYS 132 HE2 LYS 132 24.828 17.055 -1.429 1801 2HE LYS 132 HE3 LYS 132 24.610 15.305 -1.530 1802 1HZ LYS 132 HZ1 LYS 132 26.724 15.853 -0.510 1803 2HZ LYS 132 HZ2 LYS 132 27.012 15.112 -1.931 1804 3HZ LYS 132 HZ3 LYS 132 27.197 16.732 -1.797 1805 H GLU 133 HN GLU 133 21.043 13.818 -5.555 1806 HA GLU 133 HA GLU 133 21.523 15.204 -7.991 1807 1HB GLU 133 HB2 GLU 133 20.293 12.548 -7.280 1808 2HB GLU 133 HB3 GLU 133 20.111 13.179 -8.913 1809 1HG GLU 133 HG2 GLU 133 22.213 11.702 -7.982 1810 2HG GLU 133 HG3 GLU 133 22.071 12.642 -9.492 1811 H PHE 134 HN PHE 134 18.344 14.713 -6.330 1812 HA PHE 134 HA PHE 134 16.878 15.561 -8.625 1813 1HB PHE 134 HB2 PHE 134 16.177 16.118 -5.722 1814 2HB PHE 134 HB3 PHE 134 15.118 16.465 -7.080 1815 HD1 PHE 134 HD1 PHE 134 13.701 14.747 -8.000 1816 HD2 PHE 134 HD2 PHE 134 16.964 13.809 -5.414 1817 HE1 PHE 134 HE1 PHE 134 12.841 12.403 -7.756 1818 HE2 PHE 134 HE2 PHE 134 16.148 11.431 -5.187 1819 HZ PHE 134 HZ PHE 134 14.070 10.753 -6.375 1820 H ALA 135 HN ALA 135 18.651 17.418 -6.223 1821 HA ALA 135 HA ALA 135 17.731 19.987 -6.956 1822 1HB ALA 135 HB1 ALA 135 19.265 20.744 -5.422 1823 2HB ALA 135 HB2 ALA 135 19.366 19.021 -4.973 1824 3HB ALA 135 HB3 ALA 135 20.576 19.710 -6.045 1825 H GLU 136 HN GLU 136 20.137 17.819 -8.309 1826 HA GLU 136 HA GLU 136 21.409 19.806 -9.982 1827 1HB GLU 136 HB2 GLU 136 21.813 16.822 -9.656 1828 2HB GLU 136 HB3 GLU 136 22.786 17.827 -10.723 1829 1HG GLU 136 HG2 GLU 136 22.522 18.345 -7.734 1830 2HG GLU 136 HG3 GLU 136 23.762 17.317 -8.429 1831 H THR 137 HN THR 137 19.439 16.944 -10.343 1832 HA THR 137 HA THR 137 19.394 16.953 -13.238 1833 HB THR 137 HB THR 137 18.135 14.788 -12.878 1834 HG1 THR 137 HG1 THR 137 18.469 15.330 -10.136 1835 1HG2 THR 137 HG21 THR 137 19.956 13.588 -11.724 1836 2HG2 THR 137 HG22 THR 137 20.594 14.766 -12.885 1837 3HG2 THR 137 HG23 THR 137 20.639 15.121 -11.153 1838 H GLY 138 HN GLY 138 17.354 18.303 -10.756 1839 1HA GLY 138 HA2 GLY 138 15.393 19.436 -10.815 1840 2HA GLY 138 HA3 GLY 138 15.614 19.643 -12.565 1841 H LYS 139 HN LYS 139 15.305 16.634 -10.656 1842 HA LYS 139 HA LYS 139 13.924 15.309 -12.634 1843 1HB LYS 139 HB2 LYS 139 14.960 14.629 -10.105 1844 2HB LYS 139 HB3 LYS 139 13.260 14.100 -10.099 1845 1HG LYS 139 HG2 LYS 139 13.579 12.957 -12.245 1846 2HG LYS 139 HG3 LYS 139 15.279 13.473 -12.290 1847 1HD LYS 139 HD2 LYS 139 13.952 11.512 -10.405 1848 2HD LYS 139 HD3 LYS 139 15.189 11.199 -11.632 1849 1HE LYS 139 HE2 LYS 139 15.662 12.827 -9.094 1850 2HE LYS 139 HE3 LYS 139 15.971 11.103 -9.243 1851 1HZ LYS 139 HZ1 LYS 139 17.330 13.241 -10.770 1852 2HZ LYS 139 HZ2 LYS 139 17.981 12.256 -9.643 1853 3HZ LYS 139 HZ3 LYS 139 17.523 11.635 -11.081 Start of MODEL 20 1 1H MET 1 H1 MET 1 -24.086 -11.915 -7.626 2 2H MET 1 H2 MET 1 -23.375 -10.842 -8.657 3 3H MET 1 H3 MET 1 -22.450 -11.741 -7.620 4 HA MET 1 HA MET 1 -22.877 -13.724 -8.703 5 1HB MET 1 HB2 MET 1 -25.235 -13.237 -9.315 6 2HB MET 1 HB3 MET 1 -24.681 -12.124 -10.574 7 1HG MET 1 HG2 MET 1 -23.531 -14.004 -11.719 8 2HG MET 1 HG3 MET 1 -23.999 -15.089 -10.410 9 1HE MET 1 HE1 MET 1 -26.845 -13.374 -13.649 10 2HE MET 1 HE2 MET 1 -26.133 -12.310 -12.420 11 3HE MET 1 HE3 MET 1 -25.085 -13.135 -13.600 12 H ALA 2 HN ALA 2 -20.918 -14.013 -9.442 13 HA ALA 2 HA ALA 2 -19.038 -13.984 -10.552 14 1HB ALA 2 HB1 ALA 2 -20.214 -12.078 -12.604 15 2HB ALA 2 HB2 ALA 2 -18.731 -13.032 -12.751 16 3HB ALA 2 HB3 ALA 2 -20.298 -13.855 -12.677 17 H ILE 3 HN ILE 3 -17.110 -12.729 -10.878 18 HA ILE 3 HA ILE 3 -17.003 -10.247 -9.296 19 HB ILE 3 HB ILE 3 -15.009 -12.430 -9.977 20 1HG1 ILE 3 HG12 ILE 3 -14.364 -12.160 -7.619 21 2HG1 ILE 3 HG13 ILE 3 -15.556 -10.883 -7.429 22 1HG2 ILE 3 HG21 ILE 3 -14.280 -9.562 -9.210 23 2HG2 ILE 3 HG22 ILE 3 -13.162 -10.947 -9.172 24 3HG2 ILE 3 HG23 ILE 3 -13.814 -10.395 -10.707 25 1HD1 ILE 3 HD11 ILE 3 -17.365 -12.511 -7.811 26 2HD1 ILE 3 HD12 ILE 3 -16.131 -13.803 -7.984 27 3HD1 ILE 3 HD13 ILE 3 -16.305 -12.895 -6.462 28 H VAL 4 HN VAL 4 -17.670 -8.662 -10.573 29 HA VAL 4 HA VAL 4 -17.188 -8.548 -13.444 30 HB VAL 4 HB VAL 4 -18.328 -6.523 -11.503 31 1HG1 VAL 4 HG11 VAL 4 -19.590 -5.653 -13.482 32 2HG1 VAL 4 HG12 VAL 4 -17.863 -5.410 -13.623 33 3HG1 VAL 4 HG13 VAL 4 -18.649 -6.734 -14.526 34 1HG2 VAL 4 HG21 VAL 4 -19.704 -8.548 -11.346 35 2HG2 VAL 4 HG22 VAL 4 -20.580 -7.323 -12.250 36 3HG2 VAL 4 HG23 VAL 4 -19.792 -8.656 -13.118 37 H LYS 5 HN LYS 5 -16.147 -6.486 -14.300 38 HA LYS 5 HA LYS 5 -13.971 -5.517 -12.588 39 1HB LYS 5 HB2 LYS 5 -13.028 -7.197 -14.121 40 2HB LYS 5 HB3 LYS 5 -13.606 -6.251 -15.507 41 1HG LYS 5 HG2 LYS 5 -12.155 -4.381 -14.894 42 2HG LYS 5 HG3 LYS 5 -11.743 -5.140 -13.352 43 1HD LYS 5 HD2 LYS 5 -9.903 -5.346 -14.930 44 2HD LYS 5 HD3 LYS 5 -10.540 -6.937 -14.496 45 1HE LYS 5 HE2 LYS 5 -11.773 -7.078 -16.611 46 2HE LYS 5 HE3 LYS 5 -11.314 -5.421 -17.029 47 1HZ LYS 5 HZ1 LYS 5 -8.991 -6.136 -17.095 48 2HZ LYS 5 HZ2 LYS 5 -9.422 -7.682 -16.743 49 3HZ LYS 5 HZ3 LYS 5 -9.896 -7.007 -18.150 50 H ALA 6 HN ALA 6 -14.141 -3.449 -12.343 51 HA ALA 6 HA ALA 6 -16.025 -1.771 -13.832 52 1HB ALA 6 HB1 ALA 6 -16.041 -1.276 -11.561 53 2HB ALA 6 HB2 ALA 6 -14.287 -1.500 -11.383 54 3HB ALA 6 HB3 ALA 6 -14.946 -0.070 -12.182 55 H THR 7 HN THR 7 -15.100 0.486 -14.415 56 HA THR 7 HA THR 7 -12.336 0.857 -14.846 57 HB THR 7 HB THR 7 -12.687 -0.489 -16.847 58 HG1 THR 7 HG1 THR 7 -11.265 0.859 -17.458 59 1HG2 THR 7 HG21 THR 7 -14.082 0.352 -18.734 60 2HG2 THR 7 HG22 THR 7 -15.006 -0.255 -17.361 61 3HG2 THR 7 HG23 THR 7 -14.844 1.504 -17.618 62 H ASP 8 HN ASP 8 -12.392 3.043 -16.347 63 HA ASP 8 HA ASP 8 -12.581 5.091 -14.676 64 1HB ASP 8 HB2 ASP 8 -11.500 5.248 -16.789 65 2HB ASP 8 HB3 ASP 8 -13.005 5.001 -17.670 66 H GLN 9 HN GLN 9 -15.444 4.065 -16.509 67 HA GLN 9 HA GLN 9 -17.104 5.915 -14.929 68 1HB GLN 9 HB2 GLN 9 -17.073 5.601 -17.947 69 2HB GLN 9 HB3 GLN 9 -18.492 6.219 -17.094 70 1HG GLN 9 HG2 GLN 9 -17.334 8.140 -16.277 71 2HG GLN 9 HG3 GLN 9 -15.763 7.492 -16.710 72 1HE2 GLN 9 HE22 GLN 9 -14.880 8.060 -18.648 73 2HE2 GLN 9 HE21 GLN 9 -15.762 8.837 -19.962 74 H SER 10 HN SER 10 -16.857 2.889 -16.861 75 HA SER 10 HA SER 10 -19.412 1.934 -16.343 76 1HB SER 10 HB2 SER 10 -16.937 0.202 -16.418 77 2HB SER 10 HB3 SER 10 -18.583 -0.209 -16.928 78 HG SER 10 HG SER 10 -17.318 0.314 -18.738 79 H PHE 11 HN PHE 11 -16.753 2.285 -14.012 80 HA PHE 11 HA PHE 11 -17.595 0.517 -11.971 81 1HB PHE 11 HB2 PHE 11 -15.592 1.852 -11.655 82 2HB PHE 11 HB3 PHE 11 -16.451 3.326 -11.966 83 HD1 PHE 11 HD1 PHE 11 -16.003 0.603 -9.323 84 HD2 PHE 11 HD2 PHE 11 -17.563 4.546 -10.297 85 HE1 PHE 11 HE1 PHE 11 -16.106 1.204 -6.938 86 HE2 PHE 11 HE2 PHE 11 -17.713 5.071 -7.887 87 HZ PHE 11 HZ PHE 11 -16.943 3.414 -6.206 88 H SER 12 HN SER 12 -18.757 3.892 -12.702 89 HA SER 12 HA SER 12 -20.704 3.907 -10.658 90 1HB SER 12 HB2 SER 12 -20.889 5.319 -13.355 91 2HB SER 12 HB3 SER 12 -21.557 5.862 -11.809 92 HG SER 12 HG SER 12 -19.614 6.972 -12.324 93 H ALA 13 HN ALA 13 -20.867 2.980 -14.127 94 HA ALA 13 HA ALA 13 -23.648 2.705 -14.180 95 1HB ALA 13 HB1 ALA 13 -21.597 1.193 -15.859 96 2HB ALA 13 HB2 ALA 13 -23.299 1.474 -16.278 97 3HB ALA 13 HB3 ALA 13 -22.175 2.850 -16.178 98 H GLU 14 HN GLU 14 -21.124 0.371 -13.280 99 HA GLU 14 HA GLU 14 -22.904 -1.837 -12.923 100 1HB GLU 14 HB2 GLU 14 -20.018 -1.345 -12.143 101 2HB GLU 14 HB3 GLU 14 -20.847 -2.856 -11.794 102 1HG GLU 14 HG2 GLU 14 -20.466 -1.671 -14.563 103 2HG GLU 14 HG3 GLU 14 -19.514 -2.984 -13.862 104 H THR 15 HN THR 15 -22.306 0.937 -10.924 105 HA THR 15 HA THR 15 -23.011 -0.566 -8.451 106 HB THR 15 HB THR 15 -21.639 1.127 -7.286 107 HG1 THR 15 HG1 THR 15 -20.627 1.873 -9.776 108 1HG2 THR 15 HG21 THR 15 -20.232 -0.498 -9.449 109 2HG2 THR 15 HG22 THR 15 -19.350 0.559 -8.356 110 3HG2 THR 15 HG23 THR 15 -20.312 -0.778 -7.696 111 H SER 16 HN SER 16 -24.400 1.598 -10.593 112 HA SER 16 HA SER 16 -25.335 3.625 -8.822 113 1HB SER 16 HB2 SER 16 -26.280 2.777 -11.572 114 2HB SER 16 HB3 SER 16 -26.859 4.209 -10.695 115 HG SER 16 HG SER 16 -24.139 3.694 -11.359 116 H GLU 17 HN GLU 17 -26.360 0.392 -8.956 117 HA GLU 17 HA GLU 17 -28.902 1.063 -7.665 118 1HB GLU 17 HB2 GLU 17 -28.600 -0.762 -10.089 119 2HB GLU 17 HB3 GLU 17 -30.032 -0.717 -9.050 120 1HG GLU 17 HG2 GLU 17 -30.345 1.697 -9.621 121 2HG GLU 17 HG3 GLU 17 -28.986 1.589 -10.746 122 H GLY 18 HN GLY 18 -29.755 -0.739 -6.407 123 1HA GLY 18 HA2 GLY 18 -29.630 -2.473 -4.995 124 2HA GLY 18 HA3 GLY 18 -28.493 -3.250 -6.118 125 H VAL 19 HN VAL 19 -27.221 -4.008 -4.445 126 HA VAL 19 HA VAL 19 -25.387 -2.008 -3.249 127 HB VAL 19 HB VAL 19 -26.288 -4.564 -1.846 128 1HG1 VAL 19 HG11 VAL 19 -24.444 -2.283 -0.975 129 2HG1 VAL 19 HG12 VAL 19 -24.995 -3.607 0.061 130 3HG1 VAL 19 HG13 VAL 19 -23.952 -3.953 -1.320 131 1HG2 VAL 19 HG21 VAL 19 -27.041 -1.643 -1.511 132 2HG2 VAL 19 HG22 VAL 19 -28.114 -3.037 -1.718 133 3HG2 VAL 19 HG23 VAL 19 -27.241 -2.803 -0.198 134 H VAL 20 HN VAL 20 -23.355 -2.251 -3.623 135 HA VAL 20 HA VAL 20 -22.469 -4.586 -5.176 136 HB VAL 20 HB VAL 20 -22.239 -1.708 -6.168 137 1HG1 VAL 20 HG11 VAL 20 -21.513 -4.416 -7.355 138 2HG1 VAL 20 HG12 VAL 20 -21.459 -2.882 -8.247 139 3HG1 VAL 20 HG13 VAL 20 -20.388 -3.144 -6.860 140 1HG2 VAL 20 HG21 VAL 20 -23.803 -2.527 -8.010 141 2HG2 VAL 20 HG22 VAL 20 -24.173 -3.912 -6.990 142 3HG2 VAL 20 HG23 VAL 20 -24.552 -2.269 -6.443 143 H LEU 21 HN LEU 21 -20.684 -5.201 -4.327 144 HA LEU 21 HA LEU 21 -18.987 -3.517 -2.582 145 1HB LEU 21 HB2 LEU 21 -19.609 -5.889 -2.064 146 2HB LEU 21 HB3 LEU 21 -18.801 -6.422 -3.519 147 HG LEU 21 HG LEU 21 -17.592 -6.880 -1.442 148 1HD1 LEU 21 HD11 LEU 21 -15.928 -4.913 -3.035 149 2HD1 LEU 21 HD12 LEU 21 -15.407 -6.342 -2.138 150 3HD1 LEU 21 HD13 LEU 21 -16.360 -6.536 -3.616 151 1HD2 LEU 21 HD21 LEU 21 -18.308 -4.842 -0.187 152 2HD2 LEU 21 HD22 LEU 21 -16.574 -5.171 -0.087 153 3HD2 LEU 21 HD23 LEU 21 -17.160 -3.880 -1.153 154 H ALA 22 HN ALA 22 -17.305 -2.291 -3.551 155 HA ALA 22 HA ALA 22 -16.192 -3.339 -6.093 156 1HB ALA 22 HB1 ALA 22 -16.084 -0.455 -5.159 157 2HB ALA 22 HB2 ALA 22 -15.544 -1.103 -6.722 158 3HB ALA 22 HB3 ALA 22 -17.266 -1.075 -6.342 159 H ASP 23 HN ASP 23 -14.040 -3.690 -6.149 160 HA ASP 23 HA ASP 23 -12.422 -3.297 -3.681 161 1HB ASP 23 HB2 ASP 23 -13.197 -5.552 -3.598 162 2HB ASP 23 HB3 ASP 23 -12.938 -5.781 -5.324 163 H PHE 24 HN PHE 24 -10.152 -3.212 -4.077 164 HA PHE 24 HA PHE 24 -9.394 -2.409 -6.857 165 1HB PHE 24 HB2 PHE 24 -8.945 -1.062 -4.192 166 2HB PHE 24 HB3 PHE 24 -8.103 -0.598 -5.648 167 HD1 PHE 24 HD1 PHE 24 -8.982 1.098 -6.999 168 HD2 PHE 24 HD2 PHE 24 -11.639 -0.948 -4.295 169 HE1 PHE 24 HE1 PHE 24 -10.879 2.557 -7.713 170 HE2 PHE 24 HE2 PHE 24 -13.505 0.476 -5.029 171 HZ PHE 24 HZ PHE 24 -13.129 2.248 -6.739 172 H TRP 25 HN TRP 25 -7.732 -3.627 -7.508 173 HA TRP 25 HA TRP 25 -5.868 -4.850 -5.551 174 1HB TRP 25 HB2 TRP 25 -6.236 -6.985 -6.310 175 2HB TRP 25 HB3 TRP 25 -7.865 -6.347 -6.192 176 HD1 TRP 25 HD1 TRP 25 -8.802 -5.353 -8.687 177 HE1 TRP 25 HE1 TRP 25 -8.485 -6.230 -11.044 178 HE3 TRP 25 HE3 TRP 25 -4.804 -8.416 -7.816 179 HZ2 TRP 25 HZ2 TRP 25 -6.546 -7.942 -12.450 180 HZ3 TRP 25 HZ3 TRP 25 -3.699 -9.602 -9.686 181 HH2 TRP 25 HH2 TRP 25 -4.563 -9.368 -12.005 182 H ALA 26 HN ALA 26 -3.786 -5.415 -6.615 183 HA ALA 26 HA ALA 26 -3.487 -5.436 -9.429 184 1HB ALA 26 HB1 ALA 26 -1.689 -3.586 -9.495 185 2HB ALA 26 HB2 ALA 26 -3.361 -3.045 -9.450 186 3HB ALA 26 HB3 ALA 26 -2.376 -3.022 -7.959 187 HA PRO 27 HA PRO 27 -0.303 -8.129 -8.269 188 1HB PRO 27 HB2 PRO 27 1.588 -6.698 -10.145 189 2HB PRO 27 HB3 PRO 27 1.296 -8.458 -9.972 190 1HG PRO 27 HG2 PRO 27 0.108 -7.088 -11.982 191 2HG PRO 27 HG3 PRO 27 -0.860 -8.270 -11.036 192 1HD PRO 27 HD2 PRO 27 -0.770 -5.268 -10.770 193 2HD PRO 27 HD3 PRO 27 -2.174 -6.378 -10.750 194 H TRP 28 HN TRP 28 0.422 -4.757 -7.661 195 HA TRP 28 HA TRP 28 3.054 -4.877 -6.730 196 1HB TRP 28 HB2 TRP 28 0.948 -3.069 -5.585 197 2HB TRP 28 HB3 TRP 28 2.666 -2.763 -5.787 198 HD1 TRP 28 HD1 TRP 28 -0.535 -2.085 -7.270 199 HE1 TRP 28 HE1 TRP 28 -0.395 -1.092 -9.639 200 HE3 TRP 28 HE3 TRP 28 4.357 -3.146 -8.243 201 HZ2 TRP 28 HZ2 TRP 28 1.601 -0.893 -11.732 202 HZ3 TRP 28 HZ3 TRP 28 5.357 -2.568 -10.439 203 HH2 TRP 28 HH2 TRP 28 3.992 -1.446 -12.189 204 H CYS 29 HN CYS 29 0.191 -6.105 -5.053 205 HA CYS 29 HA CYS 29 1.829 -6.282 -2.573 206 1HB CYS 29 HB2 CYS 29 -0.323 -4.541 -3.014 207 2HB CYS 29 HB3 CYS 29 -1.062 -5.861 -2.151 208 H GLY 30 HN GLY 30 1.105 -7.811 -0.986 209 1HA GLY 30 HA2 GLY 30 0.503 -10.401 -2.046 210 2HA GLY 30 HA3 GLY 30 0.599 -9.938 -0.340 211 HA PRO 31 HA PRO 31 -3.806 -9.692 0.220 212 1HB PRO 31 HB2 PRO 31 -3.912 -6.716 -0.281 213 2HB PRO 31 HB3 PRO 31 -4.801 -7.691 0.939 214 1HG PRO 31 HG2 PRO 31 -2.535 -6.374 1.665 215 2HG PRO 31 HG3 PRO 31 -2.769 -8.072 2.192 216 1HD PRO 31 HD2 PRO 31 -1.103 -7.018 -0.091 217 2HD PRO 31 HD3 PRO 31 -0.708 -8.306 1.085 218 H SER 32 HN SER 32 -2.782 -7.880 -2.727 219 HA SER 32 HA SER 32 -5.202 -7.984 -4.124 220 1HB SER 32 HB2 SER 32 -2.450 -8.425 -5.338 221 2HB SER 32 HB3 SER 32 -3.816 -7.527 -6.016 222 HG SER 32 HG SER 32 -2.178 -6.195 -5.202 223 H LYS 33 HN LYS 33 -3.203 -10.621 -3.199 224 HA LYS 33 HA LYS 33 -4.735 -12.415 -5.020 225 1HB LYS 33 HB2 LYS 33 -2.080 -13.187 -3.829 226 2HB LYS 33 HB3 LYS 33 -3.048 -13.999 -5.054 227 1HG LYS 33 HG2 LYS 33 -1.450 -13.095 -6.395 228 2HG LYS 33 HG3 LYS 33 -2.660 -11.806 -6.478 229 1HD LYS 33 HD2 LYS 33 -1.426 -10.578 -4.698 230 2HD LYS 33 HD3 LYS 33 -0.261 -11.905 -4.586 231 1HE LYS 33 HE2 LYS 33 0.335 -11.506 -7.012 232 2HE LYS 33 HE3 LYS 33 -0.743 -10.101 -6.997 233 1HZ LYS 33 HZ1 LYS 33 1.712 -10.464 -5.377 234 2HZ LYS 33 HZ2 LYS 33 1.472 -9.335 -6.539 235 3HZ LYS 33 HZ3 LYS 33 0.644 -9.242 -5.135 236 H MET 34 HN MET 34 -5.163 -11.308 -2.095 237 HA MET 34 HA MET 34 -5.934 -13.963 -0.943 238 1HB MET 34 HB2 MET 34 -5.023 -11.522 0.622 239 2HB MET 34 HB3 MET 34 -5.627 -13.042 1.288 240 1HG MET 34 HG2 MET 34 -3.739 -14.230 0.111 241 2HG MET 34 HG3 MET 34 -3.064 -12.657 -0.307 242 1HE MET 34 HE1 MET 34 -3.489 -10.877 2.338 243 2HE MET 34 HE2 MET 34 -1.965 -11.220 3.178 244 3HE MET 34 HE3 MET 34 -1.966 -10.984 1.419 245 H ILE 35 HN ILE 35 -6.652 -10.405 -1.043 246 HA ILE 35 HA ILE 35 -9.353 -10.699 -0.249 247 HB ILE 35 HB ILE 35 -7.707 -8.603 -0.539 248 1HG1 ILE 35 HG12 ILE 35 -9.845 -7.130 -0.539 249 2HG1 ILE 35 HG13 ILE 35 -10.740 -8.657 -0.577 250 1HG2 ILE 35 HG21 ILE 35 -8.296 -7.134 -2.343 251 2HG2 ILE 35 HG22 ILE 35 -7.593 -8.626 -2.976 252 3HG2 ILE 35 HG23 ILE 35 -9.353 -8.358 -3.072 253 1HD1 ILE 35 HD11 ILE 35 -10.293 -7.722 1.740 254 2HD1 ILE 35 HD12 ILE 35 -9.669 -9.370 1.515 255 3HD1 ILE 35 HD13 ILE 35 -8.558 -7.983 1.458 256 H ALA 36 HN ALA 36 -7.683 -11.015 -3.364 257 HA ALA 36 HA ALA 36 -9.901 -11.032 -5.047 258 1HB ALA 36 HB1 ALA 36 -7.719 -10.808 -5.976 259 2HB ALA 36 HB2 ALA 36 -7.166 -12.356 -5.347 260 3HB ALA 36 HB3 ALA 36 -8.393 -12.318 -6.627 261 HA PRO 37 HA PRO 37 -10.381 -15.808 -4.549 262 1HB PRO 37 HB2 PRO 37 -9.291 -16.736 -2.063 263 2HB PRO 37 HB3 PRO 37 -8.774 -17.174 -3.728 264 1HG PRO 37 HG2 PRO 37 -7.600 -15.246 -1.800 265 2HG PRO 37 HG3 PRO 37 -6.793 -16.103 -3.140 266 1HD PRO 37 HD2 PRO 37 -7.433 -13.417 -3.238 267 2HD PRO 37 HD3 PRO 37 -7.361 -14.460 -4.676 268 H VAL 38 HN VAL 38 -10.046 -13.821 -1.539 269 HA VAL 38 HA VAL 38 -12.264 -14.897 -0.197 270 HB VAL 38 HB VAL 38 -10.652 -12.386 -0.091 271 1HG1 VAL 38 HG11 VAL 38 -11.981 -11.512 1.841 272 2HG1 VAL 38 HG12 VAL 38 -12.699 -11.287 0.240 273 3HG1 VAL 38 HG13 VAL 38 -13.321 -12.561 1.301 274 1HG2 VAL 38 HG21 VAL 38 -9.976 -14.505 0.985 275 2HG2 VAL 38 HG22 VAL 38 -10.189 -13.185 2.161 276 3HG2 VAL 38 HG23 VAL 38 -11.433 -14.445 1.998 277 H LEU 39 HN LEU 39 -12.159 -12.375 -2.743 278 HA LEU 39 HA LEU 39 -14.976 -11.803 -2.482 279 1HB LEU 39 HB2 LEU 39 -12.771 -10.998 -4.309 280 2HB LEU 39 HB3 LEU 39 -14.351 -11.127 -5.089 281 HG LEU 39 HG LEU 39 -15.366 -9.578 -3.563 282 1HD1 LEU 39 HD11 LEU 39 -12.753 -9.518 -2.018 283 2HD1 LEU 39 HD12 LEU 39 -14.072 -8.346 -1.821 284 3HD1 LEU 39 HD13 LEU 39 -14.350 -10.040 -1.426 285 1HD2 LEU 39 HD21 LEU 39 -13.985 -8.725 -5.501 286 2HD2 LEU 39 HD22 LEU 39 -14.202 -7.573 -4.181 287 3HD2 LEU 39 HD23 LEU 39 -12.656 -8.441 -4.362 288 H GLU 40 HN GLU 40 -13.147 -14.079 -4.631 289 HA GLU 40 HA GLU 40 -15.502 -14.851 -6.050 290 1HB GLU 40 HB2 GLU 40 -12.952 -16.423 -5.574 291 2HB GLU 40 HB3 GLU 40 -14.247 -16.806 -6.736 292 1HG GLU 40 HG2 GLU 40 -13.849 -14.681 -7.915 293 2HG GLU 40 HG3 GLU 40 -12.537 -14.291 -6.806 294 H GLU 41 HN GLU 41 -14.004 -15.950 -2.998 295 HA GLU 41 HA GLU 41 -15.883 -18.022 -2.433 296 1HB GLU 41 HB2 GLU 41 -13.911 -16.491 -0.712 297 2HB GLU 41 HB3 GLU 41 -14.942 -17.780 -0.096 298 1HG GLU 41 HG2 GLU 41 -13.997 -19.356 -1.768 299 2HG GLU 41 HG3 GLU 41 -12.885 -18.108 -2.319 300 H LEU 42 HN LEU 42 -16.125 -14.579 -2.241 301 HA LEU 42 HA LEU 42 -18.300 -14.592 -0.255 302 1HB LEU 42 HB2 LEU 42 -16.636 -12.703 -0.384 303 2HB LEU 42 HB3 LEU 42 -17.129 -12.394 -2.035 304 HG LEU 42 HG LEU 42 -19.433 -11.827 -1.256 305 1HD1 LEU 42 HD11 LEU 42 -18.130 -12.043 1.490 306 2HD1 LEU 42 HD12 LEU 42 -19.719 -11.323 1.143 307 3HD1 LEU 42 HD13 LEU 42 -19.470 -13.052 0.893 308 1HD2 LEU 42 HD21 LEU 42 -18.779 -9.638 -0.329 309 2HD2 LEU 42 HD22 LEU 42 -17.150 -10.262 0.027 310 3HD2 LEU 42 HD23 LEU 42 -17.691 -10.088 -1.652 311 H ASP 43 HN ASP 43 -17.800 -14.145 -3.791 312 HA ASP 43 HA ASP 43 -20.548 -13.552 -4.231 313 1HB ASP 43 HB2 ASP 43 -18.700 -12.878 -5.820 314 2HB ASP 43 HB3 ASP 43 -18.407 -14.569 -6.182 315 H GLN 44 HN GLN 44 -18.682 -16.590 -4.429 316 HA GLN 44 HA GLN 44 -20.894 -18.104 -5.421 317 1HB GLN 44 HB2 GLN 44 -19.588 -20.027 -5.051 318 2HB GLN 44 HB3 GLN 44 -18.496 -18.731 -5.549 319 1HG GLN 44 HG2 GLN 44 -17.972 -18.392 -3.065 320 2HG GLN 44 HG3 GLN 44 -18.877 -19.870 -2.743 321 1HE2 GLN 44 HE22 GLN 44 -16.186 -18.601 -4.773 322 2HE2 GLN 44 HE21 GLN 44 -15.252 -20.092 -4.786 323 H GLU 45 HN GLU 45 -20.456 -16.647 -2.334 324 HA GLU 45 HA GLU 45 -22.001 -18.643 -0.926 325 1HB GLU 45 HB2 GLU 45 -20.098 -18.186 0.322 326 2HB GLU 45 HB3 GLU 45 -19.959 -16.573 -0.333 327 1HG GLU 45 HG2 GLU 45 -20.293 -16.237 1.889 328 2HG GLU 45 HG3 GLU 45 -21.784 -15.776 1.101 329 H MET 46 HN MET 46 -22.041 -15.185 -1.714 330 HA MET 46 HA MET 46 -24.978 -15.131 -1.215 331 1HB MET 46 HB2 MET 46 -24.572 -12.977 -0.019 332 2HB MET 46 HB3 MET 46 -23.982 -14.411 0.819 333 1HG MET 46 HG2 MET 46 -21.677 -13.919 0.054 334 2HG MET 46 HG3 MET 46 -22.234 -12.519 -0.840 335 1HE MET 46 HE1 MET 46 -24.298 -11.059 0.934 336 2HE MET 46 HE2 MET 46 -23.122 -9.988 1.813 337 3HE MET 46 HE3 MET 46 -22.853 -10.427 0.104 338 H GLY 47 HN GLY 47 -23.042 -14.972 -3.662 339 1HA GLY 47 HA2 GLY 47 -23.468 -12.332 -4.719 340 2HA GLY 47 HA3 GLY 47 -23.032 -13.798 -5.646 341 H ASP 48 HN ASP 48 -25.722 -14.561 -4.015 342 HA ASP 48 HA ASP 48 -27.577 -14.205 -6.194 343 1HB ASP 48 HB2 ASP 48 -27.732 -16.171 -4.731 344 2HB ASP 48 HB3 ASP 48 -27.948 -15.131 -3.321 345 H LYS 49 HN LYS 49 -26.607 -12.397 -3.345 346 HA LYS 49 HA LYS 49 -28.918 -10.625 -3.647 347 1HB LYS 49 HB2 LYS 49 -27.128 -10.587 -1.257 348 2HB LYS 49 HB3 LYS 49 -28.811 -10.108 -1.416 349 1HG LYS 49 HG2 LYS 49 -29.168 -12.013 -0.289 350 2HG LYS 49 HG3 LYS 49 -29.116 -12.751 -1.905 351 1HD LYS 49 HD2 LYS 49 -27.008 -13.706 -1.543 352 2HD LYS 49 HD3 LYS 49 -26.532 -12.414 -0.421 353 1HE LYS 49 HE2 LYS 49 -26.721 -14.322 0.895 354 2HE LYS 49 HE3 LYS 49 -28.062 -13.235 1.270 355 1HZ LYS 49 HZ1 LYS 49 -28.273 -15.683 -0.410 356 2HZ LYS 49 HZ2 LYS 49 -28.826 -15.522 1.110 357 3HZ LYS 49 HZ3 LYS 49 -29.513 -14.662 -0.085 358 H LEU 50 HN LEU 50 -25.500 -10.791 -4.082 359 HA LEU 50 HA LEU 50 -25.170 -7.856 -3.955 360 1HB LEU 50 HB2 LEU 50 -24.279 -9.001 -1.975 361 2HB LEU 50 HB3 LEU 50 -23.425 -10.157 -2.997 362 HG LEU 50 HG LEU 50 -21.933 -8.373 -3.805 363 1HD1 LEU 50 HD11 LEU 50 -23.415 -6.627 -1.780 364 2HD1 LEU 50 HD12 LEU 50 -21.907 -6.185 -2.619 365 3HD1 LEU 50 HD13 LEU 50 -23.378 -6.413 -3.538 366 1HD2 LEU 50 HD21 LEU 50 -21.339 -9.767 -1.844 367 2HD2 LEU 50 HD22 LEU 50 -20.620 -8.154 -1.783 368 3HD2 LEU 50 HD23 LEU 50 -22.040 -8.527 -0.779 369 H LYS 51 HN LYS 51 -23.720 -6.948 -5.408 370 HA LYS 51 HA LYS 51 -22.576 -8.774 -7.503 371 1HB LYS 51 HB2 LYS 51 -24.108 -7.247 -8.583 372 2HB LYS 51 HB3 LYS 51 -23.416 -5.864 -7.731 373 1HG LYS 51 HG2 LYS 51 -21.300 -6.095 -8.914 374 2HG LYS 51 HG3 LYS 51 -21.820 -7.593 -9.679 375 1HD LYS 51 HD2 LYS 51 -23.366 -5.011 -10.098 376 2HD LYS 51 HD3 LYS 51 -21.876 -5.331 -10.996 377 1HE LYS 51 HE2 LYS 51 -22.754 -7.408 -11.900 378 2HE LYS 51 HE3 LYS 51 -24.245 -7.252 -10.948 379 1HZ LYS 51 HZ1 LYS 51 -23.363 -5.331 -13.030 380 2HZ LYS 51 HZ2 LYS 51 -24.494 -6.501 -13.262 381 3HZ LYS 51 HZ3 LYS 51 -24.789 -5.279 -12.218 382 H ILE 52 HN ILE 52 -20.343 -8.480 -7.934 383 HA ILE 52 HA ILE 52 -18.845 -6.838 -5.976 384 HB ILE 52 HB ILE 52 -18.580 -9.770 -6.700 385 1HG1 ILE 52 HG12 ILE 52 -18.119 -8.641 -3.932 386 2HG1 ILE 52 HG13 ILE 52 -19.774 -8.623 -4.526 387 1HG2 ILE 52 HG21 ILE 52 -16.415 -8.013 -5.478 388 2HG2 ILE 52 HG22 ILE 52 -16.385 -9.792 -5.588 389 3HG2 ILE 52 HG23 ILE 52 -16.348 -8.812 -7.058 390 1HD1 ILE 52 HD11 ILE 52 -19.703 -11.035 -4.953 391 2HD1 ILE 52 HD12 ILE 52 -18.033 -11.101 -4.318 392 3HD1 ILE 52 HD13 ILE 52 -19.390 -10.647 -3.263 393 H VAL 53 HN VAL 53 -17.244 -5.703 -6.958 394 HA VAL 53 HA VAL 53 -16.674 -6.201 -9.826 395 HB VAL 53 HB VAL 53 -17.152 -3.437 -8.630 396 1HG1 VAL 53 HG11 VAL 53 -17.460 -2.806 -10.990 397 2HG1 VAL 53 HG12 VAL 53 -15.846 -3.446 -10.637 398 3HG1 VAL 53 HG13 VAL 53 -17.041 -4.458 -11.487 399 1HG2 VAL 53 HG21 VAL 53 -19.350 -3.342 -9.694 400 2HG2 VAL 53 HG22 VAL 53 -19.235 -5.049 -10.166 401 3HG2 VAL 53 HG23 VAL 53 -19.317 -4.594 -8.457 402 H LYS 54 HN LYS 54 -14.470 -5.855 -10.316 403 HA LYS 54 HA LYS 54 -12.792 -4.794 -8.077 404 1HB LYS 54 HB2 LYS 54 -12.154 -6.909 -10.155 405 2HB LYS 54 HB3 LYS 54 -10.945 -6.126 -9.131 406 1HG LYS 54 HG2 LYS 54 -12.201 -6.881 -7.094 407 2HG LYS 54 HG3 LYS 54 -13.340 -7.725 -8.136 408 1HD LYS 54 HD2 LYS 54 -11.835 -9.382 -7.376 409 2HD LYS 54 HD3 LYS 54 -11.384 -9.045 -9.053 410 1HE LYS 54 HE2 LYS 54 -9.677 -7.320 -7.816 411 2HE LYS 54 HE3 LYS 54 -9.931 -8.386 -6.467 412 1HZ LYS 54 HZ1 LYS 54 -9.251 -10.256 -7.962 413 2HZ LYS 54 HZ2 LYS 54 -8.928 -9.182 -9.149 414 3HZ LYS 54 HZ3 LYS 54 -8.061 -9.141 -7.771 415 H ILE 55 HN ILE 55 -11.070 -3.401 -8.606 416 HA ILE 55 HA ILE 55 -11.040 -2.214 -11.329 417 HB ILE 55 HB ILE 55 -10.726 -1.031 -8.526 418 1HG1 ILE 55 HG12 ILE 55 -12.944 -0.830 -9.674 419 2HG1 ILE 55 HG13 ILE 55 -12.196 0.662 -9.134 420 1HG2 ILE 55 HG21 ILE 55 -9.487 0.048 -11.067 421 2HG2 ILE 55 HG22 ILE 55 -9.777 1.033 -9.610 422 3HG2 ILE 55 HG23 ILE 55 -8.709 -0.373 -9.546 423 1HD1 ILE 55 HD11 ILE 55 -12.206 -0.297 -12.019 424 2HD1 ILE 55 HD12 ILE 55 -13.194 1.009 -11.307 425 3HD1 ILE 55 HD13 ILE 55 -11.453 1.196 -11.425 426 H ASP 56 HN ASP 56 -9.162 -2.823 -12.318 427 HA ASP 56 HA ASP 56 -6.885 -3.922 -10.777 428 1HB ASP 56 HB2 ASP 56 -7.430 -4.940 -12.947 429 2HB ASP 56 HB3 ASP 56 -7.251 -3.381 -13.755 430 H VAL 57 HN VAL 57 -5.793 -2.296 -9.681 431 HA VAL 57 HA VAL 57 -6.009 0.407 -10.578 432 HB VAL 57 HB VAL 57 -4.771 1.024 -8.599 433 1HG1 VAL 57 HG11 VAL 57 -6.454 0.368 -6.966 434 2HG1 VAL 57 HG12 VAL 57 -7.175 0.807 -8.514 435 3HG1 VAL 57 HG13 VAL 57 -7.037 -0.915 -8.048 436 1HG2 VAL 57 HG21 VAL 57 -4.340 -0.623 -6.815 437 2HG2 VAL 57 HG22 VAL 57 -4.684 -1.927 -7.922 438 3HG2 VAL 57 HG23 VAL 57 -3.282 -0.868 -8.223 439 H ASP 58 HN ASP 58 -4.572 -1.197 -12.515 440 HA ASP 58 HA ASP 58 -2.461 0.850 -12.917 441 1HB ASP 58 HB2 ASP 58 -1.188 -1.085 -12.105 442 2HB ASP 58 HB3 ASP 58 -2.012 -2.147 -13.255 443 H GLU 59 HN GLU 59 -4.429 -1.882 -14.307 444 HA GLU 59 HA GLU 59 -4.240 -0.796 -17.005 445 1HB GLU 59 HB2 GLU 59 -4.433 -3.043 -17.153 446 2HB GLU 59 HB3 GLU 59 -5.282 -3.211 -15.621 447 1HG GLU 59 HG2 GLU 59 -7.343 -2.504 -16.551 448 2HG GLU 59 HG3 GLU 59 -6.603 -2.210 -18.139 449 H ASN 60 HN ASN 60 -6.499 -0.637 -14.290 450 HA ASN 60 HA ASN 60 -8.292 1.180 -15.805 451 1HB ASN 60 HB2 ASN 60 -8.950 -1.430 -14.405 452 2HB ASN 60 HB3 ASN 60 -10.162 -0.165 -14.448 453 1HD2 ASN 60 HD22 ASN 60 -9.948 -2.898 -15.877 454 2HD2 ASN 60 HD21 ASN 60 -10.360 -2.473 -17.518 455 H GLN 61 HN GLN 61 -6.233 1.920 -14.037 456 HA GLN 61 HA GLN 61 -7.192 1.999 -11.372 457 1HB GLN 61 HB2 GLN 61 -5.122 2.757 -10.798 458 2HB GLN 61 HB3 GLN 61 -4.752 2.102 -12.383 459 1HG GLN 61 HG2 GLN 61 -3.616 4.095 -12.396 460 2HG GLN 61 HG3 GLN 61 -5.086 4.477 -13.297 461 1HE2 GLN 61 HE22 GLN 61 -4.088 4.408 -9.768 462 2HE2 GLN 61 HE21 GLN 61 -4.722 5.997 -9.426 463 H GLU 62 HN GLU 62 -7.990 3.934 -14.040 464 HA GLU 62 HA GLU 62 -7.840 6.544 -13.203 465 1HB GLU 62 HB2 GLU 62 -9.697 5.026 -15.046 466 2HB GLU 62 HB3 GLU 62 -9.874 6.786 -14.824 467 1HG GLU 62 HG2 GLU 62 -7.495 7.096 -15.478 468 2HG GLU 62 HG3 GLU 62 -7.333 5.359 -15.727 469 H THR 63 HN THR 63 -10.644 4.312 -12.565 470 HA THR 63 HA THR 63 -12.205 6.178 -11.186 471 HB THR 63 HB THR 63 -11.879 3.199 -10.709 472 HG1 THR 63 HG1 THR 63 -13.578 3.116 -12.324 473 1HG2 THR 63 HG21 THR 63 -14.171 3.150 -9.992 474 2HG2 THR 63 HG22 THR 63 -13.312 4.284 -8.975 475 3HG2 THR 63 HG23 THR 63 -14.363 4.903 -10.273 476 H ALA 64 HN ALA 64 -9.423 4.298 -10.094 477 HA ALA 64 HA ALA 64 -9.920 4.544 -7.263 478 1HB ALA 64 HB1 ALA 64 -7.844 3.343 -7.052 479 2HB ALA 64 HB2 ALA 64 -8.597 2.707 -8.527 480 3HB ALA 64 HB3 ALA 64 -7.276 3.841 -8.654 481 H GLY 65 HN GLY 65 -7.170 5.720 -9.201 482 1HA GLY 65 HA2 GLY 65 -6.260 7.891 -7.845 483 2HA GLY 65 HA3 GLY 65 -6.408 7.859 -9.615 484 H LYS 66 HN LYS 66 -9.201 8.026 -9.986 485 HA LYS 66 HA LYS 66 -9.703 10.792 -9.635 486 1HB LYS 66 HB2 LYS 66 -10.606 9.425 -11.434 487 2HB LYS 66 HB3 LYS 66 -11.564 8.472 -10.285 488 1HG LYS 66 HG2 LYS 66 -12.839 10.604 -9.741 489 2HG LYS 66 HG3 LYS 66 -11.956 11.386 -11.061 490 1HD LYS 66 HD2 LYS 66 -13.837 8.988 -11.248 491 2HD LYS 66 HD3 LYS 66 -14.151 10.628 -11.831 492 1HE LYS 66 HE2 LYS 66 -12.274 10.395 -13.463 493 2HE LYS 66 HE3 LYS 66 -11.985 8.749 -12.889 494 1HZ LYS 66 HZ1 LYS 66 -14.439 9.674 -14.254 495 2HZ LYS 66 HZ2 LYS 66 -13.255 8.691 -14.858 496 3HZ LYS 66 HZ3 LYS 66 -14.204 8.142 -13.679 497 H TYR 67 HN TYR 67 -10.936 7.921 -7.768 498 HA TYR 67 HA TYR 67 -12.742 9.531 -6.244 499 1HB TYR 67 HB2 TYR 67 -13.022 7.092 -6.635 500 2HB TYR 67 HB3 TYR 67 -11.618 6.774 -5.625 501 HD1 TYR 67 HD1 TYR 67 -15.122 8.031 -5.678 502 HD2 TYR 67 HD2 TYR 67 -11.803 6.902 -3.160 503 HE1 TYR 67 HE1 TYR 67 -16.597 8.125 -3.696 504 HE2 TYR 67 HE2 TYR 67 -13.272 6.972 -1.179 505 HH TYR 67 HH TYR 67 -16.728 7.935 -1.371 506 H GLY 68 HN GLY 68 -9.379 8.527 -5.894 507 1HA GLY 68 HA2 GLY 68 -7.812 9.805 -4.508 508 2HA GLY 68 HA3 GLY 68 -9.106 10.038 -3.311 509 H VAL 69 HN VAL 69 -7.268 7.471 -5.090 510 HA VAL 69 HA VAL 69 -7.185 5.742 -2.763 511 HB VAL 69 HB VAL 69 -8.393 4.814 -5.429 512 1HG1 VAL 69 HG11 VAL 69 -8.450 2.575 -4.441 513 2HG1 VAL 69 HG12 VAL 69 -6.795 3.167 -4.608 514 3HG1 VAL 69 HG13 VAL 69 -7.574 3.188 -3.013 515 1HG2 VAL 69 HG21 VAL 69 -10.118 5.804 -4.112 516 2HG2 VAL 69 HG22 VAL 69 -10.318 4.053 -4.133 517 3HG2 VAL 69 HG23 VAL 69 -9.649 4.853 -2.683 518 H MET 70 HN MET 70 -5.118 5.021 -2.809 519 HA MET 70 HA MET 70 -3.590 4.980 -5.312 520 1HB MET 70 HB2 MET 70 -1.845 6.470 -4.404 521 2HB MET 70 HB3 MET 70 -3.372 7.304 -4.714 522 1HG MET 70 HG2 MET 70 -3.931 7.480 -2.452 523 2HG MET 70 HG3 MET 70 -2.823 6.188 -2.027 524 1HE MET 70 HE1 MET 70 0.046 7.197 -3.400 525 2HE MET 70 HE2 MET 70 0.624 7.683 -1.795 526 3HE MET 70 HE3 MET 70 -0.391 6.242 -1.959 527 H SER 71 HN SER 71 -4.586 3.180 -2.947 528 HA SER 71 HA SER 71 -2.049 1.954 -2.164 529 1HB SER 71 HB2 SER 71 -3.513 1.625 0.021 530 2HB SER 71 HB3 SER 71 -2.580 3.092 -0.290 531 HG SER 71 HG SER 71 -4.754 3.543 0.354 532 H ILE 72 HN ILE 72 -2.384 -0.356 -1.361 533 HA ILE 72 HA ILE 72 -4.829 -1.587 -2.461 534 HB ILE 72 HB ILE 72 -2.502 -3.370 -2.253 535 1HG1 ILE 72 HG12 ILE 72 -1.286 -1.440 -3.149 536 2HG1 ILE 72 HG13 ILE 72 -1.287 -2.846 -4.180 537 1HG2 ILE 72 HG21 ILE 72 -4.683 -3.031 -4.297 538 2HG2 ILE 72 HG22 ILE 72 -3.305 -4.121 -4.526 539 3HG2 ILE 72 HG23 ILE 72 -4.372 -4.387 -3.166 540 1HD1 ILE 72 HD11 ILE 72 -2.786 -1.879 -5.735 541 2HD1 ILE 72 HD12 ILE 72 -3.173 -0.503 -4.675 542 3HD1 ILE 72 HD13 ILE 72 -1.541 -0.679 -5.338 543 HA PRO 73 HA PRO 73 -6.047 -3.260 -2.146 544 1HB PRO 73 HB2 PRO 73 -7.813 -4.789 -0.849 545 2HB PRO 73 HB3 PRO 73 -6.215 -5.462 -1.308 546 1HG PRO 73 HG2 PRO 73 -7.089 -4.366 1.368 547 2HG PRO 73 HG3 PRO 73 -6.214 -5.884 1.045 548 1HD PRO 73 HD2 PRO 73 -4.981 -3.485 1.776 549 2HD PRO 73 HD3 PRO 73 -4.166 -4.739 0.807 550 H THR 74 HN THR 74 -8.000 -2.130 -2.457 551 HA THR 74 HA THR 74 -9.052 -0.628 -0.068 552 HB THR 74 HB THR 74 -8.793 0.459 -2.889 553 HG1 THR 74 HG1 THR 74 -6.909 0.696 -1.919 554 1HG2 THR 74 HG21 THR 74 -9.651 2.570 -1.909 555 2HG2 THR 74 HG22 THR 74 -10.887 1.317 -1.983 556 3HG2 THR 74 HG23 THR 74 -10.089 1.699 -0.434 557 H LEU 75 HN LEU 75 -11.256 -0.439 0.135 558 HA LEU 75 HA LEU 75 -12.985 -1.927 -1.793 559 1HB LEU 75 HB2 LEU 75 -13.302 -1.838 1.239 560 2HB LEU 75 HB3 LEU 75 -14.514 -2.410 0.118 561 HG LEU 75 HG LEU 75 -11.855 -3.763 0.677 562 1HD1 LEU 75 HD11 LEU 75 -13.529 -3.931 2.496 563 2HD1 LEU 75 HD12 LEU 75 -14.752 -4.525 1.351 564 3HD1 LEU 75 HD13 LEU 75 -13.304 -5.488 1.703 565 1HD2 LEU 75 HD21 LEU 75 -12.775 -5.629 -0.699 566 2HD2 LEU 75 HD22 LEU 75 -14.150 -4.584 -1.161 567 3HD2 LEU 75 HD23 LEU 75 -12.494 -4.169 -1.643 568 H LEU 76 HN LEU 76 -14.825 -0.839 -2.262 569 HA LEU 76 HA LEU 76 -15.635 1.499 -0.691 570 1HB LEU 76 HB2 LEU 76 -15.794 1.410 -3.733 571 2HB LEU 76 HB3 LEU 76 -16.368 2.684 -2.663 572 HG LEU 76 HG LEU 76 -13.450 2.030 -3.279 573 1HD1 LEU 76 HD11 LEU 76 -14.712 3.105 -5.118 574 2HD1 LEU 76 HD12 LEU 76 -15.189 4.421 -4.024 575 3HD1 LEU 76 HD13 LEU 76 -13.480 4.178 -4.440 576 1HD2 LEU 76 HD21 LEU 76 -14.629 4.257 -1.557 577 2HD2 LEU 76 HD22 LEU 76 -13.650 2.889 -0.987 578 3HD2 LEU 76 HD23 LEU 76 -12.924 4.100 -2.040 579 H VAL 77 HN VAL 77 -17.474 0.600 0.203 580 HA VAL 77 HA VAL 77 -19.001 -1.456 -1.303 581 HB VAL 77 HB VAL 77 -19.648 -0.269 1.424 582 1HG1 VAL 77 HG11 VAL 77 -21.484 -1.448 0.265 583 2HG1 VAL 77 HG12 VAL 77 -20.445 -2.878 0.085 584 3HG1 VAL 77 HG13 VAL 77 -20.955 -2.324 1.701 585 1HG2 VAL 77 HG21 VAL 77 -17.944 -2.723 0.863 586 2HG2 VAL 77 HG22 VAL 77 -17.437 -1.246 1.705 587 3HG2 VAL 77 HG23 VAL 77 -18.649 -2.300 2.437 588 H LEU 78 HN LEU 78 -20.550 -0.678 -2.707 589 HA LEU 78 HA LEU 78 -21.574 2.081 -2.258 590 1HB LEU 78 HB2 LEU 78 -21.326 0.534 -4.871 591 2HB LEU 78 HB3 LEU 78 -22.125 2.085 -4.662 592 HG LEU 78 HG LEU 78 -19.648 2.568 -3.498 593 1HD1 LEU 78 HD11 LEU 78 -18.898 0.327 -4.439 594 2HD1 LEU 78 HD12 LEU 78 -19.090 1.020 -6.052 595 3HD1 LEU 78 HD13 LEU 78 -17.921 1.720 -4.914 596 1HD2 LEU 78 HD21 LEU 78 -20.421 3.090 -6.396 597 2HD2 LEU 78 HD22 LEU 78 -20.878 4.091 -5.000 598 3HD2 LEU 78 HD23 LEU 78 -19.179 3.946 -5.459 599 H LYS 79 HN LYS 79 -23.740 2.454 -2.513 600 HA LYS 79 HA LYS 79 -25.586 0.220 -2.980 601 1HB LYS 79 HB2 LYS 79 -25.359 -0.060 -0.698 602 2HB LYS 79 HB3 LYS 79 -25.159 1.668 -0.385 603 1HG LYS 79 HG2 LYS 79 -27.465 2.121 -0.580 604 2HG LYS 79 HG3 LYS 79 -27.812 0.503 -1.246 605 1HD LYS 79 HD2 LYS 79 -27.091 -0.530 0.879 606 2HD LYS 79 HD3 LYS 79 -26.711 1.068 1.554 607 1HE LYS 79 HE2 LYS 79 -29.033 1.753 1.404 608 2HE LYS 79 HE3 LYS 79 -29.468 0.257 0.554 609 1HZ LYS 79 HZ1 LYS 79 -28.764 -0.960 2.586 610 2HZ LYS 79 HZ2 LYS 79 -28.593 0.472 3.370 611 3HZ LYS 79 HZ3 LYS 79 -30.061 0.016 2.832 612 H ASP 80 HN ASP 80 -27.260 0.935 -4.017 613 HA ASP 80 HA ASP 80 -28.345 2.213 -5.516 614 1HB ASP 80 HB2 ASP 80 -29.589 2.432 -3.381 615 2HB ASP 80 HB3 ASP 80 -28.769 3.963 -3.071 616 H GLY 81 HN GLY 81 -25.485 2.848 -5.513 617 1HA GLY 81 HA2 GLY 81 -24.366 4.076 -7.057 618 2HA GLY 81 HA3 GLY 81 -25.665 5.283 -7.127 619 H GLU 82 HN GLU 82 -24.636 4.704 -3.906 620 HA GLU 82 HA GLU 82 -22.433 6.641 -4.066 621 1HB GLU 82 HB2 GLU 82 -23.296 7.889 -2.284 622 2HB GLU 82 HB3 GLU 82 -24.665 7.573 -3.373 623 1HG GLU 82 HG2 GLU 82 -25.465 5.793 -1.871 624 2HG GLU 82 HG3 GLU 82 -24.117 6.101 -0.769 625 H VAL 83 HN VAL 83 -20.854 6.472 -2.331 626 HA VAL 83 HA VAL 83 -20.378 3.727 -1.418 627 HB VAL 83 HB VAL 83 -18.915 6.327 -0.772 628 1HG1 VAL 83 HG11 VAL 83 -17.009 4.854 -0.201 629 2HG1 VAL 83 HG12 VAL 83 -18.394 4.500 0.829 630 3HG1 VAL 83 HG13 VAL 83 -18.007 3.423 -0.531 631 1HG2 VAL 83 HG21 VAL 83 -18.804 5.918 -3.211 632 2HG2 VAL 83 HG22 VAL 83 -17.240 5.587 -2.466 633 3HG2 VAL 83 HG23 VAL 83 -18.290 4.244 -2.917 634 H VAL 84 HN VAL 84 -20.912 2.882 0.426 635 HA VAL 84 HA VAL 84 -22.108 4.587 2.556 636 HB VAL 84 HB VAL 84 -23.506 2.617 3.094 637 1HG1 VAL 84 HG11 VAL 84 -25.212 3.059 1.427 638 2HG1 VAL 84 HG12 VAL 84 -24.367 4.562 1.810 639 3HG1 VAL 84 HG13 VAL 84 -23.998 3.708 0.298 640 1HG2 VAL 84 HG21 VAL 84 -22.204 0.840 1.924 641 2HG2 VAL 84 HG22 VAL 84 -23.914 0.848 1.489 642 3HG2 VAL 84 HG23 VAL 84 -22.721 1.518 0.363 643 H GLU 85 HN GLU 85 -19.701 2.138 1.745 644 HA GLU 85 HA GLU 85 -18.565 2.597 4.351 645 1HB GLU 85 HB2 GLU 85 -19.737 -0.042 3.642 646 2HB GLU 85 HB3 GLU 85 -18.040 -0.149 4.100 647 1HG GLU 85 HG2 GLU 85 -20.175 1.242 5.714 648 2HG GLU 85 HG3 GLU 85 -19.657 -0.436 5.957 649 H THR 86 HN THR 86 -16.330 1.732 4.447 650 HA THR 86 HA THR 86 -14.958 1.632 1.827 651 HB THR 86 HB THR 86 -13.779 3.683 3.542 652 HG1 THR 86 HG1 THR 86 -15.842 4.254 4.167 653 1HG2 THR 86 HG21 THR 86 -13.886 5.010 1.468 654 2HG2 THR 86 HG22 THR 86 -13.235 3.384 1.206 655 3HG2 THR 86 HG23 THR 86 -14.922 3.754 0.741 656 H SER 87 HN SER 87 -12.758 0.867 2.068 657 HA SER 87 HA SER 87 -11.575 0.675 4.713 658 1HB SER 87 HB2 SER 87 -12.365 -1.838 3.178 659 2HB SER 87 HB3 SER 87 -11.062 -1.816 4.372 660 HG SER 87 HG SER 87 -13.513 -0.680 5.089 661 H VAL 88 HN VAL 88 -9.333 0.375 4.569 662 HA VAL 88 HA VAL 88 -8.131 0.126 1.888 663 HB VAL 88 HB VAL 88 -8.400 2.490 2.262 664 1HG1 VAL 88 HG11 VAL 88 -8.434 2.649 4.704 665 2HG1 VAL 88 HG12 VAL 88 -6.691 2.317 4.754 666 3HG1 VAL 88 HG13 VAL 88 -7.297 3.778 3.957 667 1HG2 VAL 88 HG21 VAL 88 -5.542 1.607 2.451 668 2HG2 VAL 88 HG22 VAL 88 -6.545 1.640 0.994 669 3HG2 VAL 88 HG23 VAL 88 -6.136 3.164 1.819 670 H GLY 89 HN GLY 89 -7.982 -2.028 2.731 671 1HA GLY 89 HA2 GLY 89 -5.680 -2.945 3.892 672 2HA GLY 89 HA3 GLY 89 -6.715 -2.602 5.290 673 H PHE 90 HN PHE 90 -5.829 -5.236 4.505 674 HA PHE 90 HA PHE 90 -7.881 -6.540 2.986 675 1HB PHE 90 HB2 PHE 90 -6.693 -8.594 3.491 676 2HB PHE 90 HB3 PHE 90 -5.573 -7.345 2.997 677 HD1 PHE 90 HD1 PHE 90 -3.837 -6.512 4.491 678 HD2 PHE 90 HD2 PHE 90 -6.756 -9.381 5.872 679 HE1 PHE 90 HE1 PHE 90 -2.477 -6.928 6.521 680 HE2 PHE 90 HE2 PHE 90 -5.388 -9.791 7.897 681 HZ PHE 90 HZ PHE 90 -3.248 -8.565 8.230 682 H LYS 91 HN LYS 91 -9.250 -8.318 3.808 683 HA LYS 91 HA LYS 91 -9.800 -8.399 6.692 684 1HB LYS 91 HB2 LYS 91 -11.510 -6.924 4.841 685 2HB LYS 91 HB3 LYS 91 -12.329 -8.409 5.271 686 1HG LYS 91 HG2 LYS 91 -13.118 -7.021 6.891 687 2HG LYS 91 HG3 LYS 91 -11.783 -7.799 7.734 688 1HD LYS 91 HD2 LYS 91 -11.784 -5.541 8.354 689 2HD LYS 91 HD3 LYS 91 -10.387 -5.745 7.297 690 1HE LYS 91 HE2 LYS 91 -11.559 -4.692 5.437 691 2HE LYS 91 HE3 LYS 91 -13.099 -4.761 6.307 692 1HZ LYS 91 HZ1 LYS 91 -10.789 -3.077 7.078 693 2HZ LYS 91 HZ2 LYS 91 -12.199 -2.559 6.409 694 3HZ LYS 91 HZ3 LYS 91 -12.192 -3.182 7.916 695 HA PRO 92 HA PRO 92 -10.231 -12.667 5.191 696 1HB PRO 92 HB2 PRO 92 -11.375 -13.912 7.337 697 2HB PRO 92 HB3 PRO 92 -9.679 -13.342 7.361 698 1HG PRO 92 HG2 PRO 92 -12.139 -11.915 8.420 699 2HG PRO 92 HG3 PRO 92 -10.593 -12.224 9.277 700 1HD PRO 92 HD2 PRO 92 -11.041 -9.846 8.051 701 2HD PRO 92 HD3 PRO 92 -9.432 -10.608 7.986 702 H LYS 93 HN LYS 93 -12.048 -14.285 4.856 703 HA LYS 93 HA LYS 93 -13.962 -13.075 3.288 704 1HB LYS 93 HB2 LYS 93 -13.087 -15.659 3.730 705 2HB LYS 93 HB3 LYS 93 -14.714 -15.770 4.375 706 1HG LYS 93 HG2 LYS 93 -13.895 -14.848 1.589 707 2HG LYS 93 HG3 LYS 93 -14.524 -16.430 1.991 708 1HD LYS 93 HD2 LYS 93 -16.072 -13.809 2.227 709 2HD LYS 93 HD3 LYS 93 -16.164 -14.926 0.896 710 1HE LYS 93 HE2 LYS 93 -16.932 -15.633 3.763 711 2HE LYS 93 HE3 LYS 93 -18.065 -15.102 2.524 712 1HZ LYS 93 HZ1 LYS 93 -17.452 -17.061 1.196 713 2HZ LYS 93 HZ2 LYS 93 -16.441 -17.581 2.384 714 3HZ LYS 93 HZ3 LYS 93 -18.039 -17.498 2.667 715 H GLU 94 HN GLU 94 -14.471 -14.294 6.625 716 HA GLU 94 HA GLU 94 -17.251 -13.761 6.635 717 1HB GLU 94 HB2 GLU 94 -15.225 -13.896 8.916 718 2HB GLU 94 HB3 GLU 94 -16.985 -13.820 9.138 719 1HG GLU 94 HG2 GLU 94 -17.239 -15.936 7.847 720 2HG GLU 94 HG3 GLU 94 -15.487 -16.040 7.669 721 H ALA 95 HN ALA 95 -14.453 -11.741 7.641 722 HA ALA 95 HA ALA 95 -16.067 -9.615 8.680 723 1HB ALA 95 HB1 ALA 95 -13.225 -9.583 7.623 724 2HB ALA 95 HB2 ALA 95 -13.978 -8.354 8.674 725 3HB ALA 95 HB3 ALA 95 -13.687 -9.987 9.299 726 H LEU 96 HN LEU 96 -14.714 -10.393 5.492 727 HA LEU 96 HA LEU 96 -15.364 -7.977 4.165 728 1HB LEU 96 HB2 LEU 96 -14.150 -10.372 3.444 729 2HB LEU 96 HB3 LEU 96 -15.685 -10.532 2.639 730 HG LEU 96 HG LEU 96 -14.224 -9.615 1.064 731 1HD1 LEU 96 HD11 LEU 96 -15.636 -7.116 2.092 732 2HD1 LEU 96 HD12 LEU 96 -15.074 -7.445 0.446 733 3HD1 LEU 96 HD13 LEU 96 -16.414 -8.382 1.127 734 1HD2 LEU 96 HD21 LEU 96 -12.734 -7.730 1.429 735 2HD2 LEU 96 HD22 LEU 96 -13.347 -7.519 3.090 736 3HD2 LEU 96 HD23 LEU 96 -12.440 -8.978 2.647 737 H GLN 97 HN GLN 97 -17.170 -11.061 4.448 738 HA GLN 97 HA GLN 97 -19.438 -10.114 3.029 739 1HB GLN 97 HB2 GLN 97 -20.307 -12.126 3.261 740 2HB GLN 97 HB3 GLN 97 -18.632 -12.544 3.550 741 1HG GLN 97 HG2 GLN 97 -19.092 -12.666 5.924 742 2HG GLN 97 HG3 GLN 97 -20.797 -12.244 5.625 743 1HE2 GLN 97 HE22 GLN 97 -21.924 -13.747 3.901 744 2HE2 GLN 97 HE21 GLN 97 -21.578 -15.460 4.036 745 H GLU 98 HN GLU 98 -18.654 -10.109 6.529 746 HA GLU 98 HA GLU 98 -21.130 -9.058 7.388 747 1HB GLU 98 HB2 GLU 98 -19.499 -9.986 8.914 748 2HB GLU 98 HB3 GLU 98 -18.339 -8.700 8.531 749 1HG GLU 98 HG2 GLU 98 -19.810 -7.017 9.512 750 2HG GLU 98 HG3 GLU 98 -21.079 -8.220 9.769 751 H LEU 99 HN LEU 99 -18.177 -7.364 6.273 752 HA LEU 99 HA LEU 99 -18.961 -4.760 6.915 753 1HB LEU 99 HB2 LEU 99 -16.676 -5.359 6.320 754 2HB LEU 99 HB3 LEU 99 -17.176 -5.757 4.675 755 HG LEU 99 HG LEU 99 -17.757 -3.398 4.244 756 1HD1 LEU 99 HD11 LEU 99 -16.995 -1.642 5.864 757 2HD1 LEU 99 HD12 LEU 99 -18.376 -2.574 6.445 758 3HD1 LEU 99 HD13 LEU 99 -16.746 -2.913 7.081 759 1HD2 LEU 99 HD21 LEU 99 -15.479 -2.552 4.157 760 2HD2 LEU 99 HD22 LEU 99 -14.956 -3.743 5.368 761 3HD2 LEU 99 HD23 LEU 99 -15.513 -4.280 3.767 762 H VAL 100 HN VAL 100 -19.629 -6.637 3.975 763 HA VAL 100 HA VAL 100 -21.080 -4.366 2.816 764 HB VAL 100 HB VAL 100 -19.769 -5.647 1.379 765 1HG1 VAL 100 HG11 VAL 100 -21.571 -8.071 1.861 766 2HG1 VAL 100 HG12 VAL 100 -20.222 -7.947 0.708 767 3HG1 VAL 100 HG13 VAL 100 -19.904 -7.907 2.433 768 1HG2 VAL 100 HG21 VAL 100 -22.683 -6.200 0.681 769 2HG2 VAL 100 HG22 VAL 100 -21.921 -4.605 0.567 770 3HG2 VAL 100 HG23 VAL 100 -21.316 -5.939 -0.424 771 H ASN 101 HN ASN 101 -21.925 -7.506 4.389 772 HA ASN 101 HA ASN 101 -24.710 -7.488 4.011 773 1HB ASN 101 HB2 ASN 101 -23.550 -9.408 4.872 774 2HB ASN 101 HB3 ASN 101 -23.057 -8.519 6.319 775 1HD2 ASN 101 HD22 ASN 101 -24.584 -8.143 7.988 776 2HD2 ASN 101 HD21 ASN 101 -26.163 -8.886 7.991 777 H LYS 102 HN LYS 102 -22.761 -5.568 6.248 778 HA LYS 102 HA LYS 102 -24.763 -4.616 8.006 779 1HB LYS 102 HB2 LYS 102 -22.160 -3.541 6.926 780 2HB LYS 102 HB3 LYS 102 -23.173 -2.490 7.912 781 1HG LYS 102 HG2 LYS 102 -22.930 -3.727 9.832 782 2HG LYS 102 HG3 LYS 102 -22.569 -5.235 8.985 783 1HD LYS 102 HD2 LYS 102 -20.626 -4.231 10.240 784 2HD LYS 102 HD3 LYS 102 -20.353 -4.621 8.553 785 1HE LYS 102 HE2 LYS 102 -19.307 -2.535 8.899 786 2HE LYS 102 HE3 LYS 102 -20.762 -2.232 7.943 787 1HZ LYS 102 HZ1 LYS 102 -20.488 -0.609 9.713 788 2HZ LYS 102 HZ2 LYS 102 -21.852 -1.459 9.982 789 3HZ LYS 102 HZ3 LYS 102 -20.506 -1.761 10.862 790 H HIS 103 HN HIS 103 -24.365 -3.888 4.599 791 HA HIS 103 HA HIS 103 -26.425 -1.722 4.829 792 1HB HIS 103 HB2 HIS 103 -24.064 -1.851 2.910 793 2HB HIS 103 HB3 HIS 103 -25.268 -0.562 3.019 794 HD1 HIS 103 HD1 HIS 103 -25.159 0.954 5.355 795 HD2 HIS 103 HD2 HIS 103 -22.132 -1.917 4.759 796 HE1 HIS 103 HE1 HIS 103 -23.419 1.364 7.163 797 H LEU 104 HN LEU 104 -25.350 -4.599 3.172 798 HA LEU 104 HA LEU 104 -27.126 -4.560 0.905 799 1HB LEU 104 HB2 LEU 104 -25.188 -5.919 0.802 800 2HB LEU 104 HB3 LEU 104 -25.469 -6.553 2.409 801 HG LEU 104 HG LEU 104 -27.405 -7.841 1.652 802 1HD1 LEU 104 HD11 LEU 104 -28.069 -6.389 -0.304 803 2HD1 LEU 104 HD12 LEU 104 -26.593 -6.899 -1.150 804 3HD1 LEU 104 HD13 LEU 104 -27.861 -8.076 -0.761 805 1HD2 LEU 104 HD21 LEU 104 -26.097 -9.489 0.382 806 2HD2 LEU 104 HD22 LEU 104 -24.825 -8.268 0.118 807 3HD2 LEU 104 HD23 LEU 104 -25.214 -8.830 1.758 808 1H MET 1 H1 MET 1 7.921 30.161 -12.026 809 2H MET 1 H2 MET 1 8.782 30.444 -10.661 810 3H MET 1 H3 MET 1 8.778 28.951 -11.325 811 HA MET 1 HA MET 1 6.460 30.309 -10.135 812 1HB MET 1 HB2 MET 1 5.782 28.825 -11.986 813 2HB MET 1 HB3 MET 1 6.669 27.478 -11.262 814 1HG MET 1 HG2 MET 1 4.270 27.336 -10.799 815 2HG MET 1 HG3 MET 1 5.193 27.502 -9.311 816 1HE MET 1 HE1 MET 1 3.074 28.047 -7.907 817 2HE MET 1 HE2 MET 1 1.857 29.262 -8.359 818 3HE MET 1 HE3 MET 1 2.081 27.813 -9.364 819 H GLU 2 HN GLU 2 6.642 30.365 -7.944 820 HA GLU 2 HA GLU 2 8.698 28.812 -6.584 821 1HB GLU 2 HB2 GLU 2 8.147 31.191 -6.078 822 2HB GLU 2 HB3 GLU 2 6.543 30.697 -5.525 823 1HG GLU 2 HG2 GLU 2 7.565 29.369 -3.713 824 2HG GLU 2 HG3 GLU 2 9.178 29.737 -4.328 825 H ASN 3 HN ASN 3 8.374 27.064 -5.251 826 HA ASN 3 HA ASN 3 7.582 25.355 -4.208 827 1HB ASN 3 HB2 ASN 3 4.693 25.896 -4.637 828 2HB ASN 3 HB3 ASN 3 5.518 24.923 -3.421 829 1HD2 ASN 3 HD21 ASN 3 7.378 26.826 -2.239 830 2HD2 ASN 3 HD22 ASN 3 6.443 28.131 -1.607 831 H LYS 4 HN LYS 4 7.739 23.562 -5.011 832 HA LYS 4 HA LYS 4 6.125 22.510 -7.200 833 1HB LYS 4 HB2 LYS 4 9.090 21.832 -7.007 834 2HB LYS 4 HB3 LYS 4 7.948 21.375 -8.250 835 1HG LYS 4 HG2 LYS 4 9.198 22.965 -9.317 836 2HG LYS 4 HG3 LYS 4 7.795 23.914 -8.777 837 1HD LYS 4 HD2 LYS 4 9.035 25.153 -7.282 838 2HD LYS 4 HD3 LYS 4 10.161 23.842 -6.934 839 1HE LYS 4 HE2 LYS 4 11.334 25.612 -8.041 840 2HE LYS 4 HE3 LYS 4 11.286 24.194 -9.091 841 1HZ LYS 4 HZ1 LYS 4 10.798 26.270 -10.271 842 2HZ LYS 4 HZ2 LYS 4 9.525 25.256 -10.360 843 3HZ LYS 4 HZ3 LYS 4 9.476 26.540 -9.338 844 H ILE 5 HN ILE 5 5.336 20.477 -6.427 845 HA ILE 5 HA ILE 5 6.137 19.996 -3.621 846 HB ILE 5 HB ILE 5 3.671 19.192 -5.186 847 1HG1 ILE 5 HG12 ILE 5 4.395 21.517 -3.436 848 2HG1 ILE 5 HG13 ILE 5 3.393 21.450 -4.871 849 1HG2 ILE 5 HG21 ILE 5 4.243 18.866 -2.219 850 2HG2 ILE 5 HG22 ILE 5 2.760 18.364 -3.080 851 3HG2 ILE 5 HG23 ILE 5 4.267 17.527 -3.402 852 1HD1 ILE 5 HD11 ILE 5 1.571 20.403 -3.491 853 2HD1 ILE 5 HD12 ILE 5 2.621 20.573 -2.063 854 3HD1 ILE 5 HD13 ILE 5 2.065 22.020 -2.922 855 H ILE 6 HN ILE 6 6.972 18.144 -2.925 856 HA ILE 6 HA ILE 6 7.410 15.876 -4.781 857 HB ILE 6 HB ILE 6 9.376 17.276 -5.086 858 1HG1 ILE 6 HG12 ILE 6 9.882 14.738 -3.484 859 2HG1 ILE 6 HG13 ILE 6 9.742 14.921 -5.237 860 1HG2 ILE 6 HG21 ILE 6 10.907 17.936 -3.328 861 2HG2 ILE 6 HG22 ILE 6 9.317 18.553 -2.956 862 3HG2 ILE 6 HG23 ILE 6 9.917 17.112 -2.102 863 1HD1 ILE 6 HD11 ILE 6 12.022 16.002 -3.528 864 2HD1 ILE 6 HD12 ILE 6 12.047 14.582 -4.578 865 3HD1 ILE 6 HD13 ILE 6 11.832 16.185 -5.292 866 H TYR 7 HN TYR 7 7.393 13.905 -3.685 867 HA TYR 7 HA TYR 7 6.704 14.078 -0.787 868 1HB TYR 7 HB2 TYR 7 5.045 13.471 -3.062 869 2HB TYR 7 HB3 TYR 7 5.297 11.977 -2.196 870 HD1 TYR 7 HD1 TYR 7 4.692 11.807 0.256 871 HD2 TYR 7 HD2 TYR 7 3.707 15.254 -2.143 872 HE1 TYR 7 HE1 TYR 7 2.951 12.457 1.884 873 HE2 TYR 7 HE2 TYR 7 1.984 15.891 -0.517 874 HH TYR 7 HH TYR 7 1.287 13.981 2.449 875 H PHE 8 HN PHE 8 7.510 12.490 0.511 876 HA PHE 8 HA PHE 8 8.993 10.234 -0.747 877 1HB PHE 8 HB2 PHE 8 8.937 11.190 2.136 878 2HB PHE 8 HB3 PHE 8 9.902 9.859 1.510 879 HD1 PHE 8 HD1 PHE 8 10.252 13.086 2.620 880 HD2 PHE 8 HD2 PHE 8 11.255 10.680 -0.808 881 HE1 PHE 8 HE1 PHE 8 11.999 14.705 1.989 882 HE2 PHE 8 HE2 PHE 8 12.967 12.345 -1.474 883 HZ PHE 8 HZ PHE 8 13.333 14.371 -0.059 884 H LEU 9 HN LEU 9 8.267 8.104 -0.408 885 HA LEU 9 HA LEU 9 5.877 7.700 1.300 886 1HB LEU 9 HB2 LEU 9 5.166 8.321 -1.007 887 2HB LEU 9 HB3 LEU 9 6.095 6.970 -1.654 888 HG LEU 9 HG LEU 9 4.616 5.362 -0.550 889 1HD1 LEU 9 HD11 LEU 9 2.517 6.149 0.596 890 2HD1 LEU 9 HD12 LEU 9 3.982 6.485 1.508 891 3HD1 LEU 9 HD13 LEU 9 3.184 7.798 0.609 892 1HD2 LEU 9 HD21 LEU 9 3.167 7.597 -2.050 893 2HD2 LEU 9 HD22 LEU 9 3.958 6.167 -2.753 894 3HD2 LEU 9 HD23 LEU 9 2.493 5.990 -1.774 895 H SER 10 HN SER 10 6.270 5.953 2.570 896 HA SER 10 HA SER 10 7.481 3.535 1.722 897 1HB SER 10 HB2 SER 10 9.540 3.800 3.229 898 2HB SER 10 HB3 SER 10 9.607 4.639 1.680 899 HG SER 10 HG SER 10 8.924 6.549 2.788 900 H THR 11 HN THR 11 7.511 2.058 3.546 901 HA THR 11 HA THR 11 5.250 1.886 4.886 902 HB THR 11 HB THR 11 7.865 0.891 6.057 903 HG1 THR 11 HG1 THR 11 7.912 0.115 4.050 904 1HG2 THR 11 HG21 THR 11 6.014 0.466 7.574 905 2HG2 THR 11 HG22 THR 11 5.004 -0.142 6.248 906 3HG2 THR 11 HG23 THR 11 6.449 -1.043 6.773 907 H GLY 12 HN GLY 12 4.307 3.553 5.850 908 1HA GLY 12 HA2 GLY 12 3.612 4.760 7.678 909 2HA GLY 12 HA3 GLY 12 4.606 3.675 8.669 910 H ASN 13 HN ASN 13 6.091 5.526 6.212 911 HA ASN 13 HA ASN 13 7.904 6.878 6.197 912 1HB ASN 13 HB2 ASN 13 6.965 8.738 5.559 913 2HB ASN 13 HB3 ASN 13 5.448 8.006 6.004 914 1HD2 ASN 13 HD22 ASN 13 7.171 10.785 6.295 915 2HD2 ASN 13 HD21 ASN 13 6.471 11.405 7.773 916 H SER 14 HN SER 14 7.426 6.133 9.363 917 HA SER 14 HA SER 14 8.285 8.442 10.688 918 1HB SER 14 HB2 SER 14 8.270 5.546 11.596 919 2HB SER 14 HB3 SER 14 8.407 6.963 12.654 920 HG SER 14 HG SER 14 6.231 6.382 10.881 921 H ALA 15 HN ALA 15 10.376 6.576 8.802 922 HA ALA 15 HA ALA 15 12.690 7.407 10.494 923 1HB ALA 15 HB1 ALA 15 12.463 5.028 10.664 924 2HB ALA 15 HB2 ALA 15 12.372 4.837 8.902 925 3HB ALA 15 HB3 ALA 15 13.881 5.399 9.667 926 H ARG 16 HN ARG 16 13.072 5.938 7.349 927 HA ARG 16 HA ARG 16 14.923 7.811 6.531 928 1HB ARG 16 HB2 ARG 16 13.940 6.888 4.068 929 2HB ARG 16 HB3 ARG 16 15.272 6.262 5.011 930 1HG ARG 16 HG2 ARG 16 13.923 4.416 4.408 931 2HG ARG 16 HG3 ARG 16 13.744 4.700 6.139 932 1HD ARG 16 HD2 ARG 16 11.561 6.013 5.410 933 2HD ARG 16 HD3 ARG 16 11.721 5.039 3.944 934 HE ARG 16 HE ARG 16 12.106 3.209 5.965 935 1HH1 ARG 16 HH11 ARG 16 9.401 5.395 5.209 936 2HH1 ARG 16 HH12 ARG 16 8.313 4.548 6.284 937 1HH2 ARG 16 HH21 ARG 16 10.586 1.973 7.006 938 2HH2 ARG 16 HH22 ARG 16 8.987 2.626 7.357 939 H SER 17 HN SER 17 11.396 8.044 5.898 940 HA SER 17 HA SER 17 11.555 10.158 4.050 941 1HB SER 17 HB2 SER 17 9.331 10.029 6.045 942 2HB SER 17 HB3 SER 17 9.270 10.254 4.292 943 HG SER 17 HG SER 17 9.671 8.034 4.037 944 H GLN 18 HN GLN 18 11.467 10.208 7.641 945 HA GLN 18 HA GLN 18 11.289 12.989 8.022 946 1HB GLN 18 HB2 GLN 18 12.942 11.201 9.800 947 2HB GLN 18 HB3 GLN 18 12.047 12.647 10.222 948 1HG GLN 18 HG2 GLN 18 10.770 10.002 9.428 949 2HG GLN 18 HG3 GLN 18 11.038 10.545 11.065 950 1HE2 GLN 18 HE22 GLN 18 8.497 10.122 9.195 951 2HE2 GLN 18 HE21 GLN 18 7.541 11.527 9.637 952 H MET 19 HN MET 19 14.098 10.806 7.724 953 HA MET 19 HA MET 19 16.007 12.868 8.127 954 1HB MET 19 HB2 MET 19 17.483 11.206 8.180 955 2HB MET 19 HB3 MET 19 16.107 10.140 8.140 956 1HG MET 19 HG2 MET 19 16.404 9.740 5.766 957 2HG MET 19 HG3 MET 19 17.574 11.058 5.657 958 1HE MET 19 HE1 MET 19 18.652 7.063 7.716 959 2HE MET 19 HE2 MET 19 17.433 8.170 8.415 960 3HE MET 19 HE3 MET 19 17.090 7.298 6.897 961 H ALA 20 HN ALA 20 14.582 11.441 5.152 962 HA ALA 20 HA ALA 20 16.103 12.939 3.302 963 1HB ALA 20 HB1 ALA 20 14.929 10.924 2.670 964 2HB ALA 20 HB2 ALA 20 13.354 11.711 2.980 965 3HB ALA 20 HB3 ALA 20 14.421 12.288 1.677 966 H GLU 21 HN GLU 21 13.092 13.809 5.085 967 HA GLU 21 HA GLU 21 12.579 16.163 3.593 968 1HB GLU 21 HB2 GLU 21 12.123 15.907 6.587 969 2HB GLU 21 HB3 GLU 21 11.381 17.050 5.441 970 1HG GLU 21 HG2 GLU 21 10.633 14.671 4.352 971 2HG GLU 21 HG3 GLU 21 10.744 14.241 6.075 972 H GLY 22 HN GLY 22 14.585 15.656 6.495 973 1HA GLY 22 HA2 GLY 22 15.529 18.330 6.778 974 2HA GLY 22 HA3 GLY 22 16.347 16.868 7.364 975 H TRP 23 HN TRP 23 16.979 15.507 5.058 976 HA TRP 23 HA TRP 23 19.251 16.824 4.010 977 1HB TRP 23 HB2 TRP 23 17.639 14.398 3.256 978 2HB TRP 23 HB3 TRP 23 18.761 15.036 2.067 979 HD1 TRP 23 HD1 TRP 23 18.689 12.884 5.049 980 HE1 TRP 23 HE1 TRP 23 21.034 12.176 5.697 981 HE3 TRP 23 HE3 TRP 23 21.332 16.169 2.151 982 HZ2 TRP 23 HZ2 TRP 23 23.765 12.911 5.027 983 HZ3 TRP 23 HZ3 TRP 23 23.816 16.097 2.128 984 HH2 TRP 23 HH2 TRP 23 25.040 14.466 3.548 985 H ALA 24 HN ALA 24 15.920 16.564 2.653 986 HA ALA 24 HA ALA 24 16.634 17.699 0.175 987 1HB ALA 24 HB1 ALA 24 13.932 17.965 1.609 988 2HB ALA 24 HB2 ALA 24 14.249 18.157 -0.123 989 3HB ALA 24 HB3 ALA 24 14.411 16.556 0.642 990 H LYS 25 HN LYS 25 15.196 19.246 3.146 991 HA LYS 25 HA LYS 25 15.082 21.731 1.779 992 1HB LYS 25 HB2 LYS 25 14.738 21.039 4.711 993 2HB LYS 25 HB3 LYS 25 14.631 22.698 4.096 994 1HG LYS 25 HG2 LYS 25 12.891 21.918 2.423 995 2HG LYS 25 HG3 LYS 25 12.879 20.345 3.245 996 1HD LYS 25 HD2 LYS 25 12.221 21.453 5.348 997 2HD LYS 25 HD3 LYS 25 12.298 23.035 4.555 998 1HE LYS 25 HE2 LYS 25 10.433 22.376 3.015 999 2HE LYS 25 HE3 LYS 25 10.387 20.775 3.751 1000 1HZ LYS 25 HZ1 LYS 25 8.696 22.215 4.676 1001 2HZ LYS 25 HZ2 LYS 25 9.756 21.827 5.849 1002 3HZ LYS 25 HZ3 LYS 25 9.798 23.311 5.165 1003 H GLN 26 HN GLN 26 17.783 20.301 3.602 1004 HA GLN 26 HA GLN 26 19.123 22.789 3.791 1005 1HB GLN 26 HB2 GLN 26 21.021 21.680 4.459 1006 2HB GLN 26 HB3 GLN 26 19.701 20.736 5.089 1007 1HG GLN 26 HG2 GLN 26 20.349 18.878 3.993 1008 2HG GLN 26 HG3 GLN 26 20.512 19.688 2.456 1009 1HE2 GLN 26 HE22 GLN 26 22.273 17.642 3.859 1010 2HE2 GLN 26 HE21 GLN 26 23.858 18.369 3.837 1011 H TYR 27 HN TYR 27 18.566 20.810 0.972 1012 HA TYR 27 HA TYR 27 20.615 22.378 -0.518 1013 1HB TYR 27 HB2 TYR 27 19.876 19.488 -0.599 1014 2HB TYR 27 HB3 TYR 27 20.052 20.246 -2.168 1015 HD1 TYR 27 HD1 TYR 27 22.136 21.511 -2.771 1016 HD2 TYR 27 HD2 TYR 27 21.894 18.910 0.660 1017 HE1 TYR 27 HE1 TYR 27 24.605 21.549 -2.575 1018 HE2 TYR 27 HE2 TYR 27 24.356 18.960 0.884 1019 HH TYR 27 HH TYR 27 26.458 20.855 -1.338 1020 H LEU 28 HN LEU 28 17.221 21.837 -0.188 1021 HA LEU 28 HA LEU 28 16.615 23.063 -2.802 1022 1HB LEU 28 HB2 LEU 28 14.843 21.725 -0.728 1023 2HB LEU 28 HB3 LEU 28 14.310 22.406 -2.262 1024 HG LEU 28 HG LEU 28 16.085 19.978 -1.890 1025 1HD1 LEU 28 HD11 LEU 28 13.574 19.877 -1.435 1026 2HD1 LEU 28 HD12 LEU 28 13.330 20.244 -3.144 1027 3HD1 LEU 28 HD13 LEU 28 14.176 18.756 -2.653 1028 1HD2 LEU 28 HD21 LEU 28 15.151 21.218 -4.512 1029 2HD2 LEU 28 HD22 LEU 28 16.823 21.209 -3.910 1030 3HD2 LEU 28 HD23 LEU 28 16.048 19.693 -4.311 1031 H GLY 29 HN GLY 29 14.179 23.787 -0.863 1032 1HA GLY 29 HA2 GLY 29 14.703 25.629 1.078 1033 2HA GLY 29 HA3 GLY 29 14.824 26.568 -0.431 1034 H ASP 30 HN ASP 30 12.739 27.480 0.858 1035 HA ASP 30 HA ASP 30 10.276 26.067 0.596 1036 1HB ASP 30 HB2 ASP 30 10.600 28.056 2.033 1037 2HB ASP 30 HB3 ASP 30 10.764 29.065 0.589 1038 H GLU 31 HN GLU 31 12.327 27.431 -1.758 1039 HA GLU 31 HA GLU 31 10.659 28.016 -3.952 1040 1HB GLU 31 HB2 GLU 31 13.052 28.426 -3.917 1041 2HB GLU 31 HB3 GLU 31 13.402 26.714 -3.681 1042 1HG GLU 31 HG2 GLU 31 12.562 26.197 -5.928 1043 2HG GLU 31 HG3 GLU 31 12.118 27.889 -6.175 1044 H TRP 32 HN TRP 32 11.328 24.983 -2.326 1045 HA TRP 32 HA TRP 32 9.701 23.435 -4.269 1046 1HB TRP 32 HB2 TRP 32 12.035 22.388 -2.639 1047 2HB TRP 32 HB3 TRP 32 11.105 21.517 -3.848 1048 HD1 TRP 32 HD1 TRP 32 13.725 24.327 -3.565 1049 HE1 TRP 32 HE1 TRP 32 14.810 24.775 -5.825 1050 HE3 TRP 32 HE3 TRP 32 11.092 20.982 -6.410 1051 HZ2 TRP 32 HZ2 TRP 32 14.720 23.696 -8.472 1052 HZ3 TRP 32 HZ3 TRP 32 11.591 20.747 -8.832 1053 HH2 TRP 32 HH2 TRP 32 13.401 22.093 -9.879 1054 H LYS 33 HN LYS 33 8.690 21.489 -2.990 1055 HA LYS 33 HA LYS 33 8.166 22.292 -0.172 1056 1HB LYS 33 HB2 LYS 33 6.442 22.963 -2.239 1057 2HB LYS 33 HB3 LYS 33 5.811 21.403 -1.723 1058 1HG LYS 33 HG2 LYS 33 4.668 22.907 -0.404 1059 2HG LYS 33 HG3 LYS 33 5.964 22.323 0.694 1060 1HD LYS 33 HD2 LYS 33 7.226 24.416 0.273 1061 2HD LYS 33 HD3 LYS 33 5.977 24.933 -0.889 1062 1HE LYS 33 HE2 LYS 33 4.266 24.680 0.941 1063 2HE LYS 33 HE3 LYS 33 5.579 24.357 2.074 1064 1HZ LYS 33 HZ1 LYS 33 5.015 26.666 2.200 1065 2HZ LYS 33 HZ2 LYS 33 6.483 26.603 1.467 1066 3HZ LYS 33 HZ3 LYS 33 5.128 26.881 0.588 1067 H VAL 34 HN VAL 34 8.823 20.654 0.958 1068 HA VAL 34 HA VAL 34 8.815 17.943 -0.218 1069 HB VAL 34 HB VAL 34 10.350 19.180 2.119 1070 1HG1 VAL 34 HG11 VAL 34 10.163 16.815 2.536 1071 2HG1 VAL 34 HG12 VAL 34 10.549 16.434 0.834 1072 3HG1 VAL 34 HG13 VAL 34 11.776 17.145 1.900 1073 1HG2 VAL 34 HG21 VAL 34 11.002 20.079 -0.154 1074 2HG2 VAL 34 HG22 VAL 34 12.264 19.217 0.695 1075 3HG2 VAL 34 HG23 VAL 34 11.394 18.413 -0.632 1076 H TYR 35 HN TYR 35 7.557 16.364 0.590 1077 HA TYR 35 HA TYR 35 6.217 16.633 3.228 1078 1HB TYR 35 HB2 TYR 35 4.939 16.064 0.543 1079 2HB TYR 35 HB3 TYR 35 4.176 15.699 2.083 1080 HD1 TYR 35 HD1 TYR 35 5.175 18.407 -0.206 1081 HD2 TYR 35 HD2 TYR 35 3.213 17.413 3.502 1082 HE1 TYR 35 HE1 TYR 35 4.069 20.622 -0.202 1083 HE2 TYR 35 HE2 TYR 35 2.136 19.644 3.542 1084 HH TYR 35 HH TYR 35 2.602 22.062 0.922 1085 H SER 36 HN SER 36 5.270 14.462 3.837 1086 HA SER 36 HA SER 36 6.384 12.106 2.478 1087 1HB SER 36 HB2 SER 36 6.752 12.685 5.445 1088 2HB SER 36 HB3 SER 36 7.237 11.211 4.573 1089 HG SER 36 HG SER 36 8.279 13.835 4.372 1090 H ALA 37 HN ALA 37 5.116 10.205 2.951 1091 HA ALA 37 HA ALA 37 3.145 10.263 5.082 1092 1HB ALA 37 HB1 ALA 37 1.798 11.364 3.380 1093 2HB ALA 37 HB2 ALA 37 2.211 10.097 2.179 1094 3HB ALA 37 HB3 ALA 37 1.237 9.726 3.618 1095 H GLY 38 HN GLY 38 1.818 8.072 4.853 1096 1HA GLY 38 HA2 GLY 38 2.739 5.827 3.478 1097 2HA GLY 38 HA3 GLY 38 3.642 5.897 4.997 1098 H ILE 39 HN ILE 39 2.203 3.784 4.992 1099 HA ILE 39 HA ILE 39 -0.516 3.687 5.329 1100 HB ILE 39 HB ILE 39 0.562 1.727 5.101 1101 1HG1 ILE 39 HG12 ILE 39 -0.089 1.464 8.047 1102 2HG1 ILE 39 HG13 ILE 39 -1.351 1.847 6.876 1103 1HG2 ILE 39 HG21 ILE 39 2.333 2.196 7.520 1104 2HG2 ILE 39 HG22 ILE 39 2.249 0.689 6.600 1105 3HG2 ILE 39 HG23 ILE 39 2.818 2.166 5.842 1106 1HD1 ILE 39 HD11 ILE 39 0.383 -0.636 6.748 1107 2HD1 ILE 39 HD12 ILE 39 -1.296 -0.538 7.321 1108 3HD1 ILE 39 HD13 ILE 39 -0.922 -0.160 5.629 1109 H GLU 40 HN GLU 40 1.762 3.955 8.047 1110 HA GLU 40 HA GLU 40 -0.425 4.953 9.783 1111 1HB GLU 40 HB2 GLU 40 0.690 3.631 11.621 1112 2HB GLU 40 HB3 GLU 40 -0.142 2.694 10.400 1113 1HG GLU 40 HG2 GLU 40 1.835 1.749 9.524 1114 2HG GLU 40 HG3 GLU 40 2.848 3.059 10.113 1115 H ALA 41 HN ALA 41 1.318 6.430 8.194 1116 HA ALA 41 HA ALA 41 3.751 7.301 9.379 1117 1HB ALA 41 HB1 ALA 41 3.345 9.138 7.584 1118 2HB ALA 41 HB2 ALA 41 3.458 7.441 7.042 1119 3HB ALA 41 HB3 ALA 41 1.885 8.243 7.196 1120 H HIS 42 HN HIS 42 4.088 8.556 10.994 1121 HA HIS 42 HA HIS 42 3.038 11.111 11.282 1122 1HB HIS 42 HB2 HIS 42 1.024 9.650 12.244 1123 2HB HIS 42 HB3 HIS 42 2.072 9.389 13.613 1124 HD1 HIS 42 HD1 HIS 42 3.063 12.217 14.352 1125 HD2 HIS 42 HD2 HIS 42 -0.760 11.378 12.810 1126 HE1 HIS 42 HE1 HIS 42 1.544 14.135 15.108 1127 H GLY 43 HN GLY 43 4.940 8.440 12.341 1128 1HA GLY 43 HA2 GLY 43 5.819 9.505 14.871 1129 2HA GLY 43 HA3 GLY 43 6.329 8.022 14.058 1130 H LEU 44 HN LEU 44 8.266 9.145 15.280 1131 HA LEU 44 HA LEU 44 10.055 10.154 13.190 1132 1HB LEU 44 HB2 LEU 44 9.234 12.226 14.182 1133 2HB LEU 44 HB3 LEU 44 9.538 11.619 15.811 1134 HG LEU 44 HG LEU 44 11.975 11.593 15.375 1135 1HD1 LEU 44 HD11 LEU 44 12.828 12.775 13.306 1136 2HD1 LEU 44 HD12 LEU 44 12.139 11.182 13.003 1137 3HD1 LEU 44 HD13 LEU 44 11.196 12.655 12.630 1138 1HD2 LEU 44 HD21 LEU 44 10.695 14.252 14.658 1139 2HD2 LEU 44 HD22 LEU 44 10.891 13.608 16.304 1140 3HD2 LEU 44 HD23 LEU 44 12.313 13.991 15.325 1141 H ASN 45 HN ASN 45 11.054 8.193 13.259 1142 HA ASN 45 HA ASN 45 11.731 6.723 15.614 1143 1HB ASN 45 HB2 ASN 45 11.449 5.806 13.306 1144 2HB ASN 45 HB3 ASN 45 12.926 6.628 12.807 1145 1HD2 ASN 45 HD22 ASN 45 12.393 3.724 12.707 1146 2HD2 ASN 45 HD21 ASN 45 13.578 2.985 13.745 1147 HA PRO 46 HA PRO 46 15.168 9.403 16.738 1148 1HB PRO 46 HB2 PRO 46 16.553 7.724 18.464 1149 2HB PRO 46 HB3 PRO 46 15.119 8.706 18.893 1150 1HG PRO 46 HG2 PRO 46 15.212 5.792 18.076 1151 2HG PRO 46 HG3 PRO 46 14.315 6.533 19.441 1152 1HD PRO 46 HD2 PRO 46 13.076 5.957 17.121 1153 2HD PRO 46 HD3 PRO 46 12.703 7.482 17.975 1154 H ASN 47 HN ASN 47 15.550 6.239 15.135 1155 HA ASN 47 HA ASN 47 18.343 6.476 14.593 1156 1HB ASN 47 HB2 ASN 47 18.071 4.720 13.273 1157 2HB ASN 47 HB3 ASN 47 16.542 4.514 14.108 1158 1HD2 ASN 47 HD21 ASN 47 18.128 4.916 11.098 1159 2HD2 ASN 47 HD22 ASN 47 16.677 5.022 10.109 1160 H ALA 48 HN ALA 48 15.429 7.899 13.042 1161 HA ALA 48 HA ALA 48 16.916 8.898 10.785 1162 1HB ALA 48 HB1 ALA 48 14.831 10.144 10.287 1163 2HB ALA 48 HB2 ALA 48 14.515 8.444 10.688 1164 3HB ALA 48 HB3 ALA 48 14.170 9.720 11.876 1165 H VAL 49 HN VAL 49 15.842 10.127 13.935 1166 HA VAL 49 HA VAL 49 16.744 12.833 13.607 1167 HB VAL 49 HB VAL 49 16.678 11.227 16.199 1168 1HG1 VAL 49 HG11 VAL 49 16.389 13.443 17.267 1169 2HG1 VAL 49 HG12 VAL 49 17.927 13.351 16.406 1170 3HG1 VAL 49 HG13 VAL 49 16.564 14.237 15.686 1171 1HG2 VAL 49 HG21 VAL 49 14.451 11.181 15.108 1172 2HG2 VAL 49 HG22 VAL 49 14.432 12.217 16.533 1173 3HG2 VAL 49 HG23 VAL 49 14.513 12.943 14.914 1174 H LYS 50 HN LYS 50 18.429 9.951 14.987 1175 HA LYS 50 HA LYS 50 20.949 11.159 15.362 1176 1HB LYS 50 HB2 LYS 50 20.356 8.993 16.316 1177 2HB LYS 50 HB3 LYS 50 20.220 8.268 14.706 1178 1HG LYS 50 HG2 LYS 50 22.611 8.574 14.301 1179 2HG LYS 50 HG3 LYS 50 22.792 9.463 15.826 1180 1HD LYS 50 HD2 LYS 50 22.216 7.456 17.106 1181 2HD LYS 50 HD3 LYS 50 21.904 6.549 15.606 1182 1HE LYS 50 HE2 LYS 50 24.231 6.797 14.908 1183 2HE LYS 50 HE3 LYS 50 24.578 7.850 16.286 1184 1HZ LYS 50 HZ1 LYS 50 24.157 5.970 17.756 1185 2HZ LYS 50 HZ2 LYS 50 23.850 4.984 16.488 1186 3HZ LYS 50 HZ3 LYS 50 25.344 5.614 16.698 1187 H ALA 51 HN ALA 51 19.647 9.445 12.480 1188 HA ALA 51 HA ALA 51 21.845 9.531 10.834 1189 1HB ALA 51 HB1 ALA 51 18.937 9.937 10.037 1190 2HB ALA 51 HB2 ALA 51 20.266 9.447 8.971 1191 3HB ALA 51 HB3 ALA 51 19.753 8.380 10.290 1192 H MET 52 HN MET 52 19.583 12.281 11.581 1193 HA MET 52 HA MET 52 20.883 13.962 9.582 1194 1HB MET 52 HB2 MET 52 18.741 14.581 11.663 1195 2HB MET 52 HB3 MET 52 19.307 15.677 10.403 1196 1HG MET 52 HG2 MET 52 17.732 13.133 10.088 1197 2HG MET 52 HG3 MET 52 17.331 14.745 9.529 1198 1HE MET 52 HE1 MET 52 19.610 15.201 6.421 1199 2HE MET 52 HE2 MET 52 18.385 15.886 7.516 1200 3HE MET 52 HE3 MET 52 20.068 15.626 8.072 1201 H LYS 53 HN LYS 53 21.148 13.442 13.106 1202 HA LYS 53 HA LYS 53 22.799 15.752 13.529 1203 1HB LYS 53 HB2 LYS 53 22.946 13.074 14.985 1204 2HB LYS 53 HB3 LYS 53 23.619 14.598 15.547 1205 1HG LYS 53 HG2 LYS 53 20.660 14.018 15.176 1206 2HG LYS 53 HG3 LYS 53 21.520 13.963 16.700 1207 1HD LYS 53 HD2 LYS 53 21.883 16.338 16.701 1208 2HD LYS 53 HD3 LYS 53 21.313 16.501 15.022 1209 1HE LYS 53 HE2 LYS 53 19.079 15.849 15.597 1210 2HE LYS 53 HE3 LYS 53 19.547 15.391 17.240 1211 1HZ LYS 53 HZ1 LYS 53 19.846 18.171 16.307 1212 2HZ LYS 53 HZ2 LYS 53 18.420 17.634 16.905 1213 3HZ LYS 53 HZ3 LYS 53 19.772 17.621 17.844 1214 H GLU 54 HN GLU 54 23.494 12.633 11.963 1215 HA GLU 54 HA GLU 54 26.325 12.782 12.110 1216 1HB GLU 54 HB2 GLU 54 24.678 11.642 9.814 1217 2HB GLU 54 HB3 GLU 54 26.378 11.333 10.149 1218 1HG GLU 54 HG2 GLU 54 25.654 10.379 12.406 1219 2HG GLU 54 HG3 GLU 54 23.994 10.476 11.790 1220 H VAL 55 HN VAL 55 24.068 14.672 10.241 1221 HA VAL 55 HA VAL 55 26.272 15.924 8.692 1222 HB VAL 55 HB VAL 55 24.903 14.641 7.261 1223 1HG1 VAL 55 HG11 VAL 55 22.462 14.979 6.961 1224 2HG1 VAL 55 HG12 VAL 55 22.890 14.275 8.518 1225 3HG1 VAL 55 HG13 VAL 55 22.453 16.003 8.410 1226 1HG2 VAL 55 HG21 VAL 55 24.125 16.194 5.632 1227 2HG2 VAL 55 HG22 VAL 55 23.942 17.481 6.821 1228 3HG2 VAL 55 HG23 VAL 55 25.565 16.879 6.399 1229 H GLY 56 HN GLY 56 24.802 16.371 11.479 1230 1HA GLY 56 HA2 GLY 56 24.441 18.169 12.812 1231 2HA GLY 56 HA3 GLY 56 25.296 19.150 11.609 1232 H ILE 57 HN ILE 57 22.184 17.305 11.225 1233 HA ILE 57 HA ILE 57 20.759 19.914 10.854 1234 HB ILE 57 HB ILE 57 20.458 17.297 9.359 1235 1HG1 ILE 57 HG12 ILE 57 20.970 20.152 8.422 1236 2HG1 ILE 57 HG13 ILE 57 22.165 18.859 8.496 1237 1HG2 ILE 57 HG21 ILE 57 18.453 18.251 8.260 1238 2HG2 ILE 57 HG22 ILE 57 18.190 18.109 9.984 1239 3HG2 ILE 57 HG23 ILE 57 18.570 19.696 9.282 1240 1HD1 ILE 57 HD11 ILE 57 20.848 17.571 6.794 1241 2HD1 ILE 57 HD12 ILE 57 19.776 18.987 6.604 1242 3HD1 ILE 57 HD13 ILE 57 21.497 19.117 6.231 1243 H ASP 58 HN ASP 58 18.868 20.045 12.061 1244 HA ASP 58 HA ASP 58 18.373 17.827 14.002 1245 1HB ASP 58 HB2 ASP 58 18.941 19.883 15.152 1246 2HB ASP 58 HB3 ASP 58 17.785 20.805 14.176 1247 H ILE 59 HN ILE 59 16.438 16.886 13.994 1248 HA ILE 59 HA ILE 59 14.162 18.127 12.583 1249 HB ILE 59 HB ILE 59 13.487 16.019 11.612 1250 1HG1 ILE 59 HG12 ILE 59 16.257 14.878 12.280 1251 2HG1 ILE 59 HG13 ILE 59 14.802 14.517 13.208 1252 1HG2 ILE 59 HG21 ILE 59 16.304 16.719 10.660 1253 2HG2 ILE 59 HG22 ILE 59 14.984 16.022 9.691 1254 3HG2 ILE 59 HG23 ILE 59 14.851 17.674 10.303 1255 1HD1 ILE 59 HD11 ILE 59 15.271 13.806 10.294 1256 2HD1 ILE 59 HD12 ILE 59 15.116 12.716 11.687 1257 3HD1 ILE 59 HD13 ILE 59 13.719 13.652 11.143 1258 H SER 60 HN SER 60 15.159 17.486 15.521 1259 HA SER 60 HA SER 60 13.624 15.335 16.436 1260 1HB SER 60 HB2 SER 60 13.990 16.411 18.712 1261 2HB SER 60 HB3 SER 60 15.427 16.055 17.746 1262 HG SER 60 HG SER 60 15.674 18.163 17.234 1263 H ASN 61 HN ASN 61 12.428 18.334 15.385 1264 HA ASN 61 HA ASN 61 9.992 18.306 17.001 1265 1HB ASN 61 HB2 ASN 61 11.169 20.431 16.534 1266 2HB ASN 61 HB3 ASN 61 10.978 20.166 14.801 1267 1HD2 ASN 61 HD22 ASN 61 9.208 21.182 13.878 1268 2HD2 ASN 61 HD21 ASN 61 7.789 21.695 14.750 1269 H GLN 62 HN GLN 62 11.025 16.860 13.994 1270 HA GLN 62 HA GLN 62 8.896 17.499 12.318 1271 1HB GLN 62 HB2 GLN 62 10.868 15.262 12.209 1272 2HB GLN 62 HB3 GLN 62 9.502 15.418 11.078 1273 1HG GLN 62 HG2 GLN 62 10.167 17.757 10.561 1274 2HG GLN 62 HG3 GLN 62 11.588 17.572 11.591 1275 1HE2 GLN 62 HE22 GLN 62 10.997 14.617 9.883 1276 2HE2 GLN 62 HE21 GLN 62 12.215 14.917 8.633 1277 H THR 63 HN THR 63 7.016 16.688 11.839 1278 HA THR 63 HA THR 63 5.859 14.298 13.172 1279 HB THR 63 HB THR 63 3.709 15.576 13.167 1280 HG1 THR 63 HG1 THR 63 3.727 17.745 12.693 1281 1HG2 THR 63 HG21 THR 63 5.928 17.097 14.586 1282 2HG2 THR 63 HG22 THR 63 4.214 17.034 15.059 1283 3HG2 THR 63 HG23 THR 63 5.222 15.578 15.185 1284 H SER 64 HN SER 64 3.727 13.692 11.761 1285 HA SER 64 HA SER 64 4.042 14.112 8.897 1286 1HB SER 64 HB2 SER 64 4.820 11.464 10.221 1287 2HB SER 64 HB3 SER 64 4.390 11.619 8.507 1288 HG SER 64 HG SER 64 6.170 13.524 9.398 1289 H ASP 65 HN ASP 65 2.523 12.107 7.884 1290 HA ASP 65 HA ASP 65 0.006 11.832 9.316 1291 1HB ASP 65 HB2 ASP 65 -0.039 14.194 8.401 1292 2HB ASP 65 HB3 ASP 65 0.242 13.516 6.787 1293 H ILE 66 HN ILE 66 -1.513 10.502 7.930 1294 HA ILE 66 HA ILE 66 -0.068 8.447 6.545 1295 HB ILE 66 HB ILE 66 -2.347 7.460 6.320 1296 1HG1 ILE 66 HG12 ILE 66 -3.260 9.834 7.989 1297 2HG1 ILE 66 HG13 ILE 66 -3.604 9.634 6.262 1298 1HG2 ILE 66 HG21 ILE 66 -2.471 6.867 8.670 1299 2HG2 ILE 66 HG22 ILE 66 -0.784 7.054 8.193 1300 3HG2 ILE 66 HG23 ILE 66 -1.575 8.335 9.136 1301 1HD1 ILE 66 HD11 ILE 66 -4.543 7.855 8.539 1302 2HD1 ILE 66 HD12 ILE 66 -5.521 8.948 7.549 1303 3HD1 ILE 66 HD13 ILE 66 -4.801 7.499 6.810 1304 H ILE 67 HN ILE 67 -1.003 7.530 4.427 1305 HA ILE 67 HA ILE 67 -0.426 9.259 2.367 1306 HB ILE 67 HB ILE 67 -0.748 7.623 0.912 1307 1HG1 ILE 67 HG12 ILE 67 -3.335 6.731 2.216 1308 2HG1 ILE 67 HG13 ILE 67 -3.155 7.748 0.780 1309 1HG2 ILE 67 HG21 ILE 67 0.470 6.599 2.766 1310 2HG2 ILE 67 HG22 ILE 67 -1.048 5.867 3.365 1311 3HG2 ILE 67 HG23 ILE 67 -0.382 5.420 1.785 1312 1HD1 ILE 67 HD11 ILE 67 -3.658 5.733 -0.164 1313 2HD1 ILE 67 HD12 ILE 67 -1.885 5.694 -0.263 1314 3HD1 ILE 67 HD13 ILE 67 -2.700 4.795 1.017 1315 H ASP 68 HN ASP 68 -1.415 10.878 1.339 1316 HA ASP 68 HA ASP 68 -4.346 11.193 1.503 1317 1HB ASP 68 HB2 ASP 68 -3.495 12.340 3.503 1318 2HB ASP 68 HB3 ASP 68 -2.458 13.350 2.491 1319 H SER 69 HN SER 69 -4.490 10.843 -0.600 1320 HA SER 69 HA SER 69 -3.145 11.712 -2.748 1321 1HB SER 69 HB2 SER 69 -6.149 11.669 -2.397 1322 2HB SER 69 HB3 SER 69 -5.254 11.388 -3.911 1323 HG SER 69 HG SER 69 -5.910 9.430 -2.843 1324 H ASP 70 HN ASP 70 -5.024 13.911 -0.655 1325 HA ASP 70 HA ASP 70 -5.566 15.920 -2.625 1326 1HB ASP 70 HB2 ASP 70 -6.646 15.737 -0.353 1327 2HB ASP 70 HB3 ASP 70 -5.106 16.285 0.348 1328 H ILE 71 HN ILE 71 -2.624 15.011 -1.053 1329 HA ILE 71 HA ILE 71 -1.306 17.408 -2.229 1330 HB ILE 71 HB ILE 71 -0.152 16.063 0.144 1331 1HG1 ILE 71 HG12 ILE 71 -1.282 18.286 1.360 1332 2HG1 ILE 71 HG13 ILE 71 -2.599 17.802 0.298 1333 1HG2 ILE 71 HG21 ILE 71 0.936 18.080 0.599 1334 2HG2 ILE 71 HG22 ILE 71 1.147 17.793 -1.145 1335 3HG2 ILE 71 HG23 ILE 71 -0.036 18.995 -0.590 1336 1HD1 ILE 71 HD11 ILE 71 -2.394 15.476 1.213 1337 2HD1 ILE 71 HD12 ILE 71 -1.052 16.073 2.239 1338 3HD1 ILE 71 HD13 ILE 71 -2.709 16.685 2.491 1339 H LEU 72 HN LEU 72 -1.122 13.886 -1.382 1340 HA LEU 72 HA LEU 72 1.399 13.450 -2.623 1341 1HB LEU 72 HB2 LEU 72 0.338 11.905 -1.029 1342 2HB LEU 72 HB3 LEU 72 -0.923 11.521 -2.184 1343 HG LEU 72 HG LEU 72 0.800 9.808 -1.932 1344 1HD1 LEU 72 HD11 LEU 72 -0.451 10.032 -4.138 1345 2HD1 LEU 72 HD12 LEU 72 1.022 10.782 -4.799 1346 3HD1 LEU 72 HD13 LEU 72 1.078 9.140 -4.182 1347 1HD2 LEU 72 HD21 LEU 72 3.032 10.010 -2.851 1348 2HD2 LEU 72 HD22 LEU 72 2.757 11.726 -3.215 1349 3HD2 LEU 72 HD23 LEU 72 2.751 11.143 -1.531 1350 H ASN 73 HN ASN 73 -1.955 12.915 -3.948 1351 HA ASN 73 HA ASN 73 -0.961 12.285 -6.551 1352 1HB ASN 73 HB2 ASN 73 -3.037 11.658 -6.911 1353 2HB ASN 73 HB3 ASN 73 -3.512 12.204 -5.327 1354 1HD2 ASN 73 HD22 ASN 73 -4.243 14.578 -5.202 1355 2HD2 ASN 73 HD21 ASN 73 -5.071 15.232 -6.606 1356 H ASN 74 HN ASN 74 -1.462 15.221 -4.812 1357 HA ASN 74 HA ASN 74 -1.614 17.059 -7.015 1358 1HB ASN 74 HB2 ASN 74 -2.203 17.112 -4.340 1359 2HB ASN 74 HB3 ASN 74 -0.686 18.007 -4.341 1360 1HD2 ASN 74 HD22 ASN 74 -3.571 18.737 -3.827 1361 2HD2 ASN 74 HD21 ASN 74 -3.872 20.117 -4.874 1362 H ALA 75 HN ALA 75 1.009 15.470 -5.299 1363 HA ALA 75 HA ALA 75 3.084 17.271 -5.650 1364 1HB ALA 75 HB1 ALA 75 3.308 14.232 -5.744 1365 2HB ALA 75 HB2 ALA 75 4.548 15.391 -5.234 1366 3HB ALA 75 HB3 ALA 75 3.084 15.173 -4.261 1367 H ASP 76 HN ASP 76 4.995 16.992 -7.019 1368 HA ASP 76 HA ASP 76 4.350 16.461 -9.876 1369 1HB ASP 76 HB2 ASP 76 5.577 18.530 -9.276 1370 2HB ASP 76 HB3 ASP 76 6.869 17.552 -8.568 1371 H LEU 77 HN LEU 77 6.120 15.064 -7.116 1372 HA LEU 77 HA LEU 77 6.879 12.759 -8.756 1373 1HB LEU 77 HB2 LEU 77 8.697 14.745 -8.373 1374 2HB LEU 77 HB3 LEU 77 8.922 13.874 -6.869 1375 HG LEU 77 HG LEU 77 9.330 12.873 -9.672 1376 1HD1 LEU 77 HD11 LEU 77 11.269 13.207 -7.378 1377 2HD1 LEU 77 HD12 LEU 77 11.648 12.664 -9.034 1378 3HD1 LEU 77 HD13 LEU 77 11.081 14.316 -8.755 1379 1HD2 LEU 77 HD21 LEU 77 10.235 10.762 -8.733 1380 2HD2 LEU 77 HD22 LEU 77 9.518 11.202 -7.170 1381 3HD2 LEU 77 HD23 LEU 77 8.498 10.933 -8.617 1382 H VAL 78 HN VAL 78 6.539 10.881 -7.647 1383 HA VAL 78 HA VAL 78 6.409 10.889 -4.669 1384 HB VAL 78 HB VAL 78 5.383 8.733 -6.526 1385 1HG1 VAL 78 HG11 VAL 78 4.257 8.021 -4.384 1386 2HG1 VAL 78 HG12 VAL 78 6.017 7.937 -4.297 1387 3HG1 VAL 78 HG13 VAL 78 5.156 9.283 -3.525 1388 1HG2 VAL 78 HG21 VAL 78 3.941 11.100 -5.268 1389 2HG2 VAL 78 HG22 VAL 78 3.943 10.531 -6.951 1390 3HG2 VAL 78 HG23 VAL 78 3.108 9.589 -5.727 1391 H VAL 79 HN VAL 79 8.429 10.774 -4.018 1392 HA VAL 79 HA VAL 79 10.378 9.022 -5.343 1393 HB VAL 79 HB VAL 79 10.537 10.817 -2.888 1394 1HG1 VAL 79 HG11 VAL 79 12.120 8.943 -2.698 1395 2HG1 VAL 79 HG12 VAL 79 12.666 9.219 -4.360 1396 3HG1 VAL 79 HG13 VAL 79 12.998 10.423 -3.089 1397 1HG2 VAL 79 HG21 VAL 79 11.971 12.234 -4.322 1398 2HG2 VAL 79 HG22 VAL 79 11.612 11.192 -5.712 1399 3HG2 VAL 79 HG23 VAL 79 10.320 12.142 -4.937 1400 H THR 80 HN THR 80 9.832 6.881 -4.990 1401 HA THR 80 HA THR 80 8.776 6.016 -2.398 1402 HB THR 80 HB THR 80 10.031 4.393 -4.649 1403 HG1 THR 80 HG1 THR 80 7.922 5.774 -4.711 1404 1HG2 THR 80 HG21 THR 80 9.954 3.116 -2.515 1405 2HG2 THR 80 HG22 THR 80 8.251 3.570 -2.301 1406 3HG2 THR 80 HG23 THR 80 8.743 2.507 -3.649 1407 H LEU 81 HN LEU 81 10.031 5.423 -0.622 1408 HA LEU 81 HA LEU 81 12.956 5.978 -0.902 1409 1HB LEU 81 HB2 LEU 81 11.282 7.736 0.069 1410 2HB LEU 81 HB3 LEU 81 11.261 6.690 1.486 1411 HG LEU 81 HG LEU 81 13.832 6.927 1.535 1412 1HD1 LEU 81 HD11 LEU 81 14.306 7.679 -0.749 1413 2HD1 LEU 81 HD12 LEU 81 13.202 9.059 -0.562 1414 3HD1 LEU 81 HD13 LEU 81 14.702 8.992 0.362 1415 1HD2 LEU 81 HD21 LEU 81 12.183 8.202 2.934 1416 2HD2 LEU 81 HD22 LEU 81 13.715 9.038 2.652 1417 3HD2 LEU 81 HD23 LEU 81 12.266 9.524 1.749 1418 H SER 82 HN SER 82 12.277 3.389 -1.119 1419 HA SER 82 HA SER 82 13.780 2.226 0.994 1420 1HB SER 82 HB2 SER 82 10.868 1.341 0.795 1421 2HB SER 82 HB3 SER 82 12.124 0.503 1.724 1422 HG SER 82 HG SER 82 12.023 3.154 2.307 1423 H GLY 83 HN GLY 83 12.119 1.959 -2.110 1424 1HA GLY 83 HA2 GLY 83 13.107 0.916 -3.975 1425 2HA GLY 83 HA3 GLY 83 14.015 -0.170 -2.908 1426 H ASP 84 HN ASP 84 12.041 -0.987 -1.168 1427 HA ASP 84 HA ASP 84 9.600 -1.810 -2.525 1428 1HB ASP 84 HB2 ASP 84 11.015 -3.762 -2.980 1429 2HB ASP 84 HB3 ASP 84 11.599 -3.779 -1.312 1430 H ALA 85 HN ALA 85 7.946 -2.090 -0.883 1431 HA ALA 85 HA ALA 85 8.669 -1.471 1.910 1432 1HB ALA 85 HB1 ALA 85 8.531 0.753 0.849 1433 2HB ALA 85 HB2 ALA 85 6.975 0.328 0.099 1434 3HB ALA 85 HB3 ALA 85 7.091 0.494 1.854 1435 H ALA 86 HN ALA 86 6.979 -1.932 3.343 1436 HA ALA 86 HA ALA 86 4.910 -3.827 2.548 1437 1HB ALA 86 HB1 ALA 86 5.902 -3.737 4.903 1438 2HB ALA 86 HB2 ALA 86 5.198 -2.117 5.092 1439 3HB ALA 86 HB3 ALA 86 4.127 -3.473 4.878 1440 H ASP 87 HN ASP 87 5.121 -0.519 3.650 1441 HA ASP 87 HA ASP 87 3.463 0.881 4.327 1442 1HB ASP 87 HB2 ASP 87 4.918 1.734 2.489 1443 2HB ASP 87 HB3 ASP 87 3.618 1.427 1.352 1444 H LYS 88 HN LYS 88 2.277 0.178 1.275 1445 HA LYS 88 HA LYS 88 -0.005 -1.387 1.815 1446 1HB LYS 88 HB2 LYS 88 -0.707 1.507 1.046 1447 2HB LYS 88 HB3 LYS 88 -1.818 0.137 0.967 1448 1HG LYS 88 HG2 LYS 88 -1.491 -0.182 3.447 1449 2HG LYS 88 HG3 LYS 88 -0.683 1.412 3.438 1450 1HD LYS 88 HD2 LYS 88 -2.704 2.426 2.453 1451 2HD LYS 88 HD3 LYS 88 -3.510 0.852 2.498 1452 1HE LYS 88 HE2 LYS 88 -2.488 2.349 4.968 1453 2HE LYS 88 HE3 LYS 88 -4.153 2.454 4.342 1454 1HZ LYS 88 HZ1 LYS 88 -4.506 0.189 4.823 1455 2HZ LYS 88 HZ2 LYS 88 -2.934 -0.109 5.202 1456 3HZ LYS 88 HZ3 LYS 88 -3.869 0.839 6.161 1457 H CYS 89 HN CYS 89 2.310 -1.416 0.209 1458 HA CYS 89 HA CYS 89 3.284 -1.005 -1.843 1459 1HB CYS 89 HB2 CYS 89 0.989 -2.724 -2.775 1460 2HB CYS 89 HB3 CYS 89 2.653 -2.749 -3.318 1461 HA PRO 90 HA PRO 90 -0.138 2.131 -2.869 1462 1HB PRO 90 HB2 PRO 90 2.306 3.880 -3.205 1463 2HB PRO 90 HB3 PRO 90 0.667 4.342 -2.653 1464 1HG PRO 90 HG2 PRO 90 2.581 3.892 -0.807 1465 2HG PRO 90 HG3 PRO 90 0.958 3.177 -0.573 1466 1HD PRO 90 HD2 PRO 90 3.460 1.866 -1.700 1467 2HD PRO 90 HD3 PRO 90 2.334 1.266 -0.461 1468 H MET 91 HN MET 91 -1.058 2.400 -4.864 1469 HA MET 91 HA MET 91 0.606 1.552 -7.145 1470 1HB MET 91 HB2 MET 91 -1.511 1.540 -8.427 1471 2HB MET 91 HB3 MET 91 -1.404 0.461 -7.063 1472 1HG MET 91 HG2 MET 91 -3.489 1.321 -6.833 1473 2HG MET 91 HG3 MET 91 -2.621 2.323 -5.718 1474 1HE MET 91 HE1 MET 91 -5.550 4.247 -7.189 1475 2HE MET 91 HE2 MET 91 -5.390 2.464 -7.191 1476 3HE MET 91 HE3 MET 91 -4.721 3.322 -5.820 1477 H THR 92 HN THR 92 0.164 4.510 -5.767 1478 HA THR 92 HA THR 92 0.418 6.656 -6.406 1479 HB THR 92 HB THR 92 2.442 6.964 -7.910 1480 HG1 THR 92 HG1 THR 92 2.141 4.877 -8.916 1481 1HG2 THR 92 HG21 THR 92 3.974 6.214 -6.165 1482 2HG2 THR 92 HG22 THR 92 2.521 6.907 -5.426 1483 3HG2 THR 92 HG23 THR 92 2.726 5.146 -5.476 1484 HA PRO 93 HA PRO 93 -2.427 6.690 -9.935 1485 1HB PRO 93 HB2 PRO 93 -3.551 9.202 -9.537 1486 2HB PRO 93 HB3 PRO 93 -4.033 7.751 -8.593 1487 1HG PRO 93 HG2 PRO 93 -1.987 9.829 -7.799 1488 2HG PRO 93 HG3 PRO 93 -3.379 9.188 -6.851 1489 1HD PRO 93 HD2 PRO 93 -0.935 8.186 -6.484 1490 2HD PRO 93 HD3 PRO 93 -2.324 7.053 -6.623 1491 HA PRO 94 HA PRO 94 0.667 8.244 -12.569 1492 1HB PRO 94 HB2 PRO 94 -0.545 8.233 -15.054 1493 2HB PRO 94 HB3 PRO 94 -0.109 6.771 -14.126 1494 1HG PRO 94 HG2 PRO 94 -2.794 8.184 -14.211 1495 2HG PRO 94 HG3 PRO 94 -2.454 6.438 -14.458 1496 1HD PRO 94 HD2 PRO 94 -3.245 7.390 -12.057 1497 2HD PRO 94 HD3 PRO 94 -1.996 6.104 -12.160 1498 H HIS 95 HN HIS 95 -1.488 10.420 -11.532 1499 HA HIS 95 HA HIS 95 -1.092 12.634 -13.369 1500 1HB HIS 95 HB2 HIS 95 -1.754 12.679 -10.400 1501 2HB HIS 95 HB3 HIS 95 -2.025 13.966 -11.567 1502 HD1 HIS 95 HD1 HIS 95 -4.374 12.683 -9.776 1503 HD2 HIS 95 HD2 HIS 95 -3.427 11.783 -13.785 1504 HE1 HIS 95 HE1 HIS 95 -6.480 11.686 -10.810 1505 H VAL 96 HN VAL 96 1.090 10.915 -11.405 1506 HA VAL 96 HA VAL 96 2.837 13.278 -10.934 1507 HB VAL 96 HB VAL 96 2.525 10.921 -9.025 1508 1HG1 VAL 96 HG11 VAL 96 4.507 12.286 -8.691 1509 2HG1 VAL 96 HG12 VAL 96 3.548 13.764 -8.762 1510 3HG1 VAL 96 HG13 VAL 96 3.370 12.660 -7.393 1511 1HG2 VAL 96 HG21 VAL 96 0.933 13.508 -8.920 1512 2HG2 VAL 96 HG22 VAL 96 0.279 11.852 -9.040 1513 3HG2 VAL 96 HG23 VAL 96 1.106 12.362 -7.573 1514 H LYS 97 HN LYS 97 5.132 12.821 -11.049 1515 HA LYS 97 HA LYS 97 5.953 10.470 -12.601 1516 1HB LYS 97 HB2 LYS 97 6.949 12.806 -12.750 1517 2HB LYS 97 HB3 LYS 97 7.659 12.536 -11.163 1518 1HG LYS 97 HG2 LYS 97 8.167 10.274 -12.969 1519 2HG LYS 97 HG3 LYS 97 8.672 11.779 -13.725 1520 1HD LYS 97 HD2 LYS 97 9.467 10.904 -10.964 1521 2HD LYS 97 HD3 LYS 97 10.369 10.416 -12.385 1522 1HE LYS 97 HE2 LYS 97 10.017 13.313 -11.442 1523 2HE LYS 97 HE3 LYS 97 11.485 12.356 -11.283 1524 1HZ LYS 97 HZ1 LYS 97 11.637 13.798 -13.170 1525 2HZ LYS 97 HZ2 LYS 97 11.613 12.254 -13.713 1526 3HZ LYS 97 HZ3 LYS 97 10.279 13.195 -13.854 1527 H ARG 98 HN ARG 98 7.437 8.809 -11.656 1528 HA ARG 98 HA ARG 98 7.655 8.818 -8.729 1529 1HB ARG 98 HB2 ARG 98 5.544 7.531 -9.235 1530 2HB ARG 98 HB3 ARG 98 6.518 6.413 -10.206 1531 1HG ARG 98 HG2 ARG 98 7.914 6.017 -8.029 1532 2HG ARG 98 HG3 ARG 98 6.615 6.912 -7.199 1533 1HD ARG 98 HD2 ARG 98 4.989 5.283 -8.117 1534 2HD ARG 98 HD3 ARG 98 6.306 4.363 -8.855 1535 HE ARG 98 HE ARG 98 7.135 4.482 -6.294 1536 1HH1 ARG 98 HH11 ARG 98 3.876 3.658 -7.442 1537 2HH1 ARG 98 HH12 ARG 98 3.572 2.546 -6.159 1538 1HH2 ARG 98 HH21 ARG 98 6.661 3.272 -4.548 1539 2HH2 ARG 98 HH22 ARG 98 5.237 2.265 -4.467 1540 H GLU 99 HN GLU 99 9.513 7.830 -8.063 1541 HA GLU 99 HA GLU 99 10.879 5.896 -9.659 1542 1HB GLU 99 HB2 GLU 99 11.774 7.995 -10.693 1543 2HB GLU 99 HB3 GLU 99 12.238 8.585 -9.100 1544 1HG GLU 99 HG2 GLU 99 14.153 7.697 -10.368 1545 2HG GLU 99 HG3 GLU 99 13.899 6.809 -8.879 1546 H HIS 100 HN HIS 100 12.469 4.839 -8.198 1547 HA HIS 100 HA HIS 100 11.987 5.555 -5.351 1548 1HB HIS 100 HB2 HIS 100 12.636 3.421 -4.662 1549 2HB HIS 100 HB3 HIS 100 11.477 3.198 -5.963 1550 HD1 HIS 100 HD1 HIS 100 14.988 2.289 -4.960 1551 HD2 HIS 100 HD2 HIS 100 12.515 2.281 -8.377 1552 HE1 HIS 100 HE1 HIS 100 16.068 0.696 -6.640 1553 H TRP 101 HN TRP 101 13.501 6.560 -4.239 1554 HA TRP 101 HA TRP 101 16.291 6.652 -5.342 1555 1HB TRP 101 HB2 TRP 101 14.927 8.649 -3.522 1556 2HB TRP 101 HB3 TRP 101 16.557 8.751 -4.130 1557 HD1 TRP 101 HD1 TRP 101 14.821 7.818 -7.139 1558 HE1 TRP 101 HE1 TRP 101 13.848 9.778 -8.443 1559 HE3 TRP 101 HE3 TRP 101 15.361 11.467 -3.610 1560 HZ2 TRP 101 HZ2 TRP 101 13.700 12.657 -8.145 1561 HZ3 TRP 101 HZ3 TRP 101 14.740 13.811 -4.140 1562 HH2 TRP 101 HH2 TRP 101 13.895 14.409 -6.395 1563 H GLY 102 HN GLY 102 14.425 5.145 -3.054 1564 1HA GLY 102 HA2 GLY 102 16.722 4.774 -1.179 1565 2HA GLY 102 HA3 GLY 102 15.030 4.494 -0.748 1566 H PHE 103 HN PHE 103 16.939 2.506 -0.520 1567 HA PHE 103 HA PHE 103 16.222 0.494 -2.591 1568 1HB PHE 103 HB2 PHE 103 19.060 1.220 -1.745 1569 2HB PHE 103 HB3 PHE 103 18.618 -0.099 -2.811 1570 HD1 PHE 103 HD1 PHE 103 18.895 3.592 -2.528 1571 HD2 PHE 103 HD2 PHE 103 18.081 0.275 -5.160 1572 HE1 PHE 103 HE1 PHE 103 19.115 5.096 -4.485 1573 HE2 PHE 103 HE2 PHE 103 18.309 1.786 -7.121 1574 HZ PHE 103 HZ PHE 103 18.812 4.198 -6.787 1575 H ASP 104 HN ASP 104 16.619 1.290 0.684 1576 HA ASP 104 HA ASP 104 16.187 -1.362 1.640 1577 1HB ASP 104 HB2 ASP 104 18.671 -1.408 1.484 1578 2HB ASP 104 HB3 ASP 104 18.760 0.112 2.371 1579 H ASP 105 HN ASP 105 15.899 -1.034 4.173 1580 HA ASP 105 HA ASP 105 14.837 1.709 4.678 1581 1HB ASP 105 HB2 ASP 105 12.980 0.339 4.097 1582 2HB ASP 105 HB3 ASP 105 13.442 -0.893 5.261 1583 HA PRO 106 HA PRO 106 17.899 0.881 7.828 1584 1HB PRO 106 HB2 PRO 106 17.968 3.351 9.043 1585 2HB PRO 106 HB3 PRO 106 18.706 2.981 7.456 1586 1HG PRO 106 HG2 PRO 106 16.013 4.250 8.027 1587 2HG PRO 106 HG3 PRO 106 17.261 4.765 6.841 1588 1HD PRO 106 HD2 PRO 106 15.105 3.206 6.150 1589 2HD PRO 106 HD3 PRO 106 16.691 2.997 5.365 1590 H ALA 107 HN ALA 107 14.589 1.903 8.624 1591 HA ALA 107 HA ALA 107 14.678 1.500 11.425 1592 1HB ALA 107 HB1 ALA 107 12.829 2.629 10.225 1593 2HB ALA 107 HB2 ALA 107 12.400 1.097 9.431 1594 3HB ALA 107 HB3 ALA 107 12.226 1.270 11.190 1595 H ARG 108 HN ARG 108 15.251 -0.715 8.950 1596 HA ARG 108 HA ARG 108 14.037 -3.060 10.351 1597 1HB ARG 108 HB2 ARG 108 15.452 -3.051 7.673 1598 2HB ARG 108 HB3 ARG 108 14.381 -4.289 8.313 1599 1HG ARG 108 HG2 ARG 108 13.548 -1.480 7.467 1600 2HG ARG 108 HG3 ARG 108 13.349 -2.943 6.508 1601 1HD ARG 108 HD2 ARG 108 11.712 -3.834 8.078 1602 2HD ARG 108 HD3 ARG 108 12.039 -2.495 9.219 1603 HE ARG 108 HE ARG 108 11.327 -0.975 7.326 1604 1HH1 ARG 108 HH11 ARG 108 9.756 -4.151 7.702 1605 2HH1 ARG 108 HH12 ARG 108 8.496 -3.775 6.588 1606 1HH2 ARG 108 HH21 ARG 108 9.877 -0.529 5.913 1607 2HH2 ARG 108 HH22 ARG 108 8.499 -1.559 5.557 1608 H ALA 109 HN ALA 109 16.817 -1.423 10.720 1609 HA ALA 109 HA ALA 109 18.972 -2.960 10.266 1610 1HB ALA 109 HB1 ALA 109 19.078 -0.758 11.361 1611 2HB ALA 109 HB2 ALA 109 18.411 -1.465 12.858 1612 3HB ALA 109 HB3 ALA 109 19.995 -1.994 12.257 1613 H GLN 110 HN GLN 110 20.103 -4.600 11.135 1614 HA GLN 110 HA GLN 110 18.677 -6.794 12.073 1615 1HB GLN 110 HB2 GLN 110 20.818 -7.045 10.918 1616 2HB GLN 110 HB3 GLN 110 21.661 -6.204 12.224 1617 1HG GLN 110 HG2 GLN 110 22.081 -8.601 12.296 1618 2HG GLN 110 HG3 GLN 110 21.319 -8.021 13.764 1619 1HE2 GLN 110 HE22 GLN 110 19.021 -8.559 14.155 1620 2HE2 GLN 110 HE21 GLN 110 18.356 -9.995 13.396 1621 H GLY 111 HN GLY 111 20.740 -4.524 13.922 1622 1HA GLY 111 HA2 GLY 111 19.444 -3.864 15.970 1623 2HA GLY 111 HA3 GLY 111 19.504 -5.616 16.378 1624 H THR 112 HN THR 112 22.366 -5.529 15.228 1625 HA THR 112 HA THR 112 23.640 -5.268 17.835 1626 HB THR 112 HB THR 112 25.690 -5.894 16.717 1627 HG1 THR 112 HG1 THR 112 25.692 -6.162 14.452 1628 1HG2 THR 112 HG21 THR 112 23.900 -7.643 17.085 1629 2HG2 THR 112 HG22 THR 112 23.477 -7.456 15.355 1630 3HG2 THR 112 HG23 THR 112 25.098 -8.022 15.819 1631 H GLU 113 HN GLU 113 25.474 -3.760 18.203 1632 HA GLU 113 HA GLU 113 24.616 -1.166 17.772 1633 1HB GLU 113 HB2 GLU 113 27.448 -2.206 18.326 1634 2HB GLU 113 HB3 GLU 113 26.926 -0.527 18.605 1635 1HG GLU 113 HG2 GLU 113 25.187 -1.390 20.207 1636 2HG GLU 113 HG3 GLU 113 25.850 -3.013 20.003 1637 H GLU 114 HN GLU 114 26.880 -3.117 15.912 1638 HA GLU 114 HA GLU 114 27.766 -0.992 14.192 1639 1HB GLU 114 HB2 GLU 114 28.651 -3.019 12.857 1640 2HB GLU 114 HB3 GLU 114 29.374 -2.678 14.442 1641 1HG GLU 114 HG2 GLU 114 27.907 -4.467 15.426 1642 2HG GLU 114 HG3 GLU 114 27.321 -4.802 13.778 1643 H GLU 115 HN GLU 115 25.201 -3.648 14.027 1644 HA GLU 115 HA GLU 115 24.926 -3.069 11.214 1645 1HB GLU 115 HB2 GLU 115 23.307 -4.748 13.114 1646 2HB GLU 115 HB3 GLU 115 22.911 -4.543 11.405 1647 1HG GLU 115 HG2 GLU 115 25.710 -5.429 12.206 1648 2HG GLU 115 HG3 GLU 115 24.381 -6.589 12.127 1649 H LYS 116 HN LYS 116 23.373 -1.935 14.207 1650 HA LYS 116 HA LYS 116 21.257 -0.521 12.892 1651 1HB LYS 116 HB2 LYS 116 22.636 0.083 15.551 1652 2HB LYS 116 HB3 LYS 116 21.184 0.880 14.945 1653 1HG LYS 116 HG2 LYS 116 20.371 -1.739 14.781 1654 2HG LYS 116 HG3 LYS 116 21.531 -1.839 16.096 1655 1HD LYS 116 HD2 LYS 116 19.689 -1.438 17.328 1656 2HD LYS 116 HD3 LYS 116 20.201 0.236 17.072 1657 1HE LYS 116 HE2 LYS 116 18.630 0.331 15.080 1658 2HE LYS 116 HE3 LYS 116 18.146 -1.336 15.438 1659 1HZ LYS 116 HZ1 LYS 116 17.290 -0.567 17.573 1660 2HZ LYS 116 HZ2 LYS 116 17.738 0.972 17.263 1661 3HZ LYS 116 HZ3 LYS 116 16.580 0.259 16.365 1662 H TRP 117 HN TRP 117 24.508 0.633 13.917 1663 HA TRP 117 HA TRP 117 24.008 3.158 12.665 1664 1HB TRP 117 HB2 TRP 117 25.876 2.500 14.360 1665 2HB TRP 117 HB3 TRP 117 26.810 2.055 12.936 1666 HD1 TRP 117 HD1 TRP 117 25.785 4.631 11.160 1667 HE1 TRP 117 HE1 TRP 117 26.657 6.953 11.665 1668 HE3 TRP 117 HE3 TRP 117 27.376 3.808 15.961 1669 HZ2 TRP 117 HZ2 TRP 117 27.805 8.314 13.900 1670 HZ3 TRP 117 HZ3 TRP 117 28.329 5.683 17.281 1671 HH2 TRP 117 HH2 TRP 117 28.546 7.949 16.272 1672 H ALA 118 HN ALA 118 25.467 0.110 11.423 1673 HA ALA 118 HA ALA 118 26.327 1.085 8.960 1674 1HB ALA 118 HB1 ALA 118 25.219 -1.670 9.668 1675 2HB ALA 118 HB2 ALA 118 26.239 -1.310 8.258 1676 3HB ALA 118 HB3 ALA 118 26.895 -1.163 9.905 1677 H PHE 119 HN PHE 119 23.066 -0.177 9.790 1678 HA PHE 119 HA PHE 119 22.034 0.026 7.128 1679 1HB PHE 119 HB2 PHE 119 20.865 -0.210 9.889 1680 2HB PHE 119 HB3 PHE 119 19.827 0.364 8.616 1681 HD1 PHE 119 HD1 PHE 119 22.388 -2.430 8.893 1682 HD2 PHE 119 HD2 PHE 119 18.405 -1.247 7.715 1683 HE1 PHE 119 HE1 PHE 119 21.862 -4.770 8.297 1684 HE2 PHE 119 HE2 PHE 119 17.899 -3.580 7.098 1685 HZ PHE 119 HZ PHE 119 19.614 -5.359 7.405 1686 H PHE 120 HN PHE 120 22.030 2.316 9.929 1687 HA PHE 120 HA PHE 120 20.476 4.303 8.588 1688 1HB PHE 120 HB2 PHE 120 22.570 4.917 10.683 1689 2HB PHE 120 HB3 PHE 120 21.104 5.808 10.319 1690 HD1 PHE 120 HD1 PHE 120 19.538 2.795 10.418 1691 HD2 PHE 120 HD2 PHE 120 21.958 5.233 13.034 1692 HE1 PHE 120 HE1 PHE 120 18.532 1.692 12.367 1693 HE2 PHE 120 HE2 PHE 120 20.947 4.104 14.996 1694 HZ PHE 120 HZ PHE 120 19.234 2.338 14.672 1695 H GLN 121 HN GLN 121 23.986 3.775 8.848 1696 HA GLN 121 HA GLN 121 24.925 6.181 7.804 1697 1HB GLN 121 HB2 GLN 121 26.210 4.399 9.039 1698 2HB GLN 121 HB3 GLN 121 26.137 3.371 7.624 1699 1HG GLN 121 HG2 GLN 121 28.306 4.397 7.829 1700 2HG GLN 121 HG3 GLN 121 27.499 5.017 6.364 1701 1HE2 GLN 121 HE22 GLN 121 27.759 5.788 9.907 1702 2HE2 GLN 121 HE21 GLN 121 27.600 7.513 9.720 1703 H ARG 122 HN ARG 122 24.413 3.027 6.122 1704 HA ARG 122 HA ARG 122 25.300 4.008 3.629 1705 1HB ARG 122 HB2 ARG 122 25.198 1.603 4.247 1706 2HB ARG 122 HB3 ARG 122 23.428 1.661 4.246 1707 1HG ARG 122 HG2 ARG 122 23.454 2.215 1.814 1708 2HG ARG 122 HG3 ARG 122 25.231 2.169 1.831 1709 1HD ARG 122 HD2 ARG 122 25.159 -0.211 2.502 1710 2HD ARG 122 HD3 ARG 122 23.381 -0.152 2.530 1711 HE ARG 122 HE ARG 122 24.357 0.711 -0.016 1712 1HH1 ARG 122 HH11 ARG 122 23.958 -2.261 1.884 1713 2HH1 ARG 122 HH12 ARG 122 23.811 -3.292 0.511 1714 1HH2 ARG 122 HH21 ARG 122 24.158 -0.660 -1.851 1715 2HH2 ARG 122 HH22 ARG 122 23.932 -2.356 -1.661 1716 H VAL 123 HN VAL 123 21.931 3.587 4.933 1717 HA VAL 123 HA VAL 123 20.781 4.468 2.468 1718 HB VAL 123 HB VAL 123 19.491 4.344 5.223 1719 1HG1 VAL 123 HG11 VAL 123 17.369 4.181 3.798 1720 2HG1 VAL 123 HG12 VAL 123 18.167 5.749 3.742 1721 3HG1 VAL 123 HG13 VAL 123 18.350 4.609 2.394 1722 1HG2 VAL 123 HG21 VAL 123 19.527 2.341 2.909 1723 2HG2 VAL 123 HG22 VAL 123 20.340 2.122 4.470 1724 3HG2 VAL 123 HG23 VAL 123 18.583 2.173 4.404 1725 H ARG 124 HN ARG 124 21.561 6.295 5.531 1726 HA ARG 124 HA ARG 124 20.469 8.738 4.679 1727 1HB ARG 124 HB2 ARG 124 21.306 8.279 6.953 1728 2HB ARG 124 HB3 ARG 124 22.965 8.243 6.341 1729 1HG ARG 124 HG2 ARG 124 22.081 10.726 5.477 1730 2HG ARG 124 HG3 ARG 124 21.165 10.536 6.964 1731 1HD ARG 124 HD2 ARG 124 23.176 11.722 7.463 1732 2HD ARG 124 HD3 ARG 124 23.347 10.109 8.150 1733 HE ARG 124 HE ARG 124 24.602 11.132 5.614 1734 1HH1 ARG 124 HH11 ARG 124 24.755 8.852 8.402 1735 2HH1 ARG 124 HH12 ARG 124 26.277 8.227 7.851 1736 1HH2 ARG 124 HH21 ARG 124 26.653 10.179 5.016 1737 2HH2 ARG 124 HH22 ARG 124 27.275 8.880 5.993 1738 H ASP 125 HN ASP 125 23.799 7.450 4.072 1739 HA ASP 125 HA ASP 125 24.772 9.719 2.717 1740 1HB ASP 125 HB2 ASP 125 26.211 7.874 3.433 1741 2HB ASP 125 HB3 ASP 125 25.432 6.780 2.287 1742 H GLU 126 HN GLU 126 22.992 6.879 1.421 1743 HA GLU 126 HA GLU 126 23.046 7.718 -1.304 1744 1HB GLU 126 HB2 GLU 126 22.530 5.401 -0.375 1745 2HB GLU 126 HB3 GLU 126 20.958 6.008 0.115 1746 1HG GLU 126 HG2 GLU 126 20.713 4.829 -1.947 1747 2HG GLU 126 HG3 GLU 126 20.416 6.538 -2.254 1748 H ILE 127 HN ILE 127 20.590 8.171 1.298 1749 HA ILE 127 HA ILE 127 18.625 9.516 -0.200 1750 HB ILE 127 HB ILE 127 19.356 9.164 2.683 1751 1HG1 ILE 127 HG12 ILE 127 16.789 8.888 1.078 1752 2HG1 ILE 127 HG13 ILE 127 17.940 7.590 1.407 1753 1HG2 ILE 127 HG21 ILE 127 18.940 11.512 2.808 1754 2HG2 ILE 127 HG22 ILE 127 17.410 11.338 1.896 1755 3HG2 ILE 127 HG23 ILE 127 17.619 10.642 3.529 1756 1HD1 ILE 127 HD11 ILE 127 16.103 8.988 3.387 1757 2HD1 ILE 127 HD12 ILE 127 16.124 7.288 2.900 1758 3HD1 ILE 127 HD13 ILE 127 17.450 7.941 3.890 1759 H GLY 128 HN GLY 128 21.364 10.922 1.689 1760 1HA GLY 128 HA2 GLY 128 20.644 13.614 1.086 1761 2HA GLY 128 HA3 GLY 128 22.252 13.030 1.620 1762 H ASN 129 HN ASN 129 22.904 11.314 -0.570 1763 HA ASN 129 HA ASN 129 23.759 13.214 -2.493 1764 1HB ASN 129 HB2 ASN 129 24.971 11.101 -2.226 1765 2HB ASN 129 HB3 ASN 129 23.537 10.176 -2.687 1766 1HD2 ASN 129 HD22 ASN 129 23.233 9.747 -4.909 1767 2HD2 ASN 129 HD21 ASN 129 23.987 10.678 -6.197 1768 H ARG 130 HN ARG 130 20.925 11.003 -2.536 1769 HA ARG 130 HA ARG 130 20.246 11.850 -5.238 1770 1HB ARG 130 HB2 ARG 130 18.485 10.491 -3.161 1771 2HB ARG 130 HB3 ARG 130 18.069 10.743 -4.859 1772 1HG ARG 130 HG2 ARG 130 20.321 9.010 -3.786 1773 2HG ARG 130 HG3 ARG 130 18.840 8.452 -4.539 1774 1HD ARG 130 HD2 ARG 130 19.547 9.295 -6.709 1775 2HD ARG 130 HD3 ARG 130 20.946 10.119 -5.988 1776 HE ARG 130 HE ARG 130 21.083 7.388 -5.279 1777 1HH1 ARG 130 HH21 ARG 130 21.769 9.564 -8.048 1778 2HH1 ARG 130 HH22 ARG 130 22.811 8.404 -8.800 1779 1HH2 ARG 130 HH11 ARG 130 22.517 6.094 -6.079 1780 2HH2 ARG 130 HH12 ARG 130 23.310 6.329 -7.627 1781 H LEU 131 HN LEU 131 19.305 13.118 -2.012 1782 HA LEU 131 HA LEU 131 17.469 14.946 -3.282 1783 1HB LEU 131 HB2 LEU 131 18.533 14.581 -0.502 1784 2HB LEU 131 HB3 LEU 131 18.044 16.209 -0.923 1785 HG LEU 131 HG LEU 131 16.203 15.030 0.115 1786 1HD1 LEU 131 HD11 LEU 131 15.527 15.401 -2.850 1787 2HD1 LEU 131 HD12 LEU 131 14.451 15.566 -1.481 1788 3HD1 LEU 131 HD13 LEU 131 15.759 16.732 -1.721 1789 1HD2 LEU 131 HD21 LEU 131 15.121 13.090 -0.890 1790 2HD2 LEU 131 HD22 LEU 131 16.314 13.058 -2.198 1791 3HD2 LEU 131 HD23 LEU 131 16.807 12.733 -0.526 1792 H LYS 132 HN LYS 132 20.940 15.234 -2.395 1793 HA LYS 132 HA LYS 132 20.983 17.984 -3.214 1794 1HB LYS 132 HB2 LYS 132 23.116 18.043 -2.705 1795 2HB LYS 132 HB3 LYS 132 22.679 16.600 -1.790 1796 1HG LYS 132 HG2 LYS 132 23.543 15.262 -3.817 1797 2HG LYS 132 HG3 LYS 132 24.203 16.795 -4.408 1798 1HD LYS 132 HD2 LYS 132 24.807 15.432 -1.745 1799 2HD LYS 132 HD3 LYS 132 25.890 15.498 -3.154 1800 1HE LYS 132 HE2 LYS 132 25.893 18.019 -2.941 1801 2HE LYS 132 HE3 LYS 132 24.911 17.855 -1.480 1802 1HZ LYS 132 HZ1 LYS 132 27.220 18.102 -0.923 1803 2HZ LYS 132 HZ2 LYS 132 26.755 16.603 -0.480 1804 3HZ LYS 132 HZ3 LYS 132 27.665 16.816 -1.823 1805 H GLU 133 HN GLU 133 21.511 14.905 -4.984 1806 HA GLU 133 HA GLU 133 21.957 16.082 -7.536 1807 1HB GLU 133 HB2 GLU 133 20.754 13.457 -6.617 1808 2HB GLU 133 HB3 GLU 133 20.511 13.959 -8.295 1809 1HG GLU 133 HG2 GLU 133 22.786 14.009 -8.790 1810 2HG GLU 133 HG3 GLU 133 23.271 13.884 -7.085 1811 H PHE 134 HN PHE 134 18.781 15.481 -5.805 1812 HA PHE 134 HA PHE 134 17.270 16.232 -8.064 1813 1HB PHE 134 HB2 PHE 134 16.255 15.175 -6.165 1814 2HB PHE 134 HB3 PHE 134 16.680 16.515 -5.110 1815 HD1 PHE 134 HD1 PHE 134 14.873 17.792 -4.467 1816 HD2 PHE 134 HD2 PHE 134 14.940 16.205 -8.455 1817 HE1 PHE 134 HE1 PHE 134 12.741 18.981 -4.975 1818 HE2 PHE 134 HE2 PHE 134 12.803 17.364 -8.954 1819 HZ PHE 134 HZ PHE 134 11.696 18.738 -7.216 1820 H ALA 135 HN ALA 135 18.776 18.289 -5.584 1821 HA ALA 135 HA ALA 135 17.751 20.766 -6.490 1822 1HB ALA 135 HB1 ALA 135 20.486 20.261 -5.232 1823 2HB ALA 135 HB2 ALA 135 19.565 21.775 -5.241 1824 3HB ALA 135 HB3 ALA 135 18.963 20.381 -4.325 1825 H GLU 136 HN GLU 136 20.348 18.745 -7.737 1826 HA GLU 136 HA GLU 136 21.497 20.786 -9.442 1827 1HB GLU 136 HB2 GLU 136 22.062 17.826 -9.091 1828 2HB GLU 136 HB3 GLU 136 22.959 18.857 -10.190 1829 1HG GLU 136 HG2 GLU 136 22.771 19.470 -7.216 1830 2HG GLU 136 HG3 GLU 136 23.952 18.354 -7.877 1831 H THR 137 HN THR 137 19.748 17.771 -9.811 1832 HA THR 137 HA THR 137 19.761 17.790 -12.702 1833 HB THR 137 HB THR 137 18.628 15.537 -12.377 1834 HG1 THR 137 HG1 THR 137 18.878 16.084 -9.625 1835 1HG2 THR 137 HG21 THR 137 20.525 14.467 -11.213 1836 2HG2 THR 137 HG22 THR 137 21.093 15.713 -12.337 1837 3HG2 THR 137 HG23 THR 137 21.076 16.035 -10.598 1838 H GLY 138 HN GLY 138 17.519 18.870 -10.220 1839 1HA GLY 138 HA2 GLY 138 15.364 19.564 -10.234 1840 2HA GLY 138 HA3 GLY 138 15.607 20.082 -11.920 1841 H LYS 139 HN LYS 139 15.864 16.858 -10.462 1842 HA LYS 139 HA LYS 139 15.093 15.422 -12.581 1843 1HB LYS 139 HB2 LYS 139 15.949 14.771 -10.154 1844 2HB LYS 139 HB3 LYS 139 14.255 14.314 -9.903 1845 1HG LYS 139 HG2 LYS 139 14.330 12.859 -11.882 1846 2HG LYS 139 HG3 LYS 139 15.978 13.401 -12.252 1847 1HD LYS 139 HD2 LYS 139 15.024 11.493 -10.164 1848 2HD LYS 139 HD3 LYS 139 16.331 11.343 -11.342 1849 1HE LYS 139 HE2 LYS 139 16.444 13.037 -8.807 1850 2HE LYS 139 HE3 LYS 139 17.082 11.406 -8.981 1851 1HZ LYS 139 HZ1 LYS 139 18.526 12.281 -10.789 1852 2HZ LYS 139 HZ2 LYS 139 18.058 13.815 -10.397 1853 3HZ LYS 139 HZ3 LYS 139 18.858 12.890 -9.314 Start of MODEL 21 1 1H MET 1 H1 MET 1 -24.154 -11.863 -7.656 2 2H MET 1 H2 MET 1 -22.917 -10.960 -8.237 3 3H MET 1 H3 MET 1 -22.643 -12.507 -7.804 4 HA MET 1 HA MET 1 -24.249 -13.249 -9.491 5 1HB MET 1 HB2 MET 1 -23.870 -10.414 -10.562 6 2HB MET 1 HB3 MET 1 -24.634 -11.766 -11.401 7 1HG MET 1 HG2 MET 1 -26.439 -10.557 -10.559 8 2HG MET 1 HG3 MET 1 -26.274 -11.904 -9.440 9 1HE MET 1 HE1 MET 1 -28.145 -9.842 -8.430 10 2HE MET 1 HE2 MET 1 -27.469 -11.087 -7.351 11 3HE MET 1 HE3 MET 1 -27.505 -9.388 -6.832 12 H ALA 2 HN ALA 2 -21.481 -10.935 -10.129 13 HA ALA 2 HA ALA 2 -19.682 -13.158 -10.539 14 1HB ALA 2 HB1 ALA 2 -20.649 -12.908 -12.845 15 2HB ALA 2 HB2 ALA 2 -20.255 -11.173 -12.807 16 3HB ALA 2 HB3 ALA 2 -18.959 -12.386 -12.788 17 H ILE 3 HN ILE 3 -17.464 -12.177 -10.927 18 HA ILE 3 HA ILE 3 -17.110 -9.686 -9.407 19 HB ILE 3 HB ILE 3 -15.248 -11.938 -10.282 20 1HG1 ILE 3 HG12 ILE 3 -14.486 -11.700 -7.886 21 2HG1 ILE 3 HG13 ILE 3 -15.804 -10.558 -7.631 22 1HG2 ILE 3 HG21 ILE 3 -14.065 -9.877 -10.935 23 2HG2 ILE 3 HG22 ILE 3 -14.442 -9.144 -9.360 24 3HG2 ILE 3 HG23 ILE 3 -13.342 -10.543 -9.477 25 1HD1 ILE 3 HD11 ILE 3 -16.081 -13.487 -8.384 26 2HD1 ILE 3 HD12 ILE 3 -16.309 -12.730 -6.793 27 3HD1 ILE 3 HD13 ILE 3 -17.434 -12.348 -8.094 28 H VAL 4 HN VAL 4 -17.888 -8.136 -10.672 29 HA VAL 4 HA VAL 4 -17.483 -8.019 -13.555 30 HB VAL 4 HB VAL 4 -18.670 -6.029 -11.580 31 1HG1 VAL 4 HG11 VAL 4 -20.018 -5.235 -13.542 32 2HG1 VAL 4 HG12 VAL 4 -18.311 -4.886 -13.695 33 3HG1 VAL 4 HG13 VAL 4 -19.022 -6.251 -14.599 34 1HG2 VAL 4 HG21 VAL 4 -20.076 -8.225 -13.160 35 2HG2 VAL 4 HG22 VAL 4 -19.959 -8.095 -11.391 36 3HG2 VAL 4 HG23 VAL 4 -20.905 -6.920 -12.284 37 H LYS 5 HN LYS 5 -16.605 -5.884 -14.422 38 HA LYS 5 HA LYS 5 -14.258 -4.967 -12.906 39 1HB LYS 5 HB2 LYS 5 -12.953 -4.873 -14.981 40 2HB LYS 5 HB3 LYS 5 -13.419 -6.511 -14.522 41 1HG LYS 5 HG2 LYS 5 -15.363 -6.295 -16.199 42 2HG LYS 5 HG3 LYS 5 -14.583 -4.804 -16.761 43 1HD LYS 5 HD2 LYS 5 -12.578 -6.063 -17.416 44 2HD LYS 5 HD3 LYS 5 -13.201 -7.521 -16.630 45 1HE LYS 5 HE2 LYS 5 -13.572 -7.814 -18.962 46 2HE LYS 5 HE3 LYS 5 -15.139 -7.550 -18.190 47 1HZ LYS 5 HZ1 LYS 5 -13.600 -5.498 -19.689 48 2HZ LYS 5 HZ2 LYS 5 -14.904 -6.293 -20.248 49 3HZ LYS 5 HZ3 LYS 5 -15.069 -5.256 -19.005 50 H ALA 6 HN ALA 6 -14.321 -2.889 -12.587 51 HA ALA 6 HA ALA 6 -16.366 -1.189 -13.864 52 1HB ALA 6 HB1 ALA 6 -14.484 -0.936 -11.519 53 2HB ALA 6 HB2 ALA 6 -15.262 0.488 -12.230 54 3HB ALA 6 HB3 ALA 6 -16.249 -0.789 -11.554 55 H THR 7 HN THR 7 -15.535 1.011 -14.595 56 HA THR 7 HA THR 7 -12.700 1.198 -15.371 57 HB THR 7 HB THR 7 -13.277 2.172 -17.499 58 HG1 THR 7 HG1 THR 7 -15.278 2.572 -18.143 59 1HG2 THR 7 HG21 THR 7 -13.140 -0.281 -17.428 60 2HG2 THR 7 HG22 THR 7 -14.914 -0.359 -17.211 61 3HG2 THR 7 HG23 THR 7 -14.216 0.322 -18.707 62 H ASP 8 HN ASP 8 -12.836 3.662 -16.394 63 HA ASP 8 HA ASP 8 -12.862 5.618 -14.365 64 1HB ASP 8 HB2 ASP 8 -11.730 5.964 -16.449 65 2HB ASP 8 HB3 ASP 8 -13.198 5.673 -17.376 66 H GLN 9 HN GLN 9 -15.588 4.280 -16.172 67 HA GLN 9 HA GLN 9 -17.443 6.123 -14.801 68 1HB GLN 9 HB2 GLN 9 -17.277 5.491 -17.765 69 2HB GLN 9 HB3 GLN 9 -18.754 6.123 -17.025 70 1HG GLN 9 HG2 GLN 9 -17.726 8.187 -16.409 71 2HG GLN 9 HG3 GLN 9 -16.110 7.570 -16.694 72 1HE2 GLN 9 HE22 GLN 9 -15.156 8.312 -18.497 73 2HE2 GLN 9 HE21 GLN 9 -15.989 8.757 -19.986 74 H SER 10 HN SER 10 -16.906 2.938 -16.375 75 HA SER 10 HA SER 10 -19.511 1.970 -15.912 76 1HB SER 10 HB2 SER 10 -17.018 0.248 -15.878 77 2HB SER 10 HB3 SER 10 -18.670 -0.225 -16.289 78 HG SER 10 HG SER 10 -16.817 1.344 -17.705 79 H PHE 11 HN PHE 11 -16.959 2.587 -13.562 80 HA PHE 11 HA PHE 11 -17.779 0.877 -11.451 81 1HB PHE 11 HB2 PHE 11 -15.792 2.265 -11.198 82 2HB PHE 11 HB3 PHE 11 -16.703 3.720 -11.503 83 HD1 PHE 11 HD1 PHE 11 -17.747 4.921 -9.763 84 HD2 PHE 11 HD2 PHE 11 -16.255 0.923 -8.962 85 HE1 PHE 11 HE1 PHE 11 -18.045 5.283 -7.335 86 HE2 PHE 11 HE2 PHE 11 -16.505 1.358 -6.543 87 HZ PHE 11 HZ PHE 11 -17.397 3.512 -5.720 88 H SER 12 HN SER 12 -18.918 4.267 -12.196 89 HA SER 12 HA SER 12 -20.910 4.201 -10.225 90 1HB SER 12 HB2 SER 12 -21.075 5.703 -12.877 91 2HB SER 12 HB3 SER 12 -21.723 6.215 -11.311 92 HG SER 12 HG SER 12 -19.765 7.306 -11.812 93 H ALA 13 HN ALA 13 -21.025 3.368 -13.707 94 HA ALA 13 HA ALA 13 -23.801 3.144 -13.854 95 1HB ALA 13 HB1 ALA 13 -21.729 1.611 -15.485 96 2HB ALA 13 HB2 ALA 13 -23.404 1.953 -15.964 97 3HB ALA 13 HB3 ALA 13 -22.244 3.291 -15.792 98 H GLU 14 HN GLU 14 -21.366 0.710 -12.928 99 HA GLU 14 HA GLU 14 -23.280 -1.413 -12.688 100 1HB GLU 14 HB2 GLU 14 -20.354 -1.124 -11.937 101 2HB GLU 14 HB3 GLU 14 -21.261 -2.585 -11.585 102 1HG GLU 14 HG2 GLU 14 -20.896 -1.404 -14.365 103 2HG GLU 14 HG3 GLU 14 -19.975 -2.748 -13.694 104 H THR 15 HN THR 15 -22.381 1.188 -10.556 105 HA THR 15 HA THR 15 -23.110 -0.436 -8.185 106 HB THR 15 HB THR 15 -21.747 1.226 -6.927 107 HG1 THR 15 HG1 THR 15 -20.807 2.132 -9.393 108 1HG2 THR 15 HG21 THR 15 -19.475 0.743 -8.011 109 2HG2 THR 15 HG22 THR 15 -20.428 -0.673 -7.518 110 3HG2 THR 15 HG23 THR 15 -20.331 -0.204 -9.225 111 H SER 16 HN SER 16 -24.563 1.858 -10.135 112 HA SER 16 HA SER 16 -25.636 3.609 -8.125 113 1HB SER 16 HB2 SER 16 -26.476 3.099 -10.999 114 2HB SER 16 HB3 SER 16 -27.091 4.403 -9.962 115 HG SER 16 HG SER 16 -24.372 3.999 -10.726 116 H GLU 17 HN GLU 17 -26.359 0.368 -8.557 117 HA GLU 17 HA GLU 17 -28.989 0.669 -7.331 118 1HB GLU 17 HB2 GLU 17 -28.416 -0.900 -9.888 119 2HB GLU 17 HB3 GLU 17 -29.854 -1.154 -8.888 120 1HG GLU 17 HG2 GLU 17 -30.484 1.247 -9.242 121 2HG GLU 17 HG3 GLU 17 -29.120 1.413 -10.355 122 H GLY 18 HN GLY 18 -29.658 -1.302 -6.221 123 1HA GLY 18 HA2 GLY 18 -29.410 -3.178 -5.016 124 2HA GLY 18 HA3 GLY 18 -28.104 -3.676 -6.113 125 H VAL 19 HN VAL 19 -27.200 -4.547 -4.150 126 HA VAL 19 HA VAL 19 -25.442 -2.549 -2.819 127 HB VAL 19 HB VAL 19 -26.306 -5.175 -1.537 128 1HG1 VAL 19 HG11 VAL 19 -24.702 -2.765 -0.544 129 2HG1 VAL 19 HG12 VAL 19 -25.183 -4.132 0.462 130 3HG1 VAL 19 HG13 VAL 19 -24.064 -4.389 -0.870 131 1HG2 VAL 19 HG21 VAL 19 -27.379 -2.371 -1.192 132 2HG2 VAL 19 HG22 VAL 19 -28.273 -3.867 -1.476 133 3HG2 VAL 19 HG23 VAL 19 -27.515 -3.579 0.092 134 H VAL 20 HN VAL 20 -23.417 -2.767 -2.984 135 HA VAL 20 HA VAL 20 -22.386 -4.985 -4.600 136 HB VAL 20 HB VAL 20 -23.335 -3.374 -6.159 137 1HG1 VAL 20 HG11 VAL 20 -23.335 -1.330 -4.801 138 2HG1 VAL 20 HG12 VAL 20 -21.550 -1.294 -4.849 139 3HG1 VAL 20 HG13 VAL 20 -22.502 -1.063 -6.317 140 1HG2 VAL 20 HG21 VAL 20 -21.187 -4.478 -6.783 141 2HG2 VAL 20 HG22 VAL 20 -21.456 -2.917 -7.569 142 3HG2 VAL 20 HG23 VAL 20 -20.315 -3.038 -6.215 143 H LEU 21 HN LEU 21 -20.315 -5.204 -4.477 144 HA LEU 21 HA LEU 21 -18.753 -3.706 -2.409 145 1HB LEU 21 HB2 LEU 21 -19.400 -6.065 -1.852 146 2HB LEU 21 HB3 LEU 21 -18.545 -6.610 -3.299 147 HG LEU 21 HG LEU 21 -16.405 -5.736 -2.339 148 1HD1 LEU 21 HD11 LEU 21 -17.155 -3.946 -0.898 149 2HD1 LEU 21 HD12 LEU 21 -18.225 -5.043 0.017 150 3HD1 LEU 21 HD13 LEU 21 -16.471 -5.186 0.152 151 1HD2 LEU 21 HD21 LEU 21 -16.175 -7.468 -0.617 152 2HD2 LEU 21 HD22 LEU 21 -17.939 -7.597 -0.467 153 3HD2 LEU 21 HD23 LEU 21 -17.130 -8.083 -1.973 154 H ALA 22 HN ALA 22 -17.495 -2.266 -3.588 155 HA ALA 22 HA ALA 22 -16.240 -3.231 -6.076 156 1HB ALA 22 HB1 ALA 22 -15.665 -0.927 -6.533 157 2HB ALA 22 HB2 ALA 22 -17.395 -1.033 -6.185 158 3HB ALA 22 HB3 ALA 22 -16.272 -0.425 -4.937 159 H ASP 23 HN ASP 23 -14.057 -3.361 -6.266 160 HA ASP 23 HA ASP 23 -12.371 -3.085 -3.834 161 1HB ASP 23 HB2 ASP 23 -13.087 -5.389 -3.907 162 2HB ASP 23 HB3 ASP 23 -12.791 -5.483 -5.637 163 H PHE 24 HN PHE 24 -10.170 -2.779 -4.300 164 HA PHE 24 HA PHE 24 -9.520 -1.865 -7.070 165 1HB PHE 24 HB2 PHE 24 -9.115 -0.534 -4.384 166 2HB PHE 24 HB3 PHE 24 -8.342 0.004 -5.844 167 HD1 PHE 24 HD1 PHE 24 -9.381 1.639 -7.170 168 HD2 PHE 24 HD2 PHE 24 -11.814 -0.604 -4.421 169 HE1 PHE 24 HE1 PHE 24 -11.354 3.028 -7.768 170 HE2 PHE 24 HE2 PHE 24 -13.782 0.734 -5.063 171 HZ PHE 24 HZ PHE 24 -13.560 2.571 -6.726 172 H TRP 25 HN TRP 25 -8.007 -3.246 -7.720 173 HA TRP 25 HA TRP 25 -6.062 -4.426 -5.799 174 1HB TRP 25 HB2 TRP 25 -6.350 -6.519 -6.728 175 2HB TRP 25 HB3 TRP 25 -7.994 -5.933 -6.619 176 HD1 TRP 25 HD1 TRP 25 -8.888 -4.793 -9.058 177 HE1 TRP 25 HE1 TRP 25 -8.463 -5.452 -11.464 178 HE3 TRP 25 HE3 TRP 25 -4.936 -7.952 -8.297 179 HZ2 TRP 25 HZ2 TRP 25 -6.377 -6.939 -12.940 180 HZ3 TRP 25 HZ3 TRP 25 -3.731 -8.940 -10.210 181 HH2 TRP 25 HH2 TRP 25 -4.438 -8.426 -12.538 182 H ALA 26 HN ALA 26 -3.913 -4.790 -6.812 183 HA ALA 26 HA ALA 26 -3.533 -4.394 -9.625 184 1HB ALA 26 HB1 ALA 26 -2.843 -2.190 -7.705 185 2HB ALA 26 HB2 ALA 26 -1.864 -2.395 -9.176 186 3HB ALA 26 HB3 ALA 26 -3.588 -2.065 -9.321 187 HA PRO 27 HA PRO 27 -0.004 -6.816 -8.914 188 1HB PRO 27 HB2 PRO 27 1.678 -4.907 -10.530 189 2HB PRO 27 HB3 PRO 27 1.490 -6.677 -10.715 190 1HG PRO 27 HG2 PRO 27 0.186 -4.965 -12.377 191 2HG PRO 27 HG3 PRO 27 -0.685 -6.402 -11.727 192 1HD PRO 27 HD2 PRO 27 -0.777 -3.551 -10.779 193 2HD PRO 27 HD3 PRO 27 -2.108 -4.711 -11.062 194 H TRP 28 HN TRP 28 0.222 -3.591 -7.692 195 HA TRP 28 HA TRP 28 2.850 -3.278 -6.814 196 1HB TRP 28 HB2 TRP 28 0.366 -2.446 -5.341 197 2HB TRP 28 HB3 TRP 28 1.994 -1.814 -5.137 198 HD1 TRP 28 HD1 TRP 28 -1.050 -1.413 -7.181 199 HE1 TRP 28 HE1 TRP 28 -0.809 0.369 -8.998 200 HE3 TRP 28 HE3 TRP 28 3.959 -0.596 -6.735 201 HZ2 TRP 28 HZ2 TRP 28 1.333 2.002 -10.080 202 HZ3 TRP 28 HZ3 TRP 28 5.082 1.102 -8.151 203 HH2 TRP 28 HH2 TRP 28 3.784 2.403 -9.826 204 H CYS 29 HN CYS 29 0.262 -5.120 -5.031 205 HA CYS 29 HA CYS 29 2.442 -6.504 -3.621 206 1HB CYS 29 HB2 CYS 29 0.686 -4.428 -2.328 207 2HB CYS 29 HB3 CYS 29 1.205 -5.802 -1.365 208 H GLY 30 HN GLY 30 1.713 -7.953 -1.953 209 1HA GLY 30 HA2 GLY 30 0.471 -10.128 -2.822 210 2HA GLY 30 HA3 GLY 30 0.552 -9.697 -1.117 211 HA PRO 31 HA PRO 31 -3.669 -9.345 -0.489 212 1HB PRO 31 HB2 PRO 31 -3.935 -6.362 -0.831 213 2HB PRO 31 HB3 PRO 31 -4.670 -7.424 0.416 214 1HG PRO 31 HG2 PRO 31 -2.395 -6.020 0.978 215 2HG PRO 31 HG3 PRO 31 -2.520 -7.738 1.479 216 1HD PRO 31 HD2 PRO 31 -1.077 -6.573 -0.907 217 2HD PRO 31 HD3 PRO 31 -0.549 -7.869 0.209 218 H SER 32 HN SER 32 -2.889 -7.346 -3.395 219 HA SER 32 HA SER 32 -5.429 -7.514 -4.633 220 1HB SER 32 HB2 SER 32 -2.645 -7.570 -5.895 221 2HB SER 32 HB3 SER 32 -4.125 -6.961 -6.647 222 HG SER 32 HG SER 32 -2.526 -5.485 -5.585 223 H LYS 33 HN LYS 33 -3.214 -10.046 -4.000 224 HA LYS 33 HA LYS 33 -4.569 -11.830 -5.969 225 1HB LYS 33 HB2 LYS 33 -1.939 -12.373 -4.561 226 2HB LYS 33 HB3 LYS 33 -2.725 -13.282 -5.851 227 1HG LYS 33 HG2 LYS 33 -1.101 -12.219 -7.042 228 2HG LYS 33 HG3 LYS 33 -2.465 -11.128 -7.299 229 1HD LYS 33 HD2 LYS 33 -1.571 -9.628 -5.522 230 2HD LYS 33 HD3 LYS 33 -0.240 -10.739 -5.227 231 1HE LYS 33 HE2 LYS 33 -0.792 -9.299 -7.867 232 2HE LYS 33 HE3 LYS 33 0.324 -8.722 -6.625 233 1HZ LYS 33 HZ1 LYS 33 0.616 -11.269 -8.117 234 2HZ LYS 33 HZ2 LYS 33 1.502 -9.923 -8.342 235 3HZ LYS 33 HZ3 LYS 33 1.632 -10.748 -6.945 236 H MET 34 HN MET 34 -5.063 -10.907 -2.913 237 HA MET 34 HA MET 34 -5.605 -13.663 -1.865 238 1HB MET 34 HB2 MET 34 -4.783 -11.228 -0.241 239 2HB MET 34 HB3 MET 34 -5.072 -12.866 0.353 240 1HG MET 34 HG2 MET 34 -3.158 -13.698 -0.989 241 2HG MET 34 HG3 MET 34 -2.888 -12.084 -1.620 242 1HE MET 34 HE1 MET 34 -1.703 -13.725 2.462 243 2HE MET 34 HE2 MET 34 -3.387 -13.829 1.889 244 3HE MET 34 HE3 MET 34 -2.084 -14.615 0.966 245 H ILE 35 HN ILE 35 -6.540 -10.160 -1.752 246 HA ILE 35 HA ILE 35 -9.171 -10.659 -0.812 247 HB ILE 35 HB ILE 35 -7.697 -8.445 -1.062 248 1HG1 ILE 35 HG12 ILE 35 -9.993 -7.135 -1.002 249 2HG1 ILE 35 HG13 ILE 35 -10.708 -8.754 -0.976 250 1HG2 ILE 35 HG21 ILE 35 -9.430 -8.181 -3.531 251 2HG2 ILE 35 HG22 ILE 35 -8.412 -6.942 -2.771 252 3HG2 ILE 35 HG23 ILE 35 -7.655 -8.359 -3.501 253 1HD1 ILE 35 HD11 ILE 35 -9.388 -9.315 1.038 254 2HD1 ILE 35 HD12 ILE 35 -8.517 -7.766 0.916 255 3HD1 ILE 35 HD13 ILE 35 -10.255 -7.787 1.308 256 H ALA 36 HN ALA 36 -7.627 -10.670 -4.027 257 HA ALA 36 HA ALA 36 -9.852 -10.798 -5.657 258 1HB ALA 36 HB1 ALA 36 -7.725 -10.480 -6.641 259 2HB ALA 36 HB2 ALA 36 -7.051 -11.972 -5.993 260 3HB ALA 36 HB3 ALA 36 -8.296 -12.042 -7.259 261 HA PRO 37 HA PRO 37 -10.170 -15.586 -5.309 262 1HB PRO 37 HB2 PRO 37 -8.954 -16.617 -2.929 263 2HB PRO 37 HB3 PRO 37 -8.466 -16.912 -4.631 264 1HG PRO 37 HG2 PRO 37 -7.329 -15.050 -2.610 265 2HG PRO 37 HG3 PRO 37 -6.519 -15.795 -4.015 266 1HD PRO 37 HD2 PRO 37 -7.286 -13.144 -3.949 267 2HD PRO 37 HD3 PRO 37 -7.197 -14.106 -5.442 268 H VAL 38 HN VAL 38 -9.818 -13.747 -2.214 269 HA VAL 38 HA VAL 38 -11.964 -14.936 -0.827 270 HB VAL 38 HB VAL 38 -10.431 -12.380 -0.700 271 1HG1 VAL 38 HG11 VAL 38 -12.565 -11.505 -0.229 272 2HG1 VAL 38 HG12 VAL 38 -12.976 -12.838 0.850 273 3HG1 VAL 38 HG13 VAL 38 -11.701 -11.669 1.313 274 1HG2 VAL 38 HG21 VAL 38 -9.781 -13.271 1.462 275 2HG2 VAL 38 HG22 VAL 38 -10.966 -14.591 1.313 276 3HG2 VAL 38 HG23 VAL 38 -9.574 -14.521 0.214 277 H LEU 39 HN LEU 39 -12.010 -12.281 -3.243 278 HA LEU 39 HA LEU 39 -14.814 -11.760 -2.872 279 1HB LEU 39 HB2 LEU 39 -12.947 -11.246 -5.221 280 2HB LEU 39 HB3 LEU 39 -14.629 -10.759 -5.215 281 HG LEU 39 HG LEU 39 -12.593 -9.862 -3.114 282 1HD1 LEU 39 HD11 LEU 39 -13.554 -8.337 -5.562 283 2HD1 LEU 39 HD12 LEU 39 -12.447 -7.764 -4.294 284 3HD1 LEU 39 HD13 LEU 39 -11.949 -9.080 -5.355 285 1HD2 LEU 39 HD21 LEU 39 -14.896 -9.664 -2.289 286 2HD2 LEU 39 HD22 LEU 39 -14.143 -8.088 -2.548 287 3HD2 LEU 39 HD23 LEU 39 -15.326 -8.692 -3.708 288 H GLU 40 HN GLU 40 -13.019 -13.904 -5.190 289 HA GLU 40 HA GLU 40 -15.398 -14.673 -6.560 290 1HB GLU 40 HB2 GLU 40 -12.766 -16.157 -6.310 291 2HB GLU 40 HB3 GLU 40 -14.094 -16.514 -7.442 292 1HG GLU 40 HG2 GLU 40 -13.842 -14.297 -8.480 293 2HG GLU 40 HG3 GLU 40 -12.505 -13.921 -7.399 294 H GLU 41 HN GLU 41 -13.738 -15.927 -3.657 295 HA GLU 41 HA GLU 41 -15.474 -18.143 -3.215 296 1HB GLU 41 HB2 GLU 41 -13.546 -16.626 -1.429 297 2HB GLU 41 HB3 GLU 41 -14.486 -18.011 -0.874 298 1HG GLU 41 HG2 GLU 41 -13.506 -19.416 -2.667 299 2HG GLU 41 HG3 GLU 41 -12.492 -18.071 -3.175 300 H LEU 42 HN LEU 42 -15.902 -14.755 -2.716 301 HA LEU 42 HA LEU 42 -18.029 -15.085 -0.687 302 1HB LEU 42 HB2 LEU 42 -16.426 -13.113 -0.681 303 2HB LEU 42 HB3 LEU 42 -16.954 -12.691 -2.296 304 HG LEU 42 HG LEU 42 -19.258 -12.244 -1.434 305 1HD1 LEU 42 HD11 LEU 42 -19.190 -13.619 0.617 306 2HD1 LEU 42 HD12 LEU 42 -17.831 -12.644 1.227 307 3HD1 LEU 42 HD13 LEU 42 -19.435 -11.909 1.016 308 1HD2 LEU 42 HD21 LEU 42 -16.979 -10.699 -0.106 309 2HD2 LEU 42 HD22 LEU 42 -17.608 -10.426 -1.743 310 3HD2 LEU 42 HD23 LEU 42 -18.642 -10.118 -0.341 311 H ASP 43 HN ASP 43 -17.642 -14.241 -4.157 312 HA ASP 43 HA ASP 43 -20.434 -13.756 -4.476 313 1HB ASP 43 HB2 ASP 43 -18.826 -12.786 -6.054 314 2HB ASP 43 HB3 ASP 43 -18.185 -14.379 -6.447 315 H GLN 44 HN GLN 44 -18.406 -16.645 -4.974 316 HA GLN 44 HA GLN 44 -20.562 -18.169 -6.051 317 1HB GLN 44 HB2 GLN 44 -19.150 -20.037 -5.942 318 2HB GLN 44 HB3 GLN 44 -18.134 -18.638 -6.299 319 1HG GLN 44 HG2 GLN 44 -17.564 -18.575 -3.806 320 2HG GLN 44 HG3 GLN 44 -18.400 -20.118 -3.640 321 1HE2 GLN 44 HE22 GLN 44 -15.829 -18.517 -5.592 322 2HE2 GLN 44 HE21 GLN 44 -14.825 -19.952 -5.777 323 H GLU 45 HN GLU 45 -20.248 -16.941 -2.864 324 HA GLU 45 HA GLU 45 -21.810 -19.117 -1.761 325 1HB GLU 45 HB2 GLU 45 -20.064 -19.022 -0.359 326 2HB GLU 45 HB3 GLU 45 -19.719 -17.317 -0.688 327 1HG GLU 45 HG2 GLU 45 -21.379 -16.532 0.705 328 2HG GLU 45 HG3 GLU 45 -22.179 -18.111 0.859 329 H MET 46 HN MET 46 -21.709 -15.570 -2.004 330 HA MET 46 HA MET 46 -24.639 -15.508 -1.471 331 1HB MET 46 HB2 MET 46 -24.217 -13.444 -0.178 332 2HB MET 46 HB3 MET 46 -23.665 -14.952 0.564 333 1HG MET 46 HG2 MET 46 -21.351 -14.482 -0.110 334 2HG MET 46 HG3 MET 46 -21.843 -13.009 -0.934 335 1HE MET 46 HE1 MET 46 -23.996 -11.675 1.081 336 2HE MET 46 HE2 MET 46 -22.734 -10.599 1.822 337 3HE MET 46 HE3 MET 46 -22.663 -11.035 0.093 338 H GLY 47 HN GLY 47 -22.711 -15.144 -3.954 339 1HA GLY 47 HA2 GLY 47 -23.286 -12.528 -4.934 340 2HA GLY 47 HA3 GLY 47 -22.912 -13.991 -5.897 341 H ASP 48 HN ASP 48 -25.455 -14.888 -4.148 342 HA ASP 48 HA ASP 48 -27.433 -14.521 -6.208 343 1HB ASP 48 HB2 ASP 48 -27.461 -16.499 -4.735 344 2HB ASP 48 HB3 ASP 48 -27.688 -15.459 -3.327 345 H LYS 49 HN LYS 49 -26.338 -12.699 -3.421 346 HA LYS 49 HA LYS 49 -28.645 -10.899 -3.670 347 1HB LYS 49 HB2 LYS 49 -26.870 -10.994 -1.253 348 2HB LYS 49 HB3 LYS 49 -28.564 -10.537 -1.379 349 1HG LYS 49 HG2 LYS 49 -28.895 -12.480 -0.318 350 2HG LYS 49 HG3 LYS 49 -28.780 -13.208 -1.928 351 1HD LYS 49 HD2 LYS 49 -26.581 -13.946 -1.601 352 2HD LYS 49 HD3 LYS 49 -26.256 -12.759 -0.327 353 1HE LYS 49 HE2 LYS 49 -27.731 -15.365 -0.063 354 2HE LYS 49 HE3 LYS 49 -26.201 -14.821 0.679 355 1HZ LYS 49 HZ1 LYS 49 -27.462 -13.239 2.000 356 2HZ LYS 49 HZ2 LYS 49 -28.876 -13.746 1.344 357 3HZ LYS 49 HZ3 LYS 49 -27.995 -14.752 2.266 358 H LEU 50 HN LEU 50 -25.252 -11.134 -4.154 359 HA LEU 50 HA LEU 50 -24.830 -8.236 -3.772 360 1HB LEU 50 HB2 LEU 50 -23.867 -9.575 -1.969 361 2HB LEU 50 HB3 LEU 50 -23.112 -10.658 -3.141 362 HG LEU 50 HG LEU 50 -21.622 -8.820 -3.893 363 1HD1 LEU 50 HD11 LEU 50 -23.031 -6.877 -3.291 364 2HD1 LEU 50 HD12 LEU 50 -22.911 -7.297 -1.577 365 3HD1 LEU 50 HD13 LEU 50 -21.471 -6.776 -2.494 366 1HD2 LEU 50 HD21 LEU 50 -21.526 -9.360 -0.910 367 2HD2 LEU 50 HD22 LEU 50 -20.917 -10.441 -2.185 368 3HD2 LEU 50 HD23 LEU 50 -20.174 -8.849 -1.948 369 H LYS 51 HN LYS 51 -23.596 -7.192 -5.217 370 HA LYS 51 HA LYS 51 -22.527 -8.678 -7.593 371 1HB LYS 51 HB2 LYS 51 -24.180 -6.888 -8.133 372 2HB LYS 51 HB3 LYS 51 -23.185 -5.713 -7.266 373 1HG LYS 51 HG2 LYS 51 -21.291 -6.233 -8.886 374 2HG LYS 51 HG3 LYS 51 -22.404 -7.270 -9.782 375 1HD LYS 51 HD2 LYS 51 -22.677 -4.270 -9.296 376 2HD LYS 51 HD3 LYS 51 -22.100 -5.035 -10.780 377 1HE LYS 51 HE2 LYS 51 -24.322 -6.160 -11.042 378 2HE LYS 51 HE3 LYS 51 -24.901 -5.308 -9.599 379 1HZ LYS 51 HZ1 LYS 51 -25.520 -4.110 -11.590 380 2HZ LYS 51 HZ2 LYS 51 -24.402 -3.215 -10.764 381 3HZ LYS 51 HZ3 LYS 51 -23.957 -4.045 -12.108 382 H ILE 52 HN ILE 52 -20.230 -8.305 -8.049 383 HA ILE 52 HA ILE 52 -18.780 -6.712 -6.014 384 HB ILE 52 HB ILE 52 -17.988 -9.399 -7.216 385 1HG1 ILE 52 HG12 ILE 52 -18.650 -8.604 -4.342 386 2HG1 ILE 52 HG13 ILE 52 -19.593 -9.665 -5.388 387 1HG2 ILE 52 HG21 ILE 52 -16.436 -7.485 -5.421 388 2HG2 ILE 52 HG22 ILE 52 -15.919 -9.125 -5.859 389 3HG2 ILE 52 HG23 ILE 52 -16.053 -7.912 -7.106 390 1HD1 ILE 52 HD11 ILE 52 -18.482 -11.154 -3.992 391 2HD1 ILE 52 HD12 ILE 52 -17.487 -11.166 -5.465 392 3HD1 ILE 52 HD13 ILE 52 -16.959 -10.251 -4.048 393 H VAL 53 HN VAL 53 -17.153 -5.424 -6.984 394 HA VAL 53 HA VAL 53 -16.811 -5.706 -9.914 395 HB VAL 53 HB VAL 53 -17.206 -2.972 -8.648 396 1HG1 VAL 53 HG11 VAL 53 -17.663 -2.331 -10.990 397 2HG1 VAL 53 HG12 VAL 53 -16.032 -2.981 -10.745 398 3HG1 VAL 53 HG13 VAL 53 -17.291 -3.983 -11.513 399 1HG2 VAL 53 HG21 VAL 53 -19.387 -4.566 -10.064 400 2HG2 VAL 53 HG22 VAL 53 -19.368 -4.113 -8.354 401 3HG2 VAL 53 HG23 VAL 53 -19.472 -2.857 -9.583 402 H LYS 54 HN LYS 54 -14.640 -5.301 -10.536 403 HA LYS 54 HA LYS 54 -12.837 -4.321 -8.359 404 1HB LYS 54 HB2 LYS 54 -12.305 -6.346 -10.550 405 2HB LYS 54 HB3 LYS 54 -11.046 -5.602 -9.558 406 1HG LYS 54 HG2 LYS 54 -12.183 -6.460 -7.493 407 2HG LYS 54 HG3 LYS 54 -13.376 -7.262 -8.511 408 1HD LYS 54 HD2 LYS 54 -11.836 -8.955 -7.942 409 2HD LYS 54 HD3 LYS 54 -11.428 -8.501 -9.602 410 1HE LYS 54 HE2 LYS 54 -9.715 -6.846 -8.335 411 2HE LYS 54 HE3 LYS 54 -9.946 -7.941 -7.001 412 1HZ LYS 54 HZ1 LYS 54 -9.268 -9.774 -8.546 413 2HZ LYS 54 HZ2 LYS 54 -8.961 -8.670 -9.709 414 3HZ LYS 54 HZ3 LYS 54 -8.084 -8.657 -8.338 415 H ILE 55 HN ILE 55 -11.181 -2.859 -8.899 416 HA ILE 55 HA ILE 55 -11.186 -1.670 -11.617 417 HB ILE 55 HB ILE 55 -10.863 -0.457 -8.830 418 1HG1 ILE 55 HG12 ILE 55 -13.117 -0.314 -9.944 419 2HG1 ILE 55 HG13 ILE 55 -12.409 1.177 -9.373 420 1HG2 ILE 55 HG21 ILE 55 -8.887 0.212 -9.983 421 2HG2 ILE 55 HG22 ILE 55 -9.769 0.696 -11.418 422 3HG2 ILE 55 HG23 ILE 55 -9.968 1.609 -9.896 423 1HD1 ILE 55 HD11 ILE 55 -13.450 1.570 -11.524 424 2HD1 ILE 55 HD12 ILE 55 -11.724 1.826 -11.658 425 3HD1 ILE 55 HD13 ILE 55 -12.431 0.322 -12.289 426 H ASP 56 HN ASP 56 -9.187 -2.052 -12.564 427 HA ASP 56 HA ASP 56 -6.966 -3.219 -10.994 428 1HB ASP 56 HB2 ASP 56 -7.448 -4.150 -13.206 429 2HB ASP 56 HB3 ASP 56 -7.288 -2.561 -13.945 430 H VAL 57 HN VAL 57 -6.051 -1.635 -9.734 431 HA VAL 57 HA VAL 57 -6.081 1.088 -10.627 432 HB VAL 57 HB VAL 57 -5.146 1.738 -8.509 433 1HG1 VAL 57 HG11 VAL 57 -7.088 1.280 -7.204 434 2HG1 VAL 57 HG12 VAL 57 -7.539 1.537 -8.894 435 3HG1 VAL 57 HG13 VAL 57 -7.516 -0.120 -8.222 436 1HG2 VAL 57 HG21 VAL 57 -5.271 -1.207 -7.781 437 2HG2 VAL 57 HG22 VAL 57 -3.829 -0.157 -7.824 438 3HG2 VAL 57 HG23 VAL 57 -5.123 0.117 -6.638 439 H ASP 58 HN ASP 58 -4.682 -0.200 -12.450 440 HA ASP 58 HA ASP 58 -2.369 1.588 -12.470 441 1HB ASP 58 HB2 ASP 58 -1.294 -0.480 -11.636 442 2HB ASP 58 HB3 ASP 58 -2.042 -1.419 -12.934 443 H GLU 59 HN GLU 59 -4.406 -0.931 -14.201 444 HA GLU 59 HA GLU 59 -3.797 0.070 -16.801 445 1HB GLU 59 HB2 GLU 59 -4.317 -2.250 -16.437 446 2HB GLU 59 HB3 GLU 59 -5.757 -1.836 -15.462 447 1HG GLU 59 HG2 GLU 59 -6.959 -1.082 -17.189 448 2HG GLU 59 HG3 GLU 59 -5.577 -0.986 -18.300 449 H ASN 60 HN ASN 60 -6.571 0.201 -14.576 450 HA ASN 60 HA ASN 60 -7.631 2.572 -15.970 451 1HB ASN 60 HB2 ASN 60 -9.884 1.698 -16.071 452 2HB ASN 60 HB3 ASN 60 -8.767 0.790 -17.065 453 1HD2 ASN 60 HD22 ASN 60 -10.142 0.633 -13.714 454 2HD2 ASN 60 HD21 ASN 60 -10.690 -1.035 -13.922 455 H GLN 61 HN GLN 61 -6.222 2.846 -13.861 456 HA GLN 61 HA GLN 61 -7.571 2.622 -11.374 457 1HB GLN 61 HB2 GLN 61 -5.606 3.526 -10.438 458 2HB GLN 61 HB3 GLN 61 -5.099 2.585 -11.843 459 1HG GLN 61 HG2 GLN 61 -4.890 4.677 -13.168 460 2HG GLN 61 HG3 GLN 61 -5.198 5.590 -11.691 461 1HE2 GLN 61 HE22 GLN 61 -3.747 4.717 -9.679 462 2HE2 GLN 61 HE21 GLN 61 -2.065 4.502 -10.055 463 H GLU 62 HN GLU 62 -8.415 4.594 -13.797 464 HA GLU 62 HA GLU 62 -8.135 7.242 -12.947 465 1HB GLU 62 HB2 GLU 62 -9.880 5.683 -14.827 466 2HB GLU 62 HB3 GLU 62 -10.244 7.404 -14.580 467 1HG GLU 62 HG2 GLU 62 -7.524 6.326 -15.444 468 2HG GLU 62 HG3 GLU 62 -8.780 6.831 -16.566 469 H THR 63 HN THR 63 -10.986 5.032 -12.413 470 HA THR 63 HA THR 63 -12.499 6.879 -10.886 471 HB THR 63 HB THR 63 -12.292 3.859 -10.936 472 HG1 THR 63 HG1 THR 63 -13.929 4.105 -12.369 473 1HG2 THR 63 HG21 THR 63 -14.410 3.677 -9.769 474 2HG2 THR 63 HG22 THR 63 -13.255 4.443 -8.700 475 3HG2 THR 63 HG23 THR 63 -14.478 5.442 -9.513 476 H ALA 64 HN ALA 64 -9.716 4.896 -10.003 477 HA ALA 64 HA ALA 64 -10.168 4.992 -7.149 478 1HB ALA 64 HB1 ALA 64 -7.527 4.400 -8.552 479 2HB ALA 64 HB2 ALA 64 -8.196 3.690 -7.072 480 3HB ALA 64 HB3 ALA 64 -8.883 3.278 -8.640 481 H GLY 65 HN GLY 65 -7.583 6.403 -9.184 482 1HA GLY 65 HA2 GLY 65 -6.722 8.490 -7.585 483 2HA GLY 65 HA3 GLY 65 -6.807 8.570 -9.361 484 H LYS 66 HN LYS 66 -9.675 8.589 -9.687 485 HA LYS 66 HA LYS 66 -10.311 11.307 -9.232 486 1HB LYS 66 HB2 LYS 66 -11.222 9.910 -10.998 487 2HB LYS 66 HB3 LYS 66 -12.086 8.908 -9.822 488 1HG LYS 66 HG2 LYS 66 -13.456 10.934 -9.211 489 2HG LYS 66 HG3 LYS 66 -12.647 11.811 -10.521 490 1HD LYS 66 HD2 LYS 66 -14.387 9.311 -10.767 491 2HD LYS 66 HD3 LYS 66 -14.811 10.950 -11.285 492 1HE LYS 66 HE2 LYS 66 -12.956 10.895 -12.953 493 2HE LYS 66 HE3 LYS 66 -12.543 9.256 -12.442 494 1HZ LYS 66 HZ1 LYS 66 -13.821 9.164 -14.391 495 2HZ LYS 66 HZ2 LYS 66 -14.722 8.517 -13.225 496 3HZ LYS 66 HZ3 LYS 66 -15.067 10.044 -13.755 497 H TYR 67 HN TYR 67 -11.290 8.342 -7.394 498 HA TYR 67 HA TYR 67 -12.688 9.888 -5.417 499 1HB TYR 67 HB2 TYR 67 -12.038 6.992 -5.815 500 2HB TYR 67 HB3 TYR 67 -12.406 7.542 -4.191 501 HD1 TYR 67 HD1 TYR 67 -14.606 7.548 -3.454 502 HD2 TYR 67 HD2 TYR 67 -13.826 7.872 -7.687 503 HE1 TYR 67 HE1 TYR 67 -17.038 7.546 -3.900 504 HE2 TYR 67 HE2 TYR 67 -16.252 7.883 -8.141 505 HH TYR 67 HH TYR 67 -18.397 7.876 -7.211 506 H GLY 68 HN GLY 68 -9.361 9.333 -6.016 507 1HA GLY 68 HA2 GLY 68 -7.494 10.069 -4.938 508 2HA GLY 68 HA3 GLY 68 -8.526 10.871 -3.737 509 H VAL 69 HN VAL 69 -7.751 7.418 -4.742 510 HA VAL 69 HA VAL 69 -8.133 6.690 -1.900 511 HB VAL 69 HB VAL 69 -8.759 4.623 -2.537 512 1HG1 VAL 69 HG11 VAL 69 -10.205 6.458 -4.431 513 2HG1 VAL 69 HG12 VAL 69 -10.834 4.969 -3.713 514 3HG1 VAL 69 HG13 VAL 69 -10.494 6.368 -2.680 515 1HG2 VAL 69 HG21 VAL 69 -9.083 3.841 -4.887 516 2HG2 VAL 69 HG22 VAL 69 -8.028 5.186 -5.376 517 3HG2 VAL 69 HG23 VAL 69 -7.421 3.889 -4.310 518 H MET 70 HN MET 70 -6.108 6.001 -4.657 519 HA MET 70 HA MET 70 -3.951 5.728 -4.978 520 1HB MET 70 HB2 MET 70 -3.312 7.121 -2.428 521 2HB MET 70 HB3 MET 70 -2.480 7.193 -3.983 522 1HG MET 70 HG2 MET 70 -4.598 8.415 -4.841 523 2HG MET 70 HG3 MET 70 -5.069 8.536 -3.144 524 1HE MET 70 HE1 MET 70 -1.765 8.787 -2.142 525 2HE MET 70 HE2 MET 70 -1.959 10.486 -1.644 526 3HE MET 70 HE3 MET 70 -3.255 9.315 -1.317 527 H SER 71 HN SER 71 -5.382 3.781 -2.927 528 HA SER 71 HA SER 71 -2.902 2.686 -1.752 529 1HB SER 71 HB2 SER 71 -5.634 2.916 -0.475 530 2HB SER 71 HB3 SER 71 -4.160 2.296 0.303 531 HG SER 71 HG SER 71 -4.797 4.921 -0.537 532 H ILE 72 HN ILE 72 -3.078 0.365 -1.021 533 HA ILE 72 HA ILE 72 -5.086 -1.158 -2.555 534 HB ILE 72 HB ILE 72 -2.306 -2.224 -2.128 535 1HG1 ILE 72 HG12 ILE 72 -1.841 -0.082 -3.179 536 2HG1 ILE 72 HG13 ILE 72 -1.479 -1.430 -4.234 537 1HG2 ILE 72 HG21 ILE 72 -4.407 -2.701 -4.284 538 2HG2 ILE 72 HG22 ILE 72 -2.791 -3.422 -4.254 539 3HG2 ILE 72 HG23 ILE 72 -3.937 -3.819 -2.981 540 1HD1 ILE 72 HD11 ILE 72 -4.216 -0.499 -4.684 541 2HD1 ILE 72 HD12 ILE 72 -3.052 0.818 -4.777 542 3HD1 ILE 72 HD13 ILE 72 -2.844 -0.628 -5.804 543 HA PRO 73 HA PRO 73 -6.198 -2.870 -2.486 544 1HB PRO 73 HB2 PRO 73 -8.000 -4.578 -1.448 545 2HB PRO 73 HB3 PRO 73 -6.364 -5.132 -1.928 546 1HG PRO 73 HG2 PRO 73 -7.391 -4.489 0.836 547 2HG PRO 73 HG3 PRO 73 -6.373 -5.859 0.328 548 1HD PRO 73 HD2 PRO 73 -5.394 -3.487 1.455 549 2HD PRO 73 HD3 PRO 73 -4.429 -4.538 0.394 550 H THR 74 HN THR 74 -7.745 -1.236 -2.801 551 HA THR 74 HA THR 74 -9.011 -0.095 -0.321 552 HB THR 74 HB THR 74 -9.140 1.080 -3.116 553 HG1 THR 74 HG1 THR 74 -7.107 1.361 -2.287 554 1HG2 THR 74 HG21 THR 74 -11.130 1.647 -1.809 555 2HG2 THR 74 HG22 THR 74 -10.115 2.077 -0.408 556 3HG2 THR 74 HG23 THR 74 -10.064 3.033 -1.901 557 H LEU 75 HN LEU 75 -11.213 -0.244 0.013 558 HA LEU 75 HA LEU 75 -12.853 -1.955 -1.814 559 1HB LEU 75 HB2 LEU 75 -11.717 -3.100 0.281 560 2HB LEU 75 HB3 LEU 75 -12.803 -2.085 1.217 561 HG LEU 75 HG LEU 75 -14.715 -3.160 -0.212 562 1HD1 LEU 75 HD11 LEU 75 -12.472 -5.222 -0.632 563 2HD1 LEU 75 HD12 LEU 75 -14.196 -5.456 -1.005 564 3HD1 LEU 75 HD13 LEU 75 -13.260 -4.252 -1.895 565 1HD2 LEU 75 HD21 LEU 75 -13.071 -4.616 1.904 566 2HD2 LEU 75 HD22 LEU 75 -14.462 -3.541 2.141 567 3HD2 LEU 75 HD23 LEU 75 -14.695 -5.131 1.410 568 H LEU 76 HN LEU 76 -14.763 -0.957 -2.212 569 HA LEU 76 HA LEU 76 -15.727 1.139 -0.372 570 1HB LEU 76 HB2 LEU 76 -16.056 1.251 -3.390 571 2HB LEU 76 HB3 LEU 76 -16.612 2.416 -2.201 572 HG LEU 76 HG LEU 76 -13.725 1.931 -3.066 573 1HD1 LEU 76 HD11 LEU 76 -13.903 4.189 -3.988 574 2HD1 LEU 76 HD12 LEU 76 -15.117 3.120 -4.699 575 3HD1 LEU 76 HD13 LEU 76 -15.596 4.299 -3.459 576 1HD2 LEU 76 HD21 LEU 76 -13.131 3.857 -1.661 577 2HD2 LEU 76 HD22 LEU 76 -14.805 3.969 -1.072 578 3HD2 LEU 76 HD23 LEU 76 -13.797 2.561 -0.665 579 H VAL 77 HN VAL 77 -17.453 0.150 0.554 580 HA VAL 77 HA VAL 77 -19.097 -1.774 -1.007 581 HB VAL 77 HB VAL 77 -19.751 -0.777 1.773 582 1HG1 VAL 77 HG11 VAL 77 -21.410 -2.124 0.537 583 2HG1 VAL 77 HG12 VAL 77 -20.222 -3.433 0.378 584 3HG1 VAL 77 HG13 VAL 77 -20.828 -2.951 1.984 585 1HG2 VAL 77 HG21 VAL 77 -18.551 -2.719 2.759 586 2HG2 VAL 77 HG22 VAL 77 -17.764 -3.005 1.197 587 3HG2 VAL 77 HG23 VAL 77 -17.449 -1.512 2.090 588 H LEU 78 HN LEU 78 -20.992 -1.018 -2.006 589 HA LEU 78 HA LEU 78 -21.937 1.692 -1.263 590 1HB LEU 78 HB2 LEU 78 -21.890 0.753 -4.153 591 2HB LEU 78 HB3 LEU 78 -22.467 2.261 -3.526 592 HG LEU 78 HG LEU 78 -19.892 2.441 -2.677 593 1HD1 LEU 78 HD11 LEU 78 -18.367 1.586 -4.367 594 2HD1 LEU 78 HD12 LEU 78 -19.317 0.227 -3.755 595 3HD1 LEU 78 HD13 LEU 78 -19.710 0.935 -5.328 596 1HD2 LEU 78 HD21 LEU 78 -19.479 3.849 -4.654 597 2HD2 LEU 78 HD22 LEU 78 -20.871 3.123 -5.486 598 3HD2 LEU 78 HD23 LEU 78 -21.108 4.116 -4.033 599 H LYS 79 HN LYS 79 -24.200 2.024 -1.713 600 HA LYS 79 HA LYS 79 -25.703 -0.278 -2.639 601 1HB LYS 79 HB2 LYS 79 -27.360 -0.217 -0.892 602 2HB LYS 79 HB3 LYS 79 -25.781 -0.667 -0.232 603 1HG LYS 79 HG2 LYS 79 -25.571 1.744 0.576 604 2HG LYS 79 HG3 LYS 79 -27.249 1.988 0.086 605 1HD LYS 79 HD2 LYS 79 -26.268 -0.066 2.119 606 2HD LYS 79 HD3 LYS 79 -27.071 1.475 2.491 607 1HE LYS 79 HE2 LYS 79 -29.101 0.742 1.373 608 2HE LYS 79 HE3 LYS 79 -28.318 -0.767 0.865 609 1HZ LYS 79 HZ1 LYS 79 -28.771 -0.044 3.697 610 2HZ LYS 79 HZ2 LYS 79 -29.744 -1.019 2.829 611 3HZ LYS 79 HZ3 LYS 79 -28.213 -1.488 3.117 612 H ASP 80 HN ASP 80 -27.411 0.379 -3.808 613 HA ASP 80 HA ASP 80 -28.484 1.682 -5.238 614 1HB ASP 80 HB2 ASP 80 -29.867 1.594 -3.176 615 2HB ASP 80 HB3 ASP 80 -29.229 3.165 -2.695 616 H GLY 81 HN GLY 81 -25.701 2.618 -4.912 617 1HA GLY 81 HA2 GLY 81 -24.612 4.092 -6.280 618 2HA GLY 81 HA3 GLY 81 -26.013 5.178 -6.324 619 H GLU 82 HN GLU 82 -25.018 4.226 -3.131 620 HA GLU 82 HA GLU 82 -23.151 6.490 -2.905 621 1HB GLU 82 HB2 GLU 82 -24.179 7.312 -1.003 622 2HB GLU 82 HB3 GLU 82 -25.539 6.865 -2.046 623 1HG GLU 82 HG2 GLU 82 -25.797 4.748 -0.739 624 2HG GLU 82 HG3 GLU 82 -24.491 5.258 0.328 625 H VAL 83 HN VAL 83 -21.414 6.194 -1.471 626 HA VAL 83 HA VAL 83 -20.601 3.465 -0.802 627 HB VAL 83 HB VAL 83 -19.436 6.157 0.037 628 1HG1 VAL 83 HG11 VAL 83 -18.202 3.360 0.076 629 2HG1 VAL 83 HG12 VAL 83 -17.358 4.868 0.480 630 3HG1 VAL 83 HG13 VAL 83 -18.677 4.305 1.503 631 1HG2 VAL 83 HG21 VAL 83 -17.739 5.804 -1.716 632 2HG2 VAL 83 HG22 VAL 83 -18.559 4.325 -2.243 633 3HG2 VAL 83 HG23 VAL 83 -19.344 5.907 -2.438 634 H VAL 84 HN VAL 84 -20.945 2.445 1.032 635 HA VAL 84 HA VAL 84 -22.317 3.872 3.257 636 HB VAL 84 HB VAL 84 -23.889 2.666 1.848 637 1HG1 VAL 84 HG11 VAL 84 -23.966 0.213 1.745 638 2HG1 VAL 84 HG12 VAL 84 -22.515 0.844 0.972 639 3HG1 VAL 84 HG13 VAL 84 -22.408 0.111 2.592 640 1HG2 VAL 84 HG21 VAL 84 -25.055 1.426 3.597 641 2HG2 VAL 84 HG22 VAL 84 -23.585 1.394 4.585 642 3HG2 VAL 84 HG23 VAL 84 -24.384 2.942 4.210 643 H GLU 85 HN GLU 85 -19.776 1.668 2.244 644 HA GLU 85 HA GLU 85 -18.634 1.946 4.863 645 1HB GLU 85 HB2 GLU 85 -19.684 -0.682 3.941 646 2HB GLU 85 HB3 GLU 85 -17.977 -0.733 4.387 647 1HG GLU 85 HG2 GLU 85 -20.154 0.420 6.122 648 2HG GLU 85 HG3 GLU 85 -19.613 -1.265 6.180 649 H THR 86 HN THR 86 -16.350 1.255 4.842 650 HA THR 86 HA THR 86 -15.078 1.311 2.177 651 HB THR 86 HB THR 86 -13.945 3.360 3.941 652 HG1 THR 86 HG1 THR 86 -16.030 3.843 4.556 653 1HG2 THR 86 HG21 THR 86 -13.391 3.098 1.581 654 2HG2 THR 86 HG22 THR 86 -15.084 3.463 1.141 655 3HG2 THR 86 HG23 THR 86 -14.058 4.711 1.893 656 H SER 87 HN SER 87 -12.893 0.577 2.277 657 HA SER 87 HA SER 87 -11.535 0.376 4.836 658 1HB SER 87 HB2 SER 87 -12.426 -2.112 3.324 659 2HB SER 87 HB3 SER 87 -10.995 -2.112 4.362 660 HG SER 87 HG SER 87 -13.390 -1.032 5.343 661 H VAL 88 HN VAL 88 -9.301 -0.031 4.554 662 HA VAL 88 HA VAL 88 -8.239 -0.139 1.824 663 HB VAL 88 HB VAL 88 -8.485 2.190 2.142 664 1HG1 VAL 88 HG11 VAL 88 -6.879 2.054 4.721 665 2HG1 VAL 88 HG12 VAL 88 -7.406 3.521 3.872 666 3HG1 VAL 88 HG13 VAL 88 -8.606 2.433 4.572 667 1HG2 VAL 88 HG21 VAL 88 -5.577 1.394 2.483 668 2HG2 VAL 88 HG22 VAL 88 -6.523 1.352 0.984 669 3HG2 VAL 88 HG23 VAL 88 -6.203 2.910 1.789 670 H GLY 89 HN GLY 89 -7.985 -2.278 2.537 671 1HA GLY 89 HA2 GLY 89 -5.565 -3.122 3.602 672 2HA GLY 89 HA3 GLY 89 -6.615 -2.946 5.011 673 H PHE 90 HN PHE 90 -5.513 -5.428 4.018 674 HA PHE 90 HA PHE 90 -7.459 -6.933 2.576 675 1HB PHE 90 HB2 PHE 90 -5.124 -7.641 2.691 676 2HB PHE 90 HB3 PHE 90 -5.198 -7.743 4.444 677 HD1 PHE 90 HD1 PHE 90 -6.598 -9.271 1.304 678 HD2 PHE 90 HD2 PHE 90 -5.901 -9.741 5.540 679 HE1 PHE 90 HE1 PHE 90 -7.430 -11.610 1.196 680 HE2 PHE 90 HE2 PHE 90 -6.689 -12.088 5.405 681 HZ PHE 90 HZ PHE 90 -7.456 -13.025 3.232 682 H LYS 91 HN LYS 91 -8.977 -8.488 3.363 683 HA LYS 91 HA LYS 91 -9.357 -8.769 6.255 684 1HB LYS 91 HB2 LYS 91 -11.200 -7.175 4.644 685 2HB LYS 91 HB3 LYS 91 -11.980 -8.695 5.042 686 1HG LYS 91 HG2 LYS 91 -12.642 -7.455 6.819 687 2HG LYS 91 HG3 LYS 91 -11.215 -8.230 7.491 688 1HD LYS 91 HD2 LYS 91 -11.169 -6.012 8.228 689 2HD LYS 91 HD3 LYS 91 -9.932 -6.084 6.968 690 1HE LYS 91 HE2 LYS 91 -11.422 -5.008 5.362 691 2HE LYS 91 HE3 LYS 91 -12.802 -5.187 6.453 692 1HZ LYS 91 HZ1 LYS 91 -11.954 -2.947 6.506 693 2HZ LYS 91 HZ2 LYS 91 -11.742 -3.631 7.974 694 3HZ LYS 91 HZ3 LYS 91 -10.461 -3.448 6.971 695 HA PRO 92 HA PRO 92 -9.741 -12.905 4.494 696 1HB PRO 92 HB2 PRO 92 -10.708 -14.342 6.609 697 2HB PRO 92 HB3 PRO 92 -9.036 -13.702 6.568 698 1HG PRO 92 HG2 PRO 92 -11.479 -12.453 7.868 699 2HG PRO 92 HG3 PRO 92 -9.871 -12.754 8.609 700 1HD PRO 92 HD2 PRO 92 -10.471 -10.320 7.578 701 2HD PRO 92 HD3 PRO 92 -8.847 -11.019 7.348 702 H LYS 93 HN LYS 93 -11.499 -14.603 4.181 703 HA LYS 93 HA LYS 93 -13.548 -13.424 2.779 704 1HB LYS 93 HB2 LYS 93 -12.570 -16.017 3.136 705 2HB LYS 93 HB3 LYS 93 -14.198 -16.166 3.766 706 1HG LYS 93 HG2 LYS 93 -13.378 -15.151 1.015 707 2HG LYS 93 HG3 LYS 93 -14.007 -16.745 1.365 708 1HD LYS 93 HD2 LYS 93 -15.558 -14.138 1.715 709 2HD LYS 93 HD3 LYS 93 -15.643 -15.184 0.320 710 1HE LYS 93 HE2 LYS 93 -16.426 -16.044 3.142 711 2HE LYS 93 HE3 LYS 93 -17.546 -15.445 1.924 712 1HZ LYS 93 HZ1 LYS 93 -17.612 -17.780 1.865 713 2HZ LYS 93 HZ2 LYS 93 -16.878 -17.331 0.491 714 3HZ LYS 93 HZ3 LYS 93 -15.983 -17.950 1.737 715 H GLU 94 HN GLU 94 -13.829 -14.797 6.079 716 HA GLU 94 HA GLU 94 -16.620 -14.352 6.243 717 1HB GLU 94 HB2 GLU 94 -14.485 -14.541 8.418 718 2HB GLU 94 HB3 GLU 94 -16.236 -14.541 8.722 719 1HG GLU 94 HG2 GLU 94 -16.479 -16.598 7.337 720 2HG GLU 94 HG3 GLU 94 -14.736 -16.626 7.068 721 H ALA 95 HN ALA 95 -13.826 -12.312 7.249 722 HA ALA 95 HA ALA 95 -15.445 -10.340 8.539 723 1HB ALA 95 HB1 ALA 95 -13.008 -10.633 8.960 724 2HB ALA 95 HB2 ALA 95 -12.688 -10.081 7.292 725 3HB ALA 95 HB3 ALA 95 -13.418 -8.975 8.483 726 H LEU 96 HN LEU 96 -14.261 -10.809 5.219 727 HA LEU 96 HA LEU 96 -15.145 -8.269 4.267 728 1HB LEU 96 HB2 LEU 96 -13.550 -10.203 3.178 729 2HB LEU 96 HB3 LEU 96 -15.067 -10.636 2.410 730 HG LEU 96 HG LEU 96 -15.272 -8.130 1.737 731 1HD1 LEU 96 HD11 LEU 96 -13.639 -7.123 3.289 732 2HD1 LEU 96 HD12 LEU 96 -12.358 -8.185 2.667 733 3HD1 LEU 96 HD13 LEU 96 -13.040 -6.924 1.637 734 1HD2 LEU 96 HD21 LEU 96 -12.808 -9.505 0.624 735 2HD2 LEU 96 HD22 LEU 96 -14.480 -9.936 0.161 736 3HD2 LEU 96 HD23 LEU 96 -13.839 -8.318 -0.183 737 H GLN 97 HN GLN 97 -16.682 -11.516 4.231 738 HA GLN 97 HA GLN 97 -19.032 -10.618 2.890 739 1HB GLN 97 HB2 GLN 97 -19.827 -12.656 3.086 740 2HB GLN 97 HB3 GLN 97 -18.135 -13.052 3.340 741 1HG GLN 97 HG2 GLN 97 -18.571 -13.206 5.727 742 2HG GLN 97 HG3 GLN 97 -20.288 -12.823 5.451 743 1HE2 GLN 97 HE22 GLN 97 -21.210 -14.343 3.424 744 2HE2 GLN 97 HE21 GLN 97 -20.872 -16.045 3.688 745 H GLU 98 HN GLU 98 -18.099 -10.726 6.353 746 HA GLU 98 HA GLU 98 -20.624 -9.901 7.337 747 1HB GLU 98 HB2 GLU 98 -18.907 -10.834 8.768 748 2HB GLU 98 HB3 GLU 98 -17.832 -9.463 8.459 749 1HG GLU 98 HG2 GLU 98 -19.380 -7.936 9.580 750 2HG GLU 98 HG3 GLU 98 -20.567 -9.231 9.779 751 H LEU 99 HN LEU 99 -17.811 -7.988 6.291 752 HA LEU 99 HA LEU 99 -18.677 -5.459 7.068 753 1HB LEU 99 HB2 LEU 99 -16.392 -5.972 6.456 754 2HB LEU 99 HB3 LEU 99 -16.873 -6.367 4.807 755 HG LEU 99 HG LEU 99 -17.407 -4.034 4.333 756 1HD1 LEU 99 HD11 LEU 99 -18.133 -3.153 6.464 757 2HD1 LEU 99 HD12 LEU 99 -16.557 -3.504 7.216 758 3HD1 LEU 99 HD13 LEU 99 -16.706 -2.250 5.966 759 1HD2 LEU 99 HD21 LEU 99 -15.121 -3.175 4.368 760 2HD2 LEU 99 HD22 LEU 99 -14.673 -4.325 5.642 761 3HD2 LEU 99 HD23 LEU 99 -15.100 -4.914 4.023 762 H VAL 100 HN VAL 100 -19.407 -7.246 4.076 763 HA VAL 100 HA VAL 100 -21.031 -4.950 3.147 764 HB VAL 100 HB VAL 100 -19.738 -5.990 1.527 765 1HG1 VAL 100 HG11 VAL 100 -19.634 -8.345 2.331 766 2HG1 VAL 100 HG12 VAL 100 -21.333 -8.574 1.877 767 3HG1 VAL 100 HG13 VAL 100 -20.105 -8.242 0.640 768 1HG2 VAL 100 HG21 VAL 100 -22.628 -6.700 0.907 769 2HG2 VAL 100 HG22 VAL 100 -22.016 -5.038 0.965 770 3HG2 VAL 100 HG23 VAL 100 -21.345 -6.173 -0.210 771 H ASN 101 HN ASN 101 -21.575 -8.253 4.475 772 HA ASN 101 HA ASN 101 -24.313 -8.485 3.935 773 1HB ASN 101 HB2 ASN 101 -23.012 -10.363 4.715 774 2HB ASN 101 HB3 ASN 101 -22.736 -9.579 6.278 775 1HD2 ASN 101 HD22 ASN 101 -24.421 -9.637 7.858 776 2HD2 ASN 101 HD21 ASN 101 -25.922 -10.482 7.592 777 H LYS 102 HN LYS 102 -22.686 -6.748 6.572 778 HA LYS 102 HA LYS 102 -25.070 -6.341 8.102 779 1HB LYS 102 HB2 LYS 102 -23.729 -5.006 9.543 780 2HB LYS 102 HB3 LYS 102 -22.718 -6.327 8.953 781 1HG LYS 102 HG2 LYS 102 -21.884 -4.634 7.178 782 2HG LYS 102 HG3 LYS 102 -22.639 -3.414 8.234 783 1HD LYS 102 HD2 LYS 102 -21.282 -4.297 10.165 784 2HD LYS 102 HD3 LYS 102 -20.556 -5.485 9.060 785 1HE LYS 102 HE2 LYS 102 -18.987 -3.760 9.204 786 2HE LYS 102 HE3 LYS 102 -19.790 -3.617 7.623 787 1HZ LYS 102 HZ1 LYS 102 -21.046 -1.768 8.448 788 2HZ LYS 102 HZ2 LYS 102 -20.449 -1.941 9.979 789 3HZ LYS 102 HZ3 LYS 102 -19.470 -1.465 8.751 790 H HIS 103 HN HIS 103 -24.290 -4.931 5.121 791 HA HIS 103 HA HIS 103 -26.278 -2.744 5.599 792 1HB HIS 103 HB2 HIS 103 -23.856 -2.694 3.751 793 2HB HIS 103 HB3 HIS 103 -25.079 -1.429 3.884 794 HD1 HIS 103 HD1 HIS 103 -25.243 -0.322 6.525 795 HD2 HIS 103 HD2 HIS 103 -21.816 -2.490 5.367 796 HE1 HIS 103 HE1 HIS 103 -23.438 0.248 8.221 797 H LEU 104 HN LEU 104 -25.245 -5.417 3.646 798 HA LEU 104 HA LEU 104 -26.844 -5.178 1.297 799 1HB LEU 104 HB2 LEU 104 -24.979 -6.654 1.441 800 2HB LEU 104 HB3 LEU 104 -25.609 -7.351 2.939 801 HG LEU 104 HG LEU 104 -27.307 -8.538 1.864 802 1HD1 LEU 104 HD11 LEU 104 -26.313 -7.380 -0.793 803 2HD1 LEU 104 HD12 LEU 104 -27.617 -8.561 -0.586 804 3HD1 LEU 104 HD13 LEU 104 -27.838 -6.914 -0.011 805 1HD2 LEU 104 HD21 LEU 104 -25.945 -10.096 0.562 806 2HD2 LEU 104 HD22 LEU 104 -24.670 -8.868 0.390 807 3HD2 LEU 104 HD23 LEU 104 -25.083 -9.532 1.989 808 1H MET 1 H1 MET 1 8.236 29.654 -12.195 809 2H MET 1 H2 MET 1 9.042 28.620 -11.199 810 3H MET 1 H3 MET 1 8.768 30.160 -10.727 811 HA MET 1 HA MET 1 6.426 29.818 -10.600 812 1HB MET 1 HB2 MET 1 7.098 27.007 -11.588 813 2HB MET 1 HB3 MET 1 5.609 27.416 -10.743 814 1HG MET 1 HG2 MET 1 5.078 27.468 -13.036 815 2HG MET 1 HG3 MET 1 5.081 29.126 -12.461 816 1HE MET 1 HE1 MET 1 8.030 27.220 -15.486 817 2HE MET 1 HE2 MET 1 7.916 26.604 -13.824 818 3HE MET 1 HE3 MET 1 6.510 26.503 -14.909 819 H GLU 2 HN GLU 2 5.957 29.824 -8.455 820 HA GLU 2 HA GLU 2 7.909 29.059 -6.525 821 1HB GLU 2 HB2 GLU 2 6.245 30.894 -6.291 822 2HB GLU 2 HB3 GLU 2 4.941 29.704 -6.200 823 1HG GLU 2 HG2 GLU 2 5.919 28.782 -4.118 824 2HG GLU 2 HG3 GLU 2 7.272 29.906 -4.242 825 H ASN 3 HN ASN 3 8.162 27.277 -5.350 826 HA ASN 3 HA ASN 3 8.286 25.207 -5.040 827 1HB ASN 3 HB2 ASN 3 6.954 24.189 -3.522 828 2HB ASN 3 HB3 ASN 3 7.538 25.777 -3.007 829 1HD2 ASN 3 HD22 ASN 3 5.123 25.836 -5.239 830 2HD2 ASN 3 HD21 ASN 3 3.688 26.227 -4.239 831 H LYS 4 HN LYS 4 8.603 23.880 -6.268 832 HA LYS 4 HA LYS 4 6.601 22.488 -7.874 833 1HB LYS 4 HB2 LYS 4 9.579 22.058 -7.391 834 2HB LYS 4 HB3 LYS 4 8.631 21.051 -8.495 835 1HG LYS 4 HG2 LYS 4 8.258 22.939 -9.982 836 2HG LYS 4 HG3 LYS 4 8.987 24.070 -8.822 837 1HD LYS 4 HD2 LYS 4 11.128 22.799 -8.954 838 2HD LYS 4 HD3 LYS 4 10.439 21.775 -10.215 839 1HE LYS 4 HE2 LYS 4 10.742 24.816 -10.370 840 2HE LYS 4 HE3 LYS 4 11.925 23.671 -11.001 841 1HZ LYS 4 HZ1 LYS 4 9.127 23.890 -11.959 842 2HZ LYS 4 HZ2 LYS 4 10.456 24.415 -12.747 843 3HZ LYS 4 HZ3 LYS 4 10.234 22.820 -12.515 844 H ILE 5 HN ILE 5 5.489 20.703 -6.905 845 HA ILE 5 HA ILE 5 6.302 20.219 -4.095 846 HB ILE 5 HB ILE 5 3.724 19.641 -5.580 847 1HG1 ILE 5 HG12 ILE 5 4.763 21.818 -3.765 848 2HG1 ILE 5 HG13 ILE 5 3.803 21.940 -5.230 849 1HG2 ILE 5 HG21 ILE 5 4.398 19.154 -2.651 850 2HG2 ILE 5 HG22 ILE 5 2.810 18.898 -3.438 851 3HG2 ILE 5 HG23 ILE 5 4.170 17.892 -3.890 852 1HD1 ILE 5 HD11 ILE 5 2.499 22.626 -3.321 853 2HD1 ILE 5 HD12 ILE 5 1.822 21.094 -3.930 854 3HD1 ILE 5 HD13 ILE 5 2.847 21.113 -2.466 855 H ILE 6 HN ILE 6 6.879 18.270 -3.294 856 HA ILE 6 HA ILE 6 7.070 15.922 -5.055 857 HB ILE 6 HB ILE 6 8.993 17.082 -5.702 858 1HG1 ILE 6 HG12 ILE 6 9.186 14.579 -5.038 859 2HG1 ILE 6 HG13 ILE 6 10.567 15.495 -5.555 860 1HG2 ILE 6 HG21 ILE 6 9.263 18.790 -4.050 861 2HG2 ILE 6 HG22 ILE 6 9.670 17.601 -2.802 862 3HG2 ILE 6 HG23 ILE 6 10.775 17.906 -4.167 863 1HD1 ILE 6 HD11 ILE 6 11.132 14.080 -3.637 864 2HD1 ILE 6 HD12 ILE 6 11.353 15.778 -3.227 865 3HD1 ILE 6 HD13 ILE 6 9.922 14.901 -2.632 866 H TYR 7 HN TYR 7 7.248 13.991 -3.867 867 HA TYR 7 HA TYR 7 6.563 14.295 -0.978 868 1HB TYR 7 HB2 TYR 7 4.799 13.873 -3.010 869 2HB TYR 7 HB3 TYR 7 5.274 12.224 -2.710 870 HD1 TYR 7 HD1 TYR 7 4.061 11.005 -1.042 871 HD2 TYR 7 HD2 TYR 7 4.033 15.321 -0.978 872 HE1 TYR 7 HE1 TYR 7 2.062 10.972 0.391 873 HE2 TYR 7 HE2 TYR 7 2.118 15.282 0.590 874 HH TYR 7 HH TYR 7 0.503 13.944 1.640 875 H PHE 8 HN PHE 8 7.137 12.521 0.360 876 HA PHE 8 HA PHE 8 8.743 10.305 -0.851 877 1HB PHE 8 HB2 PHE 8 8.851 11.522 1.930 878 2HB PHE 8 HB3 PHE 8 9.615 10.005 1.498 879 HD1 PHE 8 HD1 PHE 8 11.344 10.004 -0.410 880 HD2 PHE 8 HD2 PHE 8 10.103 13.554 1.687 881 HE1 PHE 8 HE1 PHE 8 13.376 11.178 -1.192 882 HE2 PHE 8 HE2 PHE 8 12.167 14.688 0.942 883 HZ PHE 8 HZ PHE 8 13.788 13.531 -0.488 884 H LEU 9 HN LEU 9 8.040 8.180 -0.341 885 HA LEU 9 HA LEU 9 5.584 7.957 1.315 886 1HB LEU 9 HB2 LEU 9 5.204 8.538 -1.131 887 2HB LEU 9 HB3 LEU 9 5.908 6.984 -1.557 888 HG LEU 9 HG LEU 9 4.065 5.807 -0.461 889 1HD1 LEU 9 HD11 LEU 9 2.093 7.135 0.416 890 2HD1 LEU 9 HD12 LEU 9 3.517 7.214 1.444 891 3HD1 LEU 9 HD13 LEU 9 3.116 8.590 0.386 892 1HD2 LEU 9 HD21 LEU 9 3.245 8.138 -2.245 893 2HD2 LEU 9 HD22 LEU 9 3.729 6.510 -2.765 894 3HD2 LEU 9 HD23 LEU 9 2.194 6.766 -1.913 895 H SER 10 HN SER 10 6.095 6.444 2.817 896 HA SER 10 HA SER 10 6.923 3.808 2.103 897 1HB SER 10 HB2 SER 10 9.108 3.987 3.508 898 2HB SER 10 HB3 SER 10 9.128 4.516 1.835 899 HG SER 10 HG SER 10 8.870 6.654 2.532 900 H THR 11 HN THR 11 6.828 2.380 3.950 901 HA THR 11 HA THR 11 4.731 2.487 5.439 902 HB THR 11 HB THR 11 7.371 1.212 6.178 903 HG1 THR 11 HG1 THR 11 6.374 -0.515 5.040 904 1HG2 THR 11 HG21 THR 11 6.082 -0.419 7.461 905 2HG2 THR 11 HG22 THR 11 5.852 1.173 8.160 906 3HG2 THR 11 HG23 THR 11 4.568 0.478 7.145 907 H GLY 12 HN GLY 12 3.837 3.847 6.819 908 1HA GLY 12 HA2 GLY 12 3.459 5.002 8.750 909 2HA GLY 12 HA3 GLY 12 4.891 4.195 9.416 910 H ASN 13 HN ASN 13 5.708 5.934 6.616 911 HA ASN 13 HA ASN 13 7.226 7.557 6.308 912 1HB ASN 13 HB2 ASN 13 5.130 8.899 6.892 913 2HB ASN 13 HB3 ASN 13 5.895 9.227 8.465 914 1HD2 ASN 13 HD22 ASN 13 7.629 10.870 8.415 915 2HD2 ASN 13 HD21 ASN 13 7.997 11.716 6.937 916 H SER 14 HN SER 14 7.659 5.506 8.529 917 HA SER 14 HA SER 14 9.061 6.729 10.632 918 1HB SER 14 HB2 SER 14 9.428 3.916 9.530 919 2HB SER 14 HB3 SER 14 9.700 4.469 11.192 920 HG SER 14 HG SER 14 7.675 3.426 10.970 921 H ALA 15 HN ALA 15 11.010 7.481 10.803 922 HA ALA 15 HA ALA 15 13.159 7.929 10.549 923 1HB ALA 15 HB1 ALA 15 13.326 5.126 9.371 924 2HB ALA 15 HB2 ALA 15 14.666 6.074 10.048 925 3HB ALA 15 HB3 ALA 15 13.322 5.549 11.087 926 H ARG 16 HN ARG 16 13.123 6.010 7.507 927 HA ARG 16 HA ARG 16 15.034 7.712 6.324 928 1HB ARG 16 HB2 ARG 16 13.930 6.613 4.072 929 2HB ARG 16 HB3 ARG 16 15.187 5.924 5.067 930 1HG ARG 16 HG2 ARG 16 13.655 4.195 4.586 931 2HG ARG 16 HG3 ARG 16 13.536 4.606 6.291 932 1HD ARG 16 HD2 ARG 16 11.474 5.990 5.680 933 2HD ARG 16 HD3 ARG 16 11.497 5.132 4.136 934 HE ARG 16 HE ARG 16 11.826 3.232 6.222 935 1HH1 ARG 16 HH11 ARG 16 9.317 5.628 5.439 936 2HH1 ARG 16 HH12 ARG 16 8.092 4.760 6.325 937 1HH2 ARG 16 HH22 ARG 16 10.182 2.037 7.183 938 2HH2 ARG 16 HH21 ARG 16 8.606 2.790 7.402 939 H SER 17 HN SER 17 11.494 7.831 6.018 940 HA SER 17 HA SER 17 11.356 9.754 3.981 941 1HB SER 17 HB2 SER 17 9.377 9.583 6.213 942 2HB SER 17 HB3 SER 17 9.085 9.633 4.459 943 HG SER 17 HG SER 17 9.436 7.466 4.361 944 H GLN 18 HN GLN 18 11.866 10.085 7.444 945 HA GLN 18 HA GLN 18 11.414 12.929 7.709 946 1HB GLN 18 HB2 GLN 18 13.153 11.236 9.488 947 2HB GLN 18 HB3 GLN 18 12.283 12.688 9.880 948 1HG GLN 18 HG2 GLN 18 10.937 10.021 9.258 949 2HG GLN 18 HG3 GLN 18 11.388 10.551 10.852 950 1HE2 GLN 18 HE22 GLN 18 8.730 9.876 10.049 951 2HE2 GLN 18 HE21 GLN 18 7.763 11.309 10.414 952 H MET 19 HN MET 19 14.309 10.758 7.527 953 HA MET 19 HA MET 19 16.065 12.961 7.641 954 1HB MET 19 HB2 MET 19 17.866 11.577 7.310 955 2HB MET 19 HB3 MET 19 16.697 10.571 8.161 956 1HG MET 19 HG2 MET 19 16.151 9.421 6.054 957 2HG MET 19 HG3 MET 19 17.158 10.543 5.145 958 1HE MET 19 HE1 MET 19 17.489 8.320 8.330 959 2HE MET 19 HE2 MET 19 17.157 7.166 6.998 960 3HE MET 19 HE3 MET 19 18.757 7.178 7.796 961 H ALA 20 HN ALA 20 14.559 11.275 4.857 962 HA ALA 20 HA ALA 20 16.179 12.502 2.855 963 1HB ALA 20 HB1 ALA 20 14.899 10.439 2.475 964 2HB ALA 20 HB2 ALA 20 13.391 11.399 2.506 965 3HB ALA 20 HB3 ALA 20 14.653 11.695 1.270 966 H GLU 21 HN GLU 21 13.075 13.504 4.395 967 HA GLU 21 HA GLU 21 12.850 15.739 2.647 968 1HB GLU 21 HB2 GLU 21 11.015 16.395 3.837 969 2HB GLU 21 HB3 GLU 21 11.022 14.639 3.937 970 1HG GLU 21 HG2 GLU 21 11.212 14.586 6.178 971 2HG GLU 21 HG3 GLU 21 12.314 15.956 6.237 972 H GLY 22 HN GLY 22 14.776 15.284 5.591 973 1HA GLY 22 HA2 GLY 22 15.398 18.132 5.846 974 2HA GLY 22 HA3 GLY 22 16.208 16.775 6.641 975 H TRP 23 HN TRP 23 17.100 15.225 4.559 976 HA TRP 23 HA TRP 23 19.410 16.409 3.513 977 1HB TRP 23 HB2 TRP 23 17.737 13.993 2.826 978 2HB TRP 23 HB3 TRP 23 18.937 14.511 1.666 979 HD1 TRP 23 HD1 TRP 23 18.655 12.346 4.580 980 HE1 TRP 23 HE1 TRP 23 20.953 11.528 5.312 981 HE3 TRP 23 HE3 TRP 23 21.528 15.619 1.914 982 HZ2 TRP 23 HZ2 TRP 23 23.729 12.168 4.752 983 HZ3 TRP 23 HZ3 TRP 23 24.011 15.449 1.977 984 HH2 TRP 23 HH2 TRP 23 25.114 13.732 3.386 985 H ALA 24 HN ALA 24 16.168 16.063 1.967 986 HA ALA 24 HA ALA 24 16.945 17.184 -0.490 987 1HB ALA 24 HB1 ALA 24 14.530 17.589 -0.839 988 2HB ALA 24 HB2 ALA 24 14.738 16.006 -0.052 989 3HB ALA 24 HB3 ALA 24 14.214 17.416 0.895 990 H LYS 25 HN LYS 25 15.510 18.729 2.474 991 HA LYS 25 HA LYS 25 15.179 21.220 1.207 992 1HB LYS 25 HB2 LYS 25 15.249 20.382 4.122 993 2HB LYS 25 HB3 LYS 25 15.078 22.083 3.668 994 1HG LYS 25 HG2 LYS 25 13.078 21.606 2.342 995 2HG LYS 25 HG3 LYS 25 13.215 19.880 2.679 996 1HD LYS 25 HD2 LYS 25 12.934 20.375 5.138 997 2HD LYS 25 HD3 LYS 25 12.783 22.089 4.735 998 1HE LYS 25 HE2 LYS 25 10.546 21.357 4.986 999 2HE LYS 25 HE3 LYS 25 10.797 21.471 3.244 1000 1HZ LYS 25 HZ1 LYS 25 11.285 18.991 3.393 1001 2HZ LYS 25 HZ2 LYS 25 10.681 19.018 4.916 1002 3HZ LYS 25 HZ3 LYS 25 9.716 19.416 3.660 1003 H GLN 26 HN GLN 26 18.068 19.881 2.809 1004 HA GLN 26 HA GLN 26 19.371 22.402 2.899 1005 1HB GLN 26 HB2 GLN 26 21.264 21.349 3.605 1006 2HB GLN 26 HB3 GLN 26 19.963 20.392 4.259 1007 1HG GLN 26 HG2 GLN 26 20.669 18.520 3.241 1008 2HG GLN 26 HG3 GLN 26 20.767 19.274 1.673 1009 1HE2 GLN 26 HE22 GLN 26 22.610 17.298 2.840 1010 2HE2 GLN 26 HE21 GLN 26 24.182 18.057 2.786 1011 H TYR 27 HN TYR 27 18.675 20.459 0.131 1012 HA TYR 27 HA TYR 27 20.784 21.898 -1.407 1013 1HB TYR 27 HB2 TYR 27 20.297 18.992 -1.157 1014 2HB TYR 27 HB3 TYR 27 20.346 19.531 -2.821 1015 HD1 TYR 27 HD1 TYR 27 22.369 18.764 0.061 1016 HD2 TYR 27 HD2 TYR 27 22.292 20.945 -3.654 1017 HE1 TYR 27 HE1 TYR 27 24.828 19.020 0.176 1018 HE2 TYR 27 HE2 TYR 27 24.763 21.148 -3.594 1019 HH TYR 27 HH TYR 27 26.738 19.866 -0.873 1020 H LEU 28 HN LEU 28 17.368 21.215 -1.246 1021 HA LEU 28 HA LEU 28 16.942 21.981 -4.059 1022 1HB LEU 28 HB2 LEU 28 15.030 21.249 -1.796 1023 2HB LEU 28 HB3 LEU 28 14.558 21.650 -3.443 1024 HG LEU 28 HG LEU 28 16.065 19.203 -2.498 1025 1HD1 LEU 28 HD11 LEU 28 13.560 19.335 -2.332 1026 2HD1 LEU 28 HD12 LEU 28 13.495 19.464 -4.098 1027 3HD1 LEU 28 HD13 LEU 28 14.170 18.008 -3.324 1028 1HD2 LEU 28 HD21 LEU 28 15.586 20.001 -5.392 1029 2HD2 LEU 28 HD22 LEU 28 17.158 19.847 -4.566 1030 3HD2 LEU 28 HD23 LEU 28 16.175 18.419 -4.817 1031 H GLY 29 HN GLY 29 14.543 23.371 -2.272 1032 1HA GLY 29 HA2 GLY 29 15.457 25.565 -0.918 1033 2HA GLY 29 HA3 GLY 29 15.609 26.063 -2.614 1034 H ASP 30 HN ASP 30 13.991 27.686 -1.689 1035 HA ASP 30 HA ASP 30 11.254 27.103 -1.292 1036 1HB ASP 30 HB2 ASP 30 12.301 29.266 -0.806 1037 2HB ASP 30 HB3 ASP 30 12.629 29.519 -2.522 1038 H GLU 31 HN GLU 31 13.178 26.940 -4.149 1039 HA GLU 31 HA GLU 31 11.280 27.079 -6.241 1040 1HB GLU 31 HB2 GLU 31 13.684 27.041 -6.573 1041 2HB GLU 31 HB3 GLU 31 13.822 25.456 -5.812 1042 1HG GLU 31 HG2 GLU 31 12.587 24.431 -7.670 1043 2HG GLU 31 HG3 GLU 31 12.359 26.013 -8.421 1044 H TRP 32 HN TRP 32 11.578 24.757 -3.632 1045 HA TRP 32 HA TRP 32 9.541 23.026 -4.894 1046 1HB TRP 32 HB2 TRP 32 11.921 22.027 -3.272 1047 2HB TRP 32 HB3 TRP 32 10.708 21.040 -4.064 1048 HD1 TRP 32 HD1 TRP 32 13.684 23.314 -4.916 1049 HE1 TRP 32 HE1 TRP 32 14.575 22.768 -7.244 1050 HE3 TRP 32 HE3 TRP 32 10.275 19.736 -6.272 1051 HZ2 TRP 32 HZ2 TRP 32 14.051 20.864 -9.318 1052 HZ3 TRP 32 HZ3 TRP 32 10.462 18.620 -8.480 1053 HH2 TRP 32 HH2 TRP 32 12.347 19.159 -10.009 1054 H LYS 33 HN LYS 33 8.533 21.537 -3.292 1055 HA LYS 33 HA LYS 33 8.674 22.400 -0.479 1056 1HB LYS 33 HB2 LYS 33 6.710 23.556 -1.543 1057 2HB LYS 33 HB3 LYS 33 5.978 21.973 -1.850 1058 1HG LYS 33 HG2 LYS 33 6.815 23.026 0.890 1059 2HG LYS 33 HG3 LYS 33 5.253 23.376 0.145 1060 1HD LYS 33 HD2 LYS 33 4.755 20.909 0.060 1061 2HD LYS 33 HD3 LYS 33 6.290 20.607 0.877 1062 1HE LYS 33 HE2 LYS 33 4.576 20.509 2.535 1063 2HE LYS 33 HE3 LYS 33 5.550 21.950 2.825 1064 1HZ LYS 33 HZ1 LYS 33 3.184 22.395 3.031 1065 2HZ LYS 33 HZ2 LYS 33 3.784 23.267 1.798 1066 3HZ LYS 33 HZ3 LYS 33 2.891 21.925 1.501 1067 H VAL 34 HN VAL 34 8.946 20.600 0.701 1068 HA VAL 34 HA VAL 34 8.671 17.987 -0.706 1069 HB VAL 34 HB VAL 34 10.773 18.706 1.362 1070 1HG1 VAL 34 HG11 VAL 34 10.635 16.558 -0.791 1071 2HG1 VAL 34 HG12 VAL 34 11.965 16.811 0.353 1072 3HG1 VAL 34 HG13 VAL 34 10.371 16.317 0.949 1073 1HG2 VAL 34 HG21 VAL 34 11.141 18.979 -1.642 1074 2HG2 VAL 34 HG22 VAL 34 11.204 20.294 -0.448 1075 3HG2 VAL 34 HG23 VAL 34 12.420 19.029 -0.406 1076 H TYR 35 HN TYR 35 7.344 16.592 0.341 1077 HA TYR 35 HA TYR 35 7.031 16.803 3.269 1078 1HB TYR 35 HB2 TYR 35 5.139 18.018 2.017 1079 2HB TYR 35 HB3 TYR 35 4.638 16.432 1.442 1080 HD1 TYR 35 HD1 TYR 35 5.404 18.401 4.546 1081 HD2 TYR 35 HD2 TYR 35 3.248 15.053 2.877 1082 HE1 TYR 35 HE1 TYR 35 4.273 18.056 6.716 1083 HE2 TYR 35 HE2 TYR 35 2.114 14.699 5.047 1084 HH TYR 35 HH TYR 35 2.745 16.781 7.915 1085 H SER 36 HN SER 36 5.798 14.707 4.037 1086 HA SER 36 HA SER 36 6.611 12.355 2.447 1087 1HB SER 36 HB2 SER 36 7.541 12.739 5.305 1088 2HB SER 36 HB3 SER 36 8.079 11.545 4.103 1089 HG SER 36 HG SER 36 9.641 13.097 4.333 1090 H ALA 37 HN ALA 37 5.353 10.514 2.982 1091 HA ALA 37 HA ALA 37 3.478 10.663 5.256 1092 1HB ALA 37 HB1 ALA 37 1.552 10.444 3.871 1093 2HB ALA 37 HB2 ALA 37 2.422 11.870 3.309 1094 3HB ALA 37 HB3 ALA 37 2.533 10.339 2.393 1095 H GLY 38 HN GLY 38 1.979 8.585 5.107 1096 1HA GLY 38 HA2 GLY 38 2.739 6.298 3.640 1097 2HA GLY 38 HA3 GLY 38 3.529 6.224 5.217 1098 H ILE 39 HN ILE 39 1.971 4.237 4.990 1099 HA ILE 39 HA ILE 39 -0.643 4.073 4.926 1100 HB ILE 39 HB ILE 39 0.458 2.108 5.107 1101 1HG1 ILE 39 HG12 ILE 39 -0.887 2.003 7.815 1102 2HG1 ILE 39 HG13 ILE 39 -1.832 2.351 6.382 1103 1HG2 ILE 39 HG21 ILE 39 1.704 1.219 7.029 1104 2HG2 ILE 39 HG22 ILE 39 2.453 2.659 6.358 1105 3HG2 ILE 39 HG23 ILE 39 1.534 2.758 7.876 1106 1HD1 ILE 39 HD11 ILE 39 -0.254 -0.171 6.882 1107 2HD1 ILE 39 HD12 ILE 39 -2.016 0.034 6.794 1108 3HD1 ILE 39 HD13 ILE 39 -1.045 0.241 5.334 1109 H GLU 40 HN GLU 40 0.723 4.433 8.198 1110 HA GLU 40 HA GLU 40 -1.683 5.911 9.134 1111 1HB GLU 40 HB2 GLU 40 -1.609 4.648 11.219 1112 2HB GLU 40 HB3 GLU 40 -1.972 3.629 9.832 1113 1HG GLU 40 HG2 GLU 40 0.301 2.712 9.832 1114 2HG GLU 40 HG3 GLU 40 0.791 3.811 11.117 1115 H ALA 41 HN ALA 41 0.718 6.846 8.061 1116 HA ALA 41 HA ALA 41 2.937 7.029 9.638 1117 1HB ALA 41 HB1 ALA 41 1.799 8.629 7.361 1118 2HB ALA 41 HB2 ALA 41 3.330 9.120 8.091 1119 3HB ALA 41 HB3 ALA 41 3.160 7.498 7.359 1120 H HIS 42 HN HIS 42 3.808 8.181 11.005 1121 HA HIS 42 HA HIS 42 3.584 10.922 11.456 1122 1HB HIS 42 HB2 HIS 42 2.691 10.944 13.779 1123 2HB HIS 42 HB3 HIS 42 1.467 10.442 12.643 1124 HD1 HIS 42 HD1 HIS 42 1.058 7.557 12.626 1125 HD2 HIS 42 HD2 HIS 42 3.131 9.384 15.820 1126 HE1 HIS 42 HE1 HIS 42 1.040 5.896 14.536 1127 H GLY 43 HN GLY 43 5.447 8.539 11.046 1128 1HA GLY 43 HA2 GLY 43 6.631 7.795 13.563 1129 2HA GLY 43 HA3 GLY 43 7.062 7.241 11.953 1130 H LEU 44 HN LEU 44 7.322 10.421 13.792 1131 HA LEU 44 HA LEU 44 9.967 10.806 12.593 1132 1HB LEU 44 HB2 LEU 44 8.812 12.813 13.321 1133 2HB LEU 44 HB3 LEU 44 8.752 12.212 14.989 1134 HG LEU 44 HG LEU 44 11.196 12.287 15.167 1135 1HD1 LEU 44 HD11 LEU 44 11.193 13.244 12.270 1136 2HD1 LEU 44 HD12 LEU 44 12.588 13.317 13.361 1137 3HD1 LEU 44 HD13 LEU 44 11.939 11.753 12.888 1138 1HD2 LEU 44 HD21 LEU 44 10.135 14.869 13.971 1139 2HD2 LEU 44 HD22 LEU 44 9.910 14.342 15.653 1140 3HD2 LEU 44 HD23 LEU 44 11.536 14.703 15.045 1141 H ASN 45 HN ASN 45 11.629 9.533 13.095 1142 HA ASN 45 HA ASN 45 11.594 8.000 15.640 1143 1HB ASN 45 HB2 ASN 45 11.386 6.775 13.488 1144 2HB ASN 45 HB3 ASN 45 12.947 7.417 12.972 1145 1HD2 ASN 45 HD22 ASN 45 12.256 4.580 13.219 1146 2HD2 ASN 45 HD21 ASN 45 13.314 3.927 14.437 1147 HA PRO 46 HA PRO 46 15.124 10.590 16.694 1148 1HB PRO 46 HB2 PRO 46 16.278 9.037 18.689 1149 2HB PRO 46 HB3 PRO 46 14.902 10.160 18.903 1150 1HG PRO 46 HG2 PRO 46 14.818 7.169 18.437 1151 2HG PRO 46 HG3 PRO 46 13.900 8.133 19.639 1152 1HD PRO 46 HD2 PRO 46 12.758 7.367 17.330 1153 2HD PRO 46 HD3 PRO 46 12.465 9.013 17.959 1154 H ASN 47 HN ASN 47 15.410 7.227 15.537 1155 HA ASN 47 HA ASN 47 18.243 7.270 15.161 1156 1HB ASN 47 HB2 ASN 47 17.977 5.355 14.055 1157 2HB ASN 47 HB3 ASN 47 16.402 5.322 14.842 1158 1HD2 ASN 47 HD21 ASN 47 18.070 5.141 11.879 1159 2HD2 ASN 47 HD22 ASN 47 16.707 5.424 10.807 1160 H ALA 48 HN ALA 48 15.529 8.641 13.247 1161 HA ALA 48 HA ALA 48 17.242 9.237 10.989 1162 1HB ALA 48 HB1 ALA 48 14.960 8.860 10.584 1163 2HB ALA 48 HB2 ALA 48 14.418 10.121 11.725 1164 3HB ALA 48 HB3 ALA 48 15.238 10.570 10.214 1165 H VAL 49 HN VAL 49 16.051 10.881 13.885 1166 HA VAL 49 HA VAL 49 17.144 13.478 13.324 1167 HB VAL 49 HB VAL 49 16.949 12.170 16.065 1168 1HG1 VAL 49 HG11 VAL 49 16.735 14.490 16.872 1169 2HG1 VAL 49 HG12 VAL 49 18.265 14.264 16.018 1170 3HG1 VAL 49 HG13 VAL 49 16.919 15.099 15.215 1171 1HG2 VAL 49 HG21 VAL 49 14.704 12.084 14.921 1172 2HG2 VAL 49 HG22 VAL 49 14.736 13.166 16.312 1173 3HG2 VAL 49 HG23 VAL 49 14.799 13.832 14.679 1174 H LYS 50 HN LYS 50 18.600 10.586 14.960 1175 HA LYS 50 HA LYS 50 21.212 11.650 15.204 1176 1HB LYS 50 HB2 LYS 50 20.449 9.638 16.376 1177 2HB LYS 50 HB3 LYS 50 20.297 8.762 14.850 1178 1HG LYS 50 HG2 LYS 50 22.730 8.929 14.475 1179 2HG LYS 50 HG3 LYS 50 22.903 9.867 15.973 1180 1HD LYS 50 HD2 LYS 50 22.108 7.924 17.290 1181 2HD LYS 50 HD3 LYS 50 21.793 7.030 15.803 1182 1HE LYS 50 HE2 LYS 50 23.850 6.201 16.684 1183 2HE LYS 50 HE3 LYS 50 24.226 7.125 15.229 1184 1HZ LYS 50 HZ1 LYS 50 25.751 7.617 17.036 1185 2HZ LYS 50 HZ2 LYS 50 24.909 8.969 16.675 1186 3HZ LYS 50 HZ3 LYS 50 24.538 8.103 18.016 1187 H ALA 51 HN ALA 51 19.772 9.734 12.529 1188 HA ALA 51 HA ALA 51 21.982 9.507 10.879 1189 1HB ALA 51 HB1 ALA 51 19.089 9.956 10.030 1190 2HB ALA 51 HB2 ALA 51 20.361 9.180 9.081 1191 3HB ALA 51 HB3 ALA 51 19.770 8.399 10.555 1192 H MET 52 HN MET 52 19.781 12.328 11.266 1193 HA MET 52 HA MET 52 20.984 13.834 9.104 1194 1HB MET 52 HB2 MET 52 19.073 14.516 11.388 1195 2HB MET 52 HB3 MET 52 19.564 15.688 10.178 1196 1HG MET 52 HG2 MET 52 18.415 13.097 9.185 1197 2HG MET 52 HG3 MET 52 17.345 14.224 9.991 1198 1HE MET 52 HE1 MET 52 20.438 15.202 7.541 1199 2HE MET 52 HE2 MET 52 19.738 13.662 6.971 1200 3HE MET 52 HE3 MET 52 19.524 15.143 6.015 1201 H LYS 53 HN LYS 53 21.256 13.747 12.698 1202 HA LYS 53 HA LYS 53 23.045 15.933 12.885 1203 1HB LYS 53 HB2 LYS 53 22.690 13.464 14.640 1204 2HB LYS 53 HB3 LYS 53 23.734 14.802 15.083 1205 1HG LYS 53 HG2 LYS 53 20.770 15.216 14.499 1206 2HG LYS 53 HG3 LYS 53 21.383 14.748 16.088 1207 1HD LYS 53 HD2 LYS 53 22.803 16.793 16.122 1208 2HD LYS 53 HD3 LYS 53 22.098 17.293 14.565 1209 1HE LYS 53 HE2 LYS 53 19.869 17.412 15.535 1210 2HE LYS 53 HE3 LYS 53 20.422 16.658 17.032 1211 1HZ LYS 53 HZ1 LYS 53 21.316 19.327 16.099 1212 2HZ LYS 53 HZ2 LYS 53 20.203 19.055 17.268 1213 3HZ LYS 53 HZ3 LYS 53 21.748 18.609 17.500 1214 H GLU 54 HN GLU 54 23.709 12.524 11.981 1215 HA GLU 54 HA GLU 54 26.506 12.563 12.171 1216 1HB GLU 54 HB2 GLU 54 24.805 11.340 9.957 1217 2HB GLU 54 HB3 GLU 54 26.527 11.079 10.170 1218 1HG GLU 54 HG2 GLU 54 26.030 10.135 12.477 1219 2HG GLU 54 HG3 GLU 54 24.319 10.141 12.007 1220 H VAL 55 HN VAL 55 24.448 14.242 9.833 1221 HA VAL 55 HA VAL 55 26.857 15.349 8.482 1222 HB VAL 55 HB VAL 55 25.422 15.638 6.512 1223 1HG1 VAL 55 HG11 VAL 55 26.866 13.623 6.851 1224 2HG1 VAL 55 HG12 VAL 55 25.454 12.748 7.482 1225 3HG1 VAL 55 HG13 VAL 55 25.477 13.331 5.807 1226 1HG2 VAL 55 HG21 VAL 55 23.253 14.594 6.292 1227 2HG2 VAL 55 HG22 VAL 55 23.319 13.947 7.941 1228 3HG2 VAL 55 HG23 VAL 55 23.185 15.699 7.662 1229 H GLY 56 HN GLY 56 25.239 16.175 10.986 1230 1HA GLY 56 HA2 GLY 56 24.941 18.145 12.039 1231 2HA GLY 56 HA3 GLY 56 25.747 18.935 10.677 1232 H ILE 57 HN ILE 57 22.643 17.086 10.304 1233 HA ILE 57 HA ILE 57 21.241 19.715 9.980 1234 HB ILE 57 HB ILE 57 20.702 17.015 8.706 1235 1HG1 ILE 57 HG12 ILE 57 21.403 19.744 7.535 1236 2HG1 ILE 57 HG13 ILE 57 22.474 18.349 7.624 1237 1HG2 ILE 57 HG21 ILE 57 18.539 18.037 9.353 1238 2HG2 ILE 57 HG22 ILE 57 19.004 19.552 8.542 1239 3HG2 ILE 57 HG23 ILE 57 18.733 18.059 7.619 1240 1HD1 ILE 57 HD11 ILE 57 20.011 18.617 5.851 1241 2HD1 ILE 57 HD12 ILE 57 21.713 18.517 5.393 1242 3HD1 ILE 57 HD13 ILE 57 20.922 17.100 6.091 1243 H ASP 58 HN ASP 58 19.179 19.806 11.079 1244 HA ASP 58 HA ASP 58 18.746 17.766 13.205 1245 1HB ASP 58 HB2 ASP 58 19.649 19.670 14.378 1246 2HB ASP 58 HB3 ASP 58 18.637 20.791 13.460 1247 H ILE 59 HN ILE 59 16.653 17.224 13.450 1248 HA ILE 59 HA ILE 59 14.556 18.569 11.866 1249 HB ILE 59 HB ILE 59 13.698 16.463 11.056 1250 1HG1 ILE 59 HG12 ILE 59 16.295 15.081 11.897 1251 2HG1 ILE 59 HG13 ILE 59 14.821 15.010 12.855 1252 1HG2 ILE 59 HG21 ILE 59 15.304 17.833 9.684 1253 2HG2 ILE 59 HG22 ILE 59 16.621 16.768 10.214 1254 3HG2 ILE 59 HG23 ILE 59 15.295 16.118 9.230 1255 1HD1 ILE 59 HD11 ILE 59 15.061 13.982 10.007 1256 2HD1 ILE 59 HD12 ILE 59 14.974 13.018 11.494 1257 3HD1 ILE 59 HD13 ILE 59 13.591 14.012 11.006 1258 H SER 60 HN SER 60 15.435 18.114 14.853 1259 HA SER 60 HA SER 60 13.478 16.468 15.987 1260 1HB SER 60 HB2 SER 60 14.693 19.002 17.188 1261 2HB SER 60 HB3 SER 60 14.014 17.629 18.081 1262 HG SER 60 HG SER 60 16.371 17.753 16.482 1263 H ASN 61 HN ASN 61 13.068 19.466 14.395 1264 HA ASN 61 HA ASN 61 10.634 20.345 15.666 1265 1HB ASN 61 HB2 ASN 61 10.675 22.098 14.071 1266 2HB ASN 61 HB3 ASN 61 12.362 21.843 14.507 1267 1HD2 ASN 61 HD22 ASN 61 10.500 22.529 11.869 1268 2HD2 ASN 61 HD21 ASN 61 11.428 21.723 10.633 1269 H GLN 62 HN GLN 62 11.384 17.954 13.177 1270 HA GLN 62 HA GLN 62 9.215 18.408 11.485 1271 1HB GLN 62 HB2 GLN 62 11.006 16.021 11.916 1272 2HB GLN 62 HB3 GLN 62 9.659 15.985 10.771 1273 1HG GLN 62 HG2 GLN 62 10.487 18.077 9.700 1274 2HG GLN 62 HG3 GLN 62 11.887 18.048 10.771 1275 1HE2 GLN 62 HE22 GLN 62 12.919 18.139 8.607 1276 2HE2 GLN 62 HE21 GLN 62 13.277 16.607 7.807 1277 H THR 63 HN THR 63 7.593 16.760 10.973 1278 HA THR 63 HA THR 63 6.518 15.031 12.968 1279 HB THR 63 HB THR 63 5.547 17.198 13.710 1280 HG1 THR 63 HG1 THR 63 3.562 16.368 13.979 1281 1HG2 THR 63 HG21 THR 63 5.343 18.373 11.536 1282 2HG2 THR 63 HG22 THR 63 4.077 17.229 11.036 1283 3HG2 THR 63 HG23 THR 63 3.806 18.322 12.409 1284 H SER 64 HN SER 64 4.306 14.122 11.794 1285 HA SER 64 HA SER 64 4.490 14.118 8.912 1286 1HB SER 64 HB2 SER 64 4.788 11.480 8.966 1287 2HB SER 64 HB3 SER 64 6.142 12.610 8.895 1288 HG SER 64 HG SER 64 5.949 12.388 11.365 1289 H ASP 65 HN ASP 65 2.911 12.203 8.117 1290 HA ASP 65 HA ASP 65 0.435 12.061 9.617 1291 1HB ASP 65 HB2 ASP 65 0.563 14.489 8.858 1292 2HB ASP 65 HB3 ASP 65 0.675 13.891 7.192 1293 H ILE 66 HN ILE 66 -1.292 11.078 8.102 1294 HA ILE 66 HA ILE 66 -0.217 8.906 6.642 1295 HB ILE 66 HB ILE 66 -2.593 8.486 6.065 1296 1HG1 ILE 66 HG12 ILE 66 -3.168 11.043 7.616 1297 2HG1 ILE 66 HG13 ILE 66 -3.360 10.837 5.873 1298 1HG2 ILE 66 HG21 ILE 66 -1.458 7.738 8.092 1299 2HG2 ILE 66 HG22 ILE 66 -2.131 9.111 9.000 1300 3HG2 ILE 66 HG23 ILE 66 -3.206 7.869 8.299 1301 1HD1 ILE 66 HD11 ILE 66 -4.915 9.425 8.067 1302 2HD1 ILE 66 HD12 ILE 66 -5.516 10.633 6.922 1303 3HD1 ILE 66 HD13 ILE 66 -5.043 9.022 6.332 1304 H ILE 67 HN ILE 67 -0.851 8.312 4.388 1305 HA ILE 67 HA ILE 67 -0.072 10.167 2.464 1306 HB ILE 67 HB ILE 67 -0.528 8.686 0.856 1307 1HG1 ILE 67 HG12 ILE 67 -2.939 7.483 2.257 1308 2HG1 ILE 67 HG13 ILE 67 -2.999 8.724 1.003 1309 1HG2 ILE 67 HG21 ILE 67 0.822 7.568 2.607 1310 2HG2 ILE 67 HG22 ILE 67 -0.652 6.734 3.174 1311 3HG2 ILE 67 HG23 ILE 67 -0.026 6.447 1.544 1312 1HD1 ILE 67 HD11 ILE 67 -2.163 5.845 0.624 1313 2HD1 ILE 67 HD12 ILE 67 -3.469 6.777 -0.150 1314 3HD1 ILE 67 HD13 ILE 67 -1.787 7.119 -0.554 1315 H ASP 68 HN ASP 68 -0.999 11.903 1.557 1316 HA ASP 68 HA ASP 68 -3.927 12.326 1.947 1317 1HB ASP 68 HB2 ASP 68 -2.709 13.486 3.727 1318 2HB ASP 68 HB3 ASP 68 -1.797 14.391 2.519 1319 H SER 69 HN SER 69 -4.505 11.941 -0.009 1320 HA SER 69 HA SER 69 -3.464 12.434 -2.431 1321 1HB SER 69 HB2 SER 69 -6.366 12.911 -1.713 1322 2HB SER 69 HB3 SER 69 -5.718 12.168 -3.192 1323 HG SER 69 HG SER 69 -6.577 10.627 -1.652 1324 H ASP 70 HN ASP 70 -4.710 14.983 -0.275 1325 HA ASP 70 HA ASP 70 -5.361 16.868 -2.329 1326 1HB ASP 70 HB2 ASP 70 -6.164 17.062 -0.003 1327 2HB ASP 70 HB3 ASP 70 -4.502 17.343 0.544 1328 H ILE 71 HN ILE 71 -2.344 15.812 -0.909 1329 HA ILE 71 HA ILE 71 -0.868 18.042 -2.254 1330 HB ILE 71 HB ILE 71 0.104 16.178 -0.098 1331 1HG1 ILE 71 HG12 ILE 71 -0.131 18.785 1.044 1332 2HG1 ILE 71 HG13 ILE 71 -1.647 18.553 0.173 1333 1HG2 ILE 71 HG21 ILE 71 1.923 17.192 -1.373 1334 2HG2 ILE 71 HG22 ILE 71 1.267 18.815 -1.050 1335 3HG2 ILE 71 HG23 ILE 71 1.872 17.806 0.288 1336 1HD1 ILE 71 HD11 ILE 71 -0.422 16.629 2.170 1337 2HD1 ILE 71 HD12 ILE 71 -1.791 17.728 2.480 1338 3HD1 ILE 71 HD13 ILE 71 -1.974 16.395 1.311 1339 H LEU 72 HN LEU 72 -0.973 14.426 -1.709 1340 HA LEU 72 HA LEU 72 1.262 13.945 -3.358 1341 1HB LEU 72 HB2 LEU 72 0.255 12.264 -1.847 1342 2HB LEU 72 HB3 LEU 72 -1.091 12.054 -2.978 1343 HG LEU 72 HG LEU 72 1.737 11.791 -4.027 1344 1HD1 LEU 72 HD11 LEU 72 0.339 9.578 -2.469 1345 2HD1 LEU 72 HD12 LEU 72 1.807 9.398 -3.449 1346 3HD1 LEU 72 HD13 LEU 72 1.826 10.417 -2.010 1347 1HD2 LEU 72 HD21 LEU 72 -0.298 11.495 -5.574 1348 2HD2 LEU 72 HD22 LEU 72 0.816 10.136 -5.531 1349 3HD2 LEU 72 HD23 LEU 72 -0.695 10.069 -4.618 1350 H ASN 73 HN ASN 73 -2.263 14.013 -4.317 1351 HA ASN 73 HA ASN 73 -1.723 13.338 -7.015 1352 1HB ASN 73 HB2 ASN 73 -3.899 13.544 -7.411 1353 2HB ASN 73 HB3 ASN 73 -4.050 13.593 -5.670 1354 1HD2 ASN 73 HD22 ASN 73 -4.218 15.847 -4.682 1355 2HD2 ASN 73 HD21 ASN 73 -4.873 17.155 -5.653 1356 H ASN 74 HN ASN 74 -1.387 16.372 -5.273 1357 HA ASN 74 HA ASN 74 -1.222 18.037 -7.656 1358 1HB ASN 74 HB2 ASN 74 -1.200 18.531 -4.675 1359 2HB ASN 74 HB3 ASN 74 -0.466 19.727 -5.720 1360 1HD2 ASN 74 HD22 ASN 74 -3.346 19.109 -4.222 1361 2HD2 ASN 74 HD21 ASN 74 -4.400 19.953 -5.337 1362 H ALA 75 HN ALA 75 1.008 16.223 -5.626 1363 HA ALA 75 HA ALA 75 3.353 17.670 -6.107 1364 1HB ALA 75 HB1 ALA 75 3.098 14.649 -5.860 1365 2HB ALA 75 HB2 ALA 75 4.530 15.641 -5.543 1366 3HB ALA 75 HB3 ALA 75 3.115 15.783 -4.487 1367 H ASP 76 HN ASP 76 5.059 17.256 -7.488 1368 HA ASP 76 HA ASP 76 4.347 16.515 -10.275 1369 1HB ASP 76 HB2 ASP 76 5.737 18.514 -9.875 1370 2HB ASP 76 HB3 ASP 76 6.940 17.525 -9.038 1371 H LEU 77 HN LEU 77 6.150 15.256 -7.453 1372 HA LEU 77 HA LEU 77 6.755 12.803 -8.916 1373 1HB LEU 77 HB2 LEU 77 8.578 14.388 -9.340 1374 2HB LEU 77 HB3 LEU 77 8.840 14.612 -7.627 1375 HG LEU 77 HG LEU 77 10.424 13.136 -9.070 1376 1HD1 LEU 77 HD11 LEU 77 9.482 12.129 -6.385 1377 2HD1 LEU 77 HD12 LEU 77 10.989 11.677 -7.212 1378 3HD1 LEU 77 HD13 LEU 77 10.739 13.347 -6.702 1379 1HD2 LEU 77 HD21 LEU 77 8.479 11.684 -9.912 1380 2HD2 LEU 77 HD22 LEU 77 10.008 10.901 -9.443 1381 3HD2 LEU 77 HD23 LEU 77 8.619 10.838 -8.361 1382 H VAL 78 HN VAL 78 6.640 11.032 -7.688 1383 HA VAL 78 HA VAL 78 6.584 11.194 -4.692 1384 HB VAL 78 HB VAL 78 5.187 9.283 -6.568 1385 1HG1 VAL 78 HG11 VAL 78 6.026 8.007 -4.641 1386 2HG1 VAL 78 HG12 VAL 78 5.472 9.270 -3.518 1387 3HG1 VAL 78 HG13 VAL 78 4.301 8.294 -4.420 1388 1HG2 VAL 78 HG21 VAL 78 4.061 11.131 -4.413 1389 2HG2 VAL 78 HG22 VAL 78 4.127 11.560 -6.118 1390 3HG2 VAL 78 HG23 VAL 78 3.161 10.172 -5.608 1391 H VAL 79 HN VAL 79 8.387 10.697 -3.856 1392 HA VAL 79 HA VAL 79 10.221 8.779 -5.117 1393 HB VAL 79 HB VAL 79 10.414 10.309 -2.487 1394 1HG1 VAL 79 HG11 VAL 79 12.367 8.657 -4.132 1395 2HG1 VAL 79 HG12 VAL 79 12.862 9.688 -2.773 1396 3HG1 VAL 79 HG13 VAL 79 11.807 8.306 -2.488 1397 1HG2 VAL 79 HG21 VAL 79 12.000 11.784 -3.579 1398 2HG2 VAL 79 HG22 VAL 79 11.683 10.995 -5.140 1399 3HG2 VAL 79 HG23 VAL 79 10.405 11.921 -4.301 1400 H THR 80 HN THR 80 9.420 6.668 -4.831 1401 HA THR 80 HA THR 80 8.238 5.950 -2.239 1402 HB THR 80 HB THR 80 9.320 4.232 -4.510 1403 HG1 THR 80 HG1 THR 80 7.307 5.747 -4.484 1404 1HG2 THR 80 HG21 THR 80 9.309 2.894 -2.501 1405 2HG2 THR 80 HG22 THR 80 7.727 3.554 -2.002 1406 3HG2 THR 80 HG23 THR 80 7.856 2.468 -3.417 1407 H LEU 81 HN LEU 81 9.495 5.288 -0.430 1408 HA LEU 81 HA LEU 81 12.463 5.425 -0.816 1409 1HB LEU 81 HB2 LEU 81 11.178 7.554 -0.106 1410 2HB LEU 81 HB3 LEU 81 10.916 6.720 1.415 1411 HG LEU 81 HG LEU 81 13.549 6.469 1.478 1412 1HD1 LEU 81 HD11 LEU 81 13.287 8.706 -0.561 1413 2HD1 LEU 81 HD12 LEU 81 14.759 8.234 0.289 1414 3HD1 LEU 81 HD13 LEU 81 14.010 7.111 -0.853 1415 1HD2 LEU 81 HD21 LEU 81 12.144 7.885 2.921 1416 2HD2 LEU 81 HD22 LEU 81 13.711 8.606 2.558 1417 3HD2 LEU 81 HD23 LEU 81 12.252 9.203 1.735 1418 H SER 82 HN SER 82 11.266 2.906 -0.535 1419 HA SER 82 HA SER 82 12.913 1.909 1.428 1420 1HB SER 82 HB2 SER 82 11.317 0.803 3.000 1421 2HB SER 82 HB3 SER 82 11.327 2.557 3.171 1422 HG SER 82 HG SER 82 9.206 1.647 3.119 1423 H GLY 83 HN GLY 83 9.773 1.346 -0.100 1424 1HA GLY 83 HA2 GLY 83 9.229 -0.092 -1.906 1425 2HA GLY 83 HA3 GLY 83 10.720 -1.019 -1.621 1426 H ASP 84 HN ASP 84 9.117 -0.026 1.301 1427 HA ASP 84 HA ASP 84 8.894 -2.780 1.980 1428 1HB ASP 84 HB2 ASP 84 9.735 -1.142 3.577 1429 2HB ASP 84 HB3 ASP 84 8.181 -0.299 3.568 1430 H ALA 85 HN ALA 85 7.052 -4.037 2.352 1431 HA ALA 85 HA ALA 85 4.846 -3.342 0.696 1432 1HB ALA 85 HB1 ALA 85 4.015 -5.578 1.280 1433 2HB ALA 85 HB2 ALA 85 5.746 -5.632 0.903 1434 3HB ALA 85 HB3 ALA 85 5.198 -5.696 2.598 1435 H ALA 86 HN ALA 86 5.299 -2.677 4.115 1436 HA ALA 86 HA ALA 86 2.520 -3.151 4.819 1437 1HB ALA 86 HB1 ALA 86 4.265 -3.447 6.481 1438 2HB ALA 86 HB2 ALA 86 4.778 -1.770 6.294 1439 3HB ALA 86 HB3 ALA 86 3.187 -2.129 6.989 1440 H ASP 87 HN ASP 87 4.084 -0.518 3.209 1441 HA ASP 87 HA ASP 87 2.756 1.638 4.398 1442 1HB ASP 87 HB2 ASP 87 4.850 1.600 2.931 1443 2HB ASP 87 HB3 ASP 87 3.764 1.617 1.548 1444 H LYS 88 HN LYS 88 1.039 -0.611 2.773 1445 HA LYS 88 HA LYS 88 -1.068 -0.708 1.867 1446 1HB LYS 88 HB2 LYS 88 -1.039 2.284 1.240 1447 2HB LYS 88 HB3 LYS 88 -2.354 1.168 1.000 1448 1HG LYS 88 HG2 LYS 88 -2.793 0.891 3.297 1449 2HG LYS 88 HG3 LYS 88 -1.288 1.701 3.760 1450 1HD LYS 88 HD2 LYS 88 -2.039 3.837 3.113 1451 2HD LYS 88 HD3 LYS 88 -3.409 3.197 2.211 1452 1HE LYS 88 HE2 LYS 88 -4.648 2.640 4.109 1453 2HE LYS 88 HE3 LYS 88 -3.251 2.626 5.168 1454 1HZ LYS 88 HZ1 LYS 88 -4.292 5.122 3.959 1455 2HZ LYS 88 HZ2 LYS 88 -4.749 4.571 5.426 1456 3HZ LYS 88 HZ3 LYS 88 -3.199 4.982 5.198 1457 H CYS 89 HN CYS 89 1.826 -0.260 0.573 1458 HA CYS 89 HA CYS 89 2.822 0.133 -1.427 1459 1HB CYS 89 HB2 CYS 89 0.895 -2.005 -2.363 1460 2HB CYS 89 HB3 CYS 89 2.508 -1.679 -2.989 1461 HA PRO 90 HA PRO 90 -0.926 2.709 -2.549 1462 1HB PRO 90 HB2 PRO 90 0.443 5.162 -2.810 1463 2HB PRO 90 HB3 PRO 90 -0.421 4.562 -1.360 1464 1HG PRO 90 HG2 PRO 90 2.520 4.357 -1.998 1465 2HG PRO 90 HG3 PRO 90 1.726 4.773 -0.434 1466 1HD PRO 90 HD2 PRO 90 2.685 2.304 -0.896 1467 2HD PRO 90 HD3 PRO 90 1.109 2.523 -0.075 1468 H MET 91 HN MET 91 -1.741 3.315 -4.543 1469 HA MET 91 HA MET 91 0.002 2.516 -6.738 1470 1HB MET 91 HB2 MET 91 -2.101 2.371 -8.051 1471 2HB MET 91 HB3 MET 91 -1.946 1.323 -6.658 1472 1HG MET 91 HG2 MET 91 -4.113 2.099 -6.593 1473 2HG MET 91 HG3 MET 91 -3.323 3.030 -5.360 1474 1HE MET 91 HE1 MET 91 -5.428 4.172 -5.495 1475 2HE MET 91 HE2 MET 91 -6.145 5.150 -6.869 1476 3HE MET 91 HE3 MET 91 -5.993 3.354 -6.942 1477 H THR 92 HN THR 92 -0.395 5.503 -5.458 1478 HA THR 92 HA THR 92 -0.080 7.606 -6.241 1479 HB THR 92 HB THR 92 1.912 7.727 -7.799 1480 HG1 THR 92 HG1 THR 92 1.471 5.641 -8.741 1481 1HG2 THR 92 HG21 THR 92 3.485 6.858 -6.114 1482 2HG2 THR 92 HG22 THR 92 2.159 7.747 -5.346 1483 3HG2 THR 92 HG23 THR 92 2.169 5.974 -5.313 1484 HA PRO 93 HA PRO 93 -3.072 7.325 -9.640 1485 1HB PRO 93 HB2 PRO 93 -4.364 9.748 -9.284 1486 2HB PRO 93 HB3 PRO 93 -4.676 8.273 -8.302 1487 1HG PRO 93 HG2 PRO 93 -2.874 10.587 -7.545 1488 2HG PRO 93 HG3 PRO 93 -4.175 9.758 -6.599 1489 1HD PRO 93 HD2 PRO 93 -1.571 9.057 -6.326 1490 2HD PRO 93 HD3 PRO 93 -2.850 7.807 -6.307 1491 HA PRO 94 HA PRO 94 -0.379 8.799 -12.642 1492 1HB PRO 94 HB2 PRO 94 -1.955 9.109 -14.919 1493 2HB PRO 94 HB3 PRO 94 -1.476 7.554 -14.180 1494 1HG PRO 94 HG2 PRO 94 -4.034 9.123 -13.725 1495 2HG PRO 94 HG3 PRO 94 -3.858 7.381 -14.135 1496 1HD PRO 94 HD2 PRO 94 -4.203 8.123 -11.577 1497 2HD PRO 94 HD3 PRO 94 -2.964 6.887 -11.983 1498 H HIS 95 HN HIS 95 -2.162 11.169 -11.292 1499 HA HIS 95 HA HIS 95 -1.619 13.371 -13.097 1500 1HB HIS 95 HB2 HIS 95 -2.112 13.384 -10.092 1501 2HB HIS 95 HB3 HIS 95 -2.261 14.754 -11.187 1502 HD1 HIS 95 HD1 HIS 95 -4.289 14.143 -13.264 1503 HD2 HIS 95 HD2 HIS 95 -4.376 12.285 -9.486 1504 HE1 HIS 95 HE1 HIS 95 -6.649 13.242 -12.960 1505 H VAL 96 HN VAL 96 0.442 11.329 -11.310 1506 HA VAL 96 HA VAL 96 2.488 13.446 -10.869 1507 HB VAL 96 HB VAL 96 2.044 11.055 -9.047 1508 1HG1 VAL 96 HG11 VAL 96 4.074 12.155 -8.543 1509 2HG1 VAL 96 HG12 VAL 96 3.386 13.758 -8.810 1510 3HG1 VAL 96 HG13 VAL 96 2.934 12.839 -7.376 1511 1HG2 VAL 96 HG21 VAL 96 -0.161 12.153 -9.005 1512 2HG2 VAL 96 HG22 VAL 96 0.708 12.363 -7.513 1513 3HG2 VAL 96 HG23 VAL 96 0.629 13.718 -8.664 1514 H LYS 97 HN LYS 97 4.713 12.747 -11.048 1515 HA LYS 97 HA LYS 97 5.191 10.266 -12.588 1516 1HB LYS 97 HB2 LYS 97 6.155 12.558 -13.161 1517 2HB LYS 97 HB3 LYS 97 7.129 12.468 -11.705 1518 1HG LYS 97 HG2 LYS 97 7.271 10.176 -13.659 1519 2HG LYS 97 HG3 LYS 97 7.941 11.708 -14.184 1520 1HD LYS 97 HD2 LYS 97 8.767 10.322 -11.623 1521 2HD LYS 97 HD3 LYS 97 9.571 10.066 -13.150 1522 1HE LYS 97 HE2 LYS 97 9.389 12.783 -11.729 1523 2HE LYS 97 HE3 LYS 97 10.758 11.684 -11.653 1524 1HZ LYS 97 HZ1 LYS 97 11.305 13.186 -13.338 1525 2HZ LYS 97 HZ2 LYS 97 10.841 11.867 -14.154 1526 3HZ LYS 97 HZ3 LYS 97 9.819 13.141 -14.041 1527 H ARG 98 HN ARG 98 6.855 8.703 -11.646 1528 HA ARG 98 HA ARG 98 7.269 8.982 -8.727 1529 1HB ARG 98 HB2 ARG 98 5.110 7.770 -9.063 1530 2HB ARG 98 HB3 ARG 98 5.970 6.564 -10.034 1531 1HG ARG 98 HG2 ARG 98 7.392 6.098 -7.910 1532 2HG ARG 98 HG3 ARG 98 6.229 7.137 -7.048 1533 1HD ARG 98 HD2 ARG 98 4.407 5.668 -7.911 1534 2HD ARG 98 HD3 ARG 98 5.600 4.626 -8.692 1535 HE ARG 98 HE ARG 98 6.519 4.532 -6.192 1536 1HH1 ARG 98 HH11 ARG 98 3.120 4.308 -7.232 1537 2HH1 ARG 98 HH12 ARG 98 2.684 3.259 -5.930 1538 1HH2 ARG 98 HH21 ARG 98 5.877 3.409 -4.418 1539 2HH2 ARG 98 HH22 ARG 98 4.288 2.685 -4.301 1540 H GLU 99 HN GLU 99 9.073 7.832 -7.970 1541 HA GLU 99 HA GLU 99 10.345 5.838 -9.628 1542 1HB GLU 99 HB2 GLU 99 11.307 8.029 -10.472 1543 2HB GLU 99 HB3 GLU 99 11.941 8.328 -8.853 1544 1HG GLU 99 HG2 GLU 99 13.349 6.321 -9.007 1545 2HG GLU 99 HG3 GLU 99 12.580 5.851 -10.528 1546 H HIS 100 HN HIS 100 11.753 4.521 -8.224 1547 HA HIS 100 HA HIS 100 11.288 4.981 -5.339 1548 1HB HIS 100 HB2 HIS 100 12.291 2.554 -6.910 1549 2HB HIS 100 HB3 HIS 100 12.189 2.631 -5.158 1550 HD1 HIS 100 HD1 HIS 100 10.395 0.805 -4.748 1551 HD2 HIS 100 HD2 HIS 100 9.303 3.642 -7.660 1552 HE1 HIS 100 HE1 HIS 100 7.973 0.321 -5.361 1553 H TRP 101 HN TRP 101 12.881 5.771 -4.120 1554 HA TRP 101 HA TRP 101 15.706 5.648 -5.125 1555 1HB TRP 101 HB2 TRP 101 14.421 7.757 -3.369 1556 2HB TRP 101 HB3 TRP 101 16.086 7.724 -3.853 1557 HD1 TRP 101 HD1 TRP 101 14.624 6.935 -7.000 1558 HE1 TRP 101 HE1 TRP 101 13.962 8.900 -8.405 1559 HE3 TRP 101 HE3 TRP 101 15.029 10.567 -3.439 1560 HZ2 TRP 101 HZ2 TRP 101 13.544 11.782 -8.028 1561 HZ3 TRP 101 HZ3 TRP 101 14.464 12.920 -3.992 1562 HH2 TRP 101 HH2 TRP 101 13.697 13.525 -6.271 1563 H GLY 102 HN GLY 102 13.626 4.317 -2.853 1564 1HA GLY 102 HA2 GLY 102 15.908 3.690 -1.060 1565 2HA GLY 102 HA3 GLY 102 14.347 4.137 -0.366 1566 H PHE 103 HN PHE 103 15.935 1.648 -0.433 1567 HA PHE 103 HA PHE 103 14.002 -0.362 -1.426 1568 1HB PHE 103 HB2 PHE 103 16.971 -0.294 -2.094 1569 2HB PHE 103 HB3 PHE 103 15.847 -1.573 -2.522 1570 HD1 PHE 103 HD1 PHE 103 17.139 1.716 -3.448 1571 HD2 PHE 103 HD2 PHE 103 13.996 -1.150 -4.183 1572 HE1 PHE 103 HE1 PHE 103 16.602 2.848 -5.593 1573 HE2 PHE 103 HE2 PHE 103 13.473 -0.021 -6.331 1574 HZ PHE 103 HZ PHE 103 14.782 1.974 -7.041 1575 H ASP 104 HN ASP 104 15.206 0.802 1.230 1576 HA ASP 104 HA ASP 104 15.747 -1.616 2.722 1577 1HB ASP 104 HB2 ASP 104 17.992 -1.057 1.750 1578 2HB ASP 104 HB3 ASP 104 17.852 0.578 2.398 1579 H ASP 105 HN ASP 105 15.928 -0.821 5.131 1580 HA ASP 105 HA ASP 105 14.541 1.756 5.554 1581 1HB ASP 105 HB2 ASP 105 12.762 0.182 4.993 1582 2HB ASP 105 HB3 ASP 105 13.261 -0.882 6.304 1583 HA PRO 106 HA PRO 106 17.583 1.004 8.791 1584 1HB PRO 106 HB2 PRO 106 17.798 3.538 9.790 1585 2HB PRO 106 HB3 PRO 106 18.478 3.043 8.210 1586 1HG PRO 106 HG2 PRO 106 15.898 4.498 8.794 1587 2HG PRO 106 HG3 PRO 106 17.102 4.837 7.516 1588 1HD PRO 106 HD2 PRO 106 14.773 3.348 7.196 1589 2HD PRO 106 HD3 PRO 106 16.202 3.136 6.147 1590 H ALA 107 HN ALA 107 14.317 2.253 9.386 1591 HA ALA 107 HA ALA 107 14.280 1.978 12.212 1592 1HB ALA 107 HB1 ALA 107 11.828 1.972 11.888 1593 2HB ALA 107 HB2 ALA 107 12.582 3.230 10.895 1594 3HB ALA 107 HB3 ALA 107 12.045 1.708 10.146 1595 H ARG 108 HN ARG 108 15.099 -0.353 10.085 1596 HA ARG 108 HA ARG 108 13.803 -2.589 11.603 1597 1HB ARG 108 HB2 ARG 108 14.711 -2.788 8.745 1598 2HB ARG 108 HB3 ARG 108 13.639 -3.864 9.637 1599 1HG ARG 108 HG2 ARG 108 12.973 -1.108 8.575 1600 2HG ARG 108 HG3 ARG 108 12.440 -2.650 7.905 1601 1HD ARG 108 HD2 ARG 108 11.629 -1.356 10.500 1602 2HD ARG 108 HD3 ARG 108 10.605 -1.692 9.108 1603 HE ARG 108 HE ARG 108 10.773 -4.070 9.594 1604 1HH1 ARG 108 HH11 ARG 108 11.717 -1.918 12.307 1605 2HH1 ARG 108 HH12 ARG 108 11.249 -3.062 13.512 1606 1HH2 ARG 108 HH21 ARG 108 10.243 -5.573 11.226 1607 2HH2 ARG 108 HH22 ARG 108 10.446 -5.182 12.891 1608 H ALA 109 HN ALA 109 16.549 -1.019 11.551 1609 HA ALA 109 HA ALA 109 18.648 -2.630 10.884 1610 1HB ALA 109 HB1 ALA 109 19.905 -1.543 12.641 1611 2HB ALA 109 HB2 ALA 109 18.802 -0.340 11.932 1612 3HB ALA 109 HB3 ALA 109 18.421 -1.085 13.507 1613 H GLN 110 HN GLN 110 19.884 -4.183 11.878 1614 HA GLN 110 HA GLN 110 18.452 -6.350 12.846 1615 1HB GLN 110 HB2 GLN 110 20.630 -6.622 11.757 1616 2HB GLN 110 HB3 GLN 110 21.434 -5.750 13.069 1617 1HG GLN 110 HG2 GLN 110 21.858 -8.143 13.205 1618 2HG GLN 110 HG3 GLN 110 21.054 -7.531 14.637 1619 1HE2 GLN 110 HE22 GLN 110 18.751 -8.068 14.983 1620 2HE2 GLN 110 HE21 GLN 110 18.110 -9.526 14.243 1621 H GLY 111 HN GLY 111 20.442 -4.023 14.701 1622 1HA GLY 111 HA2 GLY 111 19.102 -3.301 16.673 1623 2HA GLY 111 HA3 GLY 111 19.094 -5.042 17.130 1624 H THR 112 HN THR 112 22.012 -5.025 16.098 1625 HA THR 112 HA THR 112 23.192 -4.742 18.750 1626 HB THR 112 HB THR 112 25.280 -5.385 17.719 1627 HG1 THR 112 HG1 THR 112 25.383 -5.670 15.463 1628 1HG2 THR 112 HG21 THR 112 23.121 -6.957 16.286 1629 2HG2 THR 112 HG22 THR 112 24.724 -7.520 16.814 1630 3HG2 THR 112 HG23 THR 112 23.479 -7.129 18.031 1631 H GLU 113 HN GLU 113 24.984 -3.210 19.184 1632 HA GLU 113 HA GLU 113 24.103 -0.646 18.674 1633 1HB GLU 113 HB2 GLU 113 26.926 -1.619 19.379 1634 2HB GLU 113 HB3 GLU 113 26.361 0.051 19.613 1635 1HG GLU 113 HG2 GLU 113 24.559 -0.827 21.137 1636 2HG GLU 113 HG3 GLU 113 25.262 -2.439 20.984 1637 H GLU 114 HN GLU 114 26.463 -2.577 16.929 1638 HA GLU 114 HA GLU 114 27.403 -0.450 15.231 1639 1HB GLU 114 HB2 GLU 114 28.369 -2.487 13.960 1640 2HB GLU 114 HB3 GLU 114 29.024 -2.110 15.567 1641 1HG GLU 114 HG2 GLU 114 27.548 -3.902 16.525 1642 2HG GLU 114 HG3 GLU 114 27.026 -4.273 14.862 1643 H GLU 115 HN GLU 115 24.882 -3.141 14.990 1644 HA GLU 115 HA GLU 115 24.719 -2.607 12.158 1645 1HB GLU 115 HB2 GLU 115 23.042 -4.278 14.015 1646 2HB GLU 115 HB3 GLU 115 22.713 -4.097 12.289 1647 1HG GLU 115 HG2 GLU 115 25.488 -4.942 13.206 1648 2HG GLU 115 HG3 GLU 115 24.175 -6.118 13.096 1649 H LYS 116 HN LYS 116 23.086 -1.400 15.066 1650 HA LYS 116 HA LYS 116 20.983 -0.040 13.673 1651 1HB LYS 116 HB2 LYS 116 22.326 0.628 16.333 1652 2HB LYS 116 HB3 LYS 116 20.899 1.435 15.685 1653 1HG LYS 116 HG2 LYS 116 19.890 -1.016 15.559 1654 2HG LYS 116 HG3 LYS 116 21.174 -1.382 16.697 1655 1HD LYS 116 HD2 LYS 116 19.653 -0.883 18.256 1656 2HD LYS 116 HD3 LYS 116 20.157 0.787 17.957 1657 1HE LYS 116 HE2 LYS 116 18.297 0.967 16.248 1658 2HE LYS 116 HE3 LYS 116 17.833 -0.698 16.634 1659 1HZ LYS 116 HZ1 LYS 116 17.776 1.567 18.553 1660 2HZ LYS 116 HZ2 LYS 116 16.473 0.904 17.834 1661 3HZ LYS 116 HZ3 LYS 116 17.340 0.029 18.897 1662 H TRP 117 HN TRP 117 24.183 1.192 14.776 1663 HA TRP 117 HA TRP 117 23.748 3.681 13.441 1664 1HB TRP 117 HB2 TRP 117 25.500 3.071 15.252 1665 2HB TRP 117 HB3 TRP 117 26.510 2.523 13.922 1666 HD1 TRP 117 HD1 TRP 117 25.824 5.054 11.952 1667 HE1 TRP 117 HE1 TRP 117 26.825 7.320 12.431 1668 HE3 TRP 117 HE3 TRP 117 26.904 4.378 16.920 1669 HZ2 TRP 117 HZ2 TRP 117 28.004 8.670 14.661 1670 HZ3 TRP 117 HZ3 TRP 117 28.010 6.195 18.197 1671 HH2 TRP 117 HH2 TRP 117 28.579 8.351 17.085 1672 H ALA 118 HN ALA 118 25.222 0.592 12.337 1673 HA ALA 118 HA ALA 118 26.170 1.537 9.873 1674 1HB ALA 118 HB1 ALA 118 26.781 -0.667 10.907 1675 2HB ALA 118 HB2 ALA 118 25.133 -1.236 10.624 1676 3HB ALA 118 HB3 ALA 118 26.189 -0.874 9.242 1677 H PHE 119 HN PHE 119 22.915 0.219 10.664 1678 HA PHE 119 HA PHE 119 21.981 0.326 7.952 1679 1HB PHE 119 HB2 PHE 119 20.701 0.076 10.656 1680 2HB PHE 119 HB3 PHE 119 19.693 0.638 9.348 1681 HD1 PHE 119 HD1 PHE 119 22.302 -2.099 9.718 1682 HD2 PHE 119 HD2 PHE 119 18.358 -0.982 8.350 1683 HE1 PHE 119 HE1 PHE 119 21.894 -4.421 8.972 1684 HE2 PHE 119 HE2 PHE 119 17.965 -3.299 7.606 1685 HZ PHE 119 HZ PHE 119 19.725 -5.032 7.916 1686 H PHE 120 HN PHE 120 21.828 2.681 10.697 1687 HA PHE 120 HA PHE 120 20.272 4.583 9.251 1688 1HB PHE 120 HB2 PHE 120 22.326 5.378 11.319 1689 2HB PHE 120 HB3 PHE 120 20.820 6.175 10.897 1690 HD1 PHE 120 HD1 PHE 120 21.741 5.740 13.653 1691 HD2 PHE 120 HD2 PHE 120 19.358 3.146 11.162 1692 HE1 PHE 120 HE1 PHE 120 20.747 4.690 15.669 1693 HE2 PHE 120 HE2 PHE 120 18.341 2.145 13.161 1694 HZ PHE 120 HZ PHE 120 19.033 2.909 15.430 1695 H GLN 121 HN GLN 121 23.837 4.236 9.641 1696 HA GLN 121 HA GLN 121 24.567 6.543 8.230 1697 1HB GLN 121 HB2 GLN 121 25.993 5.357 9.764 1698 2HB GLN 121 HB3 GLN 121 26.064 3.938 8.707 1699 1HG GLN 121 HG2 GLN 121 27.287 5.131 7.026 1700 2HG GLN 121 HG3 GLN 121 26.952 6.693 7.787 1701 1HE2 GLN 121 HE22 GLN 121 27.723 6.853 10.231 1702 2HE2 GLN 121 HE21 GLN 121 29.329 6.216 10.518 1703 H ARG 122 HN ARG 122 24.228 3.125 7.098 1704 HA ARG 122 HA ARG 122 25.103 3.584 4.466 1705 1HB ARG 122 HB2 ARG 122 24.814 1.334 5.394 1706 2HB ARG 122 HB3 ARG 122 23.082 1.600 5.630 1707 1HG ARG 122 HG2 ARG 122 22.747 1.700 3.166 1708 2HG ARG 122 HG3 ARG 122 24.488 1.484 2.928 1709 1HD ARG 122 HD2 ARG 122 23.338 -0.611 2.578 1710 2HD ARG 122 HD3 ARG 122 24.357 -0.737 4.008 1711 HE ARG 122 HE ARG 122 21.357 -0.424 3.967 1712 1HH1 ARG 122 HH11 ARG 122 24.229 -1.548 5.772 1713 2HH1 ARG 122 HH12 ARG 122 23.288 -2.372 6.958 1714 1HH2 ARG 122 HH21 ARG 122 20.194 -1.409 5.450 1715 2HH2 ARG 122 HH22 ARG 122 20.875 -2.265 6.819 1716 H VAL 123 HN VAL 123 21.773 3.684 5.865 1717 HA VAL 123 HA VAL 123 20.567 4.313 3.360 1718 HB VAL 123 HB VAL 123 19.583 4.534 6.226 1719 1HG1 VAL 123 HG11 VAL 123 18.268 6.090 4.972 1720 2HG1 VAL 123 HG12 VAL 123 18.097 4.966 3.600 1721 3HG1 VAL 123 HG13 VAL 123 17.287 4.640 5.138 1722 1HG2 VAL 123 HG21 VAL 123 18.966 2.540 3.984 1723 2HG2 VAL 123 HG22 VAL 123 20.055 2.218 5.341 1724 3HG2 VAL 123 HG23 VAL 123 18.342 2.482 5.643 1725 H ARG 124 HN ARG 124 21.669 6.522 6.072 1726 HA ARG 124 HA ARG 124 20.603 8.782 4.714 1727 1HB ARG 124 HB2 ARG 124 21.835 10.197 6.216 1728 2HB ARG 124 HB3 ARG 124 21.081 8.851 7.048 1729 1HG ARG 124 HG2 ARG 124 22.983 8.972 8.177 1730 2HG ARG 124 HG3 ARG 124 23.396 7.751 6.984 1731 1HD ARG 124 HD2 ARG 124 24.703 9.390 5.710 1732 2HD ARG 124 HD3 ARG 124 24.156 10.689 6.797 1733 HE ARG 124 HE ARG 124 25.218 8.900 8.534 1734 1HH1 ARG 124 HH11 ARG 124 26.584 10.429 5.615 1735 2HH1 ARG 124 HH12 ARG 124 28.208 10.387 6.183 1736 1HH2 ARG 124 HH21 ARG 124 27.375 8.873 9.306 1737 2HH2 ARG 124 HH22 ARG 124 28.672 9.478 8.324 1738 H ASP 125 HN ASP 125 23.773 7.226 4.433 1739 HA ASP 125 HA ASP 125 24.977 9.196 2.758 1740 1HB ASP 125 HB2 ASP 125 26.267 7.373 3.746 1741 2HB ASP 125 HB3 ASP 125 25.351 6.174 2.828 1742 H GLU 126 HN GLU 126 22.975 6.315 1.937 1743 HA GLU 126 HA GLU 126 23.092 6.695 -0.882 1744 1HB GLU 126 HB2 GLU 126 22.523 4.582 0.265 1745 2HB GLU 126 HB3 GLU 126 21.008 5.283 0.848 1746 1HG GLU 126 HG2 GLU 126 20.202 5.531 -1.467 1747 2HG GLU 126 HG3 GLU 126 21.758 4.971 -2.089 1748 H ILE 127 HN ILE 127 20.556 7.604 1.513 1749 HA ILE 127 HA ILE 127 18.765 8.792 -0.323 1750 HB ILE 127 HB ILE 127 19.210 9.007 2.671 1751 1HG1 ILE 127 HG12 ILE 127 16.923 7.999 0.918 1752 2HG1 ILE 127 HG13 ILE 127 18.164 6.975 1.643 1753 1HG2 ILE 127 HG21 ILE 127 17.198 10.363 2.918 1754 2HG2 ILE 127 HG22 ILE 127 18.418 11.258 2.042 1755 3HG2 ILE 127 HG23 ILE 127 17.061 10.531 1.150 1756 1HD1 ILE 127 HD11 ILE 127 16.174 6.723 2.925 1757 2HD1 ILE 127 HD12 ILE 127 17.276 7.705 3.928 1758 3HD1 ILE 127 HD13 ILE 127 15.935 8.468 3.070 1759 H GLY 128 HN GLY 128 21.402 10.352 1.640 1760 1HA GLY 128 HA2 GLY 128 20.769 12.977 0.759 1761 2HA GLY 128 HA3 GLY 128 22.331 12.417 1.427 1762 H ASN 129 HN ASN 129 23.115 10.552 -0.598 1763 HA ASN 129 HA ASN 129 24.156 12.316 -2.564 1764 1HB ASN 129 HB2 ASN 129 24.009 9.296 -2.343 1765 2HB ASN 129 HB3 ASN 129 24.510 10.038 -3.855 1766 1HD2 ASN 129 HD22 ASN 129 25.442 9.537 -0.485 1767 2HD2 ASN 129 HD21 ASN 129 27.089 10.095 -0.673 1768 H ARG 130 HN ARG 130 21.384 10.061 -2.681 1769 HA ARG 130 HA ARG 130 20.768 10.643 -5.419 1770 1HB ARG 130 HB2 ARG 130 20.007 8.626 -4.176 1771 2HB ARG 130 HB3 ARG 130 18.943 9.627 -3.191 1772 1HG ARG 130 HG2 ARG 130 17.806 8.388 -4.994 1773 2HG ARG 130 HG3 ARG 130 17.533 10.130 -5.097 1774 1HD ARG 130 HD2 ARG 130 18.896 10.338 -7.022 1775 2HD ARG 130 HD3 ARG 130 19.708 8.800 -6.741 1776 HE ARG 130 HE ARG 130 17.007 9.227 -7.886 1777 1HH1 ARG 130 HH11 ARG 130 19.396 6.845 -6.770 1778 2HH1 ARG 130 HH12 ARG 130 18.710 5.535 -7.652 1779 1HH2 ARG 130 HH22 ARG 130 16.117 7.478 -9.125 1780 2HH2 ARG 130 HH21 ARG 130 16.815 5.901 -8.991 1781 H LEU 131 HN LEU 131 19.609 12.148 -2.338 1782 HA LEU 131 HA LEU 131 17.814 13.877 -3.745 1783 1HB LEU 131 HB2 LEU 131 18.808 13.642 -0.922 1784 2HB LEU 131 HB3 LEU 131 18.329 15.254 -1.402 1785 HG LEU 131 HG LEU 131 16.456 14.055 -0.357 1786 1HD1 LEU 131 HD11 LEU 131 14.768 14.642 -2.019 1787 2HD1 LEU 131 HD12 LEU 131 16.100 15.788 -2.190 1788 3HD1 LEU 131 HD13 LEU 131 15.904 14.464 -3.339 1789 1HD2 LEU 131 HD21 LEU 131 15.380 12.157 -1.461 1790 2HD2 LEU 131 HD22 LEU 131 16.651 12.111 -2.692 1791 3HD2 LEU 131 HD23 LEU 131 17.036 11.768 -0.996 1792 H LYS 132 HN LYS 132 21.259 14.237 -2.883 1793 HA LYS 132 HA LYS 132 21.397 16.973 -3.690 1794 1HB LYS 132 HB2 LYS 132 23.027 15.625 -2.306 1795 2HB LYS 132 HB3 LYS 132 23.520 14.767 -3.776 1796 1HG LYS 132 HG2 LYS 132 24.244 16.969 -4.745 1797 2HG LYS 132 HG3 LYS 132 23.819 17.749 -3.211 1798 1HD LYS 132 HD2 LYS 132 25.838 15.504 -3.583 1799 2HD LYS 132 HD3 LYS 132 26.238 17.226 -3.377 1800 1HE LYS 132 HE2 LYS 132 25.188 17.156 -1.111 1801 2HE LYS 132 HE3 LYS 132 24.891 15.426 -1.315 1802 1HZ LYS 132 HZ1 LYS 132 27.572 16.696 -1.300 1803 2HZ LYS 132 HZ2 LYS 132 26.929 15.827 -0.081 1804 3HZ LYS 132 HZ3 LYS 132 27.292 15.098 -1.491 1805 H GLU 133 HN GLU 133 21.842 13.843 -5.547 1806 HA GLU 133 HA GLU 133 22.169 15.191 -8.053 1807 1HB GLU 133 HB2 GLU 133 21.266 12.403 -7.268 1808 2HB GLU 133 HB3 GLU 133 20.886 12.990 -8.906 1809 1HG GLU 133 HG2 GLU 133 23.169 13.474 -9.385 1810 2HG GLU 133 HG3 GLU 133 23.683 13.054 -7.738 1811 H PHE 134 HN PHE 134 19.115 14.333 -6.280 1812 HA PHE 134 HA PHE 134 17.462 15.002 -8.457 1813 1HB PHE 134 HB2 PHE 134 16.592 13.942 -6.471 1814 2HB PHE 134 HB3 PHE 134 17.031 15.324 -5.476 1815 HD1 PHE 134 HD1 PHE 134 15.054 16.177 -4.599 1816 HD2 PHE 134 HD2 PHE 134 15.276 15.288 -8.790 1817 HE1 PHE 134 HE1 PHE 134 12.730 17.001 -4.900 1818 HE2 PHE 134 HE2 PHE 134 12.951 16.109 -9.103 1819 HZ PHE 134 HZ PHE 134 11.667 16.939 -7.141 1820 H ALA 135 HN ALA 135 18.943 17.139 -6.024 1821 HA ALA 135 HA ALA 135 17.821 19.569 -6.904 1822 1HB ALA 135 HB1 ALA 135 19.249 19.190 -4.827 1823 2HB ALA 135 HB2 ALA 135 20.672 19.261 -5.883 1824 3HB ALA 135 HB3 ALA 135 19.598 20.665 -5.759 1825 H GLU 136 HN GLU 136 20.495 17.713 -8.299 1826 HA GLU 136 HA GLU 136 21.311 19.852 -10.074 1827 1HB GLU 136 HB2 GLU 136 22.214 16.948 -9.981 1828 2HB GLU 136 HB3 GLU 136 22.930 18.232 -10.956 1829 1HG GLU 136 HG2 GLU 136 23.410 19.466 -8.767 1830 2HG GLU 136 HG3 GLU 136 22.936 17.977 -7.939 1831 H THR 137 HN THR 137 19.792 16.704 -10.315 1832 HA THR 137 HA THR 137 19.579 16.688 -13.200 1833 HB THR 137 HB THR 137 18.660 14.430 -12.778 1834 HG1 THR 137 HG1 THR 137 18.985 14.934 -10.046 1835 1HG2 THR 137 HG21 THR 137 20.588 13.455 -11.612 1836 2HG2 THR 137 HG22 THR 137 21.062 14.646 -12.836 1837 3HG2 THR 137 HG23 THR 137 21.131 15.077 -11.126 1838 H GLY 138 HN GLY 138 17.434 17.541 -10.532 1839 1HA GLY 138 HA2 GLY 138 15.235 18.051 -10.388 1840 2HA GLY 138 HA3 GLY 138 15.275 18.552 -12.103 1841 H LYS 139 HN LYS 139 16.229 15.366 -11.044 1842 HA LYS 139 HA LYS 139 15.779 13.440 -12.047 1843 1HB LYS 139 HB2 LYS 139 14.378 13.673 -9.832 1844 2HB LYS 139 HB3 LYS 139 12.994 13.575 -10.907 1845 1HG LYS 139 HG2 LYS 139 13.511 11.353 -10.244 1846 2HG LYS 139 HG3 LYS 139 14.101 11.495 -11.898 1847 1HD LYS 139 HD2 LYS 139 16.184 12.284 -9.944 1848 2HD LYS 139 HD3 LYS 139 15.565 10.686 -9.571 1849 1HE LYS 139 HE2 LYS 139 16.797 11.592 -12.210 1850 2HE LYS 139 HE3 LYS 139 17.558 10.601 -10.969 1851 1HZ LYS 139 HZ1 LYS 139 15.696 8.963 -11.375 1852 2HZ LYS 139 HZ2 LYS 139 15.293 9.816 -12.696 1853 3HZ LYS 139 HZ3 LYS 139 16.770 9.127 -12.615
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