NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
16716 | 2ami | 6820 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H ARG 1 H ARG 1 13.366 8.218 -5.651 2 HA ARG 1 HA ARG 1 11.820 9.471 -4.327 3 1HB ARG 1 1HB ARG 1 13.377 11.150 -3.567 4 2HB ARG 1 2HB ARG 1 14.254 9.695 -4.027 5 1HG ARG 1 1HG ARG 1 15.627 11.157 -5.090 6 2HG ARG 1 2HG ARG 1 14.441 11.055 -6.390 7 1HD ARG 1 1HD ARG 1 13.276 13.086 -5.207 8 2HD ARG 1 2HD ARG 1 14.718 13.173 -4.216 9 HE ARG 1 HE ARG 1 15.927 14.024 -5.980 10 1HH1 ARG 1 1HH1 ARG 1 12.897 12.690 -7.327 11 2HH1 ARG 1 2HH1 ARG 1 12.808 13.929 -8.561 12 1HH2 ARG 1 1HH2 ARG 1 15.939 15.367 -7.898 13 2HH2 ARG 1 2HH2 ARG 1 14.694 15.133 -9.082 14 H VAL 2 H VAL 2 10.417 11.304 -4.111 15 HA VAL 2 HA VAL 2 9.573 12.470 -6.654 16 HB VAL 2 HB VAL 2 7.877 13.636 -5.326 17 1HG1 VAL 2 1HG1 VAL 2 8.043 10.645 -4.765 18 2HG1 VAL 2 2HG1 VAL 2 6.576 11.642 -4.763 19 3HG1 VAL 2 3HG1 VAL 2 7.469 11.392 -6.271 20 1HG2 VAL 2 1HG2 VAL 2 7.487 13.055 -2.970 21 2HG2 VAL 2 2HG2 VAL 2 9.010 12.156 -2.902 22 3HG2 VAL 2 3HG2 VAL 2 9.015 13.916 -3.151 23 H GLY 3 H GLY 3 10.244 14.426 -7.493 24 1HA GLY 3 1HA GLY 3 10.856 16.752 -6.220 25 2HA GLY 3 2HA GLY 3 12.379 15.848 -6.107 26 H LEU 4 H LEU 4 11.961 18.285 -7.525 27 HA LEU 4 HA LEU 4 12.666 17.501 -10.321 28 1HB LEU 4 1HB LEU 4 11.208 19.999 -9.393 29 2HB LEU 4 2HB LEU 4 11.780 19.650 -11.028 30 HG LEU 4 HG LEU 4 9.545 18.204 -9.542 31 1HD1 LEU 4 1HD1 LEU 4 9.698 20.041 -11.965 32 2HD1 LEU 4 2HD1 LEU 4 8.225 19.211 -11.434 33 3HD1 LEU 4 3HD1 LEU 4 8.987 20.429 -10.386 34 1HD2 LEU 4 1HD2 LEU 4 10.601 16.521 -10.925 35 2HD2 LEU 4 2HD2 LEU 4 9.169 17.078 -11.782 36 3HD2 LEU 4 3HD2 LEU 4 10.772 17.658 -12.283 37 H THR 5 H THR 5 14.833 17.351 -9.899 38 HA THR 5 HA THR 5 16.327 19.488 -8.757 39 HB THR 5 HB THR 5 17.513 17.739 -10.923 40 HG1 THR 5 HG1 THR 5 16.355 16.168 -9.987 41 1HG2 THR 5 1HG2 THR 5 18.267 18.409 -8.056 42 2HG2 THR 5 2HG2 THR 5 19.278 17.522 -9.219 43 3HG2 THR 5 3HG2 THR 5 18.909 19.238 -9.500 44 H GLU 6 H GLU 6 17.747 20.980 -9.977 45 HA GLU 6 HA GLU 6 16.478 22.671 -11.725 46 1HB GLU 6 1HB GLU 6 19.469 22.069 -11.546 47 2HB GLU 6 2HB GLU 6 18.758 23.472 -12.356 48 1HG GLU 6 1HG GLU 6 17.714 24.198 -10.221 49 2HG GLU 6 2HG GLU 6 18.461 22.832 -9.378 50 H GLU 7 H GLU 7 18.553 19.902 -12.682 51 HA GLU 7 HA GLU 7 18.459 20.315 -15.470 52 1HB GLU 7 1HB GLU 7 18.572 17.673 -13.923 53 2HB GLU 7 2HB GLU 7 18.887 17.886 -15.641 54 1HG GLU 7 1HG GLU 7 21.015 17.803 -14.631 55 2HG GLU 7 2HG GLU 7 20.753 19.492 -15.075 56 H GLN 8 H GLN 8 16.136 18.627 -13.325 57 HA GLN 8 HA GLN 8 14.448 17.641 -15.469 58 1HB GLN 8 1HB GLN 8 13.817 18.153 -12.538 59 2HB GLN 8 2HB GLN 8 12.786 17.301 -13.685 60 1HG GLN 8 1HG GLN 8 14.346 15.472 -13.893 61 2HG GLN 8 2HG GLN 8 15.608 16.363 -13.029 62 1HE2 GLN 8 1HE2 GLN 8 12.197 15.226 -12.500 63 2HE2 GLN 8 2HE2 GLN 8 12.411 15.040 -10.760 64 H LYS 9 H LYS 9 14.512 20.546 -13.349 65 HA LYS 9 HA LYS 9 12.079 21.688 -14.330 66 1HB LYS 9 1HB LYS 9 14.530 23.038 -13.147 67 2HB LYS 9 2HB LYS 9 12.968 23.814 -13.452 68 1HG LYS 9 1HG LYS 9 11.833 22.291 -11.912 69 2HG LYS 9 2HG LYS 9 13.293 21.330 -11.702 70 1HD LYS 9 1HD LYS 9 12.894 22.770 -9.771 71 2HD LYS 9 2HD LYS 9 14.445 23.077 -10.542 72 1HE LYS 9 1HE LYS 9 13.325 25.168 -9.867 73 2HE LYS 9 2HE LYS 9 13.589 25.107 -11.612 74 1HZ LYS 9 1HZ LYS 9 11.294 24.452 -11.863 75 2HZ LYS 9 2HZ LYS 9 11.062 24.486 -10.232 76 3HZ LYS 9 3HZ LYS 9 11.395 25.879 -11.047 77 H GLN 10 H GLN 10 15.461 22.030 -15.467 78 HA GLN 10 HA GLN 10 14.947 23.824 -17.619 79 1HB GLN 10 1HB GLN 10 17.076 21.679 -17.261 80 2HB GLN 10 2HB GLN 10 17.044 22.827 -18.603 81 1HG GLN 10 1HG GLN 10 17.308 24.715 -17.118 82 2HG GLN 10 2HG GLN 10 17.061 23.716 -15.688 83 1HE2 GLN 10 1HE2 GLN 10 19.253 23.893 -18.569 84 2HE2 GLN 10 2HE2 GLN 10 20.679 23.425 -17.658 85 H GLU 11 H GLU 11 15.053 20.202 -17.588 86 HA GLU 11 HA GLU 11 14.299 19.794 -20.274 87 1HB GLU 11 1HB GLU 11 13.666 18.162 -17.785 88 2HB GLU 11 2HB GLU 11 13.330 17.615 -19.428 89 1HG GLU 11 1HG GLU 11 15.648 17.588 -20.023 90 2HG GLU 11 2HG GLU 11 16.131 18.445 -18.561 91 H ILE 12 H ILE 12 12.154 20.127 -17.414 92 HA ILE 12 HA ILE 12 9.675 19.950 -18.758 93 HB ILE 12 HB ILE 12 10.561 21.309 -16.199 94 1HG1 ILE 12 1HG1 ILE 12 8.808 18.853 -16.651 95 2HG1 ILE 12 2HG1 ILE 12 10.559 18.737 -16.530 96 1HG2 ILE 12 1HG2 ILE 12 8.530 22.512 -16.983 97 2HG2 ILE 12 2HG2 ILE 12 7.696 20.953 -17.144 98 3HG2 ILE 12 3HG2 ILE 12 8.205 21.545 -15.557 99 1HD1 ILE 12 1HD1 ILE 12 8.715 19.761 -14.339 100 2HD1 ILE 12 2HD1 ILE 12 9.590 18.226 -14.392 101 3HD1 ILE 12 3HD1 ILE 12 10.493 19.749 -14.270 102 H ARG 13 H ARG 13 11.707 22.849 -18.096 103 HA ARG 13 HA ARG 13 9.945 24.717 -19.340 104 1HB ARG 13 1HB ARG 13 11.809 25.136 -17.738 105 2HB ARG 13 2HB ARG 13 12.959 24.931 -19.054 106 1HG ARG 13 1HG ARG 13 10.648 26.954 -19.093 107 2HG ARG 13 2HG ARG 13 12.209 27.314 -18.358 108 1HD ARG 13 1HD ARG 13 11.757 26.589 -21.256 109 2HD ARG 13 2HD ARG 13 12.109 28.199 -20.634 110 HE ARG 13 HE ARG 13 14.220 26.938 -19.642 111 1HH1 ARG 13 1HH1 ARG 13 12.942 26.831 -22.956 112 2HH1 ARG 13 2HH1 ARG 13 14.405 26.170 -23.630 113 1HH2 ARG 13 1HH2 ARG 13 16.157 26.208 -20.541 114 2HH2 ARG 13 2HH2 ARG 13 16.256 25.796 -22.235 115 H GLU 14 H GLU 14 12.747 22.934 -20.749 116 HA GLU 14 HA GLU 14 12.472 23.969 -23.377 117 1HB GLU 14 1HB GLU 14 13.391 21.219 -22.430 118 2HB GLU 14 2HB GLU 14 13.577 21.800 -24.083 119 1HG GLU 14 1HG GLU 14 14.789 23.231 -21.671 120 2HG GLU 14 2HG GLU 14 15.621 21.975 -22.591 121 H ALA 15 H ALA 15 11.028 21.008 -21.951 122 HA ALA 15 HA ALA 15 9.539 20.176 -24.194 123 1HB ALA 15 1HB ALA 15 9.893 18.791 -22.188 124 2HB ALA 15 2HB ALA 15 8.855 19.874 -21.237 125 3HB ALA 15 3HB ALA 15 8.166 18.933 -22.575 126 H PHE 16 H PHE 16 8.591 22.347 -21.504 127 HA PHE 16 HA PHE 16 5.975 22.903 -22.277 128 1HB PHE 16 1HB PHE 16 6.929 23.624 -20.145 129 2HB PHE 16 2HB PHE 16 8.023 24.726 -20.952 130 HD1 PHE 16 HD1 PHE 16 7.364 26.954 -21.534 131 HD2 PHE 16 HD2 PHE 16 4.404 24.048 -20.375 132 HE1 PHE 16 HE1 PHE 16 5.625 28.719 -21.540 133 HE2 PHE 16 HE2 PHE 16 2.683 25.824 -20.314 134 HZ PHE 16 HZ PHE 16 3.302 28.172 -20.888 135 H ASP 17 H ASP 17 8.957 24.722 -23.103 136 HA ASP 17 HA ASP 17 7.775 26.627 -24.821 137 1HB ASP 17 1HB ASP 17 10.573 25.405 -24.909 138 2HB ASP 17 2HB ASP 17 10.055 26.815 -25.838 139 H LEU 18 H LEU 18 9.237 23.443 -25.651 140 HA LEU 18 HA LEU 18 8.765 23.583 -28.433 141 1HB LEU 18 1HB LEU 18 10.195 21.931 -27.396 142 2HB LEU 18 2HB LEU 18 8.834 21.138 -26.603 143 HG LEU 18 HG LEU 18 8.748 21.464 -29.614 144 1HD1 LEU 18 1HD1 LEU 18 11.029 20.679 -29.199 145 2HD1 LEU 18 2HD1 LEU 18 10.400 19.355 -28.184 146 3HD1 LEU 18 3HD1 LEU 18 10.033 19.406 -29.925 147 1HD2 LEU 18 1HD2 LEU 18 7.880 19.234 -27.703 148 2HD2 LEU 18 2HD2 LEU 18 6.802 20.361 -28.551 149 3HD2 LEU 18 3HD2 LEU 18 7.722 19.177 -29.467 150 H PHE 19 H PHE 19 6.689 22.119 -25.867 151 HA PHE 19 HA PHE 19 4.598 21.396 -27.643 152 1HB PHE 19 1HB PHE 19 4.518 22.109 -24.692 153 2HB PHE 19 2HB PHE 19 3.183 21.353 -25.567 154 HD1 PHE 19 HD1 PHE 19 4.973 19.330 -27.214 155 HD2 PHE 19 HD2 PHE 19 4.617 20.359 -23.033 156 HE1 PHE 19 HE1 PHE 19 5.587 17.044 -26.606 157 HE2 PHE 19 HE2 PHE 19 5.083 17.998 -22.440 158 HZ PHE 19 HZ PHE 19 5.678 16.357 -24.212 159 H ASP 20 H ASP 20 5.202 24.478 -25.935 160 HA ASP 20 HA ASP 20 2.774 25.687 -27.023 161 1HB ASP 20 1HB ASP 20 3.831 26.503 -24.933 162 2HB ASP 20 2HB ASP 20 5.257 26.991 -25.859 163 H THR 21 H THR 21 3.576 24.504 -29.146 164 HA THR 21 HA THR 21 5.550 25.552 -30.823 165 HB THR 21 HB THR 21 4.125 24.686 -32.680 166 HG1 THR 21 HG1 THR 21 2.219 24.574 -30.601 167 1HG2 THR 21 1HG2 THR 21 4.143 22.351 -32.015 168 2HG2 THR 21 2HG2 THR 21 5.593 23.143 -31.375 169 3HG2 THR 21 3HG2 THR 21 4.229 22.778 -30.300 170 H ASP 22 H ASP 22 2.272 26.781 -30.181 171 HA ASP 22 HA ASP 22 2.240 28.784 -32.221 172 1HB ASP 22 1HB ASP 22 0.237 27.951 -31.033 173 2HB ASP 22 2HB ASP 22 0.816 28.683 -29.527 174 H GLY 23 H GLY 23 3.955 28.648 -29.153 175 1HA GLY 23 1HA GLY 23 5.241 30.155 -28.048 176 2HA GLY 23 2HA GLY 23 5.263 31.158 -29.508 177 H SER 24 H SER 24 2.234 30.193 -27.805 178 HA SER 24 HA SER 24 1.332 32.883 -27.613 179 1HB SER 24 1HB SER 24 -0.235 31.315 -25.897 180 2HB SER 24 2HB SER 24 -0.487 31.609 -27.618 181 HG SER 24 HG SER 24 0.499 29.314 -26.379 182 H GLY 25 H GLY 25 3.249 30.883 -25.524 183 1HA GLY 25 1HA GLY 25 4.452 31.709 -23.613 184 2HA GLY 25 2HA GLY 25 3.163 32.878 -23.287 185 H THR 26 H THR 26 1.334 30.407 -24.219 186 HA THR 26 HA THR 26 1.361 28.761 -21.774 187 HB THR 26 HB THR 26 -0.966 29.101 -21.458 188 HG1 THR 26 HG1 THR 26 -2.119 30.513 -22.661 189 1HG2 THR 26 1HG2 THR 26 0.641 30.699 -20.311 190 2HG2 THR 26 2HG2 THR 26 0.281 31.873 -21.586 191 3HG2 THR 26 3HG2 THR 26 -1.012 31.307 -20.517 192 H ILE 27 H ILE 27 0.589 26.681 -22.194 193 HA ILE 27 HA ILE 27 0.636 25.819 -25.019 194 HB ILE 27 HB ILE 27 0.364 24.379 -22.371 195 1HG1 ILE 27 1HG1 ILE 27 2.570 24.413 -24.480 196 2HG1 ILE 27 2HG1 ILE 27 2.596 25.354 -22.984 197 1HG2 ILE 27 1HG2 ILE 27 0.633 23.084 -25.110 198 2HG2 ILE 27 2HG2 ILE 27 0.449 22.266 -23.549 199 3HG2 ILE 27 3HG2 ILE 27 -0.898 23.158 -24.206 200 1HD1 ILE 27 1HD1 ILE 27 2.423 23.223 -21.680 201 2HD1 ILE 27 2HD1 ILE 27 2.592 22.319 -23.206 202 3HD1 ILE 27 3HD1 ILE 27 3.893 23.378 -22.668 203 H ASP 28 H ASP 28 -1.299 25.995 -26.193 204 HA ASP 28 HA ASP 28 -3.871 26.312 -24.889 205 1HB ASP 28 1HB ASP 28 -3.423 27.200 -27.140 206 2HB ASP 28 2HB ASP 28 -3.188 25.555 -27.755 207 H ALA 29 H ALA 29 -5.532 24.787 -24.538 208 HA ALA 29 HA ALA 29 -5.146 22.226 -23.813 209 1HB ALA 29 1HB ALA 29 -7.294 23.385 -23.665 210 2HB ALA 29 2HB ALA 29 -7.514 23.263 -25.425 211 3HB ALA 29 3HB ALA 29 -7.507 21.795 -24.425 212 H LYS 30 H LYS 30 -5.665 23.158 -27.264 213 HA LYS 30 HA LYS 30 -5.637 20.500 -28.317 214 1HB LYS 30 1HB LYS 30 -4.848 23.151 -29.593 215 2HB LYS 30 2HB LYS 30 -5.101 21.629 -30.463 216 1HG LYS 30 1HG LYS 30 -7.447 21.545 -29.726 217 2HG LYS 30 2HG LYS 30 -7.240 23.037 -28.791 218 1HD LYS 30 1HD LYS 30 -6.662 24.272 -30.861 219 2HD LYS 30 2HD LYS 30 -6.895 22.789 -31.812 220 1HE LYS 30 1HE LYS 30 -9.271 22.691 -31.058 221 2HE LYS 30 2HE LYS 30 -9.029 24.174 -30.112 222 1HZ LYS 30 1HZ LYS 30 -8.539 25.319 -32.148 223 2HZ LYS 30 2HZ LYS 30 -8.765 23.943 -33.028 224 3HZ LYS 30 3HZ LYS 30 -10.029 24.620 -32.217 225 H GLU 31 H GLU 31 -3.003 22.853 -27.692 226 HA GLU 31 HA GLU 31 -0.902 21.259 -28.890 227 1HB GLU 31 1HB GLU 31 -0.821 23.495 -26.827 228 2HB GLU 31 2HB GLU 31 0.589 22.740 -27.575 229 1HG GLU 31 1HG GLU 31 -0.133 23.497 -29.797 230 2HG GLU 31 2HG GLU 31 -1.588 24.230 -29.105 231 H LEU 32 H LEU 32 -2.362 21.562 -25.622 232 HA LEU 32 HA LEU 32 -0.513 19.789 -24.364 233 1HB LEU 32 1HB LEU 32 -2.287 21.338 -23.244 234 2HB LEU 32 2HB LEU 32 -3.413 20.006 -23.536 235 HG LEU 32 HG LEU 32 -1.654 18.504 -22.319 236 1HD1 LEU 32 1HD1 LEU 32 -0.692 21.253 -21.420 237 2HD1 LEU 32 2HD1 LEU 32 -0.276 19.715 -20.643 238 3HD1 LEU 32 3HD1 LEU 32 0.266 20.032 -22.288 239 1HD2 LEU 32 1HD2 LEU 32 -3.258 20.640 -20.870 240 2HD2 LEU 32 2HD2 LEU 32 -3.803 19.016 -21.342 241 3HD2 LEU 32 3HD2 LEU 32 -2.558 19.203 -20.095 242 H LYS 33 H LYS 33 -3.650 19.175 -26.015 243 HA LYS 33 HA LYS 33 -3.684 16.352 -25.661 244 1HB LYS 33 1HB LYS 33 -5.568 17.618 -26.371 245 2HB LYS 33 2HB LYS 33 -4.822 18.081 -27.887 246 1HG LYS 33 1HG LYS 33 -5.364 15.188 -27.075 247 2HG LYS 33 2HG LYS 33 -6.565 16.189 -27.875 248 1HD LYS 33 1HD LYS 33 -3.921 15.242 -29.062 249 2HD LYS 33 2HD LYS 33 -5.547 14.772 -29.510 250 1HE LYS 33 1HE LYS 33 -4.269 17.507 -29.951 251 2HE LYS 33 2HE LYS 33 -4.677 16.298 -31.166 252 1HZ LYS 33 1HZ LYS 33 -6.597 17.736 -29.479 253 2HZ LYS 33 2HZ LYS 33 -6.308 18.008 -31.077 254 3HZ LYS 33 3HZ LYS 33 -6.985 16.586 -30.595 255 H VAL 34 H VAL 34 -2.192 18.311 -28.312 256 HA VAL 34 HA VAL 34 -1.018 16.103 -29.671 257 HB VAL 34 HB VAL 34 -0.101 18.995 -29.398 258 1HG1 VAL 34 1HG1 VAL 34 1.901 17.705 -29.944 259 2HG1 VAL 34 2HG1 VAL 34 1.014 16.806 -31.197 260 3HG1 VAL 34 3HG1 VAL 34 1.332 18.542 -31.389 261 1HG2 VAL 34 1HG2 VAL 34 -2.253 18.620 -30.600 262 2HG2 VAL 34 2HG2 VAL 34 -0.982 19.176 -31.693 263 3HG2 VAL 34 3HG2 VAL 34 -1.444 17.462 -31.671 264 H ALA 35 H ALA 35 0.315 18.064 -26.958 265 HA ALA 35 HA ALA 35 2.768 16.729 -26.684 266 1HB ALA 35 1HB ALA 35 2.195 18.785 -25.461 267 2HB ALA 35 2HB ALA 35 1.018 17.902 -24.474 268 3HB ALA 35 3HB ALA 35 2.721 17.500 -24.350 269 H MET 36 H MET 36 -0.400 15.925 -25.174 270 HA MET 36 HA MET 36 0.557 13.589 -23.838 271 1HB MET 36 1HB MET 36 -2.193 14.562 -24.596 272 2HB MET 36 2HB MET 36 -1.931 13.039 -23.736 273 1HG MET 36 1HG MET 36 -0.603 14.213 -21.998 274 2HG MET 36 2HG MET 36 -0.903 15.752 -22.796 275 1HE MET 36 1HE MET 36 -3.138 16.868 -22.978 276 2HE MET 36 2HE MET 36 -4.035 15.442 -23.549 277 3HE MET 36 3HE MET 36 -4.637 16.378 -22.154 278 H ARG 37 H ARG 37 -0.755 13.992 -27.147 279 HA ARG 37 HA ARG 37 -0.522 11.169 -27.723 280 1HB ARG 37 1HB ARG 37 -0.450 13.620 -29.537 281 2HB ARG 37 2HB ARG 37 -0.283 11.972 -30.134 282 1HG ARG 37 1HG ARG 37 -2.708 13.081 -28.655 283 2HG ARG 37 2HG ARG 37 -2.570 12.687 -30.381 284 1HD ARG 37 1HD ARG 37 -1.869 10.296 -29.487 285 2HD ARG 37 2HD ARG 37 -2.682 10.831 -27.998 286 HE ARG 37 HE ARG 37 -4.400 11.295 -30.211 287 1HH1 ARG 37 1HH1 ARG 37 -3.090 8.635 -28.237 288 2HH1 ARG 37 2HH1 ARG 37 -4.094 7.424 -28.983 289 1HH2 ARG 37 1HH2 ARG 37 -5.859 9.732 -31.019 290 2HH2 ARG 37 2HH2 ARG 37 -5.788 8.078 -30.477 291 H ALA 38 H ALA 38 1.892 13.823 -27.955 292 HA ALA 38 HA ALA 38 3.984 12.154 -28.942 293 1HB ALA 38 1HB ALA 38 4.296 14.567 -27.113 294 2HB ALA 38 2HB ALA 38 5.516 13.846 -28.170 295 3HB ALA 38 3HB ALA 38 4.090 14.632 -28.876 296 H LEU 39 H LEU 39 2.820 12.733 -25.621 297 HA LEU 39 HA LEU 39 4.746 10.969 -24.354 298 1HB LEU 39 1HB LEU 39 2.036 11.971 -23.420 299 2HB LEU 39 2HB LEU 39 3.196 11.126 -22.416 300 HG LEU 39 HG LEU 39 3.882 13.774 -23.756 301 1HD1 LEU 39 1HD1 LEU 39 3.407 14.818 -21.548 302 2HD1 LEU 39 2HD1 LEU 39 1.941 14.189 -22.294 303 3HD1 LEU 39 3HD1 LEU 39 2.716 13.283 -20.983 304 1HD2 LEU 39 1HD2 LEU 39 5.085 12.271 -21.394 305 2HD2 LEU 39 2HD2 LEU 39 5.816 12.444 -23.005 306 3HD2 LEU 39 3HD2 LEU 39 5.596 13.866 -21.981 307 H GLY 40 H GLY 40 2.343 10.157 -26.537 308 1HA GLY 40 1HA GLY 40 1.683 8.107 -27.233 309 2HA GLY 40 2HA GLY 40 2.590 7.359 -25.912 310 H PHE 41 H PHE 41 0.164 9.841 -25.198 311 HA PHE 41 HA PHE 41 -1.376 7.889 -23.640 312 1HB PHE 41 1HB PHE 41 -1.785 10.834 -24.208 313 2HB PHE 41 2HB PHE 41 -2.788 9.893 -23.124 314 HD1 PHE 41 HD1 PHE 41 -2.200 11.920 -21.656 315 HD2 PHE 41 HD2 PHE 41 0.620 8.787 -22.633 316 HE1 PHE 41 HE1 PHE 41 -0.755 12.605 -19.767 317 HE2 PHE 41 HE2 PHE 41 2.025 9.470 -20.758 318 HZ PHE 41 HZ PHE 41 1.372 11.396 -19.322 319 H GLU 42 H GLU 42 -3.732 7.814 -23.799 320 HA GLU 42 HA GLU 42 -4.863 8.029 -26.562 321 1HB GLU 42 1HB GLU 42 -4.602 5.711 -25.803 322 2HB GLU 42 2HB GLU 42 -5.535 6.072 -24.343 323 1HG GLU 42 1HG GLU 42 -7.513 6.640 -25.763 324 2HG GLU 42 2HG GLU 42 -6.554 6.309 -27.215 325 HA PRO 43 HA PRO 43 -6.738 11.300 -23.920 326 1HB PRO 43 1HB PRO 43 -7.743 11.975 -26.701 327 2HB PRO 43 2HB PRO 43 -7.236 13.107 -25.416 328 1HG PRO 43 1HG PRO 43 -5.528 12.524 -27.424 329 2HG PRO 43 2HG PRO 43 -4.922 12.529 -25.740 330 1HD PRO 43 1HD PRO 43 -5.757 10.156 -27.435 331 2HD PRO 43 2HD PRO 43 -4.318 10.355 -26.387 332 H LYS 44 H LYS 44 -8.766 11.392 -23.001 333 HA LYS 44 HA LYS 44 -11.112 10.235 -24.378 334 1HB LYS 44 1HB LYS 44 -10.379 9.643 -21.476 335 2HB LYS 44 2HB LYS 44 -11.816 9.093 -22.364 336 1HG LYS 44 1HG LYS 44 -10.310 7.885 -23.966 337 2HG LYS 44 2HG LYS 44 -8.927 8.376 -22.970 338 1HD LYS 44 1HD LYS 44 -9.797 7.134 -21.042 339 2HD LYS 44 2HD LYS 44 -11.241 6.679 -21.964 340 1HE LYS 44 1HE LYS 44 -9.634 4.826 -21.987 341 2HE LYS 44 2HE LYS 44 -9.809 5.484 -23.620 342 1HZ LYS 44 1HZ LYS 44 -7.766 6.735 -23.226 343 2HZ LYS 44 2HZ LYS 44 -7.606 6.017 -21.751 344 3HZ LYS 44 3HZ LYS 44 -7.551 5.108 -23.131 345 H LYS 45 H LYS 45 -12.545 11.838 -24.458 346 HA LYS 45 HA LYS 45 -12.093 14.375 -23.850 347 1HB LYS 45 1HB LYS 45 -14.478 14.843 -24.152 348 2HB LYS 45 2HB LYS 45 -13.791 13.724 -25.329 349 1HG LYS 45 1HG LYS 45 -14.834 11.800 -23.985 350 2HG LYS 45 2HG LYS 45 -15.625 13.036 -22.994 351 1HD LYS 45 1HD LYS 45 -17.210 12.335 -24.577 352 2HD LYS 45 2HD LYS 45 -16.712 13.971 -25.035 353 1HE LYS 45 1HE LYS 45 -15.277 13.039 -26.834 354 2HE LYS 45 2HE LYS 45 -15.646 11.389 -26.294 355 1HZ LYS 45 1HZ LYS 45 -17.929 11.796 -26.851 356 2HZ LYS 45 2HZ LYS 45 -17.582 13.331 -27.339 357 3HZ LYS 45 3HZ LYS 45 -16.959 12.045 -28.159 358 H GLU 46 H GLU 46 -14.175 12.469 -21.629 359 HA GLU 46 HA GLU 46 -14.524 14.592 -19.803 360 1HB GLU 46 1HB GLU 46 -15.437 13.003 -18.271 361 2HB GLU 46 2HB GLU 46 -16.003 12.666 -19.904 362 1HG GLU 46 1HG GLU 46 -13.981 11.080 -18.273 363 2HG GLU 46 2HG GLU 46 -15.581 10.576 -18.806 364 H GLU 47 H GLU 47 -12.138 11.898 -19.664 365 HA GLU 47 HA GLU 47 -10.895 12.676 -17.226 366 1HB GLU 47 1HB GLU 47 -9.871 11.185 -19.675 367 2HB GLU 47 2HB GLU 47 -8.914 11.402 -18.205 368 1HG GLU 47 1HG GLU 47 -10.460 10.155 -16.865 369 2HG GLU 47 2HG GLU 47 -11.681 10.134 -18.138 370 H ILE 48 H ILE 48 -10.096 13.464 -20.622 371 HA ILE 48 HA ILE 48 -7.851 15.139 -20.157 372 HB ILE 48 HB ILE 48 -9.970 15.039 -22.329 373 1HG1 ILE 48 1HG1 ILE 48 -8.301 13.118 -21.975 374 2HG1 ILE 48 2HG1 ILE 48 -8.464 13.803 -23.592 375 1HG2 ILE 48 1HG2 ILE 48 -7.509 16.809 -22.247 376 2HG2 ILE 48 2HG2 ILE 48 -8.393 16.393 -23.736 377 3HG2 ILE 48 3HG2 ILE 48 -9.205 17.295 -22.456 378 1HD1 ILE 48 1HD1 ILE 48 -6.238 14.539 -21.637 379 2HD1 ILE 48 2HD1 ILE 48 -6.098 13.337 -22.926 380 3HD1 ILE 48 3HD1 ILE 48 -6.377 15.030 -23.344 381 H LYS 49 H LYS 49 -11.335 16.083 -20.514 382 HA LYS 49 HA LYS 49 -10.976 18.806 -20.087 383 1HB LYS 49 1HB LYS 49 -13.022 17.626 -20.922 384 2HB LYS 49 2HB LYS 49 -13.356 17.077 -19.269 385 1HG LYS 49 1HG LYS 49 -13.456 19.471 -18.546 386 2HG LYS 49 2HG LYS 49 -13.135 19.956 -20.227 387 1HD LYS 49 1HD LYS 49 -15.223 18.799 -20.948 388 2HD LYS 49 2HD LYS 49 -15.536 18.322 -19.266 389 1HE LYS 49 1HE LYS 49 -15.651 20.723 -18.606 390 2HE LYS 49 2HE LYS 49 -15.344 21.198 -20.288 391 1HZ LYS 49 1HZ LYS 49 -17.371 20.093 -20.900 392 2HZ LYS 49 2HZ LYS 49 -17.656 19.657 -19.336 393 3HZ LYS 49 3HZ LYS 49 -17.659 21.249 -19.762 394 H LYS 50 H LYS 50 -11.708 16.227 -17.662 395 HA LYS 50 HA LYS 50 -11.826 18.036 -15.481 396 1HB LYS 50 1HB LYS 50 -12.474 15.434 -15.795 397 2HB LYS 50 2HB LYS 50 -10.916 15.189 -15.010 398 1HG LYS 50 1HG LYS 50 -13.328 16.759 -13.980 399 2HG LYS 50 2HG LYS 50 -12.786 15.166 -13.437 400 1HD LYS 50 1HD LYS 50 -10.630 16.235 -12.643 401 2HD LYS 50 2HD LYS 50 -11.341 17.821 -13.036 402 1HE LYS 50 1HE LYS 50 -13.253 17.328 -11.510 403 2HE LYS 50 2HE LYS 50 -12.482 15.793 -11.062 404 1HZ LYS 50 1HZ LYS 50 -10.624 17.051 -10.230 405 2HZ LYS 50 2HZ LYS 50 -11.353 18.471 -10.646 406 3HZ LYS 50 3HZ LYS 50 -12.023 17.508 -9.490 407 H MET 51 H MET 51 -9.084 15.939 -16.609 408 HA MET 51 HA MET 51 -7.213 16.735 -14.695 409 1HB MET 51 1HB MET 51 -7.093 14.847 -16.315 410 2HB MET 51 2HB MET 51 -6.728 15.977 -17.619 411 1HG MET 51 1HG MET 51 -5.121 15.715 -15.050 412 2HG MET 51 2HG MET 51 -4.795 14.736 -16.477 413 1HE MET 51 1HE MET 51 -3.746 15.543 -18.667 414 2HE MET 51 2HE MET 51 -5.023 16.759 -18.942 415 3HE MET 51 3HE MET 51 -3.311 17.228 -19.024 416 H ILE 52 H ILE 52 -7.797 18.114 -17.974 417 HA ILE 52 HA ILE 52 -6.013 20.285 -17.801 418 HB ILE 52 HB ILE 52 -8.630 19.912 -19.293 419 1HG1 ILE 52 1HG1 ILE 52 -5.701 20.139 -20.154 420 2HG1 ILE 52 2HG1 ILE 52 -6.570 18.618 -19.946 421 1HG2 ILE 52 1HG2 ILE 52 -8.464 22.338 -18.867 422 2HG2 ILE 52 2HG2 ILE 52 -6.787 22.333 -19.454 423 3HG2 ILE 52 3HG2 ILE 52 -8.140 21.989 -20.549 424 1HD1 ILE 52 1HD1 ILE 52 -6.542 19.089 -22.279 425 2HD1 ILE 52 2HD1 ILE 52 -8.202 19.400 -21.724 426 3HD1 ILE 52 3HD1 ILE 52 -7.089 20.750 -22.049 427 H SER 53 H SER 53 -9.466 20.137 -16.673 428 HA SER 53 HA SER 53 -9.476 22.825 -15.829 429 1HB SER 53 1HB SER 53 -11.509 22.401 -14.758 430 2HB SER 53 2HB SER 53 -11.480 21.199 -16.063 431 HG SER 53 HG SER 53 -10.660 19.723 -14.429 432 H GLU 54 H GLU 54 -8.505 19.908 -14.002 433 HA GLU 54 HA GLU 54 -8.020 21.208 -11.514 434 1HB GLU 54 1HB GLU 54 -6.719 18.762 -12.775 435 2HB GLU 54 2HB GLU 54 -6.445 19.281 -11.107 436 1HG GLU 54 1HG GLU 54 -8.809 19.053 -10.564 437 2HG GLU 54 2HG GLU 54 -9.203 18.633 -12.233 438 H ILE 55 H ILE 55 -5.816 20.628 -14.304 439 HA ILE 55 HA ILE 55 -3.600 21.986 -12.981 440 HB ILE 55 HB ILE 55 -4.025 21.289 -15.910 441 1HG1 ILE 55 1HG1 ILE 55 -4.095 19.232 -14.685 442 2HG1 ILE 55 2HG1 ILE 55 -2.515 19.366 -15.431 443 1HG2 ILE 55 1HG2 ILE 55 -1.501 22.065 -14.397 444 2HG2 ILE 55 2HG2 ILE 55 -1.538 21.401 -16.047 445 3HG2 ILE 55 3HG2 ILE 55 -2.292 22.954 -15.707 446 1HD1 ILE 55 1HD1 ILE 55 -2.277 18.475 -13.206 447 2HD1 ILE 55 2HD1 ILE 55 -1.607 20.116 -13.174 448 3HD1 ILE 55 3HD1 ILE 55 -3.216 19.789 -12.493 449 H ASP 56 H ASP 56 -6.221 23.033 -15.115 450 HA ASP 56 HA ASP 56 -4.990 25.591 -15.735 451 1HB ASP 56 1HB ASP 56 -6.381 24.354 -17.355 452 2HB ASP 56 2HB ASP 56 -7.784 24.530 -16.283 453 H LYS 57 H LYS 57 -4.713 25.961 -13.359 454 HA LYS 57 HA LYS 57 -6.929 26.770 -11.717 455 1HB LYS 57 1HB LYS 57 -4.035 27.733 -11.694 456 2HB LYS 57 2HB LYS 57 -5.183 27.951 -10.383 457 1HG LYS 57 1HG LYS 57 -4.004 25.337 -11.418 458 2HG LYS 57 2HG LYS 57 -3.682 26.109 -9.876 459 1HD LYS 57 1HD LYS 57 -6.332 24.817 -10.722 460 2HD LYS 57 2HD LYS 57 -5.100 24.134 -9.686 461 1HE LYS 57 1HE LYS 57 -6.667 24.891 -8.151 462 2HE LYS 57 2HE LYS 57 -5.437 26.163 -8.115 463 1HZ LYS 57 1HZ LYS 57 -7.984 26.221 -9.592 464 2HZ LYS 57 2HZ LYS 57 -7.662 27.024 -8.191 465 3HZ LYS 57 3HZ LYS 57 -6.880 27.440 -9.576 466 H ASP 58 H ASP 58 -4.921 28.508 -14.051 467 HA ASP 58 HA ASP 58 -6.804 30.838 -13.966 468 1HB ASP 58 1HB ASP 58 -4.997 32.386 -13.829 469 2HB ASP 58 2HB ASP 58 -4.812 31.239 -12.497 470 H GLY 59 H GLY 59 -4.581 28.859 -15.878 471 1HA GLY 59 1HA GLY 59 -4.046 30.620 -17.966 472 2HA GLY 59 2HA GLY 59 -3.976 28.870 -18.050 473 H SER 60 H SER 60 -7.088 29.068 -17.411 474 HA SER 60 HA SER 60 -9.060 29.092 -18.540 475 1HB SER 60 1HB SER 60 -7.898 31.697 -19.609 476 2HB SER 60 2HB SER 60 -9.614 31.259 -19.541 477 HG SER 60 HG SER 60 -7.840 31.555 -17.323 478 H GLY 61 H GLY 61 -8.068 27.190 -19.815 479 1HA GLY 61 1HA GLY 61 -8.565 26.135 -21.867 480 2HA GLY 61 2HA GLY 61 -8.587 27.685 -22.714 481 H THR 62 H THR 62 -5.938 28.306 -21.106 482 HA THR 62 HA THR 62 -4.126 26.538 -22.647 483 HB THR 62 HB THR 62 -2.550 28.283 -22.854 484 HG1 THR 62 HG1 THR 62 -4.315 29.839 -21.240 485 1HG2 THR 62 1HG2 THR 62 -4.486 28.370 -24.510 486 2HG2 THR 62 2HG2 THR 62 -5.235 29.607 -23.490 487 3HG2 THR 62 3HG2 THR 62 -3.672 29.920 -24.259 488 H ILE 63 H ILE 63 -2.031 26.231 -21.535 489 HA ILE 63 HA ILE 63 -2.267 26.165 -18.554 490 HB ILE 63 HB ILE 63 -0.719 24.314 -20.398 491 1HG1 ILE 63 1HG1 ILE 63 -3.084 23.876 -20.760 492 2HG1 ILE 63 2HG1 ILE 63 -2.300 22.563 -19.894 493 1HG2 ILE 63 1HG2 ILE 63 0.302 24.521 -18.209 494 2HG2 ILE 63 2HG2 ILE 63 -1.243 24.198 -17.411 495 3HG2 ILE 63 3HG2 ILE 63 -0.449 22.926 -18.364 496 1HD1 ILE 63 1HD1 ILE 63 -4.057 24.682 -18.577 497 2HD1 ILE 63 2HD1 ILE 63 -4.538 23.035 -19.006 498 3HD1 ILE 63 3HD1 ILE 63 -3.305 23.289 -17.771 499 H ASP 64 H ASP 64 -0.970 27.669 -17.693 500 HA ASP 64 HA ASP 64 1.232 28.942 -19.094 501 1HB ASP 64 1HB ASP 64 -0.107 30.199 -17.474 502 2HB ASP 64 2HB ASP 64 0.246 29.018 -16.205 503 H PHE 65 H PHE 65 3.451 28.973 -18.299 504 HA PHE 65 HA PHE 65 4.691 26.511 -18.068 505 1HB PHE 65 1HB PHE 65 5.942 28.504 -18.616 506 2HB PHE 65 2HB PHE 65 5.586 29.220 -17.044 507 HD1 PHE 65 HD1 PHE 65 6.936 25.895 -18.260 508 HD2 PHE 65 HD2 PHE 65 7.393 29.214 -15.540 509 HE1 PHE 65 HE1 PHE 65 8.970 24.847 -17.303 510 HE2 PHE 65 HE2 PHE 65 9.392 28.142 -14.569 511 HZ PHE 65 HZ PHE 65 10.208 25.967 -15.468 512 H GLU 66 H GLU 66 3.676 28.629 -15.299 513 HA GLU 66 HA GLU 66 4.777 26.860 -13.333 514 1HB GLU 66 1HB GLU 66 2.551 28.926 -13.110 515 2HB GLU 66 2HB GLU 66 3.325 28.110 -11.747 516 1HG GLU 66 1HG GLU 66 4.780 29.879 -13.773 517 2HG GLU 66 2HG GLU 66 4.286 30.357 -12.146 518 H GLU 67 H GLU 67 1.571 27.009 -14.893 519 HA GLU 67 HA GLU 67 0.326 25.040 -13.188 520 1HB GLU 67 1HB GLU 67 -0.303 25.932 -16.029 521 2HB GLU 67 2HB GLU 67 -1.323 24.879 -15.039 522 1HG GLU 67 1HG GLU 67 -1.671 26.613 -13.382 523 2HG GLU 67 2HG GLU 67 -0.574 27.717 -14.222 524 H PHE 68 H PHE 68 2.028 24.877 -16.344 525 HA PHE 68 HA PHE 68 1.800 22.065 -16.748 526 1HB PHE 68 1HB PHE 68 2.456 23.689 -18.488 527 2HB PHE 68 2HB PHE 68 3.947 24.037 -17.631 528 HD1 PHE 68 HD1 PHE 68 5.896 22.690 -17.989 529 HD2 PHE 68 HD2 PHE 68 2.050 21.342 -19.407 530 HE1 PHE 68 HE1 PHE 68 7.002 20.948 -19.376 531 HE2 PHE 68 HE2 PHE 68 3.164 19.543 -20.702 532 HZ PHE 68 HZ PHE 68 5.652 19.328 -20.644 533 H LEU 69 H LEU 69 4.335 24.034 -15.184 534 HA LEU 69 HA LEU 69 6.108 21.997 -14.420 535 1HB LEU 69 1HB LEU 69 6.676 24.355 -14.329 536 2HB LEU 69 2HB LEU 69 5.393 24.659 -13.157 537 HG LEU 69 HG LEU 69 6.571 23.350 -11.445 538 1HD1 LEU 69 1HD1 LEU 69 8.937 22.691 -11.836 539 2HD1 LEU 69 2HD1 LEU 69 7.825 21.758 -12.845 540 3HD1 LEU 69 3HD1 LEU 69 8.763 23.093 -13.557 541 1HD2 LEU 69 1HD2 LEU 69 8.261 25.506 -12.785 542 2HD2 LEU 69 2HD2 LEU 69 6.907 25.792 -11.677 543 3HD2 LEU 69 3HD2 LEU 69 8.374 24.988 -11.088 544 H THR 70 H THR 70 3.264 23.366 -12.664 545 HA THR 70 HA THR 70 3.451 21.697 -10.390 546 HB THR 70 HB THR 70 0.905 22.791 -11.668 547 HG1 THR 70 HG1 THR 70 2.453 24.412 -11.224 548 1HG2 THR 70 1HG2 THR 70 0.442 21.113 -9.905 549 2HG2 THR 70 2HG2 THR 70 1.547 21.968 -8.804 550 3HG2 THR 70 3HG2 THR 70 0.054 22.751 -9.354 551 H MET 71 H MET 71 1.606 21.162 -13.456 552 HA MET 71 HA MET 71 0.582 18.613 -12.864 553 1HB MET 71 1HB MET 71 0.047 19.995 -14.891 554 2HB MET 71 2HB MET 71 1.625 19.584 -15.554 555 1HG MET 71 1HG MET 71 0.977 17.142 -15.448 556 2HG MET 71 2HG MET 71 -0.618 17.649 -14.887 557 1HE MET 71 1HE MET 71 1.932 17.495 -17.822 558 2HE MET 71 2HE MET 71 1.065 18.312 -19.141 559 3HE MET 71 3HE MET 71 1.684 19.259 -17.773 560 H MET 72 H MET 72 3.718 19.452 -14.410 561 HA MET 72 HA MET 72 4.646 16.778 -14.633 562 1HB MET 72 1HB MET 72 6.118 19.431 -14.496 563 2HB MET 72 2HB MET 72 6.915 17.902 -14.879 564 1HG MET 72 1HG MET 72 4.479 18.512 -16.515 565 2HG MET 72 2HG MET 72 5.834 19.601 -16.725 566 1HE MET 72 1HE MET 72 4.743 15.803 -16.891 567 2HE MET 72 2HE MET 72 6.196 15.074 -17.608 568 3HE MET 72 3HE MET 72 6.259 15.702 -15.951 569 H THR 73 H THR 73 4.980 19.133 -11.974 570 HA THR 73 HA THR 73 6.737 17.585 -10.343 571 HB THR 73 HB THR 73 4.534 19.471 -9.386 572 HG1 THR 73 HG1 THR 73 5.977 20.446 -10.909 573 1HG2 THR 73 1HG2 THR 73 6.071 19.851 -7.493 574 2HG2 THR 73 2HG2 THR 73 5.580 18.149 -7.566 575 3HG2 THR 73 3HG2 THR 73 7.190 18.638 -8.144 576 H ALA 74 H ALA 74 3.149 17.661 -10.597 577 HA ALA 74 HA ALA 74 2.720 15.713 -8.536 578 1HB ALA 74 1HB ALA 74 0.436 15.604 -9.430 579 2HB ALA 74 2HB ALA 74 0.988 17.285 -9.282 580 3HB ALA 74 3HB ALA 74 0.935 16.505 -10.876 581 H LYS 75 H LYS 75 2.753 15.397 -12.116 582 HA LYS 75 HA LYS 75 2.192 12.546 -11.956 583 1HB LYS 75 1HB LYS 75 2.900 14.337 -14.312 584 2HB LYS 75 2HB LYS 75 2.316 12.683 -14.438 585 1HG LYS 75 1HG LYS 75 0.791 15.082 -13.322 586 2HG LYS 75 2HG LYS 75 0.513 14.272 -14.858 587 1HD LYS 75 1HD LYS 75 0.017 13.128 -12.069 588 2HD LYS 75 2HD LYS 75 -1.186 13.643 -13.249 589 1HE LYS 75 1HE LYS 75 -0.378 11.859 -14.828 590 2HE LYS 75 2HE LYS 75 0.725 11.278 -13.563 591 1HZ LYS 75 1HZ LYS 75 -1.159 10.882 -12.172 592 2HZ LYS 75 2HZ LYS 75 -2.194 11.406 -13.344 593 3HZ LYS 75 3HZ LYS 75 -1.290 10.049 -13.588 594 H MET 76 H MET 76 5.104 14.480 -12.604 595 HA MET 76 HA MET 76 7.160 13.956 -13.325 596 1HB MET 76 1HB MET 76 6.838 11.639 -11.374 597 2HB MET 76 2HB MET 76 8.359 12.249 -12.050 598 1HG MET 76 1HG MET 76 7.871 14.494 -11.044 599 2HG MET 76 2HG MET 76 6.416 13.812 -10.313 600 1HE MET 76 1HE MET 76 9.980 11.961 -10.520 601 2HE MET 76 2HE MET 76 10.335 13.705 -10.394 602 3HE MET 76 3HE MET 76 10.700 12.610 -9.040 Start of MODEL 2 1 H ARG 1 H ARG 1 15.499 16.980 -2.524 2 HA ARG 1 HA ARG 1 16.951 16.640 -4.366 3 1HB ARG 1 1HB ARG 1 18.335 14.654 -4.510 4 2HB ARG 1 2HB ARG 1 18.822 15.686 -3.164 5 1HG ARG 1 1HG ARG 1 17.583 14.142 -1.586 6 2HG ARG 1 2HG ARG 1 17.180 13.111 -2.973 7 1HD ARG 1 1HD ARG 1 19.088 12.185 -1.825 8 2HD ARG 1 2HD ARG 1 19.598 12.782 -3.421 9 HE ARG 1 HE ARG 1 19.949 14.831 -1.454 10 1HH1 ARG 1 1HH1 ARG 1 21.330 11.730 -2.416 11 2HH1 ARG 1 2HH1 ARG 1 22.928 12.090 -1.821 12 1HH2 ARG 1 1HH2 ARG 1 22.030 15.327 -0.674 13 2HH2 ARG 1 2HH2 ARG 1 23.328 14.177 -0.809 14 H VAL 2 H VAL 2 14.848 14.553 -2.465 15 HA VAL 2 HA VAL 2 13.982 12.941 -4.722 16 HB VAL 2 HB VAL 2 12.687 13.296 -1.988 17 1HG1 VAL 2 1HG1 VAL 2 11.215 12.210 -3.688 18 2HG1 VAL 2 2HG1 VAL 2 12.510 11.058 -4.063 19 3HG1 VAL 2 3HG1 VAL 2 11.745 11.055 -2.462 20 1HG2 VAL 2 1HG2 VAL 2 14.997 12.539 -1.655 21 2HG2 VAL 2 2HG2 VAL 2 13.893 11.186 -1.409 22 3HG2 VAL 2 3HG2 VAL 2 14.804 11.312 -2.927 23 H GLY 3 H GLY 3 13.670 14.881 -6.131 24 1HA GLY 3 1HA GLY 3 10.885 15.478 -6.453 25 2HA GLY 3 2HA GLY 3 11.754 16.870 -5.760 26 H LEU 4 H LEU 4 11.068 17.792 -7.969 27 HA LEU 4 HA LEU 4 12.439 16.866 -10.341 28 1HB LEU 4 1HB LEU 4 11.219 19.576 -9.757 29 2HB LEU 4 2HB LEU 4 11.729 18.944 -11.328 30 HG LEU 4 HG LEU 4 9.429 17.917 -9.605 31 1HD1 LEU 4 1HD1 LEU 4 9.020 20.016 -10.750 32 2HD1 LEU 4 2HD1 LEU 4 9.644 19.365 -12.274 33 3HD1 LEU 4 3HD1 LEU 4 8.130 18.735 -11.604 34 1HD2 LEU 4 1HD2 LEU 4 10.501 16.856 -12.259 35 2HD2 LEU 4 2HD2 LEU 4 10.370 15.965 -10.720 36 3HD2 LEU 4 3HD2 LEU 4 8.909 16.455 -11.579 37 H THR 5 H THR 5 14.667 16.810 -10.273 38 HA THR 5 HA THR 5 16.311 18.831 -9.060 39 HB THR 5 HB THR 5 18.081 17.887 -10.542 40 HG1 THR 5 HG1 THR 5 16.176 16.061 -11.495 41 1HG2 THR 5 1HG2 THR 5 17.592 16.751 -8.422 42 2HG2 THR 5 2HG2 THR 5 16.356 15.749 -9.203 43 3HG2 THR 5 3HG2 THR 5 18.059 15.591 -9.678 44 H GLU 6 H GLU 6 17.717 20.362 -10.298 45 HA GLU 6 HA GLU 6 16.394 22.132 -12.033 46 1HB GLU 6 1HB GLU 6 19.342 21.498 -11.605 47 2HB GLU 6 2HB GLU 6 18.795 22.722 -12.752 48 1HG GLU 6 1HG GLU 6 19.368 23.735 -10.583 49 2HG GLU 6 2HG GLU 6 17.677 23.999 -11.022 50 H GLU 7 H GLU 7 18.494 19.366 -12.856 51 HA GLU 7 HA GLU 7 18.386 19.534 -15.632 52 1HB GLU 7 1HB GLU 7 18.242 16.921 -14.036 53 2HB GLU 7 2HB GLU 7 18.829 17.161 -15.684 54 1HG GLU 7 1HG GLU 7 20.829 17.088 -14.564 55 2HG GLU 7 2HG GLU 7 20.550 18.831 -14.520 56 H GLN 8 H GLN 8 16.038 17.825 -13.476 57 HA GLN 8 HA GLN 8 14.262 17.047 -15.581 58 1HB GLN 8 1HB GLN 8 13.798 17.569 -12.632 59 2HB GLN 8 2HB GLN 8 12.533 16.984 -13.719 60 1HG GLN 8 1HG GLN 8 13.655 14.935 -14.160 61 2HG GLN 8 2HG GLN 8 15.194 15.541 -13.542 62 1HE2 GLN 8 1HE2 GLN 8 11.915 14.469 -12.507 63 2HE2 GLN 8 2HE2 GLN 8 12.413 14.190 -10.844 64 H LYS 9 H LYS 9 14.304 20.029 -13.522 65 HA LYS 9 HA LYS 9 11.957 21.148 -14.695 66 1HB LYS 9 1HB LYS 9 14.313 22.478 -13.337 67 2HB LYS 9 2HB LYS 9 12.827 23.317 -13.819 68 1HG LYS 9 1HG LYS 9 11.467 21.752 -12.468 69 2HG LYS 9 2HG LYS 9 12.925 20.919 -11.926 70 1HD LYS 9 1HD LYS 9 12.274 23.849 -11.361 71 2HD LYS 9 2HD LYS 9 12.013 22.487 -10.254 72 1HE LYS 9 1HE LYS 9 14.486 21.964 -10.416 73 2HE LYS 9 2HE LYS 9 14.688 23.504 -11.289 74 1HZ LYS 9 1HZ LYS 9 15.138 23.702 -8.973 75 2HZ LYS 9 2HZ LYS 9 13.827 24.622 -9.376 76 3HZ LYS 9 3HZ LYS 9 13.622 23.191 -8.578 77 H GLN 10 H GLN 10 15.370 21.359 -15.731 78 HA GLN 10 HA GLN 10 14.999 23.179 -17.896 79 1HB GLN 10 1HB GLN 10 16.991 20.908 -17.503 80 2HB GLN 10 2HB GLN 10 17.056 22.061 -18.835 81 1HG GLN 10 1HG GLN 10 17.477 23.907 -17.367 82 2HG GLN 10 2HG GLN 10 17.053 22.974 -15.935 83 1HE2 GLN 10 1HE2 GLN 10 19.361 22.643 -18.723 84 2HE2 GLN 10 2HE2 GLN 10 20.698 22.149 -17.698 85 H GLU 11 H GLU 11 14.944 19.560 -17.840 86 HA GLU 11 HA GLU 11 14.214 19.271 -20.576 87 1HB GLU 11 1HB GLU 11 13.649 17.471 -18.179 88 2HB GLU 11 2HB GLU 11 13.381 17.007 -19.866 89 1HG GLU 11 1HG GLU 11 16.095 17.820 -18.717 90 2HG GLU 11 2HG GLU 11 15.545 16.164 -18.973 91 H ILE 12 H ILE 12 12.129 19.532 -17.685 92 HA ILE 12 HA ILE 12 9.623 19.305 -18.993 93 HB ILE 12 HB ILE 12 10.504 20.745 -16.477 94 1HG1 ILE 12 1HG1 ILE 12 8.835 18.202 -16.837 95 2HG1 ILE 12 2HG1 ILE 12 10.587 18.141 -16.744 96 1HG2 ILE 12 1HG2 ILE 12 8.190 20.942 -15.786 97 2HG2 ILE 12 2HG2 ILE 12 8.401 21.809 -17.297 98 3HG2 ILE 12 3HG2 ILE 12 7.637 20.207 -17.296 99 1HD1 ILE 12 1HD1 ILE 12 10.532 19.201 -14.508 100 2HD1 ILE 12 2HD1 ILE 12 8.754 19.174 -14.551 101 3HD1 ILE 12 3HD1 ILE 12 9.664 17.656 -14.575 102 H ARG 13 H ARG 13 11.663 22.234 -18.366 103 HA ARG 13 HA ARG 13 9.857 24.003 -19.640 104 1HB ARG 13 1HB ARG 13 11.611 24.825 -18.181 105 2HB ARG 13 2HB ARG 13 12.863 24.226 -19.278 106 1HG ARG 13 1HG ARG 13 12.603 26.625 -19.542 107 2HG ARG 13 2HG ARG 13 12.113 25.816 -21.030 108 1HD ARG 13 1HD ARG 13 9.700 26.062 -20.308 109 2HD ARG 13 2HD ARG 13 10.276 26.936 -18.867 110 HE ARG 13 HE ARG 13 11.326 28.114 -21.253 111 1HH1 ARG 13 1HH1 ARG 13 8.325 27.782 -19.424 112 2HH1 ARG 13 2HH1 ARG 13 7.567 29.185 -20.127 113 1HH2 ARG 13 1HH2 ARG 13 10.359 29.962 -22.178 114 2HH2 ARG 13 2HH2 ARG 13 8.745 30.446 -21.732 115 H GLU 14 H GLU 14 12.642 22.147 -20.998 116 HA GLU 14 HA GLU 14 12.514 23.148 -23.609 117 1HB GLU 14 1HB GLU 14 14.240 21.632 -22.503 118 2HB GLU 14 2HB GLU 14 13.178 20.263 -22.838 119 1HG GLU 14 1HG GLU 14 14.303 22.206 -24.899 120 2HG GLU 14 2HG GLU 14 14.999 20.628 -24.506 121 H ALA 15 H ALA 15 10.906 20.222 -22.271 122 HA ALA 15 HA ALA 15 9.384 19.529 -24.541 123 1HB ALA 15 1HB ALA 15 8.671 19.200 -21.590 124 2HB ALA 15 2HB ALA 15 7.938 18.321 -22.950 125 3HB ALA 15 3HB ALA 15 9.654 18.084 -22.562 126 H PHE 16 H PHE 16 8.510 21.629 -21.765 127 HA PHE 16 HA PHE 16 5.962 22.359 -22.567 128 1HB PHE 16 1HB PHE 16 6.952 22.963 -20.389 129 2HB PHE 16 2HB PHE 16 8.019 24.117 -21.177 130 HD1 PHE 16 HD1 PHE 16 4.500 23.356 -20.337 131 HD2 PHE 16 HD2 PHE 16 7.177 26.277 -22.025 132 HE1 PHE 16 HE1 PHE 16 2.713 25.066 -20.193 133 HE2 PHE 16 HE2 PHE 16 5.342 27.935 -22.038 134 HZ PHE 16 HZ PHE 16 3.122 27.344 -21.048 135 H ASP 17 H ASP 17 9.049 23.990 -23.389 136 HA ASP 17 HA ASP 17 7.980 26.049 -24.998 137 1HB ASP 17 1HB ASP 17 10.284 26.053 -24.157 138 2HB ASP 17 2HB ASP 17 10.686 24.653 -25.161 139 H LEU 18 H LEU 18 9.192 22.780 -25.936 140 HA LEU 18 HA LEU 18 8.721 22.980 -28.703 141 1HB LEU 18 1HB LEU 18 9.866 21.052 -27.529 142 2HB LEU 18 2HB LEU 18 8.283 20.513 -26.972 143 HG LEU 18 HG LEU 18 7.715 20.684 -29.629 144 1HD1 LEU 18 1HD1 LEU 18 9.982 21.494 -30.206 145 2HD1 LEU 18 2HD1 LEU 18 10.676 19.997 -29.544 146 3HD1 LEU 18 3HD1 LEU 18 9.606 19.934 -30.962 147 1HD2 LEU 18 1HD2 LEU 18 7.359 18.714 -28.265 148 2HD2 LEU 18 2HD2 LEU 18 8.141 18.288 -29.791 149 3HD2 LEU 18 3HD2 LEU 18 9.103 18.343 -28.292 150 H PHE 19 H PHE 19 6.490 21.727 -26.154 151 HA PHE 19 HA PHE 19 4.313 21.300 -27.943 152 1HB PHE 19 1HB PHE 19 4.232 21.950 -24.982 153 2HB PHE 19 2HB PHE 19 2.939 21.179 -25.904 154 HD1 PHE 19 HD1 PHE 19 4.801 19.200 -27.498 155 HD2 PHE 19 HD2 PHE 19 4.425 20.220 -23.312 156 HE1 PHE 19 HE1 PHE 19 5.621 16.964 -26.872 157 HE2 PHE 19 HE2 PHE 19 5.122 17.927 -22.713 158 HZ PHE 19 HZ PHE 19 5.804 16.320 -24.479 159 H ASP 20 H ASP 20 5.181 24.140 -25.986 160 HA ASP 20 HA ASP 20 2.876 25.704 -26.814 161 1HB ASP 20 1HB ASP 20 3.996 26.005 -24.619 162 2HB ASP 20 2HB ASP 20 5.463 26.533 -25.452 163 H THR 21 H THR 21 3.574 24.890 -29.121 164 HA THR 21 HA THR 21 5.580 26.178 -30.620 165 HB THR 21 HB THR 21 4.102 25.748 -32.564 166 HG1 THR 21 HG1 THR 21 2.201 25.298 -30.522 167 1HG2 THR 21 1HG2 THR 21 5.499 23.916 -31.592 168 2HG2 THR 21 2HG2 THR 21 4.119 23.409 -30.599 169 3HG2 THR 21 3HG2 THR 21 4.013 23.329 -32.363 170 H ASP 22 H ASP 22 2.449 27.402 -29.489 171 HA ASP 22 HA ASP 22 2.412 29.823 -31.026 172 1HB ASP 22 1HB ASP 22 1.208 29.118 -28.308 173 2HB ASP 22 2HB ASP 22 0.882 30.618 -29.183 174 H GLY 23 H GLY 23 4.392 28.886 -28.295 175 1HA GLY 23 1HA GLY 23 5.960 29.982 -27.092 176 2HA GLY 23 2HA GLY 23 5.998 31.211 -28.369 177 H SER 24 H SER 24 2.985 30.487 -26.524 178 HA SER 24 HA SER 24 2.842 33.280 -25.729 179 1HB SER 24 1HB SER 24 0.495 32.394 -25.243 180 2HB SER 24 2HB SER 24 1.106 32.250 -26.900 181 HG SER 24 HG SER 24 0.641 30.215 -25.038 182 H GLY 25 H GLY 25 4.365 30.810 -24.319 183 1HA GLY 25 1HA GLY 25 5.071 30.353 -22.156 184 2HA GLY 25 2HA GLY 25 4.228 31.802 -21.581 185 H THR 26 H THR 26 2.399 29.569 -23.512 186 HA THR 26 HA THR 26 0.967 28.331 -21.243 187 HB THR 26 HB THR 26 -1.131 29.249 -22.535 188 HG1 THR 26 HG1 THR 26 0.648 31.394 -22.994 189 1HG2 THR 26 1HG2 THR 26 -1.229 31.250 -21.082 190 2HG2 THR 26 2HG2 THR 26 -0.689 29.823 -20.190 191 3HG2 THR 26 3HG2 THR 26 0.488 31.060 -20.682 192 H ILE 27 H ILE 27 0.671 26.232 -21.872 193 HA ILE 27 HA ILE 27 0.713 25.500 -24.754 194 HB ILE 27 HB ILE 27 0.427 23.909 -22.206 195 1HG1 ILE 27 1HG1 ILE 27 2.538 23.881 -24.421 196 2HG1 ILE 27 2HG1 ILE 27 2.699 24.790 -22.922 197 1HG2 ILE 27 1HG2 ILE 27 0.515 22.827 -25.049 198 2HG2 ILE 27 2HG2 ILE 27 0.337 21.896 -23.563 199 3HG2 ILE 27 3HG2 ILE 27 -0.974 22.927 -24.082 200 1HD1 ILE 27 1HD1 ILE 27 2.405 22.638 -21.637 201 2HD1 ILE 27 2HD1 ILE 27 2.464 21.764 -23.188 202 3HD1 ILE 27 3HD1 ILE 27 3.852 22.711 -22.662 203 H ASP 28 H ASP 28 -1.168 26.101 -25.809 204 HA ASP 28 HA ASP 28 -3.750 26.350 -24.524 205 1HB ASP 28 1HB ASP 28 -3.235 27.474 -26.646 206 2HB ASP 28 2HB ASP 28 -2.995 25.913 -27.444 207 H ALA 29 H ALA 29 -5.469 24.834 -24.457 208 HA ALA 29 HA ALA 29 -5.167 22.208 -23.949 209 1HB ALA 29 1HB ALA 29 -7.451 23.457 -25.537 210 2HB ALA 29 2HB ALA 29 -7.520 21.902 -24.681 211 3HB ALA 29 3HB ALA 29 -7.295 23.407 -23.767 212 H LYS 30 H LYS 30 -5.519 23.484 -27.298 213 HA LYS 30 HA LYS 30 -5.554 20.948 -28.624 214 1HB LYS 30 1HB LYS 30 -4.571 23.670 -29.578 215 2HB LYS 30 2HB LYS 30 -4.861 22.263 -30.613 216 1HG LYS 30 1HG LYS 30 -7.246 22.252 -29.993 217 2HG LYS 30 2HG LYS 30 -6.992 23.624 -28.900 218 1HD LYS 30 1HD LYS 30 -6.241 25.024 -30.821 219 2HD LYS 30 2HD LYS 30 -6.489 23.650 -31.911 220 1HE LYS 30 1HE LYS 30 -8.392 25.148 -32.074 221 2HE LYS 30 2HE LYS 30 -8.918 23.630 -31.329 222 1HZ LYS 30 1HZ LYS 30 -9.782 25.565 -30.215 223 2HZ LYS 30 2HZ LYS 30 -8.804 24.711 -29.202 224 3HZ LYS 30 3HZ LYS 30 -8.262 26.109 -29.886 225 H GLU 31 H GLU 31 -2.866 23.126 -27.690 226 HA GLU 31 HA GLU 31 -0.775 21.560 -28.938 227 1HB GLU 31 1HB GLU 31 -0.730 23.638 -26.719 228 2HB GLU 31 2HB GLU 31 0.700 22.901 -27.448 229 1HG GLU 31 1HG GLU 31 0.125 23.841 -29.635 230 2HG GLU 31 2HG GLU 31 -1.376 24.524 -28.989 231 H LEU 32 H LEU 32 -2.316 21.656 -25.685 232 HA LEU 32 HA LEU 32 -0.543 19.720 -24.554 233 1HB LEU 32 1HB LEU 32 -2.323 21.239 -23.333 234 2HB LEU 32 2HB LEU 32 -3.426 19.908 -23.694 235 HG LEU 32 HG LEU 32 -1.642 18.367 -22.575 236 1HD1 LEU 32 1HD1 LEU 32 -0.659 21.053 -21.541 237 2HD1 LEU 32 2HD1 LEU 32 -0.257 19.474 -20.842 238 3HD1 LEU 32 3HD1 LEU 32 0.281 19.858 -22.471 239 1HD2 LEU 32 1HD2 LEU 32 -3.172 20.440 -20.963 240 2HD2 LEU 32 2HD2 LEU 32 -3.792 18.882 -21.546 241 3HD2 LEU 32 3HD2 LEU 32 -2.521 18.918 -20.314 242 H LYS 33 H LYS 33 -3.665 19.357 -26.300 243 HA LYS 33 HA LYS 33 -3.844 16.532 -26.109 244 1HB LYS 33 1HB LYS 33 -5.650 17.972 -26.833 245 2HB LYS 33 2HB LYS 33 -4.790 18.362 -28.336 246 1HG LYS 33 1HG LYS 33 -4.866 15.961 -28.992 247 2HG LYS 33 2HG LYS 33 -5.722 15.585 -27.480 248 1HD LYS 33 1HD LYS 33 -7.585 17.075 -28.158 249 2HD LYS 33 2HD LYS 33 -6.711 17.503 -29.644 250 1HE LYS 33 1HE LYS 33 -6.777 15.122 -30.369 251 2HE LYS 33 2HE LYS 33 -7.665 14.702 -28.891 252 1HZ LYS 33 1HZ LYS 33 -9.417 16.147 -29.598 253 2HZ LYS 33 2HZ LYS 33 -8.596 16.545 -30.972 254 3HZ LYS 33 3HZ LYS 33 -9.116 14.998 -30.741 255 H VAL 34 H VAL 34 -2.218 18.577 -28.611 256 HA VAL 34 HA VAL 34 -1.088 16.431 -30.095 257 HB VAL 34 HB VAL 34 -0.111 19.268 -29.570 258 1HG1 VAL 34 1HG1 VAL 34 1.104 17.201 -31.445 259 2HG1 VAL 34 2HG1 VAL 34 1.433 18.945 -31.503 260 3HG1 VAL 34 3HG1 VAL 34 1.918 18.014 -30.088 261 1HG2 VAL 34 1HG2 VAL 34 -1.312 17.935 -32.035 262 2HG2 VAL 34 2HG2 VAL 34 -2.203 18.978 -30.911 263 3HG2 VAL 34 3HG2 VAL 34 -0.873 19.647 -31.867 264 H ALA 35 H ALA 35 0.274 18.145 -27.227 265 HA ALA 35 HA ALA 35 2.648 16.670 -26.998 266 1HB ALA 35 1HB ALA 35 2.645 17.314 -24.654 267 2HB ALA 35 2HB ALA 35 2.074 18.676 -25.644 268 3HB ALA 35 3HB ALA 35 0.932 17.707 -24.696 269 H MET 36 H MET 36 -0.578 15.933 -25.603 270 HA MET 36 HA MET 36 0.204 13.474 -24.389 271 1HB MET 36 1HB MET 36 -2.458 14.678 -25.145 272 2HB MET 36 2HB MET 36 -2.333 13.086 -24.391 273 1HG MET 36 1HG MET 36 -0.988 14.016 -22.542 274 2HG MET 36 2HG MET 36 -1.139 15.632 -23.222 275 1HE MET 36 1HE MET 36 -4.785 16.579 -22.568 276 2HE MET 36 2HE MET 36 -3.209 16.994 -23.268 277 3HE MET 36 3HE MET 36 -4.226 15.783 -24.064 278 H ARG 37 H ARG 37 -1.041 14.135 -27.693 279 HA ARG 37 HA ARG 37 -0.949 11.347 -28.429 280 1HB ARG 37 1HB ARG 37 -0.705 13.885 -30.107 281 2HB ARG 37 2HB ARG 37 -0.658 12.259 -30.786 282 1HG ARG 37 1HG ARG 37 -3.005 13.500 -29.287 283 2HG ARG 37 2HG ARG 37 -2.880 13.123 -31.015 284 1HD ARG 37 1HD ARG 37 -2.384 10.670 -30.165 285 2HD ARG 37 2HD ARG 37 -3.149 11.243 -28.663 286 HE ARG 37 HE ARG 37 -4.804 11.874 -30.898 287 1HH1 ARG 37 1HH1 ARG 37 -3.788 9.113 -28.877 288 2HH1 ARG 37 2HH1 ARG 37 -4.914 8.011 -29.614 289 1HH2 ARG 37 1HH2 ARG 37 -6.392 10.450 -31.716 290 2HH2 ARG 37 2HH2 ARG 37 -6.504 8.810 -31.140 291 H ALA 38 H ALA 38 1.614 13.868 -28.487 292 HA ALA 38 HA ALA 38 3.617 12.139 -29.552 293 1HB ALA 38 1HB ALA 38 3.873 14.596 -29.337 294 2HB ALA 38 2HB ALA 38 4.048 14.416 -27.578 295 3HB ALA 38 3HB ALA 38 5.237 13.683 -28.662 296 H LEU 39 H LEU 39 2.446 12.591 -26.211 297 HA LEU 39 HA LEU 39 4.245 10.633 -25.041 298 1HB LEU 39 1HB LEU 39 1.600 11.755 -24.054 299 2HB LEU 39 2HB LEU 39 2.701 10.780 -23.101 300 HG LEU 39 HG LEU 39 3.567 13.449 -24.281 301 1HD1 LEU 39 1HD1 LEU 39 3.128 14.394 -22.020 302 2HD1 LEU 39 2HD1 LEU 39 1.636 13.912 -22.821 303 3HD1 LEU 39 3HD1 LEU 39 2.326 12.880 -21.556 304 1HD2 LEU 39 1HD2 LEU 39 4.635 11.745 -21.993 305 2HD2 LEU 39 2HD2 LEU 39 5.396 11.950 -23.586 306 3HD2 LEU 39 3HD2 LEU 39 5.260 13.330 -22.492 307 H GLY 40 H GLY 40 1.805 10.106 -27.275 308 1HA GLY 40 1HA GLY 40 0.953 8.158 -28.063 309 2HA GLY 40 2HA GLY 40 1.836 7.266 -26.816 310 H PHE 41 H PHE 41 -0.395 9.877 -25.951 311 HA PHE 41 HA PHE 41 -2.021 7.997 -24.381 312 1HB PHE 41 1HB PHE 41 -2.094 10.979 -24.860 313 2HB PHE 41 2HB PHE 41 -3.281 10.173 -23.876 314 HD1 PHE 41 HD1 PHE 41 0.083 8.748 -23.409 315 HD2 PHE 41 HD2 PHE 41 -2.615 11.897 -22.176 316 HE1 PHE 41 HE1 PHE 41 1.460 9.158 -21.432 317 HE2 PHE 41 HE2 PHE 41 -1.199 12.309 -20.189 318 HZ PHE 41 HZ PHE 41 0.848 10.945 -19.812 319 H GLU 42 H GLU 42 -4.356 8.171 -24.406 320 HA GLU 42 HA GLU 42 -5.614 8.525 -27.090 321 1HB GLU 42 1HB GLU 42 -5.742 6.233 -26.163 322 2HB GLU 42 2HB GLU 42 -6.533 6.873 -24.712 323 1HG GLU 42 1HG GLU 42 -8.376 7.784 -26.176 324 2HG GLU 42 2HG GLU 42 -7.582 7.043 -27.577 325 HA PRO 43 HA PRO 43 -7.005 12.180 -24.707 326 1HB PRO 43 1HB PRO 43 -8.203 12.602 -27.463 327 2HB PRO 43 2HB PRO 43 -7.571 13.830 -26.324 328 1HG PRO 43 1HG PRO 43 -5.984 12.936 -28.329 329 2HG PRO 43 2HG PRO 43 -5.310 13.034 -26.674 330 1HD PRO 43 1HD PRO 43 -6.388 10.591 -28.108 331 2HD PRO 43 2HD PRO 43 -4.896 10.788 -27.117 332 H LYS 44 H LYS 44 -8.285 10.458 -23.537 333 HA LYS 44 HA LYS 44 -11.065 10.033 -24.103 334 1HB LYS 44 1HB LYS 44 -9.544 10.088 -21.468 335 2HB LYS 44 2HB LYS 44 -11.213 9.526 -21.686 336 1HG LYS 44 1HG LYS 44 -10.433 7.785 -23.270 337 2HG LYS 44 2HG LYS 44 -8.756 8.297 -23.005 338 1HD LYS 44 1HD LYS 44 -9.039 7.861 -20.550 339 2HD LYS 44 2HD LYS 44 -10.662 7.229 -20.869 340 1HE LYS 44 1HE LYS 44 -8.046 6.101 -21.993 341 2HE LYS 44 2HE LYS 44 -8.972 5.429 -20.641 342 1HZ LYS 44 1HZ LYS 44 -9.857 5.627 -23.433 343 2HZ LYS 44 2HZ LYS 44 -9.480 4.262 -22.602 344 3HZ LYS 44 3HZ LYS 44 -10.816 5.131 -22.181 345 H LYS 45 H LYS 45 -11.552 12.079 -24.920 346 HA LYS 45 HA LYS 45 -11.396 14.533 -24.361 347 1HB LYS 45 1HB LYS 45 -14.155 13.317 -24.777 348 2HB LYS 45 2HB LYS 45 -13.717 15.013 -25.043 349 1HG LYS 45 1HG LYS 45 -12.020 14.276 -26.738 350 2HG LYS 45 2HG LYS 45 -12.581 12.604 -26.533 351 1HD LYS 45 1HD LYS 45 -14.869 13.268 -27.228 352 2HD LYS 45 2HD LYS 45 -14.335 14.947 -27.399 353 1HE LYS 45 1HE LYS 45 -14.409 13.886 -29.591 354 2HE LYS 45 2HE LYS 45 -12.732 14.275 -29.174 355 1HZ LYS 45 1HZ LYS 45 -12.966 12.087 -30.109 356 2HZ LYS 45 2HZ LYS 45 -12.421 11.989 -28.558 357 3HZ LYS 45 3HZ LYS 45 -13.993 11.632 -28.903 358 H GLU 46 H GLU 46 -13.890 12.792 -22.406 359 HA GLU 46 HA GLU 46 -14.629 15.066 -20.866 360 1HB GLU 46 1HB GLU 46 -14.789 12.087 -20.185 361 2HB GLU 46 2HB GLU 46 -15.545 13.389 -19.270 362 1HG GLU 46 1HG GLU 46 -17.224 12.430 -20.674 363 2HG GLU 46 2HG GLU 46 -16.866 14.050 -21.279 364 H GLU 47 H GLU 47 -12.340 12.410 -20.147 365 HA GLU 47 HA GLU 47 -11.515 13.403 -17.579 366 1HB GLU 47 1HB GLU 47 -10.247 11.441 -19.542 367 2HB GLU 47 2HB GLU 47 -9.584 11.826 -17.954 368 1HG GLU 47 1HG GLU 47 -10.868 9.773 -17.809 369 2HG GLU 47 2HG GLU 47 -11.625 11.040 -16.838 370 H ILE 48 H ILE 48 -10.268 13.764 -20.906 371 HA ILE 48 HA ILE 48 -7.931 15.273 -20.310 372 HB ILE 48 HB ILE 48 -9.820 15.266 -22.684 373 1HG1 ILE 48 1HG1 ILE 48 -8.406 13.201 -22.112 374 2HG1 ILE 48 2HG1 ILE 48 -8.364 13.844 -23.754 375 1HG2 ILE 48 1HG2 ILE 48 -7.989 16.396 -23.968 376 2HG2 ILE 48 2HG2 ILE 48 -8.834 17.425 -22.813 377 3HG2 ILE 48 3HG2 ILE 48 -7.223 16.798 -22.413 378 1HD1 ILE 48 1HD1 ILE 48 -6.241 14.543 -21.685 379 2HD1 ILE 48 2HD1 ILE 48 -6.115 13.164 -22.784 380 3HD1 ILE 48 3HD1 ILE 48 -6.202 14.800 -23.449 381 H LYS 49 H LYS 49 -11.274 16.425 -21.012 382 HA LYS 49 HA LYS 49 -10.723 19.161 -20.679 383 1HB LYS 49 1HB LYS 49 -12.873 17.778 -21.486 384 2HB LYS 49 2HB LYS 49 -13.432 18.089 -19.855 385 1HG LYS 49 1HG LYS 49 -12.519 20.093 -21.969 386 2HG LYS 49 2HG LYS 49 -14.190 19.736 -21.563 387 1HD LYS 49 1HD LYS 49 -12.196 21.108 -19.682 388 2HD LYS 49 2HD LYS 49 -13.379 21.893 -20.708 389 1HE LYS 49 1HE LYS 49 -14.479 21.900 -18.696 390 2HE LYS 49 2HE LYS 49 -15.192 20.486 -19.487 391 1HZ LYS 49 1HZ LYS 49 -14.608 20.082 -17.215 392 2HZ LYS 49 2HZ LYS 49 -13.650 19.147 -18.174 393 3HZ LYS 49 3HZ LYS 49 -13.042 20.518 -17.481 394 H LYS 50 H LYS 50 -11.950 16.758 -18.297 395 HA LYS 50 HA LYS 50 -12.080 18.478 -16.057 396 1HB LYS 50 1HB LYS 50 -11.476 15.509 -16.279 397 2HB LYS 50 2HB LYS 50 -11.694 16.322 -14.730 398 1HG LYS 50 1HG LYS 50 -13.813 16.394 -16.925 399 2HG LYS 50 2HG LYS 50 -13.719 15.124 -15.700 400 1HD LYS 50 1HD LYS 50 -13.898 16.836 -13.896 401 2HD LYS 50 2HD LYS 50 -14.080 18.105 -15.122 402 1HE LYS 50 1HE LYS 50 -16.122 16.991 -15.987 403 2HE LYS 50 2HE LYS 50 -15.941 15.712 -14.770 404 1HZ LYS 50 1HZ LYS 50 -17.492 17.369 -14.082 405 2HZ LYS 50 2HZ LYS 50 -16.189 17.376 -13.076 406 3HZ LYS 50 3HZ LYS 50 -16.365 18.562 -14.208 407 H MET 51 H MET 51 -9.294 16.364 -17.028 408 HA MET 51 HA MET 51 -7.511 17.167 -15.065 409 1HB MET 51 1HB MET 51 -7.219 15.328 -16.783 410 2HB MET 51 2HB MET 51 -6.850 16.571 -17.982 411 1HG MET 51 1HG MET 51 -5.020 17.353 -16.281 412 2HG MET 51 2HG MET 51 -5.359 15.830 -15.459 413 1HE MET 51 1HE MET 51 -5.076 16.639 -19.407 414 2HE MET 51 2HE MET 51 -3.901 17.656 -18.532 415 3HE MET 51 3HE MET 51 -3.334 16.337 -19.576 416 H ILE 52 H ILE 52 -7.857 18.569 -18.379 417 HA ILE 52 HA ILE 52 -5.987 20.640 -18.060 418 HB ILE 52 HB ILE 52 -8.496 20.393 -19.764 419 1HG1 ILE 52 1HG1 ILE 52 -5.520 20.331 -20.451 420 2HG1 ILE 52 2HG1 ILE 52 -6.492 18.888 -20.171 421 1HG2 ILE 52 1HG2 ILE 52 -8.126 22.818 -19.445 422 2HG2 ILE 52 2HG2 ILE 52 -6.424 22.628 -19.912 423 3HG2 ILE 52 3HG2 ILE 52 -7.726 22.344 -21.081 424 1HD1 ILE 52 1HD1 ILE 52 -6.330 19.173 -22.529 425 2HD1 ILE 52 2HD1 ILE 52 -7.995 19.594 -22.071 426 3HD1 ILE 52 3HD1 ILE 52 -6.812 20.869 -22.450 427 H SER 53 H SER 53 -9.462 20.604 -17.168 428 HA SER 53 HA SER 53 -9.519 23.342 -16.335 429 1HB SER 53 1HB SER 53 -11.215 21.043 -15.247 430 2HB SER 53 2HB SER 53 -11.591 22.771 -15.194 431 HG SER 53 HG SER 53 -11.249 21.227 -17.564 432 H GLU 54 H GLU 54 -8.897 20.331 -14.443 433 HA GLU 54 HA GLU 54 -8.589 21.667 -11.937 434 1HB GLU 54 1HB GLU 54 -7.312 19.092 -12.963 435 2HB GLU 54 2HB GLU 54 -7.268 19.643 -11.285 436 1HG GLU 54 1HG GLU 54 -9.803 18.959 -12.844 437 2HG GLU 54 2HG GLU 54 -9.023 17.950 -11.627 438 H ILE 55 H ILE 55 -6.187 20.897 -14.487 439 HA ILE 55 HA ILE 55 -3.997 22.051 -12.966 440 HB ILE 55 HB ILE 55 -4.185 21.397 -15.923 441 1HG1 ILE 55 1HG1 ILE 55 -4.586 19.362 -14.654 442 2HG1 ILE 55 2HG1 ILE 55 -3.004 19.324 -15.394 443 1HG2 ILE 55 1HG2 ILE 55 -1.776 21.935 -14.130 444 2HG2 ILE 55 2HG2 ILE 55 -1.686 21.263 -15.774 445 3HG2 ILE 55 3HG2 ILE 55 -2.331 22.884 -15.513 446 1HD1 ILE 55 1HD1 ILE 55 -3.626 19.873 -12.452 447 2HD1 ILE 55 2HD1 ILE 55 -2.934 18.401 -13.141 448 3HD1 ILE 55 3HD1 ILE 55 -1.992 19.897 -13.154 449 H ASP 56 H ASP 56 -6.321 23.378 -15.345 450 HA ASP 56 HA ASP 56 -4.754 25.848 -15.605 451 1HB ASP 56 1HB ASP 56 -5.853 24.812 -17.550 452 2HB ASP 56 2HB ASP 56 -7.431 25.087 -16.800 453 H LYS 57 H LYS 57 -4.838 26.699 -13.496 454 HA LYS 57 HA LYS 57 -7.253 27.058 -11.978 455 1HB LYS 57 1HB LYS 57 -4.481 28.302 -11.837 456 2HB LYS 57 2HB LYS 57 -5.788 28.761 -10.749 457 1HG LYS 57 1HG LYS 57 -4.380 27.160 -9.670 458 2HG LYS 57 2HG LYS 57 -6.001 26.490 -9.895 459 1HD LYS 57 1HD LYS 57 -5.245 25.094 -11.736 460 2HD LYS 57 2HD LYS 57 -3.639 25.852 -11.731 461 1HE LYS 57 1HE LYS 57 -4.864 24.193 -9.474 462 2HE LYS 57 2HE LYS 57 -3.727 23.594 -10.687 463 1HZ LYS 57 1HZ LYS 57 -2.118 25.175 -9.896 464 2HZ LYS 57 2HZ LYS 57 -3.158 25.710 -8.734 465 3HZ LYS 57 3HZ LYS 57 -2.599 24.162 -8.689 466 H ASP 58 H ASP 58 -6.131 28.758 -14.796 467 HA ASP 58 HA ASP 58 -7.502 31.300 -14.098 468 1HB ASP 58 1HB ASP 58 -5.492 31.629 -15.329 469 2HB ASP 58 2HB ASP 58 -5.855 30.323 -16.462 470 H GLY 59 H GLY 59 -7.646 28.488 -16.217 471 1HA GLY 59 1HA GLY 59 -9.569 27.236 -16.482 472 2HA GLY 59 2HA GLY 59 -10.602 28.664 -16.352 473 H SER 60 H SER 60 -8.348 29.845 -18.381 474 HA SER 60 HA SER 60 -10.213 29.574 -20.587 475 1HB SER 60 1HB SER 60 -7.548 31.031 -20.537 476 2HB SER 60 2HB SER 60 -8.861 31.227 -21.710 477 HG SER 60 HG SER 60 -8.853 31.908 -18.966 478 H GLY 61 H GLY 61 -9.055 27.046 -20.081 479 1HA GLY 61 1HA GLY 61 -8.146 25.231 -21.165 480 2HA GLY 61 2HA GLY 61 -8.620 26.066 -22.653 481 H THR 62 H THR 62 -6.164 27.094 -20.266 482 HA THR 62 HA THR 62 -3.949 26.564 -22.198 483 HB THR 62 HB THR 62 -3.026 28.765 -21.408 484 HG1 THR 62 HG1 THR 62 -4.632 28.888 -19.681 485 1HG2 THR 62 1HG2 THR 62 -4.345 30.169 -22.983 486 2HG2 THR 62 2HG2 THR 62 -3.911 28.598 -23.680 487 3HG2 THR 62 3HG2 THR 62 -5.562 28.886 -23.100 488 H ILE 63 H ILE 63 -2.363 25.492 -21.196 489 HA ILE 63 HA ILE 63 -2.199 25.474 -18.220 490 HB ILE 63 HB ILE 63 -0.602 23.850 -20.224 491 1HG1 ILE 63 1HG1 ILE 63 -2.804 23.118 -20.639 492 2HG1 ILE 63 2HG1 ILE 63 -2.059 21.943 -19.555 493 1HG2 ILE 63 1HG2 ILE 63 -1.052 23.545 -17.236 494 2HG2 ILE 63 2HG2 ILE 63 -0.134 22.430 -18.268 495 3HG2 ILE 63 3HG2 ILE 63 0.423 24.094 -18.026 496 1HD1 ILE 63 1HD1 ILE 63 -4.314 22.305 -18.828 497 2HD1 ILE 63 2HD1 ILE 63 -3.267 23.068 -17.625 498 3HD1 ILE 63 3HD1 ILE 63 -4.114 24.062 -18.829 499 H ASP 64 H ASP 64 -1.165 27.325 -17.558 500 HA ASP 64 HA ASP 64 0.976 28.635 -19.008 501 1HB ASP 64 1HB ASP 64 -0.374 29.804 -17.317 502 2HB ASP 64 2HB ASP 64 0.229 28.712 -16.060 503 H PHE 65 H PHE 65 3.250 28.526 -18.606 504 HA PHE 65 HA PHE 65 4.431 26.064 -18.222 505 1HB PHE 65 1HB PHE 65 5.697 27.939 -19.057 506 2HB PHE 65 2HB PHE 65 5.559 28.779 -17.512 507 HD1 PHE 65 HD1 PHE 65 7.606 28.842 -16.342 508 HD2 PHE 65 HD2 PHE 65 6.603 25.272 -18.560 509 HE1 PHE 65 HE1 PHE 65 9.619 27.714 -15.463 510 HE2 PHE 65 HE2 PHE 65 8.586 24.135 -17.609 511 HZ PHE 65 HZ PHE 65 10.101 25.352 -16.074 512 H GLU 66 H GLU 66 3.747 28.393 -15.554 513 HA GLU 66 HA GLU 66 5.010 26.837 -13.527 514 1HB GLU 66 1HB GLU 66 2.646 28.758 -13.332 515 2HB GLU 66 2HB GLU 66 3.584 28.126 -11.968 516 1HG GLU 66 1HG GLU 66 5.652 29.147 -12.917 517 2HG GLU 66 2HG GLU 66 4.699 29.857 -14.228 518 H GLU 67 H GLU 67 1.729 26.682 -14.918 519 HA GLU 67 HA GLU 67 0.671 24.849 -12.936 520 1HB GLU 67 1HB GLU 67 -0.277 25.503 -15.756 521 2HB GLU 67 2HB GLU 67 -1.172 24.586 -14.538 522 1HG GLU 67 1HG GLU 67 -1.266 26.493 -13.041 523 2HG GLU 67 2HG GLU 67 -0.285 27.476 -14.134 524 H PHE 68 H PHE 68 2.041 24.552 -16.228 525 HA PHE 68 HA PHE 68 1.873 21.725 -16.483 526 1HB PHE 68 1HB PHE 68 2.489 23.290 -18.318 527 2HB PHE 68 2HB PHE 68 4.024 23.607 -17.534 528 HD1 PHE 68 HD1 PHE 68 1.935 20.928 -19.109 529 HD2 PHE 68 HD2 PHE 68 5.901 22.185 -17.958 530 HE1 PHE 68 HE1 PHE 68 2.916 19.116 -20.489 531 HE2 PHE 68 HE2 PHE 68 6.867 20.445 -19.448 532 HZ PHE 68 HZ PHE 68 5.396 18.869 -20.634 533 H LEU 69 H LEU 69 4.505 23.770 -15.161 534 HA LEU 69 HA LEU 69 6.276 21.737 -14.401 535 1HB LEU 69 1HB LEU 69 6.440 24.377 -14.386 536 2HB LEU 69 2HB LEU 69 5.929 24.222 -12.705 537 HG LEU 69 HG LEU 69 8.388 23.006 -14.052 538 1HD1 LEU 69 1HD1 LEU 69 9.643 24.576 -12.646 539 2HD1 LEU 69 2HD1 LEU 69 8.476 25.453 -13.652 540 3HD1 LEU 69 3HD1 LEU 69 8.132 25.179 -11.931 541 1HD2 LEU 69 1HD2 LEU 69 7.444 22.769 -11.161 542 2HD2 LEU 69 2HD2 LEU 69 7.763 21.452 -12.321 543 3HD2 LEU 69 3HD2 LEU 69 9.100 22.421 -11.700 544 H THR 70 H THR 70 3.613 23.276 -12.518 545 HA THR 70 HA THR 70 3.858 21.715 -10.189 546 HB THR 70 HB THR 70 1.279 22.824 -11.376 547 HG1 THR 70 HG1 THR 70 2.874 24.428 -11.148 548 1HG2 THR 70 1HG2 THR 70 0.873 21.288 -9.478 549 2HG2 THR 70 2HG2 THR 70 0.587 22.972 -9.009 550 3HG2 THR 70 3HG2 THR 70 2.084 22.162 -8.511 551 H MET 71 H MET 71 1.858 21.046 -13.127 552 HA MET 71 HA MET 71 0.736 18.611 -12.278 553 1HB MET 71 1HB MET 71 0.124 19.918 -14.333 554 2HB MET 71 2HB MET 71 1.621 19.366 -15.091 555 1HG MET 71 1HG MET 71 0.853 17.005 -14.827 556 2HG MET 71 2HG MET 71 -0.641 17.595 -14.095 557 1HE MET 71 1HE MET 71 1.532 17.352 -17.345 558 2HE MET 71 2HE MET 71 0.481 18.127 -18.553 559 3HE MET 71 3HE MET 71 1.260 19.112 -17.299 560 H MET 72 H MET 72 3.805 19.183 -14.080 561 HA MET 72 HA MET 72 4.597 16.426 -14.069 562 1HB MET 72 1HB MET 72 6.229 18.972 -14.361 563 2HB MET 72 2HB MET 72 6.861 17.343 -14.618 564 1HG MET 72 1HG MET 72 4.613 18.676 -16.192 565 2HG MET 72 2HG MET 72 6.252 18.383 -16.745 566 1HE MET 72 1HE MET 72 7.245 15.958 -17.198 567 2HE MET 72 2HE MET 72 6.648 15.270 -15.664 568 3HE MET 72 3HE MET 72 6.261 14.477 -17.205 569 H THR 73 H THR 73 5.035 19.007 -11.664 570 HA THR 73 HA THR 73 6.861 17.556 -9.982 571 HB THR 73 HB THR 73 4.795 19.621 -9.105 572 HG1 THR 73 HG1 THR 73 6.234 20.352 -10.784 573 1HG2 THR 73 1HG2 THR 73 7.447 18.745 -7.892 574 2HG2 THR 73 2HG2 THR 73 6.431 20.083 -7.320 575 3HG2 THR 73 3HG2 THR 73 5.835 18.419 -7.217 576 H ALA 74 H ALA 74 3.274 17.661 -10.181 577 HA ALA 74 HA ALA 74 2.863 15.874 -7.965 578 1HB ALA 74 1HB ALA 74 1.068 16.384 -10.376 579 2HB ALA 74 2HB ALA 74 0.602 15.621 -8.845 580 3HB ALA 74 3HB ALA 74 1.092 17.328 -8.872 581 H LYS 75 H LYS 75 3.056 15.310 -11.511 582 HA LYS 75 HA LYS 75 2.555 12.497 -11.339 583 1HB LYS 75 1HB LYS 75 3.905 14.170 -13.492 584 2HB LYS 75 2HB LYS 75 3.466 12.457 -13.657 585 1HG LYS 75 1HG LYS 75 1.125 12.917 -13.466 586 2HG LYS 75 2HG LYS 75 1.413 14.583 -12.966 587 1HD LYS 75 1HD LYS 75 0.669 14.508 -15.271 588 2HD LYS 75 2HD LYS 75 2.304 15.173 -15.172 589 1HE LYS 75 1HE LYS 75 1.834 12.226 -15.804 590 2HE LYS 75 2HE LYS 75 1.714 13.470 -17.056 591 1HZ LYS 75 1HZ LYS 75 3.879 12.573 -17.013 592 2HZ LYS 75 2HZ LYS 75 3.930 14.157 -16.558 593 3HZ LYS 75 3HZ LYS 75 4.099 12.970 -15.433 594 H MET 76 H MET 76 5.621 14.304 -11.706 595 HA MET 76 HA MET 76 7.761 13.676 -11.858 596 1HB MET 76 1HB MET 76 7.112 11.693 -9.642 597 2HB MET 76 2HB MET 76 8.703 12.343 -10.082 598 1HG MET 76 1HG MET 76 7.633 14.680 -9.665 599 2HG MET 76 2HG MET 76 6.374 13.774 -8.813 600 1HE MET 76 1HE MET 76 8.423 12.180 -5.869 601 2HE MET 76 2HE MET 76 6.831 12.321 -6.653 602 3HE MET 76 3HE MET 76 8.147 11.425 -7.455 Start of MODEL 3 1 H ARG 1 H ARG 1 8.053 18.950 -5.113 2 HA ARG 1 HA ARG 1 8.468 18.810 -7.443 3 1HB ARG 1 1HB ARG 1 8.444 20.758 -8.849 4 2HB ARG 1 2HB ARG 1 6.856 20.495 -8.131 5 1HG ARG 1 1HG ARG 1 7.549 22.299 -6.370 6 2HG ARG 1 2HG ARG 1 8.923 22.632 -7.443 7 1HD ARG 1 1HD ARG 1 7.153 24.175 -8.010 8 2HD ARG 1 2HD ARG 1 7.285 22.977 -9.313 9 HE ARG 1 HE ARG 1 5.372 22.363 -7.162 10 1HH1 ARG 1 1HH1 ARG 1 5.709 23.901 -10.339 11 2HH1 ARG 1 2HH1 ARG 1 4.052 23.620 -10.803 12 1HH2 ARG 1 1HH2 ARG 1 3.203 22.087 -7.707 13 2HH2 ARG 1 2HH2 ARG 1 2.614 22.585 -9.279 14 H VAL 2 H VAL 2 9.362 21.309 -5.069 15 HA VAL 2 HA VAL 2 12.099 21.562 -5.758 16 HB VAL 2 HB VAL 2 12.446 22.166 -3.389 17 1HG1 VAL 2 1HG1 VAL 2 9.996 23.474 -4.650 18 2HG1 VAL 2 2HG1 VAL 2 11.079 24.191 -3.443 19 3HG1 VAL 2 3HG1 VAL 2 11.689 23.822 -5.063 20 1HG2 VAL 2 1HG2 VAL 2 9.480 21.530 -3.002 21 2HG2 VAL 2 2HG2 VAL 2 10.847 20.715 -2.213 22 3HG2 VAL 2 3HG2 VAL 2 10.515 22.410 -1.866 23 H GLY 3 H GLY 3 13.651 20.076 -5.828 24 1HA GLY 3 1HA GLY 3 14.687 18.085 -4.573 25 2HA GLY 3 2HA GLY 3 13.087 17.339 -4.763 26 H LEU 4 H LEU 4 12.422 18.520 -7.336 27 HA LEU 4 HA LEU 4 13.761 16.806 -9.203 28 1HB LEU 4 1HB LEU 4 12.186 19.360 -9.549 29 2HB LEU 4 2HB LEU 4 12.807 18.410 -10.902 30 HG LEU 4 HG LEU 4 10.963 17.226 -8.776 31 1HD1 LEU 4 1HD1 LEU 4 9.176 17.529 -10.450 32 2HD1 LEU 4 2HD1 LEU 4 9.874 19.084 -9.954 33 3HD1 LEU 4 3HD1 LEU 4 10.328 18.371 -11.518 34 1HD2 LEU 4 1HD2 LEU 4 12.240 15.515 -10.057 35 2HD2 LEU 4 2HD2 LEU 4 10.551 15.523 -10.551 36 3HD2 LEU 4 3HD2 LEU 4 11.772 16.303 -11.581 37 H THR 5 H THR 5 15.712 17.067 -10.235 38 HA THR 5 HA THR 5 17.538 19.066 -9.298 39 HB THR 5 HB THR 5 19.012 18.205 -11.128 40 HG1 THR 5 HG1 THR 5 16.885 16.450 -11.728 41 1HG2 THR 5 1HG2 THR 5 19.185 15.891 -10.337 42 2HG2 THR 5 2HG2 THR 5 18.930 17.000 -8.977 43 3HG2 THR 5 3HG2 THR 5 17.591 15.996 -9.564 44 H GLU 6 H GLU 6 18.478 20.854 -10.446 45 HA GLU 6 HA GLU 6 16.849 22.465 -12.076 46 1HB GLU 6 1HB GLU 6 19.874 22.275 -11.755 47 2HB GLU 6 2HB GLU 6 19.099 23.458 -12.814 48 1HG GLU 6 1HG GLU 6 19.595 24.434 -10.609 49 2HG GLU 6 2HG GLU 6 17.870 24.455 -10.987 50 H GLU 7 H GLU 7 19.010 19.799 -12.965 51 HA GLU 7 HA GLU 7 18.901 20.111 -15.793 52 1HB GLU 7 1HB GLU 7 19.113 17.591 -14.074 53 2HB GLU 7 2HB GLU 7 19.443 17.671 -15.810 54 1HG GLU 7 1HG GLU 7 21.316 19.181 -15.463 55 2HG GLU 7 2HG GLU 7 20.961 19.337 -13.738 56 H GLN 8 H GLN 8 16.855 18.011 -13.626 57 HA GLN 8 HA GLN 8 15.017 17.227 -15.643 58 1HB GLN 8 1HB GLN 8 14.706 17.628 -12.653 59 2HB GLN 8 2HB GLN 8 13.391 17.020 -13.665 60 1HG GLN 8 1HG GLN 8 14.588 15.064 -14.301 61 2HG GLN 8 2HG GLN 8 16.122 15.691 -13.696 62 1HE2 GLN 8 1HE2 GLN 8 13.452 13.704 -12.871 63 2HE2 GLN 8 2HE2 GLN 8 13.776 13.629 -11.150 64 H LYS 9 H LYS 9 14.946 20.114 -13.480 65 HA LYS 9 HA LYS 9 12.472 21.124 -14.406 66 1HB LYS 9 1HB LYS 9 14.917 22.476 -13.241 67 2HB LYS 9 2HB LYS 9 13.400 23.332 -13.550 68 1HG LYS 9 1HG LYS 9 12.196 22.114 -11.946 69 2HG LYS 9 2HG LYS 9 13.331 20.765 -11.941 70 1HD LYS 9 1HD LYS 9 13.457 22.036 -9.861 71 2HD LYS 9 2HD LYS 9 14.990 21.996 -10.719 72 1HE LYS 9 1HE LYS 9 14.616 24.296 -11.565 73 2HE LYS 9 2HE LYS 9 13.037 24.342 -10.756 74 1HZ LYS 9 1HZ LYS 9 15.643 24.020 -9.419 75 2HZ LYS 9 2HZ LYS 9 14.751 25.404 -9.480 76 3HZ LYS 9 3HZ LYS 9 14.176 24.088 -8.674 77 H GLN 10 H GLN 10 15.812 21.689 -15.673 78 HA GLN 10 HA GLN 10 14.984 23.518 -17.675 79 1HB GLN 10 1HB GLN 10 17.114 23.718 -18.197 80 2HB GLN 10 2HB GLN 10 17.409 22.761 -16.763 81 1HG GLN 10 1HG GLN 10 18.822 21.899 -18.405 82 2HG GLN 10 2HG GLN 10 17.549 20.701 -18.260 83 1HE2 GLN 10 1HE2 GLN 10 18.260 23.728 -20.168 84 2HE2 GLN 10 2HE2 GLN 10 17.729 23.018 -21.693 85 H GLU 11 H GLU 11 15.380 19.947 -17.786 86 HA GLU 11 HA GLU 11 14.676 19.648 -20.528 87 1HB GLU 11 1HB GLU 11 14.219 17.785 -18.157 88 2HB GLU 11 2HB GLU 11 13.982 17.320 -19.842 89 1HG GLU 11 1HG GLU 11 16.637 18.300 -18.684 90 2HG GLU 11 2HG GLU 11 16.189 16.608 -18.900 91 H ILE 12 H ILE 12 12.602 19.623 -17.608 92 HA ILE 12 HA ILE 12 10.130 19.278 -18.980 93 HB ILE 12 HB ILE 12 10.775 20.570 -16.308 94 1HG1 ILE 12 1HG1 ILE 12 9.592 17.825 -16.965 95 2HG1 ILE 12 2HG1 ILE 12 11.307 18.070 -16.715 96 1HG2 ILE 12 1HG2 ILE 12 8.065 19.647 -17.368 97 2HG2 ILE 12 2HG2 ILE 12 8.389 20.284 -15.750 98 3HG2 ILE 12 3HG2 ILE 12 8.537 21.345 -17.140 99 1HD1 ILE 12 1HD1 ILE 12 9.144 18.517 -14.628 100 2HD1 ILE 12 2HD1 ILE 12 10.394 17.267 -14.665 101 3HD1 ILE 12 3HD1 ILE 12 10.855 18.962 -14.423 102 H ARG 13 H ARG 13 11.981 22.267 -18.170 103 HA ARG 13 HA ARG 13 10.031 24.026 -19.242 104 1HB ARG 13 1HB ARG 13 11.885 24.777 -17.769 105 2HB ARG 13 2HB ARG 13 13.040 24.418 -19.060 106 1HG ARG 13 1HG ARG 13 12.665 26.767 -19.124 107 2HG ARG 13 2HG ARG 13 11.871 26.076 -20.526 108 1HD ARG 13 1HD ARG 13 9.737 26.095 -18.830 109 2HD ARG 13 2HD ARG 13 10.719 27.339 -18.052 110 HE ARG 13 HE ARG 13 10.400 27.614 -20.958 111 1HH1 ARG 13 1HH1 ARG 13 8.896 28.330 -17.835 112 2HH1 ARG 13 2HH1 ARG 13 7.935 29.652 -18.445 113 1HH2 ARG 13 1HH2 ARG 13 8.964 29.123 -21.804 114 2HH2 ARG 13 2HH2 ARG 13 8.037 30.178 -20.759 115 H GLU 14 H GLU 14 12.871 22.468 -20.856 116 HA GLU 14 HA GLU 14 12.410 23.654 -23.401 117 1HB GLU 14 1HB GLU 14 13.624 20.948 -22.685 118 2HB GLU 14 2HB GLU 14 13.559 21.628 -24.319 119 1HG GLU 14 1HG GLU 14 14.783 23.661 -23.496 120 2HG GLU 14 2HG GLU 14 14.975 22.874 -21.923 121 H ALA 15 H ALA 15 11.147 20.569 -22.051 122 HA ALA 15 HA ALA 15 9.537 19.824 -24.245 123 1HB ALA 15 1HB ALA 15 9.967 18.374 -22.299 124 2HB ALA 15 2HB ALA 15 8.959 19.420 -21.278 125 3HB ALA 15 3HB ALA 15 8.229 18.528 -22.626 126 H PHE 16 H PHE 16 8.675 21.876 -21.423 127 HA PHE 16 HA PHE 16 6.045 22.489 -22.107 128 1HB PHE 16 1HB PHE 16 7.016 23.115 -19.973 129 2HB PHE 16 2HB PHE 16 8.155 24.196 -20.736 130 HD1 PHE 16 HD1 PHE 16 4.513 23.695 -20.154 131 HD2 PHE 16 HD2 PHE 16 7.632 26.471 -21.220 132 HE1 PHE 16 HE1 PHE 16 2.909 25.577 -19.943 133 HE2 PHE 16 HE2 PHE 16 6.017 28.342 -21.047 134 HZ PHE 16 HZ PHE 16 3.683 27.908 -20.348 135 H ASP 17 H ASP 17 8.989 24.372 -22.926 136 HA ASP 17 HA ASP 17 7.687 26.334 -24.505 137 1HB ASP 17 1HB ASP 17 10.554 25.296 -24.578 138 2HB ASP 17 2HB ASP 17 9.982 26.686 -25.510 139 H LEU 18 H LEU 18 9.189 23.219 -25.494 140 HA LEU 18 HA LEU 18 8.731 23.506 -28.275 141 1HB LEU 18 1HB LEU 18 10.147 21.788 -27.348 142 2HB LEU 18 2HB LEU 18 8.792 20.984 -26.555 143 HG LEU 18 HG LEU 18 8.616 21.429 -29.541 144 1HD1 LEU 18 1HD1 LEU 18 9.886 19.389 -29.987 145 2HD1 LEU 18 2HD1 LEU 18 10.908 20.633 -29.247 146 3HD1 LEU 18 3HD1 LEU 18 10.321 19.267 -28.265 147 1HD2 LEU 18 1HD2 LEU 18 7.590 19.143 -29.455 148 2HD2 LEU 18 2HD2 LEU 18 7.823 19.115 -27.697 149 3HD2 LEU 18 3HD2 LEU 18 6.713 20.281 -28.444 150 H PHE 19 H PHE 19 6.643 21.953 -25.759 151 HA PHE 19 HA PHE 19 4.528 21.389 -27.573 152 1HB PHE 19 1HB PHE 19 4.457 21.941 -24.587 153 2HB PHE 19 2HB PHE 19 3.105 21.272 -25.505 154 HD1 PHE 19 HD1 PHE 19 4.583 20.119 -23.028 155 HD2 PHE 19 HD2 PHE 19 4.759 19.275 -27.262 156 HE1 PHE 19 HE1 PHE 19 4.992 17.719 -22.562 157 HE2 PHE 19 HE2 PHE 19 5.325 16.947 -26.782 158 HZ PHE 19 HZ PHE 19 5.491 16.150 -24.426 159 H ASP 20 H ASP 20 5.225 24.334 -25.684 160 HA ASP 20 HA ASP 20 2.854 25.711 -26.682 161 1HB ASP 20 1HB ASP 20 3.964 26.333 -24.546 162 2HB ASP 20 2HB ASP 20 5.395 26.834 -25.456 163 H THR 21 H THR 21 3.638 24.632 -28.891 164 HA THR 21 HA THR 21 5.610 25.776 -30.512 165 HB THR 21 HB THR 21 4.160 25.075 -32.410 166 HG1 THR 21 HG1 THR 21 2.259 24.827 -30.335 167 1HG2 THR 21 1HG2 THR 21 4.219 22.985 -30.188 168 2HG2 THR 21 2HG2 THR 21 4.137 22.699 -31.931 169 3HG2 THR 21 3HG2 THR 21 5.599 23.408 -31.223 170 H ASP 22 H ASP 22 2.373 26.999 -29.717 171 HA ASP 22 HA ASP 22 2.296 29.144 -31.593 172 1HB ASP 22 1HB ASP 22 0.337 28.246 -30.376 173 2HB ASP 22 2HB ASP 22 0.989 28.868 -28.851 174 H GLY 23 H GLY 23 4.118 28.784 -28.601 175 1HA GLY 23 1HA GLY 23 5.483 30.195 -27.465 176 2HA GLY 23 2HA GLY 23 5.473 31.280 -28.866 177 H SER 24 H SER 24 2.468 30.313 -27.129 178 HA SER 24 HA SER 24 1.684 33.011 -26.690 179 1HB SER 24 1HB SER 24 0.123 31.373 -25.037 180 2HB SER 24 2HB SER 24 -0.183 31.804 -26.721 181 HG SER 24 HG SER 24 0.765 29.389 -25.695 182 H GLY 25 H GLY 25 3.592 30.776 -24.843 183 1HA GLY 25 1HA GLY 25 4.893 31.368 -22.921 184 2HA GLY 25 2HA GLY 25 3.707 32.604 -22.472 185 H THR 26 H THR 26 1.753 30.220 -23.539 186 HA THR 26 HA THR 26 1.689 28.485 -21.164 187 HB THR 26 HB THR 26 -0.635 28.945 -20.831 188 HG1 THR 26 HG1 THR 26 -1.689 30.484 -21.955 189 1HG2 THR 26 1HG2 THR 26 0.794 31.630 -20.773 190 2HG2 THR 26 2HG2 THR 26 -0.537 31.080 -19.746 191 3HG2 THR 26 3HG2 THR 26 1.071 30.351 -19.579 192 H ILE 27 H ILE 27 0.757 26.471 -21.696 193 HA ILE 27 HA ILE 27 0.805 25.818 -24.586 194 HB ILE 27 HB ILE 27 0.450 24.149 -22.091 195 1HG1 ILE 27 1HG1 ILE 27 2.704 24.297 -24.147 196 2HG1 ILE 27 2HG1 ILE 27 2.728 25.134 -22.591 197 1HG2 ILE 27 1HG2 ILE 27 0.730 23.180 -24.963 198 2HG2 ILE 27 2HG2 ILE 27 0.535 22.171 -23.523 199 3HG2 ILE 27 3HG2 ILE 27 -0.800 23.158 -24.053 200 1HD1 ILE 27 1HD1 ILE 27 3.961 23.092 -22.405 201 2HD1 ILE 27 2HD1 ILE 27 2.483 22.943 -21.427 202 3HD1 ILE 27 3HD1 ILE 27 2.622 22.120 -23.001 203 H ASP 28 H ASP 28 -1.124 26.032 -25.778 204 HA ASP 28 HA ASP 28 -3.688 26.402 -24.455 205 1HB ASP 28 1HB ASP 28 -3.188 27.391 -26.655 206 2HB ASP 28 2HB ASP 28 -3.047 25.771 -27.358 207 H ALA 29 H ALA 29 -5.383 24.917 -24.151 208 HA ALA 29 HA ALA 29 -5.119 22.301 -23.609 209 1HB ALA 29 1HB ALA 29 -7.500 22.024 -24.254 210 2HB ALA 29 2HB ALA 29 -7.212 23.539 -23.376 211 3HB ALA 29 3HB ALA 29 -7.432 23.561 -25.140 212 H LYS 30 H LYS 30 -5.641 23.471 -26.986 213 HA LYS 30 HA LYS 30 -5.730 20.901 -28.221 214 1HB LYS 30 1HB LYS 30 -4.814 23.597 -29.292 215 2HB LYS 30 2HB LYS 30 -5.125 22.164 -30.284 216 1HG LYS 30 1HG LYS 30 -7.463 22.089 -29.513 217 2HG LYS 30 2HG LYS 30 -7.229 23.535 -28.529 218 1HD LYS 30 1HD LYS 30 -6.867 23.425 -31.560 219 2HD LYS 30 2HD LYS 30 -8.342 23.940 -30.729 220 1HE LYS 30 1HE LYS 30 -7.062 25.765 -29.591 221 2HE LYS 30 2HE LYS 30 -5.620 25.311 -30.518 222 1HZ LYS 30 1HZ LYS 30 -6.826 25.780 -32.516 223 2HZ LYS 30 2HZ LYS 30 -8.167 26.208 -31.658 224 3HZ LYS 30 3HZ LYS 30 -6.790 27.101 -31.532 225 H GLU 31 H GLU 31 -2.974 23.085 -27.514 226 HA GLU 31 HA GLU 31 -0.962 21.465 -28.812 227 1HB GLU 31 1HB GLU 31 -0.771 23.558 -26.612 228 2HB GLU 31 2HB GLU 31 0.603 22.802 -27.424 229 1HG GLU 31 1HG GLU 31 -0.108 23.742 -29.579 230 2HG GLU 31 2HG GLU 31 -1.531 24.475 -28.823 231 H LEU 32 H LEU 32 -2.357 21.652 -25.509 232 HA LEU 32 HA LEU 32 -0.562 19.736 -24.377 233 1HB LEU 32 1HB LEU 32 -2.294 21.336 -23.190 234 2HB LEU 32 2HB LEU 32 -3.413 19.988 -23.438 235 HG LEU 32 HG LEU 32 -1.540 18.521 -22.318 236 1HD1 LEU 32 1HD1 LEU 32 -0.168 19.763 -20.659 237 2HD1 LEU 32 2HD1 LEU 32 0.317 20.088 -22.320 238 3HD1 LEU 32 3HD1 LEU 32 -0.647 21.288 -21.425 239 1HD2 LEU 32 1HD2 LEU 32 -2.414 19.135 -20.059 240 2HD2 LEU 32 2HD2 LEU 32 -3.166 20.577 -20.773 241 3HD2 LEU 32 3HD2 LEU 32 -3.694 18.959 -21.271 242 H LYS 33 H LYS 33 -3.724 19.361 -26.052 243 HA LYS 33 HA LYS 33 -3.869 16.513 -25.795 244 1HB LYS 33 1HB LYS 33 -5.726 17.937 -26.403 245 2HB LYS 33 2HB LYS 33 -5.003 18.259 -27.995 246 1HG LYS 33 1HG LYS 33 -5.056 15.822 -28.504 247 2HG LYS 33 2HG LYS 33 -5.776 15.500 -26.921 248 1HD LYS 33 1HD LYS 33 -7.029 17.222 -29.113 249 2HD LYS 33 2HD LYS 33 -7.405 15.519 -28.816 250 1HE LYS 33 1HE LYS 33 -8.156 16.116 -26.490 251 2HE LYS 33 2HE LYS 33 -7.911 17.830 -26.881 252 1HZ LYS 33 1HZ LYS 33 -9.503 17.603 -28.631 253 2HZ LYS 33 2HZ LYS 33 -9.740 16.011 -28.270 254 3HZ LYS 33 3HZ LYS 33 -10.161 17.176 -27.183 255 H VAL 34 H VAL 34 -2.393 18.552 -28.384 256 HA VAL 34 HA VAL 34 -1.353 16.418 -29.941 257 HB VAL 34 HB VAL 34 -0.285 19.216 -29.417 258 1HG1 VAL 34 1HG1 VAL 34 1.658 17.892 -30.070 259 2HG1 VAL 34 2HG1 VAL 34 0.737 17.140 -31.394 260 3HG1 VAL 34 3HG1 VAL 34 1.130 18.870 -31.442 261 1HG2 VAL 34 1HG2 VAL 34 -2.469 18.987 -30.655 262 2HG2 VAL 34 2HG2 VAL 34 -1.172 19.682 -31.637 263 3HG2 VAL 34 3HG2 VAL 34 -1.633 17.984 -31.856 264 H ALA 35 H ALA 35 0.154 18.103 -27.143 265 HA ALA 35 HA ALA 35 2.510 16.599 -26.981 266 1HB ALA 35 1HB ALA 35 0.874 17.760 -24.678 267 2HB ALA 35 2HB ALA 35 2.556 17.256 -24.612 268 3HB ALA 35 3HB ALA 35 2.081 18.622 -25.645 269 H MET 36 H MET 36 -0.617 15.955 -25.314 270 HA MET 36 HA MET 36 0.154 13.513 -24.114 271 1HB MET 36 1HB MET 36 -2.465 14.817 -24.798 272 2HB MET 36 2HB MET 36 -2.463 13.171 -24.179 273 1HG MET 36 1HG MET 36 -1.080 13.820 -22.257 274 2HG MET 36 2HG MET 36 -1.087 15.501 -22.801 275 1HE MET 36 1HE MET 36 -3.045 17.022 -22.725 276 2HE MET 36 2HE MET 36 -4.103 15.979 -23.679 277 3HE MET 36 3HE MET 36 -4.683 16.650 -22.136 278 H ARG 37 H ARG 37 -1.363 14.032 -27.336 279 HA ARG 37 HA ARG 37 -1.443 11.279 -28.105 280 1HB ARG 37 1HB ARG 37 -1.109 13.786 -29.762 281 2HB ARG 37 2HB ARG 37 -1.217 12.140 -30.409 282 1HG ARG 37 1HG ARG 37 -3.358 11.853 -29.004 283 2HG ARG 37 2HG ARG 37 -3.337 13.608 -28.771 284 1HD ARG 37 1HD ARG 37 -3.280 12.127 -31.415 285 2HD ARG 37 2HD ARG 37 -4.747 12.808 -30.678 286 HE ARG 37 HE ARG 37 -2.843 14.889 -30.854 287 1HH1 ARG 37 1HH1 ARG 37 -4.763 12.861 -33.002 288 2HH1 ARG 37 2HH1 ARG 37 -4.892 14.052 -34.269 289 1HH2 ARG 37 1HH2 ARG 37 -3.007 16.483 -32.501 290 2HH2 ARG 37 2HH2 ARG 37 -3.869 16.147 -33.976 291 H ALA 38 H ALA 38 1.217 13.702 -28.523 292 HA ALA 38 HA ALA 38 3.076 11.888 -29.670 293 1HB ALA 38 1HB ALA 38 4.782 13.510 -29.046 294 2HB ALA 38 2HB ALA 38 3.346 14.344 -29.673 295 3HB ALA 38 3HB ALA 38 3.670 14.316 -27.927 296 H LEU 39 H LEU 39 2.322 12.571 -26.265 297 HA LEU 39 HA LEU 39 4.354 10.812 -25.163 298 1HB LEU 39 1HB LEU 39 1.851 12.068 -24.001 299 2HB LEU 39 2HB LEU 39 3.022 11.174 -23.046 300 HG LEU 39 HG LEU 39 3.859 13.622 -24.646 301 1HD1 LEU 39 1HD1 LEU 39 2.010 14.353 -23.174 302 2HD1 LEU 39 2HD1 LEU 39 2.767 13.533 -21.798 303 3HD1 LEU 39 3HD1 LEU 39 3.557 14.931 -22.555 304 1HD2 LEU 39 1HD2 LEU 39 5.654 13.709 -22.968 305 2HD2 LEU 39 2HD2 LEU 39 5.000 12.266 -22.169 306 3HD2 LEU 39 3HD2 LEU 39 5.663 12.155 -23.814 307 H GLY 40 H GLY 40 1.603 9.994 -26.936 308 1HA GLY 40 1HA GLY 40 0.777 7.921 -27.353 309 2HA GLY 40 2HA GLY 40 1.812 7.233 -26.097 310 H PHE 41 H PHE 41 -0.382 9.904 -25.364 311 HA PHE 41 HA PHE 41 -2.040 8.233 -23.572 312 1HB PHE 41 1HB PHE 41 -2.101 11.110 -24.484 313 2HB PHE 41 2HB PHE 41 -3.402 10.441 -23.554 314 HD1 PHE 41 HD1 PHE 41 -3.431 11.348 -21.420 315 HD2 PHE 41 HD2 PHE 41 0.383 10.277 -23.150 316 HE1 PHE 41 HE1 PHE 41 -2.272 12.199 -19.414 317 HE2 PHE 41 HE2 PHE 41 1.523 11.110 -21.130 318 HZ PHE 41 HZ PHE 41 0.208 12.118 -19.273 319 H GLU 42 H GLU 42 -4.411 8.296 -23.853 320 HA GLU 42 HA GLU 42 -5.370 8.302 -26.695 321 1HB GLU 42 1HB GLU 42 -6.453 6.926 -24.205 322 2HB GLU 42 2HB GLU 42 -7.232 6.956 -25.795 323 1HG GLU 42 1HG GLU 42 -5.289 5.774 -26.782 324 2HG GLU 42 2HG GLU 42 -4.481 5.756 -25.206 325 HA PRO 43 HA PRO 43 -7.067 12.179 -24.933 326 1HB PRO 43 1HB PRO 43 -8.031 12.237 -27.808 327 2HB PRO 43 2HB PRO 43 -7.537 13.611 -26.775 328 1HG PRO 43 1HG PRO 43 -5.775 12.551 -28.509 329 2HG PRO 43 2HG PRO 43 -5.235 12.869 -26.830 330 1HD PRO 43 1HD PRO 43 -6.100 10.224 -28.059 331 2HD PRO 43 2HD PRO 43 -4.726 10.589 -26.964 332 H LYS 44 H LYS 44 -8.426 10.360 -23.787 333 HA LYS 44 HA LYS 44 -11.194 10.034 -24.578 334 1HB LYS 44 1HB LYS 44 -9.717 9.765 -21.932 335 2HB LYS 44 2HB LYS 44 -11.421 9.335 -22.172 336 1HG LYS 44 1HG LYS 44 -10.793 7.641 -23.830 337 2HG LYS 44 2HG LYS 44 -9.089 8.122 -23.733 338 1HD LYS 44 1HD LYS 44 -9.025 7.499 -21.335 339 2HD LYS 44 2HD LYS 44 -10.723 6.985 -21.424 340 1HE LYS 44 1HE LYS 44 -10.117 5.286 -23.142 341 2HE LYS 44 2HE LYS 44 -8.424 5.808 -23.065 342 1HZ LYS 44 1HZ LYS 44 -8.391 5.154 -20.769 343 2HZ LYS 44 2HZ LYS 44 -9.961 4.658 -20.846 344 3HZ LYS 44 3HZ LYS 44 -8.808 3.887 -21.736 345 H LYS 45 H LYS 45 -11.744 12.118 -25.174 346 HA LYS 45 HA LYS 45 -11.487 14.539 -24.411 347 1HB LYS 45 1HB LYS 45 -14.279 13.378 -24.708 348 2HB LYS 45 2HB LYS 45 -13.844 15.087 -24.887 349 1HG LYS 45 1HG LYS 45 -12.259 14.414 -26.745 350 2HG LYS 45 2HG LYS 45 -12.933 12.780 -26.675 351 1HD LYS 45 1HD LYS 45 -14.503 15.332 -27.260 352 2HD LYS 45 2HD LYS 45 -13.969 14.132 -28.446 353 1HE LYS 45 1HE LYS 45 -15.348 12.391 -27.251 354 2HE LYS 45 2HE LYS 45 -15.977 13.663 -26.187 355 1HZ LYS 45 1HZ LYS 45 -16.270 13.582 -29.101 356 2HZ LYS 45 2HZ LYS 45 -17.436 13.237 -27.990 357 3HZ LYS 45 3HZ LYS 45 -16.839 14.768 -28.106 358 H GLU 46 H GLU 46 -13.798 12.578 -22.465 359 HA GLU 46 HA GLU 46 -14.426 14.654 -20.613 360 1HB GLU 46 1HB GLU 46 -14.557 11.616 -20.289 361 2HB GLU 46 2HB GLU 46 -15.264 12.806 -19.195 362 1HG GLU 46 1HG GLU 46 -17.021 12.012 -20.606 363 2HG GLU 46 2HG GLU 46 -16.683 13.688 -21.047 364 H GLU 47 H GLU 47 -11.978 12.067 -20.543 365 HA GLU 47 HA GLU 47 -11.040 12.526 -17.846 366 1HB GLU 47 1HB GLU 47 -10.780 10.399 -19.183 367 2HB GLU 47 2HB GLU 47 -9.634 11.253 -20.231 368 1HG GLU 47 1HG GLU 47 -8.137 11.630 -18.288 369 2HG GLU 47 2HG GLU 47 -9.278 10.747 -17.258 370 H ILE 48 H ILE 48 -10.013 13.468 -21.127 371 HA ILE 48 HA ILE 48 -7.746 15.044 -20.450 372 HB ILE 48 HB ILE 48 -9.744 15.214 -22.737 373 1HG1 ILE 48 1HG1 ILE 48 -8.341 13.115 -22.529 374 2HG1 ILE 48 2HG1 ILE 48 -8.232 14.006 -24.046 375 1HG2 ILE 48 1HG2 ILE 48 -7.158 16.753 -22.387 376 2HG2 ILE 48 2HG2 ILE 48 -7.968 16.514 -23.953 377 3HG2 ILE 48 3HG2 ILE 48 -8.792 17.390 -22.664 378 1HD1 ILE 48 1HD1 ILE 48 -6.079 14.904 -23.477 379 2HD1 ILE 48 2HD1 ILE 48 -6.173 14.285 -21.811 380 3HD1 ILE 48 3HD1 ILE 48 -6.019 13.166 -23.166 381 H LYS 49 H LYS 49 -11.190 16.096 -20.898 382 HA LYS 49 HA LYS 49 -10.763 18.784 -20.294 383 1HB LYS 49 1HB LYS 49 -12.759 17.896 -21.389 384 2HB LYS 49 2HB LYS 49 -13.166 16.942 -19.967 385 1HG LYS 49 1HG LYS 49 -14.569 18.898 -20.132 386 2HG LYS 49 2HG LYS 49 -13.618 18.892 -18.654 387 1HD LYS 49 1HD LYS 49 -13.745 21.156 -19.644 388 2HD LYS 49 2HD LYS 49 -12.086 20.593 -19.537 389 1HE LYS 49 1HE LYS 49 -12.534 21.737 -21.677 390 2HE LYS 49 2HE LYS 49 -12.063 20.058 -21.950 391 1HZ LYS 49 1HZ LYS 49 -14.369 19.516 -22.228 392 2HZ LYS 49 2HZ LYS 49 -14.820 21.077 -21.943 393 3HZ LYS 49 3HZ LYS 49 -13.932 20.705 -23.281 394 H LYS 50 H LYS 50 -11.714 16.057 -18.121 395 HA LYS 50 HA LYS 50 -11.892 17.558 -15.727 396 1HB LYS 50 1HB LYS 50 -11.134 14.665 -16.263 397 2HB LYS 50 2HB LYS 50 -11.313 15.327 -14.630 398 1HG LYS 50 1HG LYS 50 -13.623 15.892 -14.989 399 2HG LYS 50 2HG LYS 50 -13.523 15.529 -16.717 400 1HD LYS 50 1HD LYS 50 -13.039 13.147 -16.202 401 2HD LYS 50 2HD LYS 50 -13.171 13.497 -14.465 402 1HE LYS 50 1HE LYS 50 -15.531 14.223 -14.800 403 2HE LYS 50 2HE LYS 50 -15.390 13.888 -16.537 404 1HZ LYS 50 1HZ LYS 50 -16.428 12.100 -15.370 405 2HZ LYS 50 2HZ LYS 50 -14.991 11.598 -16.001 406 3HZ LYS 50 3HZ LYS 50 -15.120 11.907 -14.387 407 H MET 51 H MET 51 -9.013 15.718 -16.985 408 HA MET 51 HA MET 51 -7.224 16.478 -14.999 409 1HB MET 51 1HB MET 51 -6.867 14.786 -16.860 410 2HB MET 51 2HB MET 51 -6.587 16.139 -17.958 411 1HG MET 51 1HG MET 51 -4.826 16.872 -16.086 412 2HG MET 51 2HG MET 51 -4.997 15.196 -15.577 413 1HE MET 51 1HE MET 51 -4.888 16.719 -19.317 414 2HE MET 51 2HE MET 51 -3.849 17.724 -18.274 415 3HE MET 51 3HE MET 51 -3.127 16.693 -19.528 416 H ILE 52 H ILE 52 -7.759 18.086 -18.182 417 HA ILE 52 HA ILE 52 -6.000 20.242 -17.814 418 HB ILE 52 HB ILE 52 -8.566 19.922 -19.413 419 1HG1 ILE 52 1HG1 ILE 52 -5.616 20.194 -20.175 420 2HG1 ILE 52 2HG1 ILE 52 -6.488 18.664 -20.044 421 1HG2 ILE 52 1HG2 ILE 52 -6.751 22.368 -19.432 422 2HG2 ILE 52 2HG2 ILE 52 -8.063 22.045 -20.580 423 3HG2 ILE 52 3HG2 ILE 52 -8.442 22.332 -18.897 424 1HD1 ILE 52 1HD1 ILE 52 -6.401 19.203 -22.357 425 2HD1 ILE 52 2HD1 ILE 52 -8.074 19.510 -21.837 426 3HD1 ILE 52 3HD1 ILE 52 -6.943 20.862 -22.088 427 H SER 53 H SER 53 -9.487 20.050 -16.897 428 HA SER 53 HA SER 53 -9.595 22.684 -15.854 429 1HB SER 53 1HB SER 53 -11.199 20.250 -14.937 430 2HB SER 53 2HB SER 53 -11.617 21.957 -14.692 431 HG SER 53 HG SER 53 -11.406 20.556 -17.157 432 H GLU 54 H GLU 54 -8.844 19.588 -14.158 433 HA GLU 54 HA GLU 54 -8.505 20.759 -11.583 434 1HB GLU 54 1HB GLU 54 -7.195 18.310 -12.845 435 2HB GLU 54 2HB GLU 54 -7.050 18.749 -11.140 436 1HG GLU 54 1HG GLU 54 -9.686 18.135 -12.558 437 2HG GLU 54 2HG GLU 54 -8.792 17.029 -11.514 438 H ILE 55 H ILE 55 -6.139 20.311 -14.251 439 HA ILE 55 HA ILE 55 -3.946 21.429 -12.702 440 HB ILE 55 HB ILE 55 -4.337 20.989 -15.684 441 1HG1 ILE 55 1HG1 ILE 55 -4.359 18.879 -14.409 442 2HG1 ILE 55 2HG1 ILE 55 -2.962 19.027 -15.459 443 1HG2 ILE 55 1HG2 ILE 55 -1.829 21.779 -14.163 444 2HG2 ILE 55 2HG2 ILE 55 -1.829 21.119 -15.815 445 3HG2 ILE 55 3HG2 ILE 55 -2.639 22.647 -15.479 446 1HD1 ILE 55 1HD1 ILE 55 -3.006 19.402 -12.427 447 2HD1 ILE 55 2HD1 ILE 55 -2.332 18.042 -13.332 448 3HD1 ILE 55 3HD1 ILE 55 -1.569 19.634 -13.447 449 H ASP 56 H ASP 56 -6.405 22.823 -14.868 450 HA ASP 56 HA ASP 56 -4.922 25.265 -15.275 451 1HB ASP 56 1HB ASP 56 -6.372 24.266 -16.984 452 2HB ASP 56 2HB ASP 56 -7.791 24.533 -15.951 453 H LYS 57 H LYS 57 -4.648 25.632 -12.921 454 HA LYS 57 HA LYS 57 -6.807 26.681 -11.318 455 1HB LYS 57 1HB LYS 57 -3.844 27.378 -11.181 456 2HB LYS 57 2HB LYS 57 -5.047 27.601 -9.911 457 1HG LYS 57 1HG LYS 57 -3.991 24.947 -10.985 458 2HG LYS 57 2HG LYS 57 -3.651 25.698 -9.423 459 1HD LYS 57 1HD LYS 57 -6.182 25.568 -8.953 460 2HD LYS 57 2HD LYS 57 -6.291 24.514 -10.376 461 1HE LYS 57 1HE LYS 57 -4.599 24.021 -7.876 462 2HE LYS 57 2HE LYS 57 -6.101 23.191 -8.316 463 1HZ LYS 57 1HZ LYS 57 -3.606 23.097 -9.859 464 2HZ LYS 57 2HZ LYS 57 -4.196 21.899 -8.890 465 3HZ LYS 57 3HZ LYS 57 -5.019 22.340 -10.249 466 H ASP 58 H ASP 58 -4.561 28.151 -13.636 467 HA ASP 58 HA ASP 58 -5.885 30.835 -13.321 468 1HB ASP 58 1HB ASP 58 -3.788 30.882 -12.150 469 2HB ASP 58 2HB ASP 58 -2.952 30.043 -13.464 470 H GLY 59 H GLY 59 -3.990 28.701 -15.462 471 1HA GLY 59 1HA GLY 59 -3.570 30.367 -17.575 472 2HA GLY 59 2HA GLY 59 -3.662 28.617 -17.652 473 H SER 60 H SER 60 -6.703 28.979 -16.888 474 HA SER 60 HA SER 60 -8.720 29.139 -17.945 475 1HB SER 60 1HB SER 60 -7.480 31.759 -18.880 476 2HB SER 60 2HB SER 60 -9.210 31.384 -18.813 477 HG SER 60 HG SER 60 -7.402 31.472 -16.611 478 H GLY 61 H GLY 61 -7.801 27.291 -19.366 479 1HA GLY 61 1HA GLY 61 -8.421 26.401 -21.490 480 2HA GLY 61 2HA GLY 61 -8.299 27.996 -22.241 481 H THR 62 H THR 62 -5.673 28.484 -20.720 482 HA THR 62 HA THR 62 -3.931 26.638 -22.264 483 HB THR 62 HB THR 62 -2.232 28.286 -22.303 484 HG1 THR 62 HG1 THR 62 -3.980 29.872 -20.702 485 1HG2 THR 62 1HG2 THR 62 -3.213 30.054 -23.664 486 2HG2 THR 62 2HG2 THR 62 -4.045 28.543 -24.046 487 3HG2 THR 62 3HG2 THR 62 -4.828 29.747 -23.008 488 H ILE 63 H ILE 63 -1.837 26.227 -21.113 489 HA ILE 63 HA ILE 63 -2.190 25.921 -18.157 490 HB ILE 63 HB ILE 63 -0.652 24.174 -20.109 491 1HG1 ILE 63 1HG1 ILE 63 -3.035 23.880 -20.562 492 2HG1 ILE 63 2HG1 ILE 63 -2.303 22.459 -19.834 493 1HG2 ILE 63 1HG2 ILE 63 -1.267 23.815 -17.157 494 2HG2 ILE 63 2HG2 ILE 63 -0.515 22.592 -18.202 495 3HG2 ILE 63 3HG2 ILE 63 0.315 24.123 -17.894 496 1HD1 ILE 63 1HD1 ILE 63 -4.002 24.471 -18.294 497 2HD1 ILE 63 2HD1 ILE 63 -4.549 22.919 -18.940 498 3HD1 ILE 63 3HD1 ILE 63 -3.328 22.950 -17.670 499 H ASP 64 H ASP 64 -0.811 27.221 -17.082 500 HA ASP 64 HA ASP 64 1.461 28.538 -18.347 501 1HB ASP 64 1HB ASP 64 0.207 29.708 -16.618 502 2HB ASP 64 2HB ASP 64 0.456 28.382 -15.472 503 H PHE 65 H PHE 65 3.677 28.322 -17.641 504 HA PHE 65 HA PHE 65 4.748 25.783 -17.692 505 1HB PHE 65 1HB PHE 65 6.104 27.735 -18.068 506 2HB PHE 65 2HB PHE 65 5.848 28.299 -16.413 507 HD1 PHE 65 HD1 PHE 65 7.785 28.097 -15.083 508 HD2 PHE 65 HD2 PHE 65 6.925 25.029 -17.999 509 HE1 PHE 65 HE1 PHE 65 9.778 26.827 -14.351 510 HE2 PHE 65 HE2 PHE 65 8.856 23.719 -17.179 511 HZ PHE 65 HZ PHE 65 10.328 24.641 -15.404 512 H GLU 66 H GLU 66 3.973 27.631 -14.676 513 HA GLU 66 HA GLU 66 5.047 25.636 -12.933 514 1HB GLU 66 1HB GLU 66 2.847 27.689 -12.426 515 2HB GLU 66 2HB GLU 66 3.709 26.759 -11.192 516 1HG GLU 66 1HG GLU 66 5.869 27.758 -11.955 517 2HG GLU 66 2HG GLU 66 4.984 28.768 -13.110 518 H GLU 67 H GLU 67 1.852 26.034 -14.425 519 HA GLU 67 HA GLU 67 0.503 23.982 -12.895 520 1HB GLU 67 1HB GLU 67 -0.155 25.223 -15.593 521 2HB GLU 67 2HB GLU 67 -1.225 24.200 -14.627 522 1HG GLU 67 1HG GLU 67 -1.269 25.824 -12.817 523 2HG GLU 67 2HG GLU 67 -0.144 26.886 -13.675 524 H PHE 68 H PHE 68 2.063 24.132 -16.119 525 HA PHE 68 HA PHE 68 1.693 21.415 -16.879 526 1HB PHE 68 1HB PHE 68 2.452 23.103 -18.452 527 2HB PHE 68 2HB PHE 68 3.904 23.403 -17.510 528 HD1 PHE 68 HD1 PHE 68 5.890 22.135 -17.869 529 HD2 PHE 68 HD2 PHE 68 2.140 20.757 -19.503 530 HE1 PHE 68 HE1 PHE 68 7.099 20.512 -19.306 531 HE2 PHE 68 HE2 PHE 68 3.353 19.037 -20.816 532 HZ PHE 68 HZ PHE 68 5.846 18.920 -20.710 533 H LEU 69 H LEU 69 4.351 22.990 -15.064 534 HA LEU 69 HA LEU 69 5.915 20.703 -14.584 535 1HB LEU 69 1HB LEU 69 6.310 23.252 -14.149 536 2HB LEU 69 2HB LEU 69 5.625 22.934 -12.559 537 HG LEU 69 HG LEU 69 8.096 21.670 -13.834 538 1HD1 LEU 69 1HD1 LEU 69 9.324 22.966 -12.139 539 2HD1 LEU 69 2HD1 LEU 69 8.364 24.025 -13.188 540 3HD1 LEU 69 3HD1 LEU 69 7.796 23.657 -11.548 541 1HD2 LEU 69 1HD2 LEU 69 8.536 20.797 -11.491 542 2HD2 LEU 69 2HD2 LEU 69 6.842 21.170 -11.103 543 3HD2 LEU 69 3HD2 LEU 69 7.248 19.985 -12.372 544 H THR 70 H THR 70 3.176 22.085 -12.682 545 HA THR 70 HA THR 70 3.083 20.145 -10.648 546 HB THR 70 HB THR 70 0.564 21.325 -11.901 547 HG1 THR 70 HG1 THR 70 2.014 23.018 -11.511 548 1HG2 THR 70 1HG2 THR 70 0.204 19.631 -10.157 549 2HG2 THR 70 2HG2 THR 70 1.284 20.516 -9.059 550 3HG2 THR 70 3HG2 THR 70 -0.241 21.250 -9.590 551 H MET 71 H MET 71 1.375 20.092 -13.829 552 HA MET 71 HA MET 71 0.131 17.583 -13.569 553 1HB MET 71 1HB MET 71 -0.259 19.278 -15.401 554 2HB MET 71 2HB MET 71 1.288 18.814 -16.099 555 1HG MET 71 1HG MET 71 0.357 16.407 -16.222 556 2HG MET 71 2HG MET 71 -1.198 17.108 -15.771 557 1HE MET 71 1HE MET 71 1.594 16.731 -18.438 558 2HE MET 71 2HE MET 71 1.031 17.768 -19.767 559 3HE MET 71 3HE MET 71 1.641 18.502 -18.269 560 H MET 72 H MET 72 3.323 18.368 -15.003 561 HA MET 72 HA MET 72 4.079 15.746 -15.655 562 1HB MET 72 1HB MET 72 5.173 17.927 -16.367 563 2HB MET 72 2HB MET 72 5.942 17.998 -14.775 564 1HG MET 72 1HG MET 72 7.488 17.066 -16.357 565 2HG MET 72 2HG MET 72 7.005 15.767 -15.265 566 1HE MET 72 1HE MET 72 7.688 13.845 -18.568 567 2HE MET 72 2HE MET 72 8.582 15.242 -17.923 568 3HE MET 72 3HE MET 72 8.020 13.955 -16.823 569 H THR 73 H THR 73 4.682 17.608 -12.651 570 HA THR 73 HA THR 73 6.134 15.632 -11.237 571 HB THR 73 HB THR 73 4.220 17.704 -10.081 572 HG1 THR 73 HG1 THR 73 5.774 18.658 -11.397 573 1HG2 THR 73 1HG2 THR 73 4.948 16.036 -8.401 574 2HG2 THR 73 2HG2 THR 73 6.640 16.277 -8.892 575 3HG2 THR 73 3HG2 THR 73 5.737 17.598 -8.127 576 H ALA 74 H ALA 74 2.582 16.221 -11.381 577 HA ALA 74 HA ALA 74 1.865 14.082 -9.637 578 1HB ALA 74 1HB ALA 74 0.350 15.932 -10.246 579 2HB ALA 74 2HB ALA 74 0.269 15.328 -11.916 580 3HB ALA 74 3HB ALA 74 -0.379 14.348 -10.586 581 H LYS 75 H LYS 75 2.339 14.198 -13.180 582 HA LYS 75 HA LYS 75 1.417 11.559 -13.694 583 1HB LYS 75 1HB LYS 75 1.583 13.281 -15.428 584 2HB LYS 75 2HB LYS 75 3.337 13.348 -15.240 585 1HG LYS 75 1HG LYS 75 2.742 12.107 -17.233 586 2HG LYS 75 2HG LYS 75 3.566 11.056 -16.079 587 1HD LYS 75 1HD LYS 75 1.383 10.070 -15.398 588 2HD LYS 75 2HD LYS 75 0.532 11.212 -16.453 589 1HE LYS 75 1HE LYS 75 0.678 9.039 -17.539 590 2HE LYS 75 2HE LYS 75 1.681 10.189 -18.435 591 1HZ LYS 75 1HZ LYS 75 2.662 8.258 -16.450 592 2HZ LYS 75 2HZ LYS 75 2.769 8.091 -18.088 593 3HZ LYS 75 3HZ LYS 75 3.594 9.297 -17.326 594 H MET 76 H MET 76 4.717 12.848 -13.058 595 HA MET 76 HA MET 76 6.068 10.344 -13.451 596 1HB MET 76 1HB MET 76 6.801 12.823 -11.853 597 2HB MET 76 2HB MET 76 7.882 11.436 -12.069 598 1HG MET 76 1HG MET 76 7.733 11.687 -14.529 599 2HG MET 76 2HG MET 76 6.750 13.131 -14.327 600 1HE MET 76 1HE MET 76 9.381 15.608 -12.715 601 2HE MET 76 2HE MET 76 7.665 15.337 -13.082 602 3HE MET 76 3HE MET 76 8.435 14.471 -11.730 Start of MODEL 4 1 H ARG 1 H ARG 1 16.598 21.690 -7.645 2 HA ARG 1 HA ARG 1 17.865 19.214 -6.743 3 1HB ARG 1 1HB ARG 1 18.831 20.534 -4.938 4 2HB ARG 1 2HB ARG 1 19.327 21.127 -6.525 5 1HG ARG 1 1HG ARG 1 17.522 22.938 -6.316 6 2HG ARG 1 2HG ARG 1 17.225 22.354 -4.668 7 1HD ARG 1 1HD ARG 1 18.708 24.265 -4.600 8 2HD ARG 1 2HD ARG 1 19.621 22.815 -4.119 9 HE ARG 1 HE ARG 1 19.894 23.188 -6.932 10 1HH1 ARG 1 1HH1 ARG 1 20.909 24.743 -3.929 11 2HH1 ARG 1 2HH1 ARG 1 22.365 25.416 -4.612 12 1HH2 ARG 1 1HH2 ARG 1 21.730 24.021 -7.827 13 2HH2 ARG 1 2HH2 ARG 1 22.855 24.997 -6.905 14 H VAL 2 H VAL 2 14.981 21.020 -6.684 15 HA VAL 2 HA VAL 2 14.116 20.264 -3.985 16 HB VAL 2 HB VAL 2 11.928 21.207 -4.791 17 1HG1 VAL 2 1HG1 VAL 2 13.545 22.526 -3.497 18 2HG1 VAL 2 2HG1 VAL 2 14.372 23.018 -4.990 19 3HG1 VAL 2 3HG1 VAL 2 12.702 23.537 -4.682 20 1HG2 VAL 2 1HG2 VAL 2 12.332 20.908 -7.299 21 2HG2 VAL 2 2HG2 VAL 2 11.805 22.520 -6.802 22 3HG2 VAL 2 3HG2 VAL 2 13.502 22.237 -7.201 23 H GLY 3 H GLY 3 14.893 17.994 -4.677 24 1HA GLY 3 1HA GLY 3 14.251 15.778 -5.000 25 2HA GLY 3 2HA GLY 3 12.586 16.282 -5.347 26 H LEU 4 H LEU 4 12.449 17.719 -7.411 27 HA LEU 4 HA LEU 4 13.579 16.355 -9.734 28 1HB LEU 4 1HB LEU 4 12.139 19.006 -9.459 29 2HB LEU 4 2HB LEU 4 12.594 18.234 -10.984 30 HG LEU 4 HG LEU 4 10.649 17.088 -8.923 31 1HD1 LEU 4 1HD1 LEU 4 8.978 17.564 -10.676 32 2HD1 LEU 4 2HD1 LEU 4 9.815 19.045 -10.169 33 3HD1 LEU 4 3HD1 LEU 4 10.257 18.257 -11.702 34 1HD2 LEU 4 1HD2 LEU 4 10.124 15.456 -10.787 35 2HD2 LEU 4 2HD2 LEU 4 11.570 16.027 -11.638 36 3HD2 LEU 4 3HD2 LEU 4 11.713 15.207 -10.063 37 H THR 5 H THR 5 15.624 16.659 -10.440 38 HA THR 5 HA THR 5 17.415 18.617 -9.365 39 HB THR 5 HB THR 5 18.887 17.885 -11.232 40 HG1 THR 5 HG1 THR 5 16.871 16.043 -11.903 41 1HG2 THR 5 1HG2 THR 5 19.115 15.544 -10.542 42 2HG2 THR 5 2HG2 THR 5 18.867 16.604 -9.143 43 3HG2 THR 5 3HG2 THR 5 17.535 15.594 -9.734 44 H GLU 6 H GLU 6 18.498 20.352 -10.620 45 HA GLU 6 HA GLU 6 16.787 22.111 -12.051 46 1HB GLU 6 1HB GLU 6 19.845 21.842 -12.156 47 2HB GLU 6 2HB GLU 6 18.881 23.178 -12.787 48 1HG GLU 6 1HG GLU 6 19.438 24.101 -10.799 49 2HG GLU 6 2HG GLU 6 17.942 23.318 -10.296 50 H GLU 7 H GLU 7 19.017 19.571 -13.167 51 HA GLU 7 HA GLU 7 18.678 19.779 -15.926 52 1HB GLU 7 1HB GLU 7 18.805 17.145 -14.374 53 2HB GLU 7 2HB GLU 7 19.196 17.434 -16.066 54 1HG GLU 7 1HG GLU 7 21.303 17.417 -15.151 55 2HG GLU 7 2HG GLU 7 20.972 19.150 -15.100 56 H GLN 8 H GLN 8 16.655 17.758 -13.685 57 HA GLN 8 HA GLN 8 14.742 17.013 -15.636 58 1HB GLN 8 1HB GLN 8 14.560 17.343 -12.633 59 2HB GLN 8 2HB GLN 8 13.192 16.775 -13.599 60 1HG GLN 8 1HG GLN 8 14.336 14.827 -14.347 61 2HG GLN 8 2HG GLN 8 15.904 15.430 -13.814 62 1HE2 GLN 8 1HE2 GLN 8 13.043 13.680 -12.805 63 2HE2 GLN 8 2HE2 GLN 8 13.557 13.458 -11.142 64 H LYS 9 H LYS 9 14.693 19.899 -13.420 65 HA LYS 9 HA LYS 9 12.136 20.763 -14.386 66 1HB LYS 9 1HB LYS 9 14.387 22.294 -13.053 67 2HB LYS 9 2HB LYS 9 12.800 22.990 -13.447 68 1HG LYS 9 1HG LYS 9 11.690 21.140 -12.165 69 2HG LYS 9 2HG LYS 9 13.271 20.571 -11.639 70 1HD LYS 9 1HD LYS 9 12.001 23.299 -11.066 71 2HD LYS 9 2HD LYS 9 12.140 21.954 -9.929 72 1HE LYS 9 1HE LYS 9 14.428 23.595 -11.102 73 2HE LYS 9 2HE LYS 9 13.856 23.591 -9.431 74 1HZ LYS 9 1HZ LYS 9 15.795 22.246 -9.677 75 2HZ LYS 9 2HZ LYS 9 14.525 21.262 -9.299 76 3HZ LYS 9 3HZ LYS 9 15.084 21.323 -10.838 77 H GLN 10 H GLN 10 15.442 21.471 -15.571 78 HA GLN 10 HA GLN 10 14.620 23.256 -17.639 79 1HB GLN 10 1HB GLN 10 17.016 21.407 -17.292 80 2HB GLN 10 2HB GLN 10 16.798 22.317 -18.771 81 1HG GLN 10 1HG GLN 10 17.036 23.485 -15.968 82 2HG GLN 10 2HG GLN 10 18.280 23.497 -17.222 83 1HE2 GLN 10 1HE2 GLN 10 16.255 24.165 -19.450 84 2HE2 GLN 10 2HE2 GLN 10 15.917 25.853 -19.136 85 H GLU 11 H GLU 11 15.097 19.677 -17.725 86 HA GLU 11 HA GLU 11 14.317 19.273 -20.396 87 1HB GLU 11 1HB GLU 11 13.852 17.538 -17.942 88 2HB GLU 11 2HB GLU 11 13.542 17.005 -19.595 89 1HG GLU 11 1HG GLU 11 15.843 17.167 -20.213 90 2HG GLU 11 2HG GLU 11 16.274 18.063 -18.760 91 H ILE 12 H ILE 12 12.211 19.421 -17.485 92 HA ILE 12 HA ILE 12 9.740 19.129 -18.878 93 HB ILE 12 HB ILE 12 10.400 20.469 -16.235 94 1HG1 ILE 12 1HG1 ILE 12 9.175 17.733 -16.844 95 2HG1 ILE 12 2HG1 ILE 12 10.885 17.964 -16.531 96 1HG2 ILE 12 1HG2 ILE 12 7.673 19.573 -17.257 97 2HG2 ILE 12 2HG2 ILE 12 8.021 20.290 -15.680 98 3HG2 ILE 12 3HG2 ILE 12 8.185 21.272 -17.124 99 1HD1 ILE 12 1HD1 ILE 12 8.639 18.480 -14.551 100 2HD1 ILE 12 2HD1 ILE 12 9.887 17.231 -14.498 101 3HD1 ILE 12 3HD1 ILE 12 10.341 18.932 -14.287 102 H ARG 13 H ARG 13 11.606 22.084 -18.040 103 HA ARG 13 HA ARG 13 9.757 23.973 -19.138 104 1HB ARG 13 1HB ARG 13 11.662 24.305 -17.500 105 2HB ARG 13 2HB ARG 13 12.750 24.353 -18.887 106 1HG ARG 13 1HG ARG 13 10.265 26.127 -18.734 107 2HG ARG 13 2HG ARG 13 11.734 26.560 -17.858 108 1HD ARG 13 1HD ARG 13 13.049 26.686 -19.809 109 2HD ARG 13 2HD ARG 13 11.847 25.890 -20.799 110 HE ARG 13 HE ARG 13 11.872 28.694 -19.915 111 1HH1 ARG 13 1HH1 ARG 13 9.966 26.098 -21.477 112 2HH1 ARG 13 2HH1 ARG 13 8.990 27.230 -22.372 113 1HH2 ARG 13 1HH2 ARG 13 10.522 30.119 -21.053 114 2HH2 ARG 13 2HH2 ARG 13 9.258 29.518 -22.091 115 H GLU 14 H GLU 14 12.432 22.220 -20.666 116 HA GLU 14 HA GLU 14 12.146 23.557 -23.213 117 1HB GLU 14 1HB GLU 14 13.605 21.093 -22.225 118 2HB GLU 14 2HB GLU 14 13.413 21.388 -23.956 119 1HG GLU 14 1HG GLU 14 15.536 22.289 -23.231 120 2HG GLU 14 2HG GLU 14 14.476 23.584 -23.785 121 H ALA 15 H ALA 15 10.896 20.435 -21.906 122 HA ALA 15 HA ALA 15 9.436 19.653 -24.213 123 1HB ALA 15 1HB ALA 15 9.749 18.206 -22.240 124 2HB ALA 15 2HB ALA 15 8.694 19.262 -21.278 125 3HB ALA 15 3HB ALA 15 8.032 18.369 -22.662 126 H PHE 16 H PHE 16 8.444 21.693 -21.438 127 HA PHE 16 HA PHE 16 5.897 22.417 -22.308 128 1HB PHE 16 1HB PHE 16 6.812 22.941 -20.088 129 2HB PHE 16 2HB PHE 16 7.918 24.104 -20.783 130 HD1 PHE 16 HD1 PHE 16 7.227 26.351 -21.312 131 HD2 PHE 16 HD2 PHE 16 4.323 23.387 -20.184 132 HE1 PHE 16 HE1 PHE 16 5.495 28.118 -21.124 133 HE2 PHE 16 HE2 PHE 16 2.609 25.169 -19.916 134 HZ PHE 16 HZ PHE 16 3.212 27.534 -20.377 135 H ASP 17 H ASP 17 9.024 24.075 -22.996 136 HA ASP 17 HA ASP 17 8.050 26.108 -24.658 137 1HB ASP 17 1HB ASP 17 10.439 25.862 -23.834 138 2HB ASP 17 2HB ASP 17 10.687 24.627 -25.064 139 H LEU 18 H LEU 18 9.194 22.834 -25.648 140 HA LEU 18 HA LEU 18 8.703 23.071 -28.412 141 1HB LEU 18 1HB LEU 18 9.888 21.146 -27.281 142 2HB LEU 18 2HB LEU 18 8.328 20.586 -26.687 143 HG LEU 18 HG LEU 18 7.699 20.745 -29.334 144 1HD1 LEU 18 1HD1 LEU 18 9.568 20.015 -30.705 145 2HD1 LEU 18 2HD1 LEU 18 9.948 21.576 -29.957 146 3HD1 LEU 18 3HD1 LEU 18 10.667 20.084 -29.311 147 1HD2 LEU 18 1HD2 LEU 18 9.137 18.420 -28.021 148 2HD2 LEU 18 2HD2 LEU 18 7.391 18.769 -27.959 149 3HD2 LEU 18 3HD2 LEU 18 8.146 18.352 -29.500 150 H PHE 19 H PHE 19 6.539 21.777 -25.843 151 HA PHE 19 HA PHE 19 4.335 21.271 -27.565 152 1HB PHE 19 1HB PHE 19 4.372 21.975 -24.618 153 2HB PHE 19 2HB PHE 19 3.011 21.235 -25.470 154 HD1 PHE 19 HD1 PHE 19 5.014 19.265 -27.116 155 HD2 PHE 19 HD2 PHE 19 4.287 20.172 -22.949 156 HE1 PHE 19 HE1 PHE 19 5.653 16.979 -26.508 157 HE2 PHE 19 HE2 PHE 19 4.832 17.828 -22.374 158 HZ PHE 19 HZ PHE 19 5.626 16.256 -24.125 159 H ASP 20 H ASP 20 5.223 24.251 -25.785 160 HA ASP 20 HA ASP 20 2.892 25.694 -26.793 161 1HB ASP 20 1HB ASP 20 4.049 26.322 -24.682 162 2HB ASP 20 2HB ASP 20 5.493 26.733 -25.615 163 H THR 21 H THR 21 3.591 24.545 -28.979 164 HA THR 21 HA THR 21 5.659 25.382 -30.606 165 HB THR 21 HB THR 21 4.129 24.836 -32.509 166 HG1 THR 21 HG1 THR 21 2.217 24.858 -30.422 167 1HG2 THR 21 1HG2 THR 21 3.770 22.498 -31.946 168 2HG2 THR 21 2HG2 THR 21 5.337 23.032 -31.309 169 3HG2 THR 21 3HG2 THR 21 3.953 22.830 -30.217 170 H ASP 22 H ASP 22 2.529 27.030 -30.092 171 HA ASP 22 HA ASP 22 2.994 29.093 -32.038 172 1HB ASP 22 1HB ASP 22 0.763 28.463 -31.204 173 2HB ASP 22 2HB ASP 22 1.184 29.064 -29.595 174 H GLY 23 H GLY 23 4.312 28.626 -28.833 175 1HA GLY 23 1HA GLY 23 5.650 29.925 -27.533 176 2HA GLY 23 2HA GLY 23 5.837 31.047 -28.890 177 H SER 24 H SER 24 2.736 30.095 -27.332 178 HA SER 24 HA SER 24 1.932 32.842 -27.070 179 1HB SER 24 1HB SER 24 0.642 30.461 -25.715 180 2HB SER 24 2HB SER 24 -0.120 31.951 -26.284 181 HG SER 24 HG SER 24 0.579 31.196 -28.456 182 H GLY 25 H GLY 25 3.809 30.765 -25.019 183 1HA GLY 25 1HA GLY 25 4.864 31.513 -23.020 184 2HA GLY 25 2HA GLY 25 3.518 32.611 -22.681 185 H THR 26 H THR 26 1.371 30.814 -23.313 186 HA THR 26 HA THR 26 1.547 28.701 -21.216 187 HB THR 26 HB THR 26 -0.781 29.092 -20.858 188 HG1 THR 26 HG1 THR 26 -1.848 30.674 -21.916 189 1HG2 THR 26 1HG2 THR 26 -0.665 31.194 -19.693 190 2HG2 THR 26 2HG2 THR 26 0.931 30.433 -19.557 191 3HG2 THR 26 3HG2 THR 26 0.678 31.761 -20.700 192 H ILE 27 H ILE 27 0.768 26.661 -21.757 193 HA ILE 27 HA ILE 27 0.742 25.987 -24.620 194 HB ILE 27 HB ILE 27 0.445 24.445 -22.033 195 1HG1 ILE 27 1HG1 ILE 27 2.479 24.359 -24.313 196 2HG1 ILE 27 2HG1 ILE 27 2.701 25.208 -22.778 197 1HG2 ILE 27 1HG2 ILE 27 0.268 22.360 -23.254 198 2HG2 ILE 27 2HG2 ILE 27 -1.066 23.367 -23.738 199 3HG2 ILE 27 3HG2 ILE 27 0.352 23.206 -24.804 200 1HD1 ILE 27 1HD1 ILE 27 2.437 22.201 -23.193 201 2HD1 ILE 27 2HD1 ILE 27 3.829 23.118 -22.621 202 3HD1 ILE 27 3HD1 ILE 27 2.381 22.981 -21.597 203 H ASP 28 H ASP 28 -1.120 26.093 -25.868 204 HA ASP 28 HA ASP 28 -3.732 26.528 -24.635 205 1HB ASP 28 1HB ASP 28 -3.158 27.449 -26.852 206 2HB ASP 28 2HB ASP 28 -2.980 25.809 -27.496 207 H ALA 29 H ALA 29 -5.429 25.027 -24.377 208 HA ALA 29 HA ALA 29 -5.181 22.429 -23.748 209 1HB ALA 29 1HB ALA 29 -7.530 22.131 -24.500 210 2HB ALA 29 2HB ALA 29 -7.286 23.671 -23.650 211 3HB ALA 29 3HB ALA 29 -7.419 23.644 -25.422 212 H LYS 30 H LYS 30 -5.573 23.501 -27.179 213 HA LYS 30 HA LYS 30 -5.595 20.891 -28.333 214 1HB LYS 30 1HB LYS 30 -4.666 23.560 -29.469 215 2HB LYS 30 2HB LYS 30 -4.900 22.079 -30.404 216 1HG LYS 30 1HG LYS 30 -7.321 22.049 -29.766 217 2HG LYS 30 2HG LYS 30 -7.065 23.484 -28.773 218 1HD LYS 30 1HD LYS 30 -7.918 24.481 -30.614 219 2HD LYS 30 2HD LYS 30 -6.206 24.604 -31.002 220 1HE LYS 30 1HE LYS 30 -8.181 22.492 -32.038 221 2HE LYS 30 2HE LYS 30 -7.608 23.907 -32.932 222 1HZ LYS 30 1HZ LYS 30 -6.418 21.997 -33.584 223 2HZ LYS 30 2HZ LYS 30 -5.386 23.008 -32.791 224 3HZ LYS 30 3HZ LYS 30 -5.962 21.655 -32.040 225 H GLU 31 H GLU 31 -2.904 23.105 -27.529 226 HA GLU 31 HA GLU 31 -0.826 21.497 -28.752 227 1HB GLU 31 1HB GLU 31 -0.784 23.699 -26.658 228 2HB GLU 31 2HB GLU 31 0.653 22.900 -27.291 229 1HG GLU 31 1HG GLU 31 0.145 23.679 -29.561 230 2HG GLU 31 2HG GLU 31 -1.368 24.413 -29.007 231 H LEU 32 H LEU 32 -2.319 21.732 -25.491 232 HA LEU 32 HA LEU 32 -0.546 19.846 -24.272 233 1HB LEU 32 1HB LEU 32 -2.308 21.407 -23.128 234 2HB LEU 32 2HB LEU 32 -3.450 20.111 -23.486 235 HG LEU 32 HG LEU 32 -1.652 18.559 -22.309 236 1HD1 LEU 32 1HD1 LEU 32 -0.861 21.266 -21.181 237 2HD1 LEU 32 2HD1 LEU 32 -0.387 19.685 -20.530 238 3HD1 LEU 32 3HD1 LEU 32 0.173 20.170 -22.129 239 1HD2 LEU 32 1HD2 LEU 32 -2.707 19.028 -20.111 240 2HD2 LEU 32 2HD2 LEU 32 -3.377 20.535 -20.766 241 3HD2 LEU 32 3HD2 LEU 32 -3.901 18.968 -21.415 242 H LYS 33 H LYS 33 -3.679 19.418 -25.994 243 HA LYS 33 HA LYS 33 -3.816 16.586 -25.735 244 1HB LYS 33 1HB LYS 33 -5.671 17.947 -26.380 245 2HB LYS 33 2HB LYS 33 -4.897 18.394 -27.917 246 1HG LYS 33 1HG LYS 33 -4.946 16.020 -28.636 247 2HG LYS 33 2HG LYS 33 -5.649 15.567 -27.073 248 1HD LYS 33 1HD LYS 33 -7.630 17.010 -27.559 249 2HD LYS 33 2HD LYS 33 -6.912 17.443 -29.123 250 1HE LYS 33 1HE LYS 33 -6.956 15.024 -29.784 251 2HE LYS 33 2HE LYS 33 -7.731 14.631 -28.236 252 1HZ LYS 33 1HZ LYS 33 -9.551 16.034 -28.857 253 2HZ LYS 33 2HZ LYS 33 -8.838 16.398 -30.298 254 3HZ LYS 33 3HZ LYS 33 -9.316 14.853 -29.981 255 H VAL 34 H VAL 34 -2.268 18.574 -28.326 256 HA VAL 34 HA VAL 34 -1.160 16.419 -29.808 257 HB VAL 34 HB VAL 34 -0.180 19.249 -29.275 258 1HG1 VAL 34 1HG1 VAL 34 1.888 18.028 -29.693 259 2HG1 VAL 34 2HG1 VAL 34 1.142 17.179 -31.067 260 3HG1 VAL 34 3HG1 VAL 34 1.444 18.925 -31.140 261 1HG2 VAL 34 1HG2 VAL 34 -0.857 19.611 -31.592 262 2HG2 VAL 34 2HG2 VAL 34 -1.270 17.893 -31.774 263 3HG2 VAL 34 3HG2 VAL 34 -2.215 18.927 -30.684 264 H ALA 35 H ALA 35 0.255 18.166 -26.990 265 HA ALA 35 HA ALA 35 2.626 16.705 -26.776 266 1HB ALA 35 1HB ALA 35 2.127 18.724 -25.458 267 2HB ALA 35 2HB ALA 35 0.935 17.838 -24.496 268 3HB ALA 35 3HB ALA 35 2.623 17.368 -24.414 269 H MET 36 H MET 36 -0.504 16.011 -25.147 270 HA MET 36 HA MET 36 0.344 13.586 -23.904 271 1HB MET 36 1HB MET 36 -2.349 14.725 -24.601 272 2HB MET 36 2HB MET 36 -2.154 13.211 -23.707 273 1HG MET 36 1HG MET 36 -0.709 14.346 -22.033 274 2HG MET 36 2HG MET 36 -0.952 15.883 -22.854 275 1HE MET 36 1HE MET 36 -4.009 15.746 -23.607 276 2HE MET 36 2HE MET 36 -4.658 16.665 -22.221 277 3HE MET 36 3HE MET 36 -3.125 17.133 -22.989 278 H ARG 37 H ARG 37 -1.183 14.139 -27.096 279 HA ARG 37 HA ARG 37 -1.382 11.396 -27.748 280 1HB ARG 37 1HB ARG 37 -2.396 13.336 -29.029 281 2HB ARG 37 2HB ARG 37 -0.785 13.708 -29.640 282 1HG ARG 37 1HG ARG 37 -1.872 12.538 -31.348 283 2HG ARG 37 2HG ARG 37 -0.721 11.381 -30.679 284 1HD ARG 37 1HD ARG 37 -3.669 11.526 -29.876 285 2HD ARG 37 2HD ARG 37 -3.116 10.545 -31.225 286 HE ARG 37 HE ARG 37 -2.858 9.945 -28.384 287 1HH1 ARG 37 1HH1 ARG 37 -1.392 9.301 -31.536 288 2HH1 ARG 37 2HH1 ARG 37 -0.680 7.790 -31.032 289 1HH2 ARG 37 1HH2 ARG 37 -1.943 8.104 -27.721 290 2HH2 ARG 37 2HH2 ARG 37 -1.012 7.057 -28.780 291 H ALA 38 H ALA 38 1.306 13.731 -28.256 292 HA ALA 38 HA ALA 38 3.135 11.895 -29.433 293 1HB ALA 38 1HB ALA 38 4.852 13.528 -28.868 294 2HB ALA 38 2HB ALA 38 3.408 14.348 -29.495 295 3HB ALA 38 3HB ALA 38 3.755 14.360 -27.754 296 H LEU 39 H LEU 39 2.454 12.661 -26.014 297 HA LEU 39 HA LEU 39 4.445 10.879 -24.909 298 1HB LEU 39 1HB LEU 39 1.888 12.026 -23.744 299 2HB LEU 39 2HB LEU 39 3.084 11.144 -22.816 300 HG LEU 39 HG LEU 39 3.910 13.644 -24.327 301 1HD1 LEU 39 1HD1 LEU 39 2.051 14.430 -22.942 302 2HD1 LEU 39 2HD1 LEU 39 2.632 13.485 -21.561 303 3HD1 LEU 39 3HD1 LEU 39 3.558 14.877 -22.158 304 1HD2 LEU 39 1HD2 LEU 39 4.959 12.274 -21.817 305 2HD2 LEU 39 2HD2 LEU 39 5.680 12.161 -23.437 306 3HD2 LEU 39 3HD2 LEU 39 5.641 13.716 -22.595 307 H GLY 40 H GLY 40 1.752 10.091 -26.778 308 1HA GLY 40 1HA GLY 40 1.188 7.975 -27.400 309 2HA GLY 40 2HA GLY 40 1.995 7.289 -25.986 310 H PHE 41 H PHE 41 -0.137 9.899 -25.156 311 HA PHE 41 HA PHE 41 -1.853 8.037 -23.703 312 1HB PHE 41 1HB PHE 41 -2.051 11.022 -24.176 313 2HB PHE 41 2HB PHE 41 -3.061 10.130 -23.064 314 HD1 PHE 41 HD1 PHE 41 0.304 8.806 -22.750 315 HD2 PHE 41 HD2 PHE 41 -2.256 12.100 -21.600 316 HE1 PHE 41 HE1 PHE 41 1.949 9.505 -21.092 317 HE2 PHE 41 HE2 PHE 41 -0.599 12.762 -19.887 318 HZ PHE 41 HZ PHE 41 1.543 11.512 -19.674 319 H GLU 42 H GLU 42 -4.233 8.075 -23.939 320 HA GLU 42 HA GLU 42 -5.183 8.449 -26.758 321 1HB GLU 42 1HB GLU 42 -6.300 6.787 -24.476 322 2HB GLU 42 2HB GLU 42 -7.038 7.011 -26.070 323 1HG GLU 42 1HG GLU 42 -4.998 6.038 -27.139 324 2HG GLU 42 2HG GLU 42 -4.302 5.754 -25.536 325 HA PRO 43 HA PRO 43 -6.742 11.907 -24.210 326 1HB PRO 43 1HB PRO 43 -6.901 13.900 -26.091 327 2HB PRO 43 2HB PRO 43 -5.402 13.396 -25.271 328 1HG PRO 43 1HG PRO 43 -6.389 12.493 -27.984 329 2HG PRO 43 2HG PRO 43 -4.767 13.110 -27.521 330 1HD PRO 43 1HD PRO 43 -5.249 10.450 -27.696 331 2HD PRO 43 2HD PRO 43 -4.240 11.123 -26.375 332 H LYS 44 H LYS 44 -8.589 10.363 -24.116 333 HA LYS 44 HA LYS 44 -10.903 10.735 -25.765 334 1HB LYS 44 1HB LYS 44 -10.700 9.868 -22.859 335 2HB LYS 44 2HB LYS 44 -12.114 9.666 -23.896 336 1HG LYS 44 1HG LYS 44 -9.388 8.327 -24.182 337 2HG LYS 44 2HG LYS 44 -10.887 7.569 -23.689 338 1HD LYS 44 1HD LYS 44 -10.208 8.673 -26.458 339 2HD LYS 44 2HD LYS 44 -10.347 6.983 -25.993 340 1HE LYS 44 1HE LYS 44 -12.641 9.003 -26.081 341 2HE LYS 44 2HE LYS 44 -12.343 7.680 -27.213 342 1HZ LYS 44 1HZ LYS 44 -13.987 7.094 -25.618 343 2HZ LYS 44 2HZ LYS 44 -12.659 6.141 -25.409 344 3HZ LYS 44 3HZ LYS 44 -12.964 7.378 -24.362 345 H LYS 45 H LYS 45 -12.205 12.386 -25.914 346 HA LYS 45 HA LYS 45 -11.703 14.892 -25.167 347 1HB LYS 45 1HB LYS 45 -14.444 13.648 -25.582 348 2HB LYS 45 2HB LYS 45 -14.135 15.390 -25.583 349 1HG LYS 45 1HG LYS 45 -12.498 15.060 -27.460 350 2HG LYS 45 2HG LYS 45 -12.976 13.362 -27.556 351 1HD LYS 45 1HD LYS 45 -14.817 15.768 -27.953 352 2HD LYS 45 2HD LYS 45 -14.140 14.739 -29.223 353 1HE LYS 45 1HE LYS 45 -15.342 12.764 -28.201 354 2HE LYS 45 2HE LYS 45 -16.127 13.878 -27.064 355 1HZ LYS 45 1HZ LYS 45 -17.063 15.030 -28.919 356 2HZ LYS 45 2HZ LYS 45 -16.349 13.992 -29.983 357 3HZ LYS 45 3HZ LYS 45 -17.494 13.441 -28.934 358 H GLU 46 H GLU 46 -14.147 12.959 -23.354 359 HA GLU 46 HA GLU 46 -14.820 15.070 -21.581 360 1HB GLU 46 1HB GLU 46 -15.105 12.042 -21.237 361 2HB GLU 46 2HB GLU 46 -15.835 13.265 -20.200 362 1HG GLU 46 1HG GLU 46 -17.511 12.524 -21.743 363 2HG GLU 46 2HG GLU 46 -17.089 14.193 -22.135 364 H GLU 47 H GLU 47 -12.634 12.293 -21.182 365 HA GLU 47 HA GLU 47 -11.793 12.796 -18.514 366 1HB GLU 47 1HB GLU 47 -10.406 11.397 -20.855 367 2HB GLU 47 2HB GLU 47 -9.806 11.416 -19.198 368 1HG GLU 47 1HG GLU 47 -10.963 9.334 -19.570 369 2HG GLU 47 2HG GLU 47 -11.847 10.301 -18.387 370 H ILE 48 H ILE 48 -10.428 13.794 -21.681 371 HA ILE 48 HA ILE 48 -8.214 15.258 -20.597 372 HB ILE 48 HB ILE 48 -9.703 15.405 -23.233 373 1HG1 ILE 48 1HG1 ILE 48 -8.387 13.294 -22.554 374 2HG1 ILE 48 2HG1 ILE 48 -8.008 14.070 -24.089 375 1HG2 ILE 48 1HG2 ILE 48 -8.699 17.567 -23.018 376 2HG2 ILE 48 2HG2 ILE 48 -7.187 16.889 -22.379 377 3HG2 ILE 48 3HG2 ILE 48 -7.652 16.618 -24.076 378 1HD1 ILE 48 1HD1 ILE 48 -6.001 13.307 -22.683 379 2HD1 ILE 48 2HD1 ILE 48 -5.995 14.970 -23.274 380 3HD1 ILE 48 3HD1 ILE 48 -6.371 14.623 -21.572 381 H LYS 49 H LYS 49 -11.527 16.368 -21.508 382 HA LYS 49 HA LYS 49 -11.090 19.104 -20.854 383 1HB LYS 49 1HB LYS 49 -13.575 17.353 -20.805 384 2HB LYS 49 2HB LYS 49 -13.610 19.082 -20.423 385 1HG LYS 49 1HG LYS 49 -12.755 19.686 -22.594 386 2HG LYS 49 2HG LYS 49 -12.467 17.990 -23.024 387 1HD LYS 49 1HD LYS 49 -14.860 17.507 -22.995 388 2HD LYS 49 2HD LYS 49 -15.221 19.110 -22.337 389 1HE LYS 49 1HE LYS 49 -15.724 19.040 -24.737 390 2HE LYS 49 2HE LYS 49 -14.423 20.192 -24.400 391 1HZ LYS 49 1HZ LYS 49 -13.960 18.827 -26.300 392 2HZ LYS 49 2HZ LYS 49 -12.855 18.541 -25.112 393 3HZ LYS 49 3HZ LYS 49 -14.059 17.453 -25.396 394 H LYS 50 H LYS 50 -12.249 16.380 -18.799 395 HA LYS 50 HA LYS 50 -12.530 17.879 -16.435 396 1HB LYS 50 1HB LYS 50 -13.392 15.593 -16.788 397 2HB LYS 50 2HB LYS 50 -11.751 14.950 -16.764 398 1HG LYS 50 1HG LYS 50 -12.903 14.577 -14.655 399 2HG LYS 50 2HG LYS 50 -11.479 15.595 -14.415 400 1HD LYS 50 1HD LYS 50 -12.828 17.579 -14.129 401 2HD LYS 50 2HD LYS 50 -14.261 16.782 -14.805 402 1HE LYS 50 1HE LYS 50 -14.459 16.997 -12.372 403 2HE LYS 50 2HE LYS 50 -14.416 15.296 -12.856 404 1HZ LYS 50 1HZ LYS 50 -12.152 16.836 -11.788 405 2HZ LYS 50 2HZ LYS 50 -13.035 15.713 -10.968 406 3HZ LYS 50 3HZ LYS 50 -12.101 15.253 -12.243 407 H MET 51 H MET 51 -9.695 15.900 -17.480 408 HA MET 51 HA MET 51 -7.899 16.469 -15.462 409 1HB MET 51 1HB MET 51 -7.645 14.776 -17.138 410 2HB MET 51 2HB MET 51 -7.578 15.953 -18.450 411 1HG MET 51 1HG MET 51 -5.508 16.056 -16.279 412 2HG MET 51 2HG MET 51 -5.452 14.796 -17.520 413 1HE MET 51 1HE MET 51 -2.574 16.996 -18.794 414 2HE MET 51 2HE MET 51 -2.996 16.580 -17.113 415 3HE MET 51 3HE MET 51 -3.120 15.352 -18.399 416 H ILE 52 H ILE 52 -8.201 18.227 -18.589 417 HA ILE 52 HA ILE 52 -6.356 20.275 -18.035 418 HB ILE 52 HB ILE 52 -8.830 20.146 -19.797 419 1HG1 ILE 52 1HG1 ILE 52 -5.826 20.252 -20.365 420 2HG1 ILE 52 2HG1 ILE 52 -6.796 18.779 -20.351 421 1HG2 ILE 52 1HG2 ILE 52 -6.866 22.468 -19.643 422 2HG2 ILE 52 2HG2 ILE 52 -8.142 22.264 -20.858 423 3HG2 ILE 52 3HG2 ILE 52 -8.581 22.529 -19.185 424 1HD1 ILE 52 1HD1 ILE 52 -6.980 21.074 -22.329 425 2HD1 ILE 52 2HD1 ILE 52 -6.520 19.396 -22.631 426 3HD1 ILE 52 3HD1 ILE 52 -8.203 19.785 -22.209 427 H SER 53 H SER 53 -9.915 20.226 -17.356 428 HA SER 53 HA SER 53 -9.959 22.818 -16.216 429 1HB SER 53 1HB SER 53 -11.724 20.434 -15.491 430 2HB SER 53 2HB SER 53 -12.068 22.146 -15.178 431 HG SER 53 HG SER 53 -11.808 20.863 -17.704 432 H GLU 54 H GLU 54 -9.365 19.650 -14.617 433 HA GLU 54 HA GLU 54 -9.165 20.661 -11.961 434 1HB GLU 54 1HB GLU 54 -7.840 18.275 -13.312 435 2HB GLU 54 2HB GLU 54 -7.717 18.622 -11.582 436 1HG GLU 54 1HG GLU 54 -10.130 18.460 -11.297 437 2HG GLU 54 2HG GLU 54 -10.373 18.234 -13.032 438 H ILE 55 H ILE 55 -6.645 20.289 -14.507 439 HA ILE 55 HA ILE 55 -4.546 21.338 -12.784 440 HB ILE 55 HB ILE 55 -4.710 20.991 -15.800 441 1HG1 ILE 55 1HG1 ILE 55 -4.906 18.834 -14.722 442 2HG1 ILE 55 2HG1 ILE 55 -3.325 18.992 -15.454 443 1HG2 ILE 55 1HG2 ILE 55 -2.295 21.612 -14.055 444 2HG2 ILE 55 2HG2 ILE 55 -2.215 21.062 -15.744 445 3HG2 ILE 55 3HG2 ILE 55 -2.976 22.600 -15.357 446 1HD1 ILE 55 1HD1 ILE 55 -3.118 17.904 -13.302 447 2HD1 ILE 55 2HD1 ILE 55 -2.394 19.512 -13.137 448 3HD1 ILE 55 3HD1 ILE 55 -4.015 19.183 -12.485 449 H ASP 56 H ASP 56 -6.829 22.825 -15.064 450 HA ASP 56 HA ASP 56 -5.294 25.235 -15.345 451 1HB ASP 56 1HB ASP 56 -6.753 24.366 -17.109 452 2HB ASP 56 2HB ASP 56 -8.176 24.613 -16.077 453 H LYS 57 H LYS 57 -5.023 25.586 -13.004 454 HA LYS 57 HA LYS 57 -7.180 26.649 -11.401 455 1HB LYS 57 1HB LYS 57 -4.220 27.326 -11.174 456 2HB LYS 57 2HB LYS 57 -5.461 27.453 -9.925 457 1HG LYS 57 1HG LYS 57 -4.243 24.921 -11.102 458 2HG LYS 57 2HG LYS 57 -4.105 25.547 -9.461 459 1HD LYS 57 1HD LYS 57 -6.618 25.201 -9.198 460 2HD LYS 57 2HD LYS 57 -6.600 24.391 -10.783 461 1HE LYS 57 1HE LYS 57 -4.870 22.796 -9.905 462 2HE LYS 57 2HE LYS 57 -5.045 23.538 -8.299 463 1HZ LYS 57 1HZ LYS 57 -7.104 22.163 -9.865 464 2HZ LYS 57 2HZ LYS 57 -6.385 21.606 -8.491 465 3HZ LYS 57 3HZ LYS 57 -7.392 22.913 -8.416 466 H ASP 58 H ASP 58 -4.690 28.157 -13.444 467 HA ASP 58 HA ASP 58 -6.125 30.794 -13.308 468 1HB ASP 58 1HB ASP 58 -3.982 31.895 -13.170 469 2HB ASP 58 2HB ASP 58 -4.148 30.750 -11.834 470 H GLY 59 H GLY 59 -4.410 28.469 -15.329 471 1HA GLY 59 1HA GLY 59 -3.527 30.159 -17.368 472 2HA GLY 59 2HA GLY 59 -3.855 28.438 -17.496 473 H SER 60 H SER 60 -6.801 29.090 -16.777 474 HA SER 60 HA SER 60 -8.780 29.561 -17.799 475 1HB SER 60 1HB SER 60 -7.248 32.022 -18.739 476 2HB SER 60 2HB SER 60 -9.006 31.862 -18.584 477 HG SER 60 HG SER 60 -7.070 31.733 -16.492 478 H GLY 61 H GLY 61 -7.982 27.626 -19.242 479 1HA GLY 61 1HA GLY 61 -8.665 26.802 -21.354 480 2HA GLY 61 2HA GLY 61 -8.468 28.394 -22.092 481 H THR 62 H THR 62 -5.777 28.751 -20.684 482 HA THR 62 HA THR 62 -4.174 26.827 -22.309 483 HB THR 62 HB THR 62 -2.378 28.414 -22.291 484 HG1 THR 62 HG1 THR 62 -4.101 29.999 -20.670 485 1HG2 THR 62 1HG2 THR 62 -4.162 28.676 -24.054 486 2HG2 THR 62 2HG2 THR 62 -4.927 29.919 -23.048 487 3HG2 THR 62 3HG2 THR 62 -3.294 30.174 -23.687 488 H ILE 63 H ILE 63 -1.997 26.424 -21.158 489 HA ILE 63 HA ILE 63 -2.341 26.033 -18.216 490 HB ILE 63 HB ILE 63 -0.925 24.241 -20.221 491 1HG1 ILE 63 1HG1 ILE 63 -3.348 24.046 -20.555 492 2HG1 ILE 63 2HG1 ILE 63 -2.620 22.585 -19.909 493 1HG2 ILE 63 1HG2 ILE 63 0.135 24.155 -18.040 494 2HG2 ILE 63 2HG2 ILE 63 -1.424 23.895 -17.242 495 3HG2 ILE 63 3HG2 ILE 63 -0.757 22.653 -18.321 496 1HD1 ILE 63 1HD1 ILE 63 -3.501 23.042 -17.676 497 2HD1 ILE 63 2HD1 ILE 63 -4.157 24.603 -18.215 498 3HD1 ILE 63 3HD1 ILE 63 -4.795 23.093 -18.875 499 H ASP 64 H ASP 64 -0.913 27.290 -17.173 500 HA ASP 64 HA ASP 64 1.363 28.541 -18.478 501 1HB ASP 64 1HB ASP 64 0.084 29.710 -16.732 502 2HB ASP 64 2HB ASP 64 0.441 28.423 -15.570 503 H PHE 65 H PHE 65 3.584 28.315 -17.764 504 HA PHE 65 HA PHE 65 4.622 25.748 -17.731 505 1HB PHE 65 1HB PHE 65 6.004 27.678 -18.192 506 2HB PHE 65 2HB PHE 65 5.759 28.301 -16.559 507 HD1 PHE 65 HD1 PHE 65 7.735 28.172 -15.293 508 HD2 PHE 65 HD2 PHE 65 6.779 24.940 -17.995 509 HE1 PHE 65 HE1 PHE 65 9.738 26.934 -14.536 510 HE2 PHE 65 HE2 PHE 65 8.748 23.685 -17.168 511 HZ PHE 65 HZ PHE 65 10.229 24.672 -15.442 512 H GLU 66 H GLU 66 3.824 27.757 -14.828 513 HA GLU 66 HA GLU 66 4.810 25.870 -12.933 514 1HB GLU 66 1HB GLU 66 2.588 27.945 -12.655 515 2HB GLU 66 2HB GLU 66 3.364 27.072 -11.326 516 1HG GLU 66 1HG GLU 66 5.565 28.030 -11.965 517 2HG GLU 66 2HG GLU 66 4.796 28.950 -13.267 518 H GLU 67 H GLU 67 1.547 26.302 -14.344 519 HA GLU 67 HA GLU 67 0.238 24.245 -12.853 520 1HB GLU 67 1HB GLU 67 -0.344 25.366 -15.625 521 2HB GLU 67 2HB GLU 67 -1.419 24.298 -14.713 522 1HG GLU 67 1HG GLU 67 -1.671 25.940 -12.932 523 2HG GLU 67 2HG GLU 67 -0.520 27.035 -13.707 524 H PHE 68 H PHE 68 1.890 24.220 -16.033 525 HA PHE 68 HA PHE 68 1.506 21.474 -16.642 526 1HB PHE 68 1HB PHE 68 2.253 23.084 -18.297 527 2HB PHE 68 2HB PHE 68 3.726 23.404 -17.397 528 HD1 PHE 68 HD1 PHE 68 1.866 20.668 -19.178 529 HD2 PHE 68 HD2 PHE 68 5.691 22.141 -17.825 530 HE1 PHE 68 HE1 PHE 68 3.011 18.854 -20.424 531 HE2 PHE 68 HE2 PHE 68 6.826 20.430 -19.222 532 HZ PHE 68 HZ PHE 68 5.510 18.721 -20.405 533 H LEU 69 H LEU 69 4.236 23.096 -14.946 534 HA LEU 69 HA LEU 69 5.797 20.806 -14.476 535 1HB LEU 69 1HB LEU 69 6.186 23.403 -14.059 536 2HB LEU 69 2HB LEU 69 5.637 23.031 -12.428 537 HG LEU 69 HG LEU 69 8.024 21.884 -13.948 538 1HD1 LEU 69 1HD1 LEU 69 7.870 23.633 -11.462 539 2HD1 LEU 69 2HD1 LEU 69 9.351 23.065 -12.261 540 3HD1 LEU 69 3HD1 LEU 69 8.272 24.193 -13.099 541 1HD2 LEU 69 1HD2 LEU 69 8.648 20.806 -11.756 542 2HD2 LEU 69 2HD2 LEU 69 7.010 21.158 -11.167 543 3HD2 LEU 69 3HD2 LEU 69 7.263 20.068 -12.556 544 H THR 70 H THR 70 3.206 22.306 -12.502 545 HA THR 70 HA THR 70 3.237 20.466 -10.360 546 HB THR 70 HB THR 70 0.805 21.939 -11.462 547 HG1 THR 70 HG1 THR 70 2.494 23.379 -11.056 548 1HG2 THR 70 1HG2 THR 70 1.490 20.923 -8.669 549 2HG2 THR 70 2HG2 THR 70 0.070 21.890 -9.107 550 3HG2 THR 70 3HG2 THR 70 0.242 20.244 -9.741 551 H MET 71 H MET 71 1.250 20.413 -13.371 552 HA MET 71 HA MET 71 -0.128 18.008 -12.935 553 1HB MET 71 1HB MET 71 -0.594 19.648 -14.694 554 2HB MET 71 2HB MET 71 0.880 19.236 -15.546 555 1HG MET 71 1HG MET 71 -1.390 17.290 -15.000 556 2HG MET 71 2HG MET 71 -1.236 18.260 -16.466 557 1HE MET 71 1HE MET 71 1.866 16.660 -18.238 558 2HE MET 71 2HE MET 71 0.661 17.968 -18.285 559 3HE MET 71 3HE MET 71 1.982 18.002 -17.087 560 H MET 72 H MET 72 2.975 18.520 -14.648 561 HA MET 72 HA MET 72 3.544 15.858 -15.263 562 1HB MET 72 1HB MET 72 4.716 17.928 -16.109 563 2HB MET 72 2HB MET 72 5.548 18.055 -14.554 564 1HG MET 72 1HG MET 72 7.010 17.006 -16.124 565 2HG MET 72 2HG MET 72 6.523 15.768 -14.964 566 1HE MET 72 1HE MET 72 7.995 15.115 -17.671 567 2HE MET 72 2HE MET 72 7.442 13.877 -16.514 568 3HE MET 72 3HE MET 72 7.044 13.723 -18.242 569 H THR 73 H THR 73 4.613 17.756 -12.411 570 HA THR 73 HA THR 73 5.972 15.704 -11.042 571 HB THR 73 HB THR 73 4.362 17.997 -9.825 572 HG1 THR 73 HG1 THR 73 5.837 18.788 -11.298 573 1HG2 THR 73 1HG2 THR 73 6.771 16.443 -8.782 574 2HG2 THR 73 2HG2 THR 73 6.026 17.855 -8.009 575 3HG2 THR 73 3HG2 THR 73 5.118 16.339 -8.133 576 H ALA 74 H ALA 74 2.502 16.630 -10.894 577 HA ALA 74 HA ALA 74 1.744 14.808 -8.882 578 1HB ALA 74 1HB ALA 74 -0.542 15.277 -9.609 579 2HB ALA 74 2HB ALA 74 0.417 16.768 -9.574 580 3HB ALA 74 3HB ALA 74 0.053 15.980 -11.125 581 H LYS 75 H LYS 75 2.684 14.009 -12.140 582 HA LYS 75 HA LYS 75 1.058 11.661 -12.454 583 1HB LYS 75 1HB LYS 75 3.878 12.232 -13.440 584 2HB LYS 75 2HB LYS 75 2.850 10.880 -13.936 585 1HG LYS 75 1HG LYS 75 1.157 12.435 -14.841 586 2HG LYS 75 2HG LYS 75 2.090 13.816 -14.280 587 1HD LYS 75 1HD LYS 75 2.456 13.508 -16.659 588 2HD LYS 75 2HD LYS 75 3.951 13.287 -15.747 589 1HE LYS 75 1HE LYS 75 3.659 11.622 -17.589 590 2HE LYS 75 2HE LYS 75 3.847 10.868 -16.006 591 1HZ LYS 75 1HZ LYS 75 2.084 9.881 -17.286 592 2HZ LYS 75 2HZ LYS 75 1.489 10.570 -15.914 593 3HZ LYS 75 3HZ LYS 75 1.279 11.317 -17.368 594 H MET 76 H MET 76 3.843 12.399 -10.404 595 HA MET 76 HA MET 76 3.814 9.574 -9.399 596 1HB MET 76 1HB MET 76 5.992 10.049 -8.399 597 2HB MET 76 2HB MET 76 6.023 10.103 -10.165 598 1HG MET 76 1HG MET 76 6.101 12.514 -10.169 599 2HG MET 76 2HG MET 76 5.828 12.585 -8.416 600 1HE MET 76 1HE MET 76 9.422 13.986 -8.738 601 2HE MET 76 2HE MET 76 8.039 14.251 -9.831 602 3HE MET 76 3HE MET 76 7.794 14.232 -8.066 Start of MODEL 5 1 H ARG 1 H ARG 1 13.637 11.661 -2.163 2 HA ARG 1 HA ARG 1 16.346 12.320 -3.027 3 1HB ARG 1 1HB ARG 1 15.775 10.187 -1.581 4 2HB ARG 1 2HB ARG 1 15.224 9.495 -3.097 5 1HG ARG 1 1HG ARG 1 18.012 10.631 -2.542 6 2HG ARG 1 2HG ARG 1 17.549 8.938 -2.396 7 1HD ARG 1 1HD ARG 1 18.674 9.151 -4.499 8 2HD ARG 1 2HD ARG 1 16.967 8.874 -4.821 9 HE ARG 1 HE ARG 1 16.781 10.956 -5.766 10 1HH1 ARG 1 1HH1 ARG 1 19.959 10.823 -4.224 11 2HH1 ARG 1 2HH1 ARG 1 20.311 12.502 -4.532 12 1HH2 ARG 1 1HH2 ARG 1 17.074 13.122 -5.860 13 2HH2 ARG 1 2HH2 ARG 1 18.658 13.843 -5.625 14 H VAL 2 H VAL 2 13.542 10.331 -4.111 15 HA VAL 2 HA VAL 2 13.913 11.077 -6.893 16 HB VAL 2 HB VAL 2 11.705 9.949 -7.197 17 1HG1 VAL 2 1HG1 VAL 2 13.839 8.743 -7.437 18 2HG1 VAL 2 2HG1 VAL 2 13.825 8.344 -5.706 19 3HG1 VAL 2 3HG1 VAL 2 12.574 7.690 -6.781 20 1HG2 VAL 2 1HG2 VAL 2 10.697 8.659 -5.419 21 2HG2 VAL 2 2HG2 VAL 2 11.929 9.154 -4.253 22 3HG2 VAL 2 3HG2 VAL 2 10.770 10.342 -4.877 23 H GLY 3 H GLY 3 12.797 12.649 -8.083 24 1HA GLY 3 1HA GLY 3 10.605 14.197 -7.344 25 2HA GLY 3 2HA GLY 3 12.040 14.969 -6.627 26 H LEU 4 H LEU 4 11.652 16.751 -8.154 27 HA LEU 4 HA LEU 4 12.514 16.222 -10.967 28 1HB LEU 4 1HB LEU 4 11.246 18.689 -9.756 29 2HB LEU 4 2HB LEU 4 11.727 18.443 -11.439 30 HG LEU 4 HG LEU 4 9.494 17.008 -9.942 31 1HD1 LEU 4 1HD1 LEU 4 9.569 18.913 -12.322 32 2HD1 LEU 4 2HD1 LEU 4 8.107 18.170 -11.648 33 3HD1 LEU 4 3HD1 LEU 4 9.052 19.319 -10.677 34 1HD2 LEU 4 1HD2 LEU 4 10.441 15.345 -11.440 35 2HD2 LEU 4 2HD2 LEU 4 8.978 15.985 -12.192 36 3HD2 LEU 4 3HD2 LEU 4 10.567 16.535 -12.759 37 H THR 5 H THR 5 14.759 16.141 -10.887 38 HA THR 5 HA THR 5 16.379 17.975 -9.362 39 HB THR 5 HB THR 5 18.151 17.311 -11.007 40 HG1 THR 5 HG1 THR 5 16.327 15.542 -12.164 41 1HG2 THR 5 1HG2 THR 5 16.525 14.969 -9.912 42 2HG2 THR 5 2HG2 THR 5 18.206 14.911 -10.475 43 3HG2 THR 5 3HG2 THR 5 17.778 15.884 -9.056 44 H GLU 6 H GLU 6 17.794 19.680 -10.442 45 HA GLU 6 HA GLU 6 16.375 21.640 -11.844 46 1HB GLU 6 1HB GLU 6 18.537 21.907 -10.569 47 2HB GLU 6 2HB GLU 6 19.387 21.091 -11.897 48 1HG GLU 6 1HG GLU 6 18.628 22.865 -13.449 49 2HG GLU 6 2HG GLU 6 17.723 23.627 -12.125 50 H GLU 7 H GLU 7 18.454 18.993 -13.040 51 HA GLU 7 HA GLU 7 18.393 19.513 -15.800 52 1HB GLU 7 1HB GLU 7 18.356 16.827 -14.341 53 2HB GLU 7 2HB GLU 7 18.720 17.065 -16.054 54 1HG GLU 7 1HG GLU 7 20.667 18.477 -15.466 55 2HG GLU 7 2HG GLU 7 20.333 18.255 -13.742 56 H GLN 8 H GLN 8 16.133 17.417 -13.893 57 HA GLN 8 HA GLN 8 14.319 16.931 -16.010 58 1HB GLN 8 1HB GLN 8 13.905 17.088 -13.020 59 2HB GLN 8 2HB GLN 8 12.626 16.604 -14.140 60 1HG GLN 8 1HG GLN 8 13.757 14.635 -14.827 61 2HG GLN 8 2HG GLN 8 15.311 15.197 -14.203 62 1HE2 GLN 8 1HE2 GLN 8 12.060 14.031 -13.153 63 2HE2 GLN 8 2HE2 GLN 8 12.581 13.721 -11.492 64 H LYS 9 H LYS 9 14.372 19.699 -13.659 65 HA LYS 9 HA LYS 9 11.984 20.869 -14.727 66 1HB LYS 9 1HB LYS 9 14.292 22.117 -13.210 67 2HB LYS 9 2HB LYS 9 12.811 22.975 -13.680 68 1HG LYS 9 1HG LYS 9 11.453 21.201 -12.539 69 2HG LYS 9 2HG LYS 9 12.930 20.478 -11.922 70 1HD LYS 9 1HD LYS 9 11.956 23.330 -11.379 71 2HD LYS 9 2HD LYS 9 11.734 21.955 -10.291 72 1HE LYS 9 1HE LYS 9 14.416 23.168 -11.100 73 2HE LYS 9 2HE LYS 9 13.600 23.340 -9.541 74 1HZ LYS 9 1HZ LYS 9 14.578 20.826 -10.689 75 2HZ LYS 9 2HZ LYS 9 15.262 21.660 -9.442 76 3HZ LYS 9 3HZ LYS 9 13.783 20.953 -9.259 77 H GLN 10 H GLN 10 15.402 21.180 -15.790 78 HA GLN 10 HA GLN 10 14.821 23.222 -17.745 79 1HB GLN 10 1HB GLN 10 16.993 21.095 -17.976 80 2HB GLN 10 2HB GLN 10 16.860 22.625 -18.837 81 1HG GLN 10 1HG GLN 10 17.801 22.098 -16.055 82 2HG GLN 10 2HG GLN 10 18.448 23.155 -17.289 83 1HE2 GLN 10 1HE2 GLN 10 16.287 22.915 -14.569 84 2HE2 GLN 10 2HE2 GLN 10 15.831 24.623 -14.530 85 H GLU 11 H GLU 11 14.950 19.643 -17.944 86 HA GLU 11 HA GLU 11 14.225 19.372 -20.661 87 1HB GLU 11 1HB GLU 11 13.567 17.594 -18.279 88 2HB GLU 11 2HB GLU 11 13.340 17.127 -19.967 89 1HG GLU 11 1HG GLU 11 15.690 17.206 -20.427 90 2HG GLU 11 2HG GLU 11 16.060 18.022 -18.909 91 H ILE 12 H ILE 12 12.095 19.565 -17.781 92 HA ILE 12 HA ILE 12 9.610 19.471 -19.140 93 HB ILE 12 HB ILE 12 10.458 20.686 -16.498 94 1HG1 ILE 12 1HG1 ILE 12 8.736 18.229 -17.085 95 2HG1 ILE 12 2HG1 ILE 12 10.487 18.116 -16.984 96 1HG2 ILE 12 1HG2 ILE 12 7.626 20.328 -17.531 97 2HG2 ILE 12 2HG2 ILE 12 8.068 20.821 -15.888 98 3HG2 ILE 12 3HG2 ILE 12 8.422 21.885 -17.236 99 1HD1 ILE 12 1HD1 ILE 12 10.449 18.979 -14.672 100 2HD1 ILE 12 2HD1 ILE 12 8.674 19.040 -14.721 101 3HD1 ILE 12 3HD1 ILE 12 9.510 17.488 -14.866 102 H ARG 13 H ARG 13 11.692 22.319 -18.317 103 HA ARG 13 HA ARG 13 9.893 24.210 -19.411 104 1HB ARG 13 1HB ARG 13 11.721 24.941 -17.986 105 2HB ARG 13 2HB ARG 13 12.920 24.295 -19.110 106 1HG ARG 13 1HG ARG 13 12.854 26.685 -19.358 107 2HG ARG 13 2HG ARG 13 12.253 25.933 -20.825 108 1HD ARG 13 1HD ARG 13 9.890 26.326 -19.408 109 2HD ARG 13 2HD ARG 13 10.869 27.671 -18.829 110 HE ARG 13 HE ARG 13 11.139 27.611 -21.629 111 1HH1 ARG 13 1HH1 ARG 13 8.553 28.024 -19.263 112 2HH1 ARG 13 2HH1 ARG 13 7.505 28.901 -20.345 113 1HH2 ARG 13 1HH2 ARG 13 9.740 28.696 -23.106 114 2HH2 ARG 13 2HH2 ARG 13 8.230 29.344 -22.541 115 H GLU 14 H GLU 14 12.660 22.538 -20.995 116 HA GLU 14 HA GLU 14 12.262 23.744 -23.542 117 1HB GLU 14 1HB GLU 14 13.365 20.974 -22.868 118 2HB GLU 14 2HB GLU 14 13.496 21.777 -24.440 119 1HG GLU 14 1HG GLU 14 14.726 22.769 -21.826 120 2HG GLU 14 2HG GLU 14 15.575 22.046 -23.190 121 H ALA 15 H ALA 15 10.904 20.703 -22.219 122 HA ALA 15 HA ALA 15 9.359 19.956 -24.452 123 1HB ALA 15 1HB ALA 15 9.707 18.536 -22.462 124 2HB ALA 15 2HB ALA 15 8.680 19.617 -21.498 125 3HB ALA 15 3HB ALA 15 7.986 18.708 -22.855 126 H PHE 16 H PHE 16 8.412 22.037 -21.660 127 HA PHE 16 HA PHE 16 5.837 22.682 -22.485 128 1HB PHE 16 1HB PHE 16 6.775 23.320 -20.298 129 2HB PHE 16 2HB PHE 16 7.852 24.475 -21.055 130 HD1 PHE 16 HD1 PHE 16 7.011 26.613 -22.002 131 HD2 PHE 16 HD2 PHE 16 4.349 23.782 -20.148 132 HE1 PHE 16 HE1 PHE 16 5.196 28.321 -21.962 133 HE2 PHE 16 HE2 PHE 16 2.591 25.525 -20.002 134 HZ PHE 16 HZ PHE 16 3.030 27.798 -20.892 135 H ASP 17 H ASP 17 8.869 24.425 -23.153 136 HA ASP 17 HA ASP 17 7.840 26.526 -24.681 137 1HB ASP 17 1HB ASP 17 10.165 26.238 -23.678 138 2HB ASP 17 2HB ASP 17 10.573 25.228 -25.071 139 H LEU 18 H LEU 18 9.148 23.369 -25.799 140 HA LEU 18 HA LEU 18 8.666 23.727 -28.570 141 1HB LEU 18 1HB LEU 18 10.062 21.979 -27.654 142 2HB LEU 18 2HB LEU 18 8.693 21.176 -26.889 143 HG LEU 18 HG LEU 18 8.617 21.658 -29.881 144 1HD1 LEU 18 1HD1 LEU 18 10.861 20.758 -29.488 145 2HD1 LEU 18 2HD1 LEU 18 10.176 19.423 -28.529 146 3HD1 LEU 18 3HD1 LEU 18 9.826 19.554 -30.270 147 1HD2 LEU 18 1HD2 LEU 18 7.489 19.413 -29.848 148 2HD2 LEU 18 2HD2 LEU 18 7.638 19.378 -28.082 149 3HD2 LEU 18 3HD2 LEU 18 6.613 20.587 -28.880 150 H PHE 19 H PHE 19 6.585 22.172 -26.058 151 HA PHE 19 HA PHE 19 4.467 21.561 -27.834 152 1HB PHE 19 1HB PHE 19 4.395 22.165 -24.865 153 2HB PHE 19 2HB PHE 19 3.071 21.421 -25.764 154 HD1 PHE 19 HD1 PHE 19 4.682 19.428 -27.471 155 HD2 PHE 19 HD2 PHE 19 4.729 20.421 -23.267 156 HE1 PHE 19 HE1 PHE 19 5.421 17.152 -26.947 157 HE2 PHE 19 HE2 PHE 19 5.367 18.089 -22.744 158 HZ PHE 19 HZ PHE 19 5.825 16.472 -24.583 159 H ASP 20 H ASP 20 5.143 24.583 -26.067 160 HA ASP 20 HA ASP 20 2.697 25.854 -27.013 161 1HB ASP 20 1HB ASP 20 3.890 26.613 -24.975 162 2HB ASP 20 2HB ASP 20 5.272 27.089 -25.975 163 H THR 21 H THR 21 3.401 24.686 -29.207 164 HA THR 21 HA THR 21 5.280 25.814 -30.962 165 HB THR 21 HB THR 21 3.824 24.895 -32.758 166 HG1 THR 21 HG1 THR 21 2.001 24.655 -30.608 167 1HG2 THR 21 1HG2 THR 21 3.961 22.561 -32.109 168 2HG2 THR 21 2HG2 THR 21 5.397 23.409 -31.506 169 3HG2 THR 21 3HG2 THR 21 4.081 22.981 -30.394 170 H ASP 22 H ASP 22 1.971 26.862 -30.188 171 HA ASP 22 HA ASP 22 1.793 28.935 -32.160 172 1HB ASP 22 1HB ASP 22 0.407 28.563 -29.467 173 2HB ASP 22 2HB ASP 22 -0.012 29.821 -30.634 174 H GLY 23 H GLY 23 3.692 28.789 -29.237 175 1HA GLY 23 1HA GLY 23 4.942 30.340 -28.150 176 2HA GLY 23 2HA GLY 23 4.819 31.367 -29.589 177 H SER 24 H SER 24 1.984 30.224 -27.670 178 HA SER 24 HA SER 24 1.009 32.915 -27.376 179 1HB SER 24 1HB SER 24 -0.610 31.287 -25.865 180 2HB SER 24 2HB SER 24 -0.713 31.536 -27.614 181 HG SER 24 HG SER 24 0.299 29.319 -26.236 182 H GLY 25 H GLY 25 3.095 30.931 -25.522 183 1HA GLY 25 1HA GLY 25 4.306 31.701 -23.605 184 2HA GLY 25 2HA GLY 25 2.982 32.798 -23.177 185 H THR 26 H THR 26 0.807 30.991 -23.600 186 HA THR 26 HA THR 26 1.150 28.898 -21.511 187 HB THR 26 HB THR 26 -1.201 29.067 -21.228 188 HG1 THR 26 HG1 THR 26 -2.394 30.527 -22.354 189 1HG2 THR 26 1HG2 THR 26 -0.005 31.868 -21.124 190 2HG2 THR 26 2HG2 THR 26 -1.350 31.234 -20.162 191 3HG2 THR 26 3HG2 THR 26 0.288 30.607 -19.915 192 H ILE 27 H ILE 27 0.525 26.791 -22.023 193 HA ILE 27 HA ILE 27 0.577 26.041 -24.882 194 HB ILE 27 HB ILE 27 0.406 24.517 -22.266 195 1HG1 ILE 27 1HG1 ILE 27 2.483 24.612 -24.509 196 2HG1 ILE 27 2HG1 ILE 27 2.596 25.496 -22.983 197 1HG2 ILE 27 1HG2 ILE 27 0.455 22.421 -23.490 198 2HG2 ILE 27 2HG2 ILE 27 -0.951 23.299 -24.018 199 3HG2 ILE 27 3HG2 ILE 27 0.509 23.273 -25.039 200 1HD1 ILE 27 1HD1 ILE 27 2.621 22.473 -23.351 201 2HD1 ILE 27 2HD1 ILE 27 3.908 23.538 -22.795 202 3HD1 ILE 27 3HD1 ILE 27 2.480 23.276 -21.770 203 H ASP 28 H ASP 28 -1.334 26.061 -26.073 204 HA ASP 28 HA ASP 28 -3.905 26.399 -24.799 205 1HB ASP 28 1HB ASP 28 -3.437 27.181 -27.093 206 2HB ASP 28 2HB ASP 28 -3.207 25.508 -27.625 207 H ALA 29 H ALA 29 -5.556 24.903 -24.390 208 HA ALA 29 HA ALA 29 -5.167 22.374 -23.534 209 1HB ALA 29 1HB ALA 29 -7.544 21.933 -24.120 210 2HB ALA 29 2HB ALA 29 -7.535 23.351 -25.189 211 3HB ALA 29 3HB ALA 29 -7.313 23.555 -23.438 212 H LYS 30 H LYS 30 -5.766 23.149 -27.002 213 HA LYS 30 HA LYS 30 -5.734 20.446 -27.938 214 1HB LYS 30 1HB LYS 30 -5.054 23.041 -29.373 215 2HB LYS 30 2HB LYS 30 -5.333 21.475 -30.151 216 1HG LYS 30 1HG LYS 30 -7.624 21.404 -29.150 217 2HG LYS 30 2HG LYS 30 -7.397 23.033 -28.516 218 1HD LYS 30 1HD LYS 30 -7.355 22.187 -31.452 219 2HD LYS 30 2HD LYS 30 -8.669 23.033 -30.632 220 1HE LYS 30 1HE LYS 30 -5.878 24.139 -31.206 221 2HE LYS 30 2HE LYS 30 -7.394 24.604 -31.980 222 1HZ LYS 30 1HZ LYS 30 -8.164 25.401 -29.853 223 2HZ LYS 30 2HZ LYS 30 -6.723 25.008 -29.151 224 3HZ LYS 30 3HZ LYS 30 -6.781 26.165 -30.320 225 H GLU 31 H GLU 31 -3.129 22.873 -27.502 226 HA GLU 31 HA GLU 31 -1.057 21.301 -28.761 227 1HB GLU 31 1HB GLU 31 -0.940 23.555 -26.725 228 2HB GLU 31 2HB GLU 31 0.469 22.792 -27.468 229 1HG GLU 31 1HG GLU 31 -0.266 23.508 -29.696 230 2HG GLU 31 2HG GLU 31 -1.719 24.248 -29.012 231 H LEU 32 H LEU 32 -2.303 21.630 -25.383 232 HA LEU 32 HA LEU 32 -0.365 19.838 -24.287 233 1HB LEU 32 1HB LEU 32 -2.126 21.349 -23.014 234 2HB LEU 32 2HB LEU 32 -3.167 19.921 -23.185 235 HG LEU 32 HG LEU 32 -1.129 18.590 -22.197 236 1HD1 LEU 32 1HD1 LEU 32 0.601 20.302 -22.296 237 2HD1 LEU 32 2HD1 LEU 32 -0.388 21.397 -21.300 238 3HD1 LEU 32 3HD1 LEU 32 0.251 19.890 -20.621 239 1HD2 LEU 32 1HD2 LEU 32 -3.253 18.880 -21.026 240 2HD2 LEU 32 2HD2 LEU 32 -1.907 19.074 -19.896 241 3HD2 LEU 32 3HD2 LEU 32 -2.771 20.503 -20.503 242 H LYS 33 H LYS 33 -3.616 19.255 -25.693 243 HA LYS 33 HA LYS 33 -3.681 16.464 -25.244 244 1HB LYS 33 1HB LYS 33 -5.546 17.891 -25.827 245 2HB LYS 33 2HB LYS 33 -4.954 18.024 -27.503 246 1HG LYS 33 1HG LYS 33 -5.193 15.519 -27.703 247 2HG LYS 33 2HG LYS 33 -5.814 15.502 -26.036 248 1HD LYS 33 1HD LYS 33 -7.660 17.052 -26.736 249 2HD LYS 33 2HD LYS 33 -7.054 16.979 -28.403 250 1HE LYS 33 1HE LYS 33 -7.435 14.493 -28.391 251 2HE LYS 33 2HE LYS 33 -8.124 14.634 -26.758 252 1HZ LYS 33 1HZ LYS 33 -9.800 16.067 -27.651 253 2HZ LYS 33 2HZ LYS 33 -9.166 15.937 -29.169 254 3HZ LYS 33 3HZ LYS 33 -9.806 14.613 -28.425 255 H VAL 34 H VAL 34 -2.419 18.261 -28.087 256 HA VAL 34 HA VAL 34 -1.343 15.986 -29.474 257 HB VAL 34 HB VAL 34 -0.555 18.933 -29.373 258 1HG1 VAL 34 1HG1 VAL 34 0.586 16.749 -31.161 259 2HG1 VAL 34 2HG1 VAL 34 0.773 18.493 -31.441 260 3HG1 VAL 34 3HG1 VAL 34 1.488 17.759 -30.006 261 1HG2 VAL 34 1HG2 VAL 34 -1.605 18.998 -31.591 262 2HG2 VAL 34 2HG2 VAL 34 -1.930 17.253 -31.518 263 3HG2 VAL 34 3HG2 VAL 34 -2.761 18.362 -30.411 264 H ALA 35 H ALA 35 0.069 18.041 -26.854 265 HA ALA 35 HA ALA 35 2.617 16.844 -26.854 266 1HB ALA 35 1HB ALA 35 2.817 17.643 -24.556 267 2HB ALA 35 2HB ALA 35 2.074 18.887 -25.584 268 3HB ALA 35 3HB ALA 35 1.099 17.943 -24.443 269 H MET 36 H MET 36 -0.249 15.976 -24.859 270 HA MET 36 HA MET 36 0.866 13.652 -23.637 271 1HB MET 36 1HB MET 36 -1.948 14.555 -24.205 272 2HB MET 36 2HB MET 36 -1.606 13.033 -23.370 273 1HG MET 36 1HG MET 36 -0.304 14.121 -21.656 274 2HG MET 36 2HG MET 36 -0.488 15.696 -22.436 275 1HE MET 36 1HE MET 36 -2.594 17.010 -22.574 276 2HE MET 36 2HE MET 36 -3.574 15.707 -23.247 277 3HE MET 36 3HE MET 36 -4.163 16.610 -21.836 278 H ARG 37 H ARG 37 -1.050 13.976 -26.655 279 HA ARG 37 HA ARG 37 -1.020 11.283 -27.443 280 1HB ARG 37 1HB ARG 37 -2.335 12.858 -28.634 281 2HB ARG 37 2HB ARG 37 -0.937 13.863 -29.006 282 1HG ARG 37 1HG ARG 37 -1.652 12.663 -30.985 283 2HG ARG 37 2HG ARG 37 -0.021 12.202 -30.499 284 1HD ARG 37 1HD ARG 37 -1.141 10.229 -31.126 285 2HD ARG 37 2HD ARG 37 -0.968 10.171 -29.374 286 HE ARG 37 HE ARG 37 -3.488 11.195 -30.600 287 1HH1 ARG 37 1HH1 ARG 37 -2.140 8.740 -28.390 288 2HH1 ARG 37 2HH1 ARG 37 -3.359 7.572 -28.772 289 1HH2 ARG 37 1HH2 ARG 37 -5.259 9.791 -30.768 290 2HH2 ARG 37 2HH2 ARG 37 -5.272 8.268 -29.921 291 H ALA 38 H ALA 38 1.481 13.787 -28.194 292 HA ALA 38 HA ALA 38 3.290 12.044 -29.502 293 1HB ALA 38 1HB ALA 38 4.942 13.815 -29.130 294 2HB ALA 38 2HB ALA 38 3.388 14.505 -29.639 295 3HB ALA 38 3HB ALA 38 3.884 14.591 -27.936 296 H LEU 39 H LEU 39 2.948 12.887 -26.058 297 HA LEU 39 HA LEU 39 5.208 11.380 -25.108 298 1HB LEU 39 1HB LEU 39 2.661 12.350 -23.782 299 2HB LEU 39 2HB LEU 39 3.951 11.565 -22.894 300 HG LEU 39 HG LEU 39 4.502 14.063 -24.542 301 1HD1 LEU 39 1HD1 LEU 39 4.190 15.362 -22.422 302 2HD1 LEU 39 2HD1 LEU 39 2.672 14.714 -23.030 303 3HD1 LEU 39 3HD1 LEU 39 3.479 13.920 -21.669 304 1HD2 LEU 39 1HD2 LEU 39 5.833 12.859 -22.080 305 2HD2 LEU 39 2HD2 LEU 39 6.448 12.760 -23.743 306 3HD2 LEU 39 3HD2 LEU 39 6.342 14.330 -22.934 307 H GLY 40 H GLY 40 2.332 10.231 -26.557 308 1HA GLY 40 1HA GLY 40 2.030 8.010 -27.062 309 2HA GLY 40 2HA GLY 40 3.014 7.497 -25.688 310 H PHE 41 H PHE 41 0.580 9.932 -25.036 311 HA PHE 41 HA PHE 41 -1.034 8.026 -23.465 312 1HB PHE 41 1HB PHE 41 -1.329 10.967 -24.130 313 2HB PHE 41 2HB PHE 41 -2.524 10.095 -23.235 314 HD1 PHE 41 HD1 PHE 41 -2.541 10.437 -20.940 315 HD2 PHE 41 HD2 PHE 41 1.246 10.558 -23.021 316 HE1 PHE 41 HE1 PHE 41 -1.392 11.041 -18.841 317 HE2 PHE 41 HE2 PHE 41 2.380 11.134 -20.910 318 HZ PHE 41 HZ PHE 41 1.068 11.392 -18.813 319 H GLU 42 H GLU 42 -3.362 7.940 -23.821 320 HA GLU 42 HA GLU 42 -4.302 8.176 -26.657 321 1HB GLU 42 1HB GLU 42 -5.223 6.303 -24.440 322 2HB GLU 42 2HB GLU 42 -5.959 6.483 -26.041 323 1HG GLU 42 1HG GLU 42 -3.768 5.806 -27.080 324 2HG GLU 42 2HG GLU 42 -3.117 5.515 -25.459 325 HA PRO 43 HA PRO 43 -5.913 11.627 -24.165 326 1HB PRO 43 1HB PRO 43 -7.014 12.301 -26.906 327 2HB PRO 43 2HB PRO 43 -6.402 13.397 -25.629 328 1HG PRO 43 1HG PRO 43 -4.776 12.671 -27.671 329 2HG PRO 43 2HG PRO 43 -4.141 12.611 -25.999 330 1HD PRO 43 1HD PRO 43 -5.223 10.326 -27.670 331 2HD PRO 43 2HD PRO 43 -3.749 10.409 -26.657 332 H LYS 44 H LYS 44 -7.316 10.167 -22.994 333 HA LYS 44 HA LYS 44 -10.025 9.654 -23.735 334 1HB LYS 44 1HB LYS 44 -8.851 10.042 -20.954 335 2HB LYS 44 2HB LYS 44 -10.377 9.255 -21.362 336 1HG LYS 44 1HG LYS 44 -7.566 8.276 -21.995 337 2HG LYS 44 2HG LYS 44 -8.705 7.593 -20.845 338 1HD LYS 44 1HD LYS 44 -9.001 7.598 -23.884 339 2HD LYS 44 2HD LYS 44 -8.575 6.231 -22.856 340 1HE LYS 44 1HE LYS 44 -10.792 6.428 -21.686 341 2HE LYS 44 2HE LYS 44 -11.254 7.703 -22.827 342 1HZ LYS 44 1HZ LYS 44 -12.068 5.591 -23.507 343 2HZ LYS 44 2HZ LYS 44 -10.969 6.144 -24.604 344 3HZ LYS 44 3HZ LYS 44 -10.551 4.951 -23.546 345 H LYS 45 H LYS 45 -10.513 11.602 -24.777 346 HA LYS 45 HA LYS 45 -10.482 14.091 -24.414 347 1HB LYS 45 1HB LYS 45 -11.870 12.986 -26.108 348 2HB LYS 45 2HB LYS 45 -13.152 12.727 -24.916 349 1HG LYS 45 1HG LYS 45 -13.390 15.206 -24.662 350 2HG LYS 45 2HG LYS 45 -12.113 15.435 -25.877 351 1HD LYS 45 1HD LYS 45 -13.515 14.249 -27.555 352 2HD LYS 45 2HD LYS 45 -14.750 13.953 -26.313 353 1HE LYS 45 1HE LYS 45 -15.066 16.399 -26.027 354 2HE LYS 45 2HE LYS 45 -13.851 16.704 -27.289 355 1HZ LYS 45 1HZ LYS 45 -16.070 16.802 -28.139 356 2HZ LYS 45 2HZ LYS 45 -15.263 15.541 -28.827 357 3HZ LYS 45 3HZ LYS 45 -16.383 15.261 -27.650 358 H GLU 46 H GLU 46 -13.141 12.472 -22.550 359 HA GLU 46 HA GLU 46 -13.963 14.916 -21.336 360 1HB GLU 46 1HB GLU 46 -14.391 12.092 -20.255 361 2HB GLU 46 2HB GLU 46 -15.329 13.543 -19.882 362 1HG GLU 46 1HG GLU 46 -15.199 12.090 -22.564 363 2HG GLU 46 2HG GLU 46 -16.570 12.203 -21.464 364 H GLU 47 H GLU 47 -11.922 12.267 -20.071 365 HA GLU 47 HA GLU 47 -11.363 13.467 -17.544 366 1HB GLU 47 1HB GLU 47 -9.671 11.486 -19.142 367 2HB GLU 47 2HB GLU 47 -9.525 11.889 -17.431 368 1HG GLU 47 1HG GLU 47 -10.784 10.023 -17.183 369 2HG GLU 47 2HG GLU 47 -12.116 11.161 -17.376 370 H ILE 48 H ILE 48 -9.684 13.570 -20.691 371 HA ILE 48 HA ILE 48 -7.454 15.173 -19.977 372 HB ILE 48 HB ILE 48 -9.062 14.846 -22.525 373 1HG1 ILE 48 1HG1 ILE 48 -7.645 12.937 -21.571 374 2HG1 ILE 48 2HG1 ILE 48 -7.432 13.392 -23.262 375 1HG2 ILE 48 1HG2 ILE 48 -7.157 15.921 -23.739 376 2HG2 ILE 48 2HG2 ILE 48 -8.167 17.025 -22.807 377 3HG2 ILE 48 3HG2 ILE 48 -6.583 16.537 -22.170 378 1HD1 ILE 48 1HD1 ILE 48 -5.591 14.377 -21.040 379 2HD1 ILE 48 2HD1 ILE 48 -5.286 12.945 -22.041 380 3HD1 ILE 48 3HD1 ILE 48 -5.381 14.540 -22.797 381 H LYS 49 H LYS 49 -10.680 16.240 -21.203 382 HA LYS 49 HA LYS 49 -10.159 19.016 -20.968 383 1HB LYS 49 1HB LYS 49 -12.737 17.410 -20.848 384 2HB LYS 49 2HB LYS 49 -12.717 19.173 -20.838 385 1HG LYS 49 1HG LYS 49 -11.380 17.566 -23.054 386 2HG LYS 49 2HG LYS 49 -13.094 18.002 -23.073 387 1HD LYS 49 1HD LYS 49 -12.511 20.412 -22.928 388 2HD LYS 49 2HD LYS 49 -10.791 20.005 -22.868 389 1HE LYS 49 1HE LYS 49 -11.373 20.693 -25.117 390 2HE LYS 49 2HE LYS 49 -10.928 18.979 -25.119 391 1HZ LYS 49 1HZ LYS 49 -13.674 20.036 -25.105 392 2HZ LYS 49 2HZ LYS 49 -12.885 19.429 -26.419 393 3HZ LYS 49 3HZ LYS 49 -13.256 18.441 -25.153 394 H LYS 50 H LYS 50 -11.663 16.765 -18.589 395 HA LYS 50 HA LYS 50 -12.122 18.708 -16.571 396 1HB LYS 50 1HB LYS 50 -11.516 15.733 -16.391 397 2HB LYS 50 2HB LYS 50 -11.931 16.734 -14.990 398 1HG LYS 50 1HG LYS 50 -14.073 17.353 -15.968 399 2HG LYS 50 2HG LYS 50 -13.689 16.486 -17.464 400 1HD LYS 50 1HD LYS 50 -13.613 14.340 -16.228 401 2HD LYS 50 2HD LYS 50 -13.886 15.194 -14.700 402 1HE LYS 50 1HE LYS 50 -15.974 14.187 -15.471 403 2HE LYS 50 2HE LYS 50 -16.111 15.952 -15.496 404 1HZ LYS 50 1HZ LYS 50 -15.544 14.245 -17.818 405 2HZ LYS 50 2HZ LYS 50 -16.995 14.943 -17.470 406 3HZ LYS 50 3HZ LYS 50 -15.699 15.885 -17.851 407 H MET 51 H MET 51 -9.234 16.551 -16.963 408 HA MET 51 HA MET 51 -7.743 17.572 -14.855 409 1HB MET 51 1HB MET 51 -7.252 15.537 -16.284 410 2HB MET 51 2HB MET 51 -6.656 16.629 -17.544 411 1HG MET 51 1HG MET 51 -5.047 17.566 -15.777 412 2HG MET 51 2HG MET 51 -5.647 16.303 -14.700 413 1HE MET 51 1HE MET 51 -4.683 16.115 -18.604 414 2HE MET 51 2HE MET 51 -3.523 17.219 -17.817 415 3HE MET 51 3HE MET 51 -2.983 15.631 -18.406 416 H ILE 52 H ILE 52 -7.649 18.590 -18.314 417 HA ILE 52 HA ILE 52 -5.823 20.705 -18.075 418 HB ILE 52 HB ILE 52 -8.193 20.210 -19.908 419 1HG1 ILE 52 1HG1 ILE 52 -5.180 20.279 -20.395 420 2HG1 ILE 52 2HG1 ILE 52 -6.076 18.808 -20.011 421 1HG2 ILE 52 1HG2 ILE 52 -7.972 22.677 -19.797 422 2HG2 ILE 52 2HG2 ILE 52 -6.242 22.536 -20.172 423 3HG2 ILE 52 3HG2 ILE 52 -7.471 22.057 -21.354 424 1HD1 ILE 52 1HD1 ILE 52 -5.773 18.857 -22.379 425 2HD1 ILE 52 2HD1 ILE 52 -7.490 19.201 -22.065 426 3HD1 ILE 52 3HD1 ILE 52 -6.371 20.509 -22.510 427 H SER 53 H SER 53 -9.402 20.814 -17.626 428 HA SER 53 HA SER 53 -9.488 23.579 -16.999 429 1HB SER 53 1HB SER 53 -11.335 21.382 -15.952 430 2HB SER 53 2HB SER 53 -11.678 23.118 -16.041 431 HG SER 53 HG SER 53 -11.227 21.328 -18.210 432 H GLU 54 H GLU 54 -9.114 20.749 -14.811 433 HA GLU 54 HA GLU 54 -9.084 22.222 -12.379 434 1HB GLU 54 1HB GLU 54 -7.802 19.575 -13.155 435 2HB GLU 54 2HB GLU 54 -7.820 20.213 -11.505 436 1HG GLU 54 1HG GLU 54 -10.238 20.191 -11.417 437 2HG GLU 54 2HG GLU 54 -10.368 19.767 -13.126 438 H ILE 55 H ILE 55 -6.404 21.390 -14.622 439 HA ILE 55 HA ILE 55 -4.401 22.663 -12.921 440 HB ILE 55 HB ILE 55 -4.296 21.803 -15.829 441 1HG1 ILE 55 1HG1 ILE 55 -4.723 19.863 -14.413 442 2HG1 ILE 55 2HG1 ILE 55 -3.095 19.828 -15.055 443 1HG2 ILE 55 1HG2 ILE 55 -1.817 21.783 -15.483 444 2HG2 ILE 55 2HG2 ILE 55 -2.534 23.393 -15.421 445 3HG2 ILE 55 3HG2 ILE 55 -2.058 22.591 -13.917 446 1HD1 ILE 55 1HD1 ILE 55 -2.247 20.626 -12.811 447 2HD1 ILE 55 2HD1 ILE 55 -3.920 20.571 -12.208 448 3HD1 ILE 55 3HD1 ILE 55 -3.118 19.090 -12.741 449 H ASP 56 H ASP 56 -6.454 23.745 -15.617 450 HA ASP 56 HA ASP 56 -5.015 26.219 -16.067 451 1HB ASP 56 1HB ASP 56 -6.285 25.006 -17.803 452 2HB ASP 56 2HB ASP 56 -7.782 25.277 -16.901 453 H LYS 57 H LYS 57 -4.971 26.836 -13.764 454 HA LYS 57 HA LYS 57 -7.186 27.237 -12.135 455 1HB LYS 57 1HB LYS 57 -4.664 28.939 -12.104 456 2HB LYS 57 2HB LYS 57 -5.778 28.661 -10.764 457 1HG LYS 57 1HG LYS 57 -3.881 26.633 -12.018 458 2HG LYS 57 2HG LYS 57 -3.807 27.351 -10.412 459 1HD LYS 57 1HD LYS 57 -5.979 26.228 -9.834 460 2HD LYS 57 2HD LYS 57 -5.970 25.457 -11.437 461 1HE LYS 57 1HE LYS 57 -3.803 24.382 -10.930 462 2HE LYS 57 2HE LYS 57 -3.826 25.091 -9.301 463 1HZ LYS 57 1HZ LYS 57 -5.835 23.264 -10.416 464 2HZ LYS 57 2HZ LYS 57 -4.651 22.842 -9.343 465 3HZ LYS 57 3HZ LYS 57 -5.848 23.884 -8.887 466 H ASP 58 H ASP 58 -6.443 29.240 -14.887 467 HA ASP 58 HA ASP 58 -8.187 31.415 -13.794 468 1HB ASP 58 1HB ASP 58 -7.061 33.008 -15.020 469 2HB ASP 58 2HB ASP 58 -5.778 32.058 -14.267 470 H GLY 59 H GLY 59 -8.406 28.713 -15.561 471 1HA GLY 59 1HA GLY 59 -9.635 27.961 -17.233 472 2HA GLY 59 2HA GLY 59 -10.814 29.196 -16.750 473 H SER 60 H SER 60 -7.575 29.572 -18.255 474 HA SER 60 HA SER 60 -8.586 31.495 -20.210 475 1HB SER 60 1HB SER 60 -6.157 31.404 -20.943 476 2HB SER 60 2HB SER 60 -6.420 31.877 -19.260 477 HG SER 60 HG SER 60 -5.679 29.944 -18.569 478 H GLY 61 H GLY 61 -8.260 28.064 -20.158 479 1HA GLY 61 1HA GLY 61 -8.735 26.516 -21.833 480 2HA GLY 61 2HA GLY 61 -8.620 27.768 -23.084 481 H THR 62 H THR 62 -6.086 27.965 -20.701 482 HA THR 62 HA THR 62 -4.221 26.429 -22.371 483 HB THR 62 HB THR 62 -2.733 28.274 -22.634 484 HG1 THR 62 HG1 THR 62 -4.478 29.596 -20.826 485 1HG2 THR 62 1HG2 THR 62 -3.932 29.864 -23.999 486 2HG2 THR 62 2HG2 THR 62 -4.732 28.307 -24.244 487 3HG2 THR 62 3HG2 THR 62 -5.468 29.524 -23.192 488 H ILE 63 H ILE 63 -2.151 26.083 -21.319 489 HA ILE 63 HA ILE 63 -2.289 26.087 -18.334 490 HB ILE 63 HB ILE 63 -0.667 24.304 -20.184 491 1HG1 ILE 63 1HG1 ILE 63 -2.966 23.718 -20.583 492 2HG1 ILE 63 2HG1 ILE 63 -2.180 22.486 -19.602 493 1HG2 ILE 63 1HG2 ILE 63 -1.190 24.198 -17.190 494 2HG2 ILE 63 2HG2 ILE 63 -0.359 22.938 -18.128 495 3HG2 ILE 63 3HG2 ILE 63 0.339 24.558 -17.996 496 1HD1 ILE 63 1HD1 ILE 63 -4.094 24.614 -18.558 497 2HD1 ILE 63 2HD1 ILE 63 -4.441 22.896 -18.793 498 3HD1 ILE 63 3HD1 ILE 63 -3.281 23.390 -17.564 499 H ASP 64 H ASP 64 -0.962 27.550 -17.417 500 HA ASP 64 HA ASP 64 1.229 28.830 -18.887 501 1HB ASP 64 1HB ASP 64 -0.106 30.133 -17.298 502 2HB ASP 64 2HB ASP 64 0.296 29.009 -15.991 503 H PHE 65 H PHE 65 3.452 28.712 -18.284 504 HA PHE 65 HA PHE 65 4.519 26.181 -17.955 505 1HB PHE 65 1HB PHE 65 5.810 28.014 -18.832 506 2HB PHE 65 2HB PHE 65 5.728 28.876 -17.294 507 HD1 PHE 65 HD1 PHE 65 7.800 28.916 -16.183 508 HD2 PHE 65 HD2 PHE 65 6.681 25.356 -18.360 509 HE1 PHE 65 HE1 PHE 65 9.825 27.762 -15.359 510 HE2 PHE 65 HE2 PHE 65 8.651 24.180 -17.427 511 HZ PHE 65 HZ PHE 65 10.243 25.387 -15.955 512 H GLU 66 H GLU 66 3.816 28.529 -15.311 513 HA GLU 66 HA GLU 66 5.018 26.960 -13.241 514 1HB GLU 66 1HB GLU 66 2.700 28.943 -13.108 515 2HB GLU 66 2HB GLU 66 3.598 28.297 -11.727 516 1HG GLU 66 1HG GLU 66 5.699 29.280 -12.608 517 2HG GLU 66 2HG GLU 66 4.818 29.965 -13.981 518 H GLU 67 H GLU 67 1.722 26.996 -14.631 519 HA GLU 67 HA GLU 67 0.571 25.139 -12.755 520 1HB GLU 67 1HB GLU 67 -0.242 25.809 -15.612 521 2HB GLU 67 2HB GLU 67 -1.216 24.927 -14.430 522 1HG GLU 67 1HG GLU 67 -1.350 26.852 -12.963 523 2HG GLU 67 2HG GLU 67 -0.293 27.800 -14.015 524 H PHE 68 H PHE 68 2.012 24.811 -16.006 525 HA PHE 68 HA PHE 68 1.760 22.012 -16.323 526 1HB PHE 68 1HB PHE 68 2.431 23.629 -18.088 527 2HB PHE 68 2HB PHE 68 3.976 23.858 -17.295 528 HD1 PHE 68 HD1 PHE 68 1.787 21.243 -18.861 529 HD2 PHE 68 HD2 PHE 68 5.812 22.465 -17.900 530 HE1 PHE 68 HE1 PHE 68 2.686 19.546 -20.437 531 HE2 PHE 68 HE2 PHE 68 6.689 20.852 -19.574 532 HZ PHE 68 HZ PHE 68 5.140 19.373 -20.805 533 H LEU 69 H LEU 69 4.485 23.914 -14.942 534 HA LEU 69 HA LEU 69 6.120 21.735 -14.247 535 1HB LEU 69 1HB LEU 69 6.912 24.037 -14.313 536 2HB LEU 69 2HB LEU 69 5.827 24.491 -12.994 537 HG LEU 69 HG LEU 69 7.066 23.075 -11.417 538 1HD1 LEU 69 1HD1 LEU 69 8.885 22.437 -13.786 539 2HD1 LEU 69 2HD1 LEU 69 9.238 22.069 -12.084 540 3HD1 LEU 69 3HD1 LEU 69 7.886 21.271 -12.885 541 1HD2 LEU 69 1HD2 LEU 69 7.744 25.422 -11.778 542 2HD2 LEU 69 2HD2 LEU 69 9.134 24.403 -11.365 543 3HD2 LEU 69 3HD2 LEU 69 8.874 24.906 -13.049 544 H THR 70 H THR 70 3.526 23.390 -12.369 545 HA THR 70 HA THR 70 3.792 21.822 -10.018 546 HB THR 70 HB THR 70 1.231 23.034 -11.143 547 HG1 THR 70 HG1 THR 70 2.888 24.576 -10.946 548 1HG2 THR 70 1HG2 THR 70 2.085 22.328 -8.300 549 2HG2 THR 70 2HG2 THR 70 0.602 23.187 -8.755 550 3HG2 THR 70 3HG2 THR 70 0.825 21.497 -9.242 551 H MET 71 H MET 71 1.728 21.301 -12.924 552 HA MET 71 HA MET 71 0.517 18.891 -12.129 553 1HB MET 71 1HB MET 71 -0.172 20.306 -13.998 554 2HB MET 71 2HB MET 71 1.258 19.874 -14.921 555 1HG MET 71 1HG MET 71 -0.773 17.831 -13.944 556 2HG MET 71 2HG MET 71 -0.949 18.695 -15.469 557 1HE MET 71 1HE MET 71 1.925 17.279 -17.671 558 2HE MET 71 2HE MET 71 0.580 18.437 -17.568 559 3HE MET 71 3HE MET 71 2.089 18.727 -16.661 560 H MET 72 H MET 72 3.600 19.408 -13.915 561 HA MET 72 HA MET 72 4.359 16.671 -14.070 562 1HB MET 72 1HB MET 72 6.009 19.215 -13.927 563 2HB MET 72 2HB MET 72 6.720 17.606 -14.123 564 1HG MET 72 1HG MET 72 4.613 18.740 -16.000 565 2HG MET 72 2HG MET 72 6.353 18.848 -16.262 566 1HE MET 72 1HE MET 72 6.081 17.799 -18.657 567 2HE MET 72 2HE MET 72 5.216 16.275 -18.966 568 3HE MET 72 3HE MET 72 4.324 17.699 -18.379 569 H THR 73 H THR 73 5.198 19.087 -11.564 570 HA THR 73 HA THR 73 6.665 17.395 -9.882 571 HB THR 73 HB THR 73 4.887 19.714 -9.009 572 HG1 THR 73 HG1 THR 73 6.301 20.358 -10.649 573 1HG2 THR 73 1HG2 THR 73 7.430 18.523 -7.812 574 2HG2 THR 73 2HG2 THR 73 6.621 20.001 -7.258 575 3HG2 THR 73 3HG2 THR 73 5.803 18.440 -7.094 576 H ALA 74 H ALA 74 3.116 17.869 -10.011 577 HA ALA 74 HA ALA 74 2.445 16.357 -7.730 578 1HB ALA 74 1HB ALA 74 0.855 17.754 -9.019 579 2HB ALA 74 2HB ALA 74 0.880 16.558 -10.333 580 3HB ALA 74 3HB ALA 74 0.247 16.109 -8.741 581 H LYS 75 H LYS 75 3.338 15.244 -11.015 582 HA LYS 75 HA LYS 75 2.692 12.433 -10.345 583 1HB LYS 75 1HB LYS 75 4.077 13.597 -12.786 584 2HB LYS 75 2HB LYS 75 3.515 11.931 -12.561 585 1HG LYS 75 1HG LYS 75 1.170 12.915 -12.191 586 2HG LYS 75 2HG LYS 75 1.810 14.447 -12.787 587 1HD LYS 75 1HD LYS 75 1.633 11.775 -14.263 588 2HD LYS 75 2HD LYS 75 0.728 13.251 -14.614 589 1HE LYS 75 1HE LYS 75 3.723 12.792 -15.008 590 2HE LYS 75 2HE LYS 75 2.494 12.984 -16.265 591 1HZ LYS 75 1HZ LYS 75 3.724 15.003 -15.894 592 2HZ LYS 75 2HZ LYS 75 2.139 15.224 -15.494 593 3HZ LYS 75 3HZ LYS 75 3.262 15.027 -14.312 594 H MET 76 H MET 76 5.525 14.446 -11.023 595 HA MET 76 HA MET 76 7.709 14.069 -11.056 596 1HB MET 76 1HB MET 76 8.747 13.736 -8.849 597 2HB MET 76 2HB MET 76 7.489 14.952 -8.919 598 1HG MET 76 1HG MET 76 7.262 13.782 -6.859 599 2HG MET 76 2HG MET 76 5.874 13.424 -7.864 600 1HE MET 76 1HE MET 76 9.085 12.078 -6.092 601 2HE MET 76 2HE MET 76 9.206 10.429 -6.750 602 3HE MET 76 3HE MET 76 9.553 11.821 -7.792 Start of MODEL 6 1 H ARG 1 H ARG 1 16.964 19.305 -4.260 2 HA ARG 1 HA ARG 1 14.707 20.058 -4.509 3 1HB ARG 1 1HB ARG 1 15.746 18.221 -6.707 4 2HB ARG 1 2HB ARG 1 14.397 19.326 -6.948 5 1HG ARG 1 1HG ARG 1 17.236 20.189 -6.234 6 2HG ARG 1 2HG ARG 1 16.480 20.213 -7.834 7 1HD ARG 1 1HD ARG 1 14.691 21.734 -6.909 8 2HD ARG 1 2HD ARG 1 15.660 21.870 -5.418 9 HE ARG 1 HE ARG 1 17.372 22.461 -7.559 10 1HH1 ARG 1 1HH1 ARG 1 14.524 23.817 -5.971 11 2HH1 ARG 1 2HH1 ARG 1 14.883 25.463 -6.419 12 1HH2 ARG 1 1HH2 ARG 1 17.859 24.603 -8.156 13 2HH2 ARG 1 2HH2 ARG 1 16.830 25.921 -7.659 14 H VAL 2 H VAL 2 12.612 19.438 -5.560 15 HA VAL 2 HA VAL 2 11.365 17.189 -4.198 16 HB VAL 2 HB VAL 2 10.289 19.376 -4.580 17 1HG1 VAL 2 1HG1 VAL 2 10.133 18.639 -7.529 18 2HG1 VAL 2 2HG1 VAL 2 9.391 20.037 -6.742 19 3HG1 VAL 2 3HG1 VAL 2 11.150 19.921 -6.851 20 1HG2 VAL 2 1HG2 VAL 2 8.925 17.278 -4.271 21 2HG2 VAL 2 2HG2 VAL 2 8.111 18.648 -5.040 22 3HG2 VAL 2 3HG2 VAL 2 8.640 17.292 -6.031 23 H GLY 3 H GLY 3 9.906 15.774 -5.840 24 1HA GLY 3 1HA GLY 3 11.358 13.874 -7.107 25 2HA GLY 3 2HA GLY 3 9.717 14.319 -7.599 26 H LEU 4 H LEU 4 10.417 16.976 -8.550 27 HA LEU 4 HA LEU 4 11.713 16.392 -11.137 28 1HB LEU 4 1HB LEU 4 10.554 18.989 -10.088 29 2HB LEU 4 2HB LEU 4 11.089 18.615 -11.733 30 HG LEU 4 HG LEU 4 8.686 17.455 -10.264 31 1HD1 LEU 4 1HD1 LEU 4 7.474 18.615 -12.099 32 2HD1 LEU 4 2HD1 LEU 4 8.456 19.741 -11.142 33 3HD1 LEU 4 3HD1 LEU 4 9.021 19.209 -12.734 34 1HD2 LEU 4 1HD2 LEU 4 9.584 15.636 -11.603 35 2HD2 LEU 4 2HD2 LEU 4 8.201 16.316 -12.464 36 3HD2 LEU 4 3HD2 LEU 4 9.854 16.719 -12.982 37 H THR 5 H THR 5 13.951 16.109 -10.704 38 HA THR 5 HA THR 5 15.496 17.961 -9.132 39 HB THR 5 HB THR 5 17.416 17.103 -10.485 40 HG1 THR 5 HG1 THR 5 15.665 15.403 -11.825 41 1HG2 THR 5 1HG2 THR 5 15.519 14.914 -9.517 42 2HG2 THR 5 2HG2 THR 5 17.253 14.731 -9.847 43 3HG2 THR 5 3HG2 THR 5 16.702 15.799 -8.543 44 H GLU 6 H GLU 6 17.168 19.446 -10.196 45 HA GLU 6 HA GLU 6 16.006 21.446 -11.804 46 1HB GLU 6 1HB GLU 6 18.958 20.687 -11.581 47 2HB GLU 6 2HB GLU 6 18.309 22.217 -12.188 48 1HG GLU 6 1HG GLU 6 17.208 22.601 -9.961 49 2HG GLU 6 2HG GLU 6 18.019 21.149 -9.341 50 H GLU 7 H GLU 7 17.952 18.618 -12.744 51 HA GLU 7 HA GLU 7 18.093 19.061 -15.521 52 1HB GLU 7 1HB GLU 7 17.814 16.402 -14.032 53 2HB GLU 7 2HB GLU 7 18.426 16.628 -15.678 54 1HG GLU 7 1HG GLU 7 19.731 17.605 -13.089 55 2HG GLU 7 2HG GLU 7 20.284 16.312 -14.147 56 H GLN 8 H GLN 8 15.625 17.172 -13.689 57 HA GLN 8 HA GLN 8 13.920 16.679 -15.914 58 1HB GLN 8 1HB GLN 8 13.349 16.967 -12.961 59 2HB GLN 8 2HB GLN 8 12.103 16.519 -14.132 60 1HG GLN 8 1HG GLN 8 13.115 14.447 -14.657 61 2HG GLN 8 2HG GLN 8 14.687 14.948 -14.022 62 1HE2 GLN 8 1HE2 GLN 8 11.382 13.883 -12.993 63 2HE2 GLN 8 2HE2 GLN 8 11.861 13.754 -11.295 64 H LYS 9 H LYS 9 14.016 19.513 -13.644 65 HA LYS 9 HA LYS 9 11.767 20.790 -14.848 66 1HB LYS 9 1HB LYS 9 14.097 21.950 -13.295 67 2HB LYS 9 2HB LYS 9 12.693 22.883 -13.840 68 1HG LYS 9 1HG LYS 9 11.174 21.317 -12.654 69 2HG LYS 9 2HG LYS 9 12.563 20.437 -12.015 70 1HD LYS 9 1HD LYS 9 11.966 23.384 -11.482 71 2HD LYS 9 2HD LYS 9 11.529 22.036 -10.417 72 1HE LYS 9 1HE LYS 9 13.958 21.416 -10.247 73 2HE LYS 9 2HE LYS 9 14.353 22.886 -11.174 74 1HZ LYS 9 1HZ LYS 9 12.960 22.820 -8.599 75 2HZ LYS 9 2HZ LYS 9 14.536 23.233 -8.839 76 3HZ LYS 9 3HZ LYS 9 13.336 24.174 -9.462 77 H GLN 10 H GLN 10 15.244 20.851 -15.789 78 HA GLN 10 HA GLN 10 14.880 22.873 -17.812 79 1HB GLN 10 1HB GLN 10 16.898 20.589 -17.928 80 2HB GLN 10 2HB GLN 10 16.914 22.114 -18.808 81 1HG GLN 10 1HG GLN 10 17.677 21.564 -15.970 82 2HG GLN 10 2HG GLN 10 18.493 22.502 -17.200 83 1HE2 GLN 10 1HE2 GLN 10 16.176 22.588 -14.604 84 2HE2 GLN 10 2HE2 GLN 10 15.889 24.333 -14.649 85 H GLU 11 H GLU 11 14.795 19.296 -17.945 86 HA GLU 11 HA GLU 11 14.162 18.993 -20.687 87 1HB GLU 11 1HB GLU 11 13.280 17.335 -18.288 88 2HB GLU 11 2HB GLU 11 13.123 16.826 -19.969 89 1HG GLU 11 1HG GLU 11 15.491 16.718 -20.280 90 2HG GLU 11 2HG GLU 11 15.830 17.582 -18.782 91 H ILE 12 H ILE 12 11.971 19.355 -17.889 92 HA ILE 12 HA ILE 12 9.526 19.315 -19.330 93 HB ILE 12 HB ILE 12 10.332 20.401 -16.623 94 1HG1 ILE 12 1HG1 ILE 12 8.599 18.003 -17.400 95 2HG1 ILE 12 2HG1 ILE 12 10.343 17.874 -17.207 96 1HG2 ILE 12 1HG2 ILE 12 7.953 20.595 -16.043 97 2HG2 ILE 12 2HG2 ILE 12 8.317 21.668 -17.379 98 3HG2 ILE 12 3HG2 ILE 12 7.502 20.125 -17.691 99 1HD1 ILE 12 1HD1 ILE 12 8.416 18.696 -15.012 100 2HD1 ILE 12 2HD1 ILE 12 9.246 17.144 -15.197 101 3HD1 ILE 12 3HD1 ILE 12 10.186 18.615 -14.866 102 H ARG 13 H ARG 13 11.677 22.087 -18.448 103 HA ARG 13 HA ARG 13 9.933 24.056 -19.527 104 1HB ARG 13 1HB ARG 13 11.803 24.604 -18.039 105 2HB ARG 13 2HB ARG 13 12.962 24.086 -19.268 106 1HG ARG 13 1HG ARG 13 12.807 26.500 -19.237 107 2HG ARG 13 2HG ARG 13 12.194 25.902 -20.781 108 1HD ARG 13 1HD ARG 13 9.855 26.209 -19.964 109 2HD ARG 13 2HD ARG 13 10.495 26.741 -18.389 110 HE ARG 13 HE ARG 13 11.595 28.317 -20.507 111 1HH1 ARG 13 1HH1 ARG 13 8.616 27.809 -18.685 112 2HH1 ARG 13 2HH1 ARG 13 7.974 29.399 -19.003 113 1HH2 ARG 13 1HH2 ARG 13 10.781 30.407 -20.931 114 2HH2 ARG 13 2HH2 ARG 13 9.238 30.910 -20.298 115 H GLU 14 H GLU 14 12.634 22.217 -21.054 116 HA GLU 14 HA GLU 14 12.460 23.380 -23.603 117 1HB GLU 14 1HB GLU 14 14.192 21.775 -22.621 118 2HB GLU 14 2HB GLU 14 13.109 20.445 -23.037 119 1HG GLU 14 1HG GLU 14 14.233 22.528 -24.961 120 2HG GLU 14 2HG GLU 14 14.897 20.907 -24.715 121 H ALA 15 H ALA 15 10.861 20.401 -22.383 122 HA ALA 15 HA ALA 15 9.278 19.819 -24.623 123 1HB ALA 15 1HB ALA 15 7.854 18.568 -23.061 124 2HB ALA 15 2HB ALA 15 9.569 18.316 -22.686 125 3HB ALA 15 3HB ALA 15 8.591 19.406 -21.679 126 H PHE 16 H PHE 16 8.469 21.866 -21.790 127 HA PHE 16 HA PHE 16 5.899 22.627 -22.505 128 1HB PHE 16 1HB PHE 16 6.877 23.147 -20.333 129 2HB PHE 16 2HB PHE 16 8.058 24.212 -21.063 130 HD1 PHE 16 HD1 PHE 16 4.460 23.815 -20.264 131 HD2 PHE 16 HD2 PHE 16 7.528 26.502 -21.675 132 HE1 PHE 16 HE1 PHE 16 2.909 25.723 -20.007 133 HE2 PHE 16 HE2 PHE 16 5.963 28.406 -21.429 134 HZ PHE 16 HZ PHE 16 3.672 28.027 -20.562 135 H ASP 17 H ASP 17 8.961 24.338 -23.249 136 HA ASP 17 HA ASP 17 7.884 26.429 -24.800 137 1HB ASP 17 1HB ASP 17 10.194 26.400 -23.961 138 2HB ASP 17 2HB ASP 17 10.594 25.051 -25.036 139 H LEU 18 H LEU 18 9.138 23.219 -25.866 140 HA LEU 18 HA LEU 18 8.634 23.573 -28.621 141 1HB LEU 18 1HB LEU 18 9.986 21.781 -27.737 142 2HB LEU 18 2HB LEU 18 8.603 21.012 -26.960 143 HG LEU 18 HG LEU 18 8.431 21.541 -29.933 144 1HD1 LEU 18 1HD1 LEU 18 10.697 20.660 -29.675 145 2HD1 LEU 18 2HD1 LEU 18 10.069 19.287 -28.727 146 3HD1 LEU 18 3HD1 LEU 18 9.628 19.473 -30.443 147 1HD2 LEU 18 1HD2 LEU 18 7.571 19.204 -28.151 148 2HD2 LEU 18 2HD2 LEU 18 6.494 20.431 -28.845 149 3HD2 LEU 18 3HD2 LEU 18 7.318 19.296 -29.903 150 H PHE 19 H PHE 19 6.512 22.049 -26.132 151 HA PHE 19 HA PHE 19 4.362 21.562 -27.915 152 1HB PHE 19 1HB PHE 19 4.323 22.077 -24.920 153 2HB PHE 19 2HB PHE 19 2.978 21.399 -25.839 154 HD1 PHE 19 HD1 PHE 19 4.499 19.418 -27.622 155 HD2 PHE 19 HD2 PHE 19 4.643 20.274 -23.392 156 HE1 PHE 19 HE1 PHE 19 5.158 17.104 -27.186 157 HE2 PHE 19 HE2 PHE 19 5.176 17.895 -22.952 158 HZ PHE 19 HZ PHE 19 5.556 16.326 -24.850 159 H ASP 20 H ASP 20 5.182 24.463 -26.034 160 HA ASP 20 HA ASP 20 2.819 25.930 -26.888 161 1HB ASP 20 1HB ASP 20 4.040 26.509 -24.832 162 2HB ASP 20 2HB ASP 20 5.492 26.862 -25.782 163 H THR 21 H THR 21 3.430 24.814 -29.147 164 HA THR 21 HA THR 21 5.345 25.943 -30.874 165 HB THR 21 HB THR 21 3.823 25.180 -32.686 166 HG1 THR 21 HG1 THR 21 2.024 24.917 -30.520 167 1HG2 THR 21 1HG2 THR 21 5.350 23.565 -31.534 168 2HG2 THR 21 2HG2 THR 21 4.028 23.136 -30.430 169 3HG2 THR 21 3HG2 THR 21 3.872 22.812 -32.162 170 H ASP 22 H ASP 22 2.119 27.108 -29.947 171 HA ASP 22 HA ASP 22 1.990 29.290 -31.805 172 1HB ASP 22 1HB ASP 22 0.662 28.833 -29.098 173 2HB ASP 22 2HB ASP 22 0.284 30.186 -30.170 174 H GLY 23 H GLY 23 3.997 28.896 -28.986 175 1HA GLY 23 1HA GLY 23 5.419 30.320 -27.941 176 2HA GLY 23 2HA GLY 23 5.242 31.420 -29.317 177 H SER 24 H SER 24 2.470 30.379 -27.267 178 HA SER 24 HA SER 24 1.839 33.134 -26.605 179 1HB SER 24 1HB SER 24 -0.103 31.642 -25.519 180 2HB SER 24 2HB SER 24 0.088 31.930 -27.256 181 HG SER 24 HG SER 24 0.680 29.552 -25.861 182 H GLY 25 H GLY 25 3.989 31.107 -25.311 183 1HA GLY 25 1HA GLY 25 5.143 30.990 -23.321 184 2HA GLY 25 2HA GLY 25 4.260 32.417 -22.748 185 H THR 26 H THR 26 2.250 29.862 -23.902 186 HA THR 26 HA THR 26 1.629 28.606 -21.340 187 HB THR 26 HB THR 26 -0.656 29.492 -21.427 188 HG1 THR 26 HG1 THR 26 0.370 31.482 -23.187 189 1HG2 THR 26 1HG2 THR 26 1.231 31.848 -21.158 190 2HG2 THR 26 2HG2 THR 26 -0.360 31.614 -20.425 191 3HG2 THR 26 3HG2 THR 26 1.001 30.601 -19.916 192 H ILE 27 H ILE 27 0.727 26.597 -21.866 193 HA ILE 27 HA ILE 27 0.699 25.879 -24.737 194 HB ILE 27 HB ILE 27 0.350 24.256 -22.208 195 1HG1 ILE 27 1HG1 ILE 27 2.628 24.430 -24.246 196 2HG1 ILE 27 2HG1 ILE 27 2.635 25.203 -22.658 197 1HG2 ILE 27 1HG2 ILE 27 0.431 22.271 -23.631 198 2HG2 ILE 27 2HG2 ILE 27 -0.886 23.268 -24.186 199 3HG2 ILE 27 3HG2 ILE 27 0.657 23.269 -25.074 200 1HD1 ILE 27 1HD1 ILE 27 2.332 22.950 -21.596 201 2HD1 ILE 27 2HD1 ILE 27 2.551 22.212 -23.207 202 3HD1 ILE 27 3HD1 ILE 27 3.846 23.165 -22.496 203 H ASP 28 H ASP 28 -1.224 26.229 -25.861 204 HA ASP 28 HA ASP 28 -3.781 26.595 -24.554 205 1HB ASP 28 1HB ASP 28 -3.251 27.507 -26.787 206 2HB ASP 28 2HB ASP 28 -3.156 25.864 -27.437 207 H ALA 29 H ALA 29 -5.444 25.078 -24.155 208 HA ALA 29 HA ALA 29 -5.082 22.470 -23.566 209 1HB ALA 29 1HB ALA 29 -7.185 23.672 -23.229 210 2HB ALA 29 2HB ALA 29 -7.510 23.651 -24.978 211 3HB ALA 29 3HB ALA 29 -7.491 22.132 -24.056 212 H LYS 30 H LYS 30 -5.762 23.602 -26.910 213 HA LYS 30 HA LYS 30 -5.912 21.073 -28.185 214 1HB LYS 30 1HB LYS 30 -4.914 23.747 -29.219 215 2HB LYS 30 2HB LYS 30 -5.257 22.334 -30.229 216 1HG LYS 30 1HG LYS 30 -7.604 22.315 -29.460 217 2HG LYS 30 2HG LYS 30 -7.327 23.756 -28.478 218 1HD LYS 30 1HD LYS 30 -6.970 23.619 -31.510 219 2HD LYS 30 2HD LYS 30 -8.419 24.202 -30.678 220 1HE LYS 30 1HE LYS 30 -7.057 25.980 -29.562 221 2HE LYS 30 2HE LYS 30 -5.638 25.456 -30.488 222 1HZ LYS 30 1HZ LYS 30 -6.827 25.956 -32.487 223 2HZ LYS 30 2HZ LYS 30 -8.145 26.454 -31.631 224 3HZ LYS 30 3HZ LYS 30 -6.725 27.282 -31.517 225 H GLU 31 H GLU 31 -3.107 23.215 -27.593 226 HA GLU 31 HA GLU 31 -1.137 21.554 -28.864 227 1HB GLU 31 1HB GLU 31 -0.888 23.667 -26.691 228 2HB GLU 31 2HB GLU 31 0.464 22.887 -27.518 229 1HG GLU 31 1HG GLU 31 -0.262 23.819 -29.668 230 2HG GLU 31 2HG GLU 31 -1.673 24.568 -28.905 231 H LEU 32 H LEU 32 -2.489 21.752 -25.527 232 HA LEU 32 HA LEU 32 -0.600 19.888 -24.481 233 1HB LEU 32 1HB LEU 32 -2.198 21.451 -23.146 234 2HB LEU 32 2HB LEU 32 -3.363 20.131 -23.326 235 HG LEU 32 HG LEU 32 -1.370 18.615 -22.433 236 1HD1 LEU 32 1HD1 LEU 32 0.448 20.218 -22.493 237 2HD1 LEU 32 2HD1 LEU 32 -0.465 21.341 -21.449 238 3HD1 LEU 32 3HD1 LEU 32 0.096 19.778 -20.825 239 1HD2 LEU 32 1HD2 LEU 32 -2.889 20.533 -20.635 240 2HD2 LEU 32 2HD2 LEU 32 -3.446 18.950 -21.217 241 3HD2 LEU 32 3HD2 LEU 32 -2.078 19.043 -20.101 242 H LYS 33 H LYS 33 -3.936 19.301 -25.837 243 HA LYS 33 HA LYS 33 -3.705 16.452 -25.434 244 1HB LYS 33 1HB LYS 33 -5.470 16.063 -26.928 245 2HB LYS 33 2HB LYS 33 -5.858 17.249 -25.670 246 1HG LYS 33 1HG LYS 33 -5.649 19.053 -27.168 247 2HG LYS 33 2HG LYS 33 -4.959 18.015 -28.439 248 1HD LYS 33 1HD LYS 33 -7.085 16.769 -28.630 249 2HD LYS 33 2HD LYS 33 -7.787 17.718 -27.310 250 1HE LYS 33 1HE LYS 33 -8.559 18.461 -29.557 251 2HE LYS 33 2HE LYS 33 -7.754 19.744 -28.648 252 1HZ LYS 33 1HZ LYS 33 -7.042 19.657 -30.929 253 2HZ LYS 33 2HZ LYS 33 -5.777 19.326 -29.929 254 3HZ LYS 33 3HZ LYS 33 -6.515 18.105 -30.754 255 H VAL 34 H VAL 34 -2.656 18.509 -28.168 256 HA VAL 34 HA VAL 34 -1.671 16.381 -29.802 257 HB VAL 34 HB VAL 34 -0.788 19.261 -29.436 258 1HG1 VAL 34 1HG1 VAL 34 1.230 18.095 -30.163 259 2HG1 VAL 34 2HG1 VAL 34 0.308 17.214 -31.404 260 3HG1 VAL 34 3HG1 VAL 34 0.537 18.970 -31.529 261 1HG2 VAL 34 1HG2 VAL 34 -3.008 18.806 -30.517 262 2HG2 VAL 34 2HG2 VAL 34 -1.842 19.553 -31.622 263 3HG2 VAL 34 3HG2 VAL 34 -2.180 17.812 -31.730 264 H ALA 35 H ALA 35 -0.051 18.227 -27.185 265 HA ALA 35 HA ALA 35 2.427 16.943 -27.213 266 1HB ALA 35 1HB ALA 35 2.605 17.665 -24.858 267 2HB ALA 35 2HB ALA 35 1.940 18.959 -25.882 268 3HB ALA 35 3HB ALA 35 0.893 18.025 -24.800 269 H MET 36 H MET 36 -0.475 16.102 -25.260 270 HA MET 36 HA MET 36 0.599 13.726 -24.124 271 1HB MET 36 1HB MET 36 -2.191 14.760 -24.564 272 2HB MET 36 2HB MET 36 -1.912 13.169 -23.850 273 1HG MET 36 1HG MET 36 -0.419 14.113 -22.150 274 2HG MET 36 2HG MET 36 -0.690 15.739 -22.785 275 1HE MET 36 1HE MET 36 -3.829 15.744 -23.311 276 2HE MET 36 2HE MET 36 -4.326 16.481 -21.766 277 3HE MET 36 3HE MET 36 -2.838 17.018 -22.591 278 H ARG 37 H ARG 37 -1.178 14.184 -27.204 279 HA ARG 37 HA ARG 37 -1.216 11.489 -27.957 280 1HB ARG 37 1HB ARG 37 -1.723 13.997 -29.217 281 2HB ARG 37 2HB ARG 37 -0.592 13.181 -30.277 282 1HG ARG 37 1HG ARG 37 -3.124 11.841 -29.241 283 2HG ARG 37 2HG ARG 37 -3.124 12.900 -30.650 284 1HD ARG 37 1HD ARG 37 -2.966 10.553 -31.369 285 2HD ARG 37 2HD ARG 37 -1.542 11.480 -31.832 286 HE ARG 37 HE ARG 37 -0.213 10.233 -30.450 287 1HH1 ARG 37 1HH1 ARG 37 -3.592 9.368 -29.667 288 2HH1 ARG 37 2HH1 ARG 37 -3.085 8.487 -28.225 289 1HH2 ARG 37 1HH2 ARG 37 0.284 9.202 -28.540 290 2HH2 ARG 37 2HH2 ARG 37 -0.962 8.314 -27.657 291 H ALA 38 H ALA 38 1.324 13.940 -28.642 292 HA ALA 38 HA ALA 38 3.198 12.204 -29.857 293 1HB ALA 38 1HB ALA 38 3.329 14.668 -29.932 294 2HB ALA 38 2HB ALA 38 3.753 14.704 -28.207 295 3HB ALA 38 3HB ALA 38 4.849 13.940 -29.373 296 H LEU 39 H LEU 39 2.693 12.965 -26.417 297 HA LEU 39 HA LEU 39 4.913 11.417 -25.420 298 1HB LEU 39 1HB LEU 39 2.359 12.440 -24.156 299 2HB LEU 39 2HB LEU 39 3.613 11.635 -23.236 300 HG LEU 39 HG LEU 39 4.218 14.135 -24.863 301 1HD1 LEU 39 1HD1 LEU 39 3.253 13.953 -21.973 302 2HD1 LEU 39 2HD1 LEU 39 3.931 15.406 -22.736 303 3HD1 LEU 39 3HD1 LEU 39 2.402 14.745 -23.311 304 1HD2 LEU 39 1HD2 LEU 39 6.073 14.346 -23.244 305 2HD2 LEU 39 2HD2 LEU 39 5.559 12.847 -22.447 306 3HD2 LEU 39 3HD2 LEU 39 6.165 12.810 -24.116 307 H GLY 40 H GLY 40 2.026 10.305 -26.894 308 1HA GLY 40 1HA GLY 40 1.605 8.055 -27.280 309 2HA GLY 40 2HA GLY 40 2.662 7.584 -25.960 310 H PHE 41 H PHE 41 0.197 10.039 -25.347 311 HA PHE 41 HA PHE 41 -1.211 8.281 -23.457 312 1HB PHE 41 1HB PHE 41 -1.655 11.098 -24.470 313 2HB PHE 41 2HB PHE 41 -2.778 10.334 -23.396 314 HD1 PHE 41 HD1 PHE 41 -2.769 11.347 -21.342 315 HD2 PHE 41 HD2 PHE 41 1.019 10.558 -23.272 316 HE1 PHE 41 HE1 PHE 41 -1.573 12.200 -19.364 317 HE2 PHE 41 HE2 PHE 41 2.197 11.392 -21.274 318 HZ PHE 41 HZ PHE 41 0.915 12.223 -19.318 319 H GLU 42 H GLU 42 -3.754 8.508 -23.652 320 HA GLU 42 HA GLU 42 -4.722 8.103 -26.454 321 1HB GLU 42 1HB GLU 42 -4.666 5.977 -25.165 322 2HB GLU 42 2HB GLU 42 -5.682 6.718 -23.917 323 1HG GLU 42 1HG GLU 42 -7.462 7.097 -25.652 324 2HG GLU 42 2HG GLU 42 -6.425 6.311 -26.855 325 HA PRO 43 HA PRO 43 -6.534 11.882 -24.644 326 1HB PRO 43 1HB PRO 43 -7.410 12.099 -27.537 327 2HB PRO 43 2HB PRO 43 -6.922 13.409 -26.423 328 1HG PRO 43 1HG PRO 43 -5.143 12.423 -28.177 329 2HG PRO 43 2HG PRO 43 -4.631 12.658 -26.477 330 1HD PRO 43 1HD PRO 43 -5.543 10.083 -27.841 331 2HD PRO 43 2HD PRO 43 -4.137 10.355 -26.767 332 H LYS 44 H LYS 44 -7.916 10.087 -23.577 333 HA LYS 44 HA LYS 44 -10.645 9.735 -24.455 334 1HB LYS 44 1HB LYS 44 -9.313 9.584 -21.728 335 2HB LYS 44 2HB LYS 44 -10.994 9.119 -22.056 336 1HG LYS 44 1HG LYS 44 -10.237 7.440 -23.698 337 2HG LYS 44 2HG LYS 44 -8.548 7.848 -23.390 338 1HD LYS 44 1HD LYS 44 -10.481 6.795 -21.270 339 2HD LYS 44 2HD LYS 44 -9.366 5.796 -22.215 340 1HE LYS 44 1HE LYS 44 -7.435 7.119 -21.331 341 2HE LYS 44 2HE LYS 44 -8.551 8.021 -20.287 342 1HZ LYS 44 1HZ LYS 44 -7.538 6.219 -19.135 343 2HZ LYS 44 2HZ LYS 44 -9.159 5.957 -19.258 344 3HZ LYS 44 3HZ LYS 44 -8.114 5.124 -20.222 345 H LYS 45 H LYS 45 -11.153 11.807 -25.168 346 HA LYS 45 HA LYS 45 -10.980 14.220 -24.404 347 1HB LYS 45 1HB LYS 45 -13.199 14.794 -25.218 348 2HB LYS 45 2HB LYS 45 -12.351 13.623 -26.234 349 1HG LYS 45 1HG LYS 45 -13.697 11.779 -25.105 350 2HG LYS 45 2HG LYS 45 -14.666 13.049 -24.334 351 1HD LYS 45 1HD LYS 45 -14.325 12.640 -27.338 352 2HD LYS 45 2HD LYS 45 -15.716 12.136 -26.368 353 1HE LYS 45 1HE LYS 45 -16.099 14.547 -25.730 354 2HE LYS 45 2HE LYS 45 -14.799 15.012 -26.846 355 1HZ LYS 45 1HZ LYS 45 -16.039 14.022 -28.617 356 2HZ LYS 45 2HZ LYS 45 -17.255 13.598 -27.588 357 3HZ LYS 45 3HZ LYS 45 -16.924 15.189 -27.863 358 H GLU 46 H GLU 46 -13.387 12.264 -22.554 359 HA GLU 46 HA GLU 46 -14.212 14.413 -20.858 360 1HB GLU 46 1HB GLU 46 -14.184 11.405 -20.327 361 2HB GLU 46 2HB GLU 46 -15.031 12.619 -19.362 362 1HG GLU 46 1HG GLU 46 -16.379 13.273 -21.354 363 2HG GLU 46 2HG GLU 46 -15.580 12.013 -22.307 364 H GLU 47 H GLU 47 -11.621 11.980 -20.535 365 HA GLU 47 HA GLU 47 -10.913 12.750 -17.817 366 1HB GLU 47 1HB GLU 47 -9.273 11.138 -19.818 367 2HB GLU 47 2HB GLU 47 -9.120 11.173 -18.057 368 1HG GLU 47 1HG GLU 47 -11.426 9.993 -19.680 369 2HG GLU 47 2HG GLU 47 -10.244 9.124 -18.703 370 H ILE 48 H ILE 48 -9.717 13.335 -21.111 371 HA ILE 48 HA ILE 48 -7.479 14.998 -20.515 372 HB ILE 48 HB ILE 48 -9.475 14.939 -22.800 373 1HG1 ILE 48 1HG1 ILE 48 -7.874 12.979 -22.421 374 2HG1 ILE 48 2HG1 ILE 48 -7.917 13.723 -24.021 375 1HG2 ILE 48 1HG2 ILE 48 -6.997 16.669 -22.586 376 2HG2 ILE 48 2HG2 ILE 48 -7.824 16.286 -24.115 377 3HG2 ILE 48 3HG2 ILE 48 -8.675 17.186 -22.861 378 1HD1 ILE 48 1HD1 ILE 48 -5.850 14.857 -23.684 379 2HD1 ILE 48 2HD1 ILE 48 -5.823 14.480 -21.942 380 3HD1 ILE 48 3HD1 ILE 48 -5.586 13.199 -23.129 381 H LYS 49 H LYS 49 -10.906 15.993 -21.178 382 HA LYS 49 HA LYS 49 -10.581 18.694 -20.642 383 1HB LYS 49 1HB LYS 49 -12.529 17.584 -21.720 384 2HB LYS 49 2HB LYS 49 -13.008 16.921 -20.145 385 1HG LYS 49 1HG LYS 49 -13.302 19.233 -19.280 386 2HG LYS 49 2HG LYS 49 -12.696 19.871 -20.817 387 1HD LYS 49 1HD LYS 49 -15.116 20.049 -20.765 388 2HD LYS 49 2HD LYS 49 -14.638 18.886 -22.013 389 1HE LYS 49 1HE LYS 49 -15.222 17.004 -20.521 390 2HE LYS 49 2HE LYS 49 -15.561 18.132 -19.194 391 1HZ LYS 49 1HZ LYS 49 -17.536 17.410 -20.295 392 2HZ LYS 49 2HZ LYS 49 -17.335 19.030 -20.512 393 3HZ LYS 49 3HZ LYS 49 -17.006 17.986 -21.745 394 H LYS 50 H LYS 50 -11.596 16.071 -18.377 395 HA LYS 50 HA LYS 50 -11.920 17.659 -16.099 396 1HB LYS 50 1HB LYS 50 -12.628 15.313 -16.238 397 2HB LYS 50 2HB LYS 50 -10.958 14.779 -16.357 398 1HG LYS 50 1HG LYS 50 -11.880 14.415 -14.112 399 2HG LYS 50 2HG LYS 50 -10.463 15.453 -14.092 400 1HD LYS 50 1HD LYS 50 -12.180 16.247 -12.541 401 2HD LYS 50 2HD LYS 50 -11.882 17.456 -13.790 402 1HE LYS 50 1HE LYS 50 -13.943 16.740 -14.988 403 2HE LYS 50 2HE LYS 50 -14.192 15.447 -13.799 404 1HZ LYS 50 1HZ LYS 50 -14.188 18.327 -13.229 405 2HZ LYS 50 2HZ LYS 50 -15.521 17.365 -13.346 406 3HZ LYS 50 3HZ LYS 50 -14.440 17.127 -12.126 407 H MET 51 H MET 51 -8.948 15.812 -17.059 408 HA MET 51 HA MET 51 -7.372 16.722 -14.946 409 1HB MET 51 1HB MET 51 -6.903 14.815 -16.562 410 2HB MET 51 2HB MET 51 -6.357 16.030 -17.734 411 1HG MET 51 1HG MET 51 -4.715 16.845 -15.979 412 2HG MET 51 2HG MET 51 -5.317 15.574 -14.909 413 1HE MET 51 1HE MET 51 -4.385 15.366 -18.818 414 2HE MET 51 2HE MET 51 -3.233 16.483 -18.041 415 3HE MET 51 3HE MET 51 -2.680 14.895 -18.615 416 H ILE 52 H ILE 52 -7.612 18.036 -18.297 417 HA ILE 52 HA ILE 52 -5.827 20.187 -17.980 418 HB ILE 52 HB ILE 52 -8.310 19.812 -19.701 419 1HG1 ILE 52 1HG1 ILE 52 -5.317 19.963 -20.286 420 2HG1 ILE 52 2HG1 ILE 52 -6.238 18.464 -20.141 421 1HG2 ILE 52 1HG2 ILE 52 -6.407 22.188 -19.829 422 2HG2 ILE 52 2HG2 ILE 52 -7.716 21.831 -20.972 423 3HG2 ILE 52 3HG2 ILE 52 -8.109 22.264 -19.323 424 1HD1 ILE 52 1HD1 ILE 52 -5.965 18.889 -22.471 425 2HD1 ILE 52 2HD1 ILE 52 -7.663 19.258 -22.091 426 3HD1 ILE 52 3HD1 ILE 52 -6.481 20.569 -22.322 427 H SER 53 H SER 53 -9.362 20.093 -17.235 428 HA SER 53 HA SER 53 -9.478 22.784 -16.341 429 1HB SER 53 1HB SER 53 -11.143 20.424 -15.345 430 2HB SER 53 2HB SER 53 -11.547 22.146 -15.214 431 HG SER 53 HG SER 53 -11.258 20.619 -17.598 432 H GLU 54 H GLU 54 -8.804 19.783 -14.477 433 HA GLU 54 HA GLU 54 -8.589 21.038 -11.929 434 1HB GLU 54 1HB GLU 54 -7.284 18.543 -13.070 435 2HB GLU 54 2HB GLU 54 -7.190 19.006 -11.366 436 1HG GLU 54 1HG GLU 54 -9.581 18.881 -11.080 437 2HG GLU 54 2HG GLU 54 -9.858 18.644 -12.805 438 H ILE 55 H ILE 55 -6.089 20.453 -14.442 439 HA ILE 55 HA ILE 55 -3.975 21.672 -12.850 440 HB ILE 55 HB ILE 55 -4.140 21.052 -15.821 441 1HG1 ILE 55 1HG1 ILE 55 -4.349 18.981 -14.622 442 2HG1 ILE 55 2HG1 ILE 55 -2.725 19.094 -15.252 443 1HG2 ILE 55 1HG2 ILE 55 -1.724 21.751 -14.102 444 2HG2 ILE 55 2HG2 ILE 55 -1.659 21.117 -15.765 445 3HG2 ILE 55 3HG2 ILE 55 -2.390 22.685 -15.448 446 1HD1 ILE 55 1HD1 ILE 55 -1.967 19.810 -12.916 447 2HD1 ILE 55 2HD1 ILE 55 -3.626 19.492 -12.363 448 3HD1 ILE 55 3HD1 ILE 55 -2.649 18.178 -13.019 449 H ASP 56 H ASP 56 -6.336 22.898 -15.206 450 HA ASP 56 HA ASP 56 -4.994 25.428 -15.573 451 1HB ASP 56 1HB ASP 56 -6.431 24.395 -17.295 452 2HB ASP 56 2HB ASP 56 -7.836 24.575 -16.228 453 H LYS 57 H LYS 57 -4.747 25.632 -13.139 454 HA LYS 57 HA LYS 57 -6.858 26.431 -11.446 455 1HB LYS 57 1HB LYS 57 -4.575 25.777 -10.751 456 2HB LYS 57 2HB LYS 57 -3.898 27.163 -11.599 457 1HG LYS 57 1HG LYS 57 -3.963 27.553 -9.220 458 2HG LYS 57 2HG LYS 57 -4.946 28.717 -10.099 459 1HD LYS 57 1HD LYS 57 -6.038 27.966 -7.995 460 2HD LYS 57 2HD LYS 57 -7.016 27.627 -9.418 461 1HE LYS 57 1HE LYS 57 -7.028 25.751 -7.802 462 2HE LYS 57 2HE LYS 57 -6.363 25.246 -9.356 463 1HZ LYS 57 1HZ LYS 57 -5.066 24.452 -7.528 464 2HZ LYS 57 2HZ LYS 57 -4.174 25.496 -8.437 465 3HZ LYS 57 3HZ LYS 57 -4.790 25.986 -6.987 466 H ASP 58 H ASP 58 -4.838 28.225 -13.741 467 HA ASP 58 HA ASP 58 -6.584 30.643 -13.504 468 1HB ASP 58 1HB ASP 58 -4.641 32.065 -13.234 469 2HB ASP 58 2HB ASP 58 -4.707 30.881 -11.924 470 H GLY 59 H GLY 59 -4.419 28.698 -15.517 471 1HA GLY 59 1HA GLY 59 -3.743 30.585 -17.460 472 2HA GLY 59 2HA GLY 59 -3.781 28.844 -17.676 473 H SER 60 H SER 60 -6.864 29.134 -17.031 474 HA SER 60 HA SER 60 -8.836 29.382 -18.136 475 1HB SER 60 1HB SER 60 -7.515 31.967 -19.057 476 2HB SER 60 2HB SER 60 -9.255 31.633 -19.003 477 HG SER 60 HG SER 60 -7.457 31.692 -16.783 478 H GLY 61 H GLY 61 -7.914 27.504 -19.510 479 1HA GLY 61 1HA GLY 61 -8.466 26.597 -21.626 480 2HA GLY 61 2HA GLY 61 -8.342 28.185 -22.391 481 H THR 62 H THR 62 -5.723 28.645 -20.799 482 HA THR 62 HA THR 62 -3.964 26.830 -22.362 483 HB THR 62 HB THR 62 -2.286 28.474 -22.356 484 HG1 THR 62 HG1 THR 62 -3.996 30.043 -20.693 485 1HG2 THR 62 1HG2 THR 62 -3.227 30.336 -23.582 486 2HG2 THR 62 2HG2 THR 62 -4.060 28.850 -24.071 487 3HG2 THR 62 3HG2 THR 62 -4.856 29.997 -22.973 488 H ILE 63 H ILE 63 -1.937 26.309 -21.220 489 HA ILE 63 HA ILE 63 -2.196 26.135 -18.246 490 HB ILE 63 HB ILE 63 -0.838 24.212 -20.171 491 1HG1 ILE 63 1HG1 ILE 63 -3.260 23.992 -20.424 492 2HG1 ILE 63 2HG1 ILE 63 -2.536 22.586 -19.657 493 1HG2 ILE 63 1HG2 ILE 63 -0.604 22.758 -18.176 494 2HG2 ILE 63 2HG2 ILE 63 0.279 24.284 -18.012 495 3HG2 ILE 63 3HG2 ILE 63 -1.256 24.064 -17.163 496 1HD1 ILE 63 1HD1 ILE 63 -3.368 23.280 -17.456 497 2HD1 ILE 63 2HD1 ILE 63 -4.038 24.770 -18.148 498 3HD1 ILE 63 3HD1 ILE 63 -4.682 23.196 -18.625 499 H ASP 64 H ASP 64 -0.828 27.588 -17.405 500 HA ASP 64 HA ASP 64 1.470 28.675 -18.806 501 1HB ASP 64 1HB ASP 64 0.197 30.041 -17.216 502 2HB ASP 64 2HB ASP 64 0.508 28.880 -15.916 503 H PHE 65 H PHE 65 3.681 28.541 -18.002 504 HA PHE 65 HA PHE 65 4.679 25.962 -17.759 505 1HB PHE 65 1HB PHE 65 6.038 27.876 -18.413 506 2HB PHE 65 2HB PHE 65 5.895 28.571 -16.796 507 HD1 PHE 65 HD1 PHE 65 6.818 25.204 -18.271 508 HD2 PHE 65 HD2 PHE 65 7.846 28.336 -15.482 509 HE1 PHE 65 HE1 PHE 65 8.789 23.906 -17.521 510 HE2 PHE 65 HE2 PHE 65 9.834 27.044 -14.775 511 HZ PHE 65 HZ PHE 65 10.310 24.825 -15.791 512 H GLU 66 H GLU 66 3.833 28.211 -15.063 513 HA GLU 66 HA GLU 66 4.849 26.528 -12.991 514 1HB GLU 66 1HB GLU 66 2.571 28.559 -12.941 515 2HB GLU 66 2HB GLU 66 3.325 27.815 -11.522 516 1HG GLU 66 1HG GLU 66 5.531 28.752 -12.194 517 2HG GLU 66 2HG GLU 66 4.772 29.561 -13.573 518 H GLU 67 H GLU 67 1.602 26.717 -14.511 519 HA GLU 67 HA GLU 67 0.358 24.731 -12.859 520 1HB GLU 67 1HB GLU 67 -0.266 25.656 -15.692 521 2HB GLU 67 2HB GLU 67 -1.310 24.621 -14.707 522 1HG GLU 67 1HG GLU 67 -1.655 26.357 -13.064 523 2HG GLU 67 2HG GLU 67 -0.484 27.427 -13.849 524 H PHE 68 H PHE 68 2.002 24.569 -16.033 525 HA PHE 68 HA PHE 68 1.679 21.802 -16.539 526 1HB PHE 68 1HB PHE 68 2.471 23.555 -18.147 527 2HB PHE 68 2HB PHE 68 3.996 23.636 -17.288 528 HD1 PHE 68 HD1 PHE 68 1.736 21.249 -19.112 529 HD2 PHE 68 HD2 PHE 68 5.787 22.262 -18.023 530 HE1 PHE 68 HE1 PHE 68 2.598 19.605 -20.762 531 HE2 PHE 68 HE2 PHE 68 6.631 20.688 -19.749 532 HZ PHE 68 HZ PHE 68 5.053 19.338 -21.080 533 H LEU 69 H LEU 69 4.366 23.552 -14.923 534 HA LEU 69 HA LEU 69 5.920 21.290 -14.271 535 1HB LEU 69 1HB LEU 69 6.684 23.608 -14.269 536 2HB LEU 69 2HB LEU 69 5.718 23.978 -12.839 537 HG LEU 69 HG LEU 69 7.722 21.696 -12.758 538 1HD1 LEU 69 1HD1 LEU 69 9.474 23.312 -12.061 539 2HD1 LEU 69 2HD1 LEU 69 8.977 23.540 -13.745 540 3HD1 LEU 69 3HD1 LEU 69 8.392 24.654 -12.490 541 1HD2 LEU 69 1HD2 LEU 69 6.249 22.082 -10.763 542 2HD2 LEU 69 2HD2 LEU 69 7.943 22.399 -10.397 543 3HD2 LEU 69 3HD2 LEU 69 6.827 23.753 -10.677 544 H THR 70 H THR 70 3.282 22.939 -12.455 545 HA THR 70 HA THR 70 3.405 21.321 -10.136 546 HB THR 70 HB THR 70 0.918 22.578 -11.373 547 HG1 THR 70 HG1 THR 70 2.603 24.076 -10.994 548 1HG2 THR 70 1HG2 THR 70 0.126 22.644 -9.036 549 2HG2 THR 70 2HG2 THR 70 0.373 20.971 -9.567 550 3HG2 THR 70 3HG2 THR 70 1.570 21.757 -8.510 551 H MET 71 H MET 71 1.480 20.842 -13.165 552 HA MET 71 HA MET 71 0.331 18.355 -12.494 553 1HB MET 71 1HB MET 71 -0.229 19.672 -14.522 554 2HB MET 71 2HB MET 71 1.343 19.278 -15.213 555 1HG MET 71 1HG MET 71 0.756 16.852 -15.158 556 2HG MET 71 2HG MET 71 -0.816 17.277 -14.476 557 1HE MET 71 1HE MET 71 1.170 19.112 -17.461 558 2HE MET 71 2HE MET 71 1.535 17.372 -17.601 559 3HE MET 71 3HE MET 71 0.514 18.172 -18.818 560 H MET 72 H MET 72 3.527 19.055 -14.034 561 HA MET 72 HA MET 72 4.257 16.307 -14.314 562 1HB MET 72 1HB MET 72 5.933 18.837 -14.103 563 2HB MET 72 2HB MET 72 6.612 17.231 -14.417 564 1HG MET 72 1HG MET 72 4.465 18.499 -16.160 565 2HG MET 72 2HG MET 72 6.198 18.610 -16.465 566 1HE MET 72 1HE MET 72 4.125 17.629 -18.604 567 2HE MET 72 2HE MET 72 5.880 17.724 -18.897 568 3HE MET 72 3HE MET 72 4.989 16.235 -19.296 569 H THR 73 H THR 73 4.749 18.607 -11.646 570 HA THR 73 HA THR 73 6.338 16.926 -9.995 571 HB THR 73 HB THR 73 4.347 19.044 -9.076 572 HG1 THR 73 HG1 THR 73 5.822 19.846 -10.635 573 1HG2 THR 73 1HG2 THR 73 5.940 19.309 -7.206 574 2HG2 THR 73 2HG2 THR 73 5.280 17.664 -7.233 575 3HG2 THR 73 3HG2 THR 73 6.922 17.973 -7.841 576 H ALA 74 H ALA 74 2.779 17.384 -10.199 577 HA ALA 74 HA ALA 74 2.084 15.574 -8.125 578 1HB ALA 74 1HB ALA 74 0.501 16.322 -10.621 579 2HB ALA 74 2HB ALA 74 -0.145 15.587 -9.142 580 3HB ALA 74 3HB ALA 74 0.529 17.228 -9.093 581 H LYS 75 H LYS 75 2.516 15.042 -11.653 582 HA LYS 75 HA LYS 75 1.848 12.240 -11.567 583 1HB LYS 75 1HB LYS 75 3.526 13.865 -13.517 584 2HB LYS 75 2HB LYS 75 3.028 12.196 -13.796 585 1HG LYS 75 1HG LYS 75 1.045 14.476 -13.352 586 2HG LYS 75 2HG LYS 75 1.652 13.981 -14.935 587 1HD LYS 75 1HD LYS 75 0.753 11.678 -14.539 588 2HD LYS 75 2HD LYS 75 0.069 12.232 -12.996 589 1HE LYS 75 1HE LYS 75 -1.284 13.935 -14.200 590 2HE LYS 75 2HE LYS 75 -0.606 13.389 -15.745 591 1HZ LYS 75 1HZ LYS 75 -1.586 11.250 -15.347 592 2HZ LYS 75 2HZ LYS 75 -2.215 11.758 -13.910 593 3HZ LYS 75 3HZ LYS 75 -2.734 12.432 -15.320 594 H MET 76 H MET 76 4.974 13.984 -11.369 595 HA MET 76 HA MET 76 6.384 11.517 -10.501 596 1HB MET 76 1HB MET 76 6.696 11.713 -12.878 597 2HB MET 76 2HB MET 76 6.951 13.462 -12.768 598 1HG MET 76 1HG MET 76 9.063 13.175 -11.677 599 2HG MET 76 2HG MET 76 8.808 11.431 -11.504 600 1HE MET 76 1HE MET 76 9.247 14.369 -14.109 601 2HE MET 76 2HE MET 76 9.541 13.462 -15.610 602 3HE MET 76 3HE MET 76 7.937 13.419 -14.855 Start of MODEL 7 1 H ARG 1 H ARG 1 16.680 19.295 -6.776 2 HA ARG 1 HA ARG 1 16.175 18.749 -4.500 3 1HB ARG 1 1HB ARG 1 14.938 21.271 -5.660 4 2HB ARG 1 2HB ARG 1 15.007 20.940 -3.917 5 1HG ARG 1 1HG ARG 1 17.448 20.720 -4.007 6 2HG ARG 1 2HG ARG 1 17.436 21.011 -5.754 7 1HD ARG 1 1HD ARG 1 16.534 23.302 -5.371 8 2HD ARG 1 2HD ARG 1 16.395 22.961 -3.647 9 HE ARG 1 HE ARG 1 18.591 23.412 -3.340 10 1HH1 ARG 1 1HH1 ARG 1 18.092 22.825 -6.780 11 2HH1 ARG 1 2HH1 ARG 1 19.765 23.075 -7.220 12 1HH2 ARG 1 1HH2 ARG 1 20.761 23.843 -3.903 13 2HH2 ARG 1 2HH2 ARG 1 21.279 23.745 -5.566 14 H VAL 2 H VAL 2 13.093 20.056 -5.789 15 HA VAL 2 HA VAL 2 11.571 18.409 -3.901 16 HB VAL 2 HB VAL 2 9.616 19.549 -4.973 17 1HG1 VAL 2 1HG1 VAL 2 10.680 20.399 -2.927 18 2HG1 VAL 2 2HG1 VAL 2 11.815 21.363 -3.896 19 3HG1 VAL 2 3HG1 VAL 2 10.078 21.725 -3.935 20 1HG2 VAL 2 1HG2 VAL 2 11.672 21.304 -6.404 21 2HG2 VAL 2 2HG2 VAL 2 10.683 20.080 -7.223 22 3HG2 VAL 2 3HG2 VAL 2 9.912 21.452 -6.421 23 H GLY 3 H GLY 3 12.811 16.536 -5.054 24 1HA GLY 3 1HA GLY 3 12.584 14.569 -6.260 25 2HA GLY 3 2HA GLY 3 11.000 15.093 -6.860 26 H LEU 4 H LEU 4 11.269 17.255 -8.233 27 HA LEU 4 HA LEU 4 12.745 16.678 -10.620 28 1HB LEU 4 1HB LEU 4 11.537 19.289 -9.677 29 2HB LEU 4 2HB LEU 4 12.064 18.892 -11.319 30 HG LEU 4 HG LEU 4 9.804 17.480 -9.817 31 1HD1 LEU 4 1HD1 LEU 4 9.253 19.768 -10.410 32 2HD1 LEU 4 2HD1 LEU 4 9.861 19.510 -12.064 33 3HD1 LEU 4 3HD1 LEU 4 8.404 18.654 -11.505 34 1HD2 LEU 4 1HD2 LEU 4 10.844 15.937 -11.466 35 2HD2 LEU 4 2HD2 LEU 4 9.297 16.524 -12.083 36 3HD2 LEU 4 3HD2 LEU 4 10.805 17.221 -12.690 37 H THR 5 H THR 5 14.927 16.718 -10.742 38 HA THR 5 HA THR 5 16.653 18.441 -9.169 39 HB THR 5 HB THR 5 18.388 17.607 -10.687 40 HG1 THR 5 HG1 THR 5 17.051 15.956 -12.245 41 1HG2 THR 5 1HG2 THR 5 17.596 16.056 -8.902 42 2HG2 THR 5 2HG2 THR 5 16.461 15.317 -10.051 43 3HG2 THR 5 3HG2 THR 5 18.208 15.207 -10.334 44 H GLU 6 H GLU 6 18.142 20.035 -10.398 45 HA GLU 6 HA GLU 6 16.706 21.983 -11.881 46 1HB GLU 6 1HB GLU 6 19.714 21.381 -11.993 47 2HB GLU 6 2HB GLU 6 18.895 22.856 -12.502 48 1HG GLU 6 1HG GLU 6 19.538 23.582 -10.467 49 2HG GLU 6 2HG GLU 6 18.018 22.848 -9.955 50 H GLU 7 H GLU 7 18.445 19.046 -12.913 51 HA GLU 7 HA GLU 7 18.389 19.710 -15.731 52 1HB GLU 7 1HB GLU 7 18.865 17.139 -14.166 53 2HB GLU 7 2HB GLU 7 18.807 17.179 -15.933 54 1HG GLU 7 1HG GLU 7 21.131 17.353 -15.054 55 2HG GLU 7 2HG GLU 7 20.655 18.705 -16.085 56 H GLN 8 H GLN 8 16.279 17.681 -13.621 57 HA GLN 8 HA GLN 8 14.416 17.084 -15.727 58 1HB GLN 8 1HB GLN 8 14.272 17.100 -12.724 59 2HB GLN 8 2HB GLN 8 12.792 16.990 -13.679 60 1HG GLN 8 1HG GLN 8 13.609 14.766 -13.075 61 2HG GLN 8 2HG GLN 8 13.517 15.001 -14.821 62 1HE2 GLN 8 1HE2 GLN 8 15.510 15.043 -16.080 63 2HE2 GLN 8 2HE2 GLN 8 17.017 14.541 -15.345 64 H LYS 9 H LYS 9 14.623 19.918 -13.480 65 HA LYS 9 HA LYS 9 12.229 21.124 -14.453 66 1HB LYS 9 1HB LYS 9 14.717 22.321 -13.196 67 2HB LYS 9 2HB LYS 9 13.253 23.248 -13.577 68 1HG LYS 9 1HG LYS 9 11.888 21.878 -12.110 69 2HG LYS 9 2HG LYS 9 13.192 20.724 -11.879 70 1HD LYS 9 1HD LYS 9 12.953 22.106 -9.902 71 2HD LYS 9 2HD LYS 9 14.539 22.299 -10.646 72 1HE LYS 9 1HE LYS 9 13.601 24.454 -9.881 73 2HE LYS 9 2HE LYS 9 13.876 24.449 -11.628 74 1HZ LYS 9 1HZ LYS 9 11.758 25.391 -11.034 75 2HZ LYS 9 2HZ LYS 9 11.543 24.024 -11.928 76 3HZ LYS 9 3HZ LYS 9 11.291 23.991 -10.299 77 H GLN 10 H GLN 10 15.633 21.486 -15.599 78 HA GLN 10 HA GLN 10 15.113 23.288 -17.730 79 1HB GLN 10 1HB GLN 10 17.156 21.059 -17.413 80 2HB GLN 10 2HB GLN 10 17.121 22.124 -18.821 81 1HG GLN 10 1HG GLN 10 17.582 24.068 -17.539 82 2HG GLN 10 2HG GLN 10 17.221 23.251 -16.012 83 1HE2 GLN 10 1HE2 GLN 10 18.654 21.824 -15.115 84 2HE2 GLN 10 2HE2 GLN 10 20.360 21.737 -15.552 85 H GLU 11 H GLU 11 15.134 19.688 -17.793 86 HA GLU 11 HA GLU 11 14.336 19.348 -20.468 87 1HB GLU 11 1HB GLU 11 13.801 17.687 -17.992 88 2HB GLU 11 2HB GLU 11 13.477 17.108 -19.629 89 1HG GLU 11 1HG GLU 11 15.746 17.027 -20.229 90 2HG GLU 11 2HG GLU 11 16.244 18.183 -18.998 91 H ILE 12 H ILE 12 12.259 19.662 -17.551 92 HA ILE 12 HA ILE 12 9.762 19.465 -18.906 93 HB ILE 12 HB ILE 12 10.606 20.716 -16.279 94 1HG1 ILE 12 1HG1 ILE 12 8.931 18.239 -16.934 95 2HG1 ILE 12 2HG1 ILE 12 10.671 18.183 -16.685 96 1HG2 ILE 12 1HG2 ILE 12 7.750 20.341 -17.263 97 2HG2 ILE 12 2HG2 ILE 12 8.242 20.918 -15.663 98 3HG2 ILE 12 3HG2 ILE 12 8.552 21.913 -17.071 99 1HD1 ILE 12 1HD1 ILE 12 10.405 19.071 -14.398 100 2HD1 ILE 12 2HD1 ILE 12 8.635 19.029 -14.590 101 3HD1 ILE 12 3HD1 ILE 12 9.564 17.528 -14.663 102 H ARG 13 H ARG 13 11.790 22.366 -18.149 103 HA ARG 13 HA ARG 13 9.961 24.211 -19.293 104 1HB ARG 13 1HB ARG 13 11.808 24.888 -17.831 105 2HB ARG 13 2HB ARG 13 12.987 24.388 -19.051 106 1HG ARG 13 1HG ARG 13 12.741 26.787 -19.105 107 2HG ARG 13 2HG ARG 13 12.110 26.123 -20.616 108 1HD ARG 13 1HD ARG 13 9.783 26.367 -19.733 109 2HD ARG 13 2HD ARG 13 10.455 26.979 -18.201 110 HE ARG 13 HE ARG 13 11.406 28.496 -20.447 111 1HH1 ARG 13 1HH1 ARG 13 8.580 28.011 -18.392 112 2HH1 ARG 13 2HH1 ARG 13 7.885 29.574 -18.720 113 1HH2 ARG 13 1HH2 ARG 13 10.522 30.555 -20.888 114 2HH2 ARG 13 2HH2 ARG 13 9.014 31.051 -20.171 115 H GLU 14 H GLU 14 12.691 22.422 -20.778 116 HA GLU 14 HA GLU 14 12.471 23.500 -23.398 117 1HB GLU 14 1HB GLU 14 13.376 20.763 -22.416 118 2HB GLU 14 2HB GLU 14 13.542 21.315 -24.087 119 1HG GLU 14 1HG GLU 14 15.019 23.106 -23.464 120 2HG GLU 14 2HG GLU 14 14.711 22.879 -21.742 121 H ALA 15 H ALA 15 10.944 20.548 -22.001 122 HA ALA 15 HA ALA 15 9.402 19.824 -24.250 123 1HB ALA 15 1HB ALA 15 8.720 19.492 -21.295 124 2HB ALA 15 2HB ALA 15 7.988 18.607 -22.650 125 3HB ALA 15 3HB ALA 15 9.709 18.387 -22.273 126 H PHE 16 H PHE 16 8.543 21.959 -21.500 127 HA PHE 16 HA PHE 16 5.941 22.636 -22.261 128 1HB PHE 16 1HB PHE 16 6.949 23.240 -20.097 129 2HB PHE 16 2HB PHE 16 8.034 24.370 -20.880 130 HD1 PHE 16 HD1 PHE 16 4.441 23.654 -20.236 131 HD2 PHE 16 HD2 PHE 16 7.330 26.622 -21.431 132 HE1 PHE 16 HE1 PHE 16 2.689 25.397 -20.136 133 HE2 PHE 16 HE2 PHE 16 5.562 28.358 -21.369 134 HZ PHE 16 HZ PHE 16 3.240 27.751 -20.721 135 H ASP 17 H ASP 17 8.971 24.402 -22.984 136 HA ASP 17 HA ASP 17 7.943 26.414 -24.635 137 1HB ASP 17 1HB ASP 17 10.224 26.398 -23.727 138 2HB ASP 17 2HB ASP 17 10.651 25.020 -24.751 139 H LEU 18 H LEU 18 9.231 23.181 -25.596 140 HA LEU 18 HA LEU 18 8.788 23.483 -28.368 141 1HB LEU 18 1HB LEU 18 10.148 21.728 -27.402 142 2HB LEU 18 2HB LEU 18 8.746 20.940 -26.675 143 HG LEU 18 HG LEU 18 8.742 21.447 -29.667 144 1HD1 LEU 18 1HD1 LEU 18 10.247 19.180 -28.319 145 2HD1 LEU 18 2HD1 LEU 18 9.935 19.350 -30.065 146 3HD1 LEU 18 3HD1 LEU 18 10.969 20.526 -29.238 147 1HD2 LEU 18 1HD2 LEU 18 7.609 19.202 -29.678 148 2HD2 LEU 18 2HD2 LEU 18 7.712 19.162 -27.909 149 3HD2 LEU 18 3HD2 LEU 18 6.715 20.379 -28.730 150 H PHE 19 H PHE 19 6.636 21.939 -25.901 151 HA PHE 19 HA PHE 19 4.534 21.416 -27.744 152 1HB PHE 19 1HB PHE 19 4.425 21.945 -24.758 153 2HB PHE 19 2HB PHE 19 3.101 21.255 -25.701 154 HD1 PHE 19 HD1 PHE 19 4.884 19.302 -27.423 155 HD2 PHE 19 HD2 PHE 19 4.491 20.111 -23.201 156 HE1 PHE 19 HE1 PHE 19 5.564 17.002 -26.926 157 HE2 PHE 19 HE2 PHE 19 5.040 17.738 -22.721 158 HZ PHE 19 HZ PHE 19 5.683 16.208 -24.570 159 H ASP 20 H ASP 20 5.309 24.334 -25.898 160 HA ASP 20 HA ASP 20 2.933 25.799 -26.687 161 1HB ASP 20 1HB ASP 20 4.367 26.240 -24.660 162 2HB ASP 20 2HB ASP 20 5.649 26.806 -25.736 163 H THR 21 H THR 21 3.672 24.626 -28.993 164 HA THR 21 HA THR 21 5.611 25.735 -30.641 165 HB THR 21 HB THR 21 4.177 24.951 -32.525 166 HG1 THR 21 HG1 THR 21 2.275 24.732 -30.444 167 1HG2 THR 21 1HG2 THR 21 4.160 22.592 -31.964 168 2HG2 THR 21 2HG2 THR 21 5.623 23.334 -31.292 169 3HG2 THR 21 3HG2 THR 21 4.251 22.940 -30.233 170 H ASP 22 H ASP 22 2.350 26.951 -29.966 171 HA ASP 22 HA ASP 22 2.272 28.979 -31.954 172 1HB ASP 22 1HB ASP 22 0.311 28.107 -30.726 173 2HB ASP 22 2HB ASP 22 0.904 28.855 -29.235 174 H GLY 23 H GLY 23 4.123 28.867 -28.969 175 1HA GLY 23 1HA GLY 23 5.555 30.403 -28.070 176 2HA GLY 23 2HA GLY 23 5.231 31.503 -29.414 177 H SER 24 H SER 24 2.492 30.241 -27.538 178 HA SER 24 HA SER 24 1.623 32.842 -26.716 179 1HB SER 24 1HB SER 24 -0.073 31.107 -25.583 180 2HB SER 24 2HB SER 24 -0.025 31.389 -27.324 181 HG SER 24 HG SER 24 0.599 29.102 -25.965 182 H GLY 25 H GLY 25 3.817 30.618 -25.379 183 1HA GLY 25 1HA GLY 25 4.859 30.422 -23.338 184 2HA GLY 25 2HA GLY 25 4.176 31.988 -22.865 185 H THR 26 H THR 26 1.935 29.577 -23.970 186 HA THR 26 HA THR 26 1.109 28.560 -21.375 187 HB THR 26 HB THR 26 -1.222 29.599 -21.845 188 HG1 THR 26 HG1 THR 26 0.380 31.545 -23.165 189 1HG2 THR 26 1HG2 THR 26 0.895 31.532 -20.848 190 2HG2 THR 26 2HG2 THR 26 -0.846 31.571 -20.537 191 3HG2 THR 26 3HG2 THR 26 0.131 30.249 -19.883 192 H ILE 27 H ILE 27 0.514 26.490 -21.937 193 HA ILE 27 HA ILE 27 0.477 25.826 -24.782 194 HB ILE 27 HB ILE 27 0.262 24.166 -22.271 195 1HG1 ILE 27 1HG1 ILE 27 2.451 24.481 -24.383 196 2HG1 ILE 27 2HG1 ILE 27 2.453 25.288 -22.815 197 1HG2 ILE 27 1HG2 ILE 27 0.573 23.144 -25.116 198 2HG2 ILE 27 2HG2 ILE 27 0.430 22.174 -23.644 199 3HG2 ILE 27 3HG2 ILE 27 -0.957 23.071 -24.212 200 1HD1 ILE 27 1HD1 ILE 27 2.430 23.060 -21.687 201 2HD1 ILE 27 2HD1 ILE 27 2.574 22.282 -23.281 202 3HD1 ILE 27 3HD1 ILE 27 3.856 23.348 -22.711 203 H ASP 28 H ASP 28 -1.330 25.833 -26.017 204 HA ASP 28 HA ASP 28 -3.991 26.100 -24.865 205 1HB ASP 28 1HB ASP 28 -3.370 27.119 -27.028 206 2HB ASP 28 2HB ASP 28 -3.087 25.513 -27.714 207 H ALA 29 H ALA 29 -5.585 24.532 -24.672 208 HA ALA 29 HA ALA 29 -5.249 21.934 -24.090 209 1HB ALA 29 1HB ALA 29 -7.403 23.114 -24.000 210 2HB ALA 29 2HB ALA 29 -7.517 23.086 -25.774 211 3HB ALA 29 3HB ALA 29 -7.577 21.568 -24.855 212 H LYS 30 H LYS 30 -5.616 23.088 -27.494 213 HA LYS 30 HA LYS 30 -5.534 20.515 -28.722 214 1HB LYS 30 1HB LYS 30 -4.672 23.245 -29.754 215 2HB LYS 30 2HB LYS 30 -4.874 21.797 -30.753 216 1HG LYS 30 1HG LYS 30 -7.243 21.628 -30.102 217 2HG LYS 30 2HG LYS 30 -7.119 23.089 -29.118 218 1HD LYS 30 1HD LYS 30 -6.600 22.976 -32.128 219 2HD LYS 30 2HD LYS 30 -8.134 23.439 -31.375 220 1HE LYS 30 1HE LYS 30 -6.979 25.317 -30.189 221 2HE LYS 30 2HE LYS 30 -5.480 24.914 -31.045 222 1HZ LYS 30 1HZ LYS 30 -8.004 25.704 -32.308 223 2HZ LYS 30 2HZ LYS 30 -6.669 26.652 -32.126 224 3HZ LYS 30 3HZ LYS 30 -6.609 25.324 -33.100 225 H GLU 31 H GLU 31 -2.912 22.819 -27.878 226 HA GLU 31 HA GLU 31 -0.773 21.283 -29.073 227 1HB GLU 31 1HB GLU 31 -0.798 23.376 -26.866 228 2HB GLU 31 2HB GLU 31 0.656 22.669 -27.574 229 1HG GLU 31 1HG GLU 31 0.087 23.585 -29.773 230 2HG GLU 31 2HG GLU 31 -1.436 24.237 -29.148 231 H LEU 32 H LEU 32 -2.273 21.452 -25.814 232 HA LEU 32 HA LEU 32 -0.483 19.579 -24.621 233 1HB LEU 32 1HB LEU 32 -2.247 21.170 -23.495 234 2HB LEU 32 2HB LEU 32 -3.366 19.835 -23.769 235 HG LEU 32 HG LEU 32 -1.529 18.368 -22.565 236 1HD1 LEU 32 1HD1 LEU 32 -0.197 19.601 -20.896 237 2HD1 LEU 32 2HD1 LEU 32 0.309 19.976 -22.542 238 3HD1 LEU 32 3HD1 LEU 32 -0.688 21.138 -21.635 239 1HD2 LEU 32 1HD2 LEU 32 -3.184 20.447 -21.080 240 2HD2 LEU 32 2HD2 LEU 32 -3.734 18.844 -21.603 241 3HD2 LEU 32 3HD2 LEU 32 -2.489 18.982 -20.350 242 H LYS 33 H LYS 33 -3.580 19.117 -26.371 243 HA LYS 33 HA LYS 33 -3.760 16.286 -26.060 244 1HB LYS 33 1HB LYS 33 -5.561 17.770 -26.805 245 2HB LYS 33 2HB LYS 33 -4.734 17.997 -28.362 246 1HG LYS 33 1HG LYS 33 -4.881 15.478 -28.701 247 2HG LYS 33 2HG LYS 33 -5.838 15.406 -27.208 248 1HD LYS 33 1HD LYS 33 -7.471 17.045 -28.261 249 2HD LYS 33 2HD LYS 33 -6.503 16.980 -29.739 250 1HE LYS 33 1HE LYS 33 -8.363 15.503 -30.050 251 2HE LYS 33 2HE LYS 33 -6.928 14.488 -29.852 252 1HZ LYS 33 1HZ LYS 33 -8.886 15.118 -27.743 253 2HZ LYS 33 2HZ LYS 33 -8.805 13.703 -28.582 254 3HZ LYS 33 3HZ LYS 33 -7.580 14.132 -27.578 255 H VAL 34 H VAL 34 -2.183 18.274 -28.634 256 HA VAL 34 HA VAL 34 -1.093 16.096 -30.100 257 HB VAL 34 HB VAL 34 -0.101 18.940 -29.684 258 1HG1 VAL 34 1HG1 VAL 34 0.994 16.808 -31.564 259 2HG1 VAL 34 2HG1 VAL 34 1.347 18.544 -31.675 260 3HG1 VAL 34 3HG1 VAL 34 1.881 17.633 -30.261 261 1HG2 VAL 34 1HG2 VAL 34 -1.406 17.546 -32.065 262 2HG2 VAL 34 2HG2 VAL 34 -2.259 18.610 -30.935 263 3HG2 VAL 34 3HG2 VAL 34 -0.967 19.262 -31.952 264 H ALA 35 H ALA 35 0.317 17.891 -27.309 265 HA ALA 35 HA ALA 35 2.688 16.408 -27.056 266 1HB ALA 35 1HB ALA 35 0.991 17.587 -24.809 267 2HB ALA 35 2HB ALA 35 2.677 17.101 -24.707 268 3HB ALA 35 3HB ALA 35 2.207 18.449 -25.766 269 H MET 36 H MET 36 -0.511 15.746 -25.541 270 HA MET 36 HA MET 36 0.260 13.327 -24.267 271 1HB MET 36 1HB MET 36 -2.376 14.563 -25.040 272 2HB MET 36 2HB MET 36 -2.321 12.952 -24.328 273 1HG MET 36 1HG MET 36 -0.975 13.777 -22.436 274 2HG MET 36 2HG MET 36 -1.029 15.413 -23.086 275 1HE MET 36 1HE MET 36 -3.010 16.890 -23.122 276 2HE MET 36 2HE MET 36 -4.088 15.775 -23.970 277 3HE MET 36 3HE MET 36 -4.620 16.560 -22.459 278 H ARG 37 H ARG 37 -1.062 13.835 -27.561 279 HA ARG 37 HA ARG 37 -1.118 11.046 -28.233 280 1HB ARG 37 1HB ARG 37 -0.585 13.484 -29.979 281 2HB ARG 37 2HB ARG 37 -0.868 11.866 -30.606 282 1HG ARG 37 1HG ARG 37 -2.950 13.093 -28.776 283 2HG ARG 37 2HG ARG 37 -2.797 13.679 -30.431 284 1HD ARG 37 1HD ARG 37 -4.492 11.970 -30.381 285 2HD ARG 37 2HD ARG 37 -3.092 11.405 -31.313 286 HE ARG 37 HE ARG 37 -3.008 10.616 -28.509 287 1HH1 ARG 37 1HH1 ARG 37 -4.471 9.775 -31.617 288 2HH1 ARG 37 2HH1 ARG 37 -4.608 8.079 -31.245 289 1HH2 ARG 37 1HH2 ARG 37 -3.164 8.422 -28.015 290 2HH2 ARG 37 2HH2 ARG 37 -3.839 7.289 -29.161 291 H ALA 38 H ALA 38 1.514 13.490 -28.564 292 HA ALA 38 HA ALA 38 3.448 11.695 -29.607 293 1HB ALA 38 1HB ALA 38 3.693 14.153 -29.604 294 2HB ALA 38 2HB ALA 38 3.934 14.131 -27.844 295 3HB ALA 38 3HB ALA 38 5.105 13.333 -28.907 296 H LEU 39 H LEU 39 2.549 12.409 -26.234 297 HA LEU 39 HA LEU 39 4.506 10.644 -25.031 298 1HB LEU 39 1HB LEU 39 1.910 11.829 -23.995 299 2HB LEU 39 2HB LEU 39 3.057 10.957 -22.993 300 HG LEU 39 HG LEU 39 3.929 13.437 -24.518 301 1HD1 LEU 39 1HD1 LEU 39 2.005 14.138 -23.152 302 2HD1 LEU 39 2HD1 LEU 39 2.668 13.287 -21.744 303 3HD1 LEU 39 3HD1 LEU 39 3.504 14.705 -22.416 304 1HD2 LEU 39 1HD2 LEU 39 5.627 13.532 -22.744 305 2HD2 LEU 39 2HD2 LEU 39 4.953 12.071 -21.995 306 3HD2 LEU 39 3HD2 LEU 39 5.708 11.987 -23.601 307 H GLY 40 H GLY 40 1.866 9.817 -26.971 308 1HA GLY 40 1HA GLY 40 0.948 7.797 -27.414 309 2HA GLY 40 2HA GLY 40 2.038 7.050 -26.236 310 H PHE 41 H PHE 41 -0.163 9.695 -25.366 311 HA PHE 41 HA PHE 41 -1.662 7.934 -23.499 312 1HB PHE 41 1HB PHE 41 -1.754 10.880 -24.180 313 2HB PHE 41 2HB PHE 41 -2.933 10.127 -23.131 314 HD1 PHE 41 HD1 PHE 41 -2.486 11.697 -21.368 315 HD2 PHE 41 HD2 PHE 41 0.657 9.096 -22.809 316 HE1 PHE 41 HE1 PHE 41 -1.061 12.333 -19.454 317 HE2 PHE 41 HE2 PHE 41 2.056 9.739 -20.907 318 HZ PHE 41 HZ PHE 41 1.223 11.366 -19.219 319 H GLU 42 H GLU 42 -4.059 7.960 -23.637 320 HA GLU 42 HA GLU 42 -5.154 8.153 -26.422 321 1HB GLU 42 1HB GLU 42 -6.155 6.616 -23.998 322 2HB GLU 42 2HB GLU 42 -6.950 6.725 -25.576 323 1HG GLU 42 1HG GLU 42 -4.926 5.705 -26.643 324 2HG GLU 42 2HG GLU 42 -4.187 5.524 -25.043 325 HA PRO 43 HA PRO 43 -6.484 11.729 -23.943 326 1HB PRO 43 1HB PRO 43 -6.694 13.683 -25.808 327 2HB PRO 43 2HB PRO 43 -5.139 13.062 -25.204 328 1HG PRO 43 1HG PRO 43 -6.577 12.184 -27.728 329 2HG PRO 43 2HG PRO 43 -4.877 12.720 -27.526 330 1HD PRO 43 1HD PRO 43 -5.562 10.080 -27.539 331 2HD PRO 43 2HD PRO 43 -4.280 10.715 -26.459 332 H LYS 44 H LYS 44 -8.388 10.236 -23.665 333 HA LYS 44 HA LYS 44 -10.764 10.499 -25.132 334 1HB LYS 44 1HB LYS 44 -10.160 8.777 -23.452 335 2HB LYS 44 2HB LYS 44 -10.414 9.952 -22.152 336 1HG LYS 44 1HG LYS 44 -12.760 10.244 -22.897 337 2HG LYS 44 2HG LYS 44 -12.493 9.089 -24.213 338 1HD LYS 44 1HD LYS 44 -12.249 8.430 -21.235 339 2HD LYS 44 2HD LYS 44 -13.693 8.144 -22.220 340 1HE LYS 44 1HE LYS 44 -12.340 6.651 -23.720 341 2HE LYS 44 2HE LYS 44 -10.951 6.857 -22.634 342 1HZ LYS 44 1HZ LYS 44 -13.542 5.721 -21.879 343 2HZ LYS 44 2HZ LYS 44 -12.151 4.881 -22.154 344 3HZ LYS 44 3HZ LYS 44 -12.247 5.921 -20.879 345 H LYS 45 H LYS 45 -11.260 12.535 -25.673 346 HA LYS 45 HA LYS 45 -11.044 14.941 -24.802 347 1HB LYS 45 1HB LYS 45 -13.694 13.819 -25.782 348 2HB LYS 45 2HB LYS 45 -13.309 15.545 -25.677 349 1HG LYS 45 1HG LYS 45 -11.387 15.226 -27.203 350 2HG LYS 45 2HG LYS 45 -11.798 13.508 -27.381 351 1HD LYS 45 1HD LYS 45 -14.056 14.141 -28.224 352 2HD LYS 45 2HD LYS 45 -13.614 15.851 -28.128 353 1HE LYS 45 1HE LYS 45 -12.211 13.744 -29.848 354 2HE LYS 45 2HE LYS 45 -13.397 14.924 -30.426 355 1HZ LYS 45 1HZ LYS 45 -10.791 15.573 -29.247 356 2HZ LYS 45 2HZ LYS 45 -11.194 15.662 -30.843 357 3HZ LYS 45 3HZ LYS 45 -11.912 16.669 -29.756 358 H GLU 46 H GLU 46 -13.865 13.117 -23.497 359 HA GLU 46 HA GLU 46 -14.828 15.075 -21.746 360 1HB GLU 46 1HB GLU 46 -14.802 12.041 -21.388 361 2HB GLU 46 2HB GLU 46 -15.807 13.169 -20.474 362 1HG GLU 46 1HG GLU 46 -16.945 13.894 -22.534 363 2HG GLU 46 2HG GLU 46 -15.938 12.815 -23.511 364 H GLU 47 H GLU 47 -12.314 12.605 -21.147 365 HA GLU 47 HA GLU 47 -11.992 13.337 -18.336 366 1HB GLU 47 1HB GLU 47 -10.161 11.644 -20.088 367 2HB GLU 47 2HB GLU 47 -10.246 11.689 -18.322 368 1HG GLU 47 1HG GLU 47 -12.342 10.600 -20.251 369 2HG GLU 47 2HG GLU 47 -11.379 9.692 -19.080 370 H ILE 48 H ILE 48 -10.339 13.907 -21.427 371 HA ILE 48 HA ILE 48 -8.093 15.319 -20.416 372 HB ILE 48 HB ILE 48 -9.592 15.452 -23.048 373 1HG1 ILE 48 1HG1 ILE 48 -8.411 13.299 -22.315 374 2HG1 ILE 48 2HG1 ILE 48 -7.996 13.985 -23.884 375 1HG2 ILE 48 1HG2 ILE 48 -8.489 17.552 -22.976 376 2HG2 ILE 48 2HG2 ILE 48 -7.001 16.845 -22.316 377 3HG2 ILE 48 3HG2 ILE 48 -7.501 16.495 -23.989 378 1HD1 ILE 48 1HD1 ILE 48 -6.285 14.654 -21.466 379 2HD1 ILE 48 2HD1 ILE 48 -6.067 13.139 -22.333 380 3HD1 ILE 48 3HD1 ILE 48 -5.898 14.668 -23.204 381 H LYS 49 H LYS 49 -11.322 16.590 -21.378 382 HA LYS 49 HA LYS 49 -10.768 19.327 -20.885 383 1HB LYS 49 1HB LYS 49 -13.315 17.684 -20.630 384 2HB LYS 49 2HB LYS 49 -13.276 19.443 -20.430 385 1HG LYS 49 1HG LYS 49 -12.480 19.789 -22.670 386 2HG LYS 49 2HG LYS 49 -12.237 18.056 -22.936 387 1HD LYS 49 1HD LYS 49 -14.672 17.654 -22.627 388 2HD LYS 49 2HD LYS 49 -14.938 19.394 -22.425 389 1HE LYS 49 1HE LYS 49 -13.786 18.042 -24.919 390 2HE LYS 49 2HE LYS 49 -15.460 18.588 -24.728 391 1HZ LYS 49 1HZ LYS 49 -14.640 20.817 -24.455 392 2HZ LYS 49 2HZ LYS 49 -13.086 20.312 -24.668 393 3HZ LYS 49 3HZ LYS 49 -14.170 20.184 -25.902 394 H LYS 50 H LYS 50 -12.067 16.826 -18.633 395 HA LYS 50 HA LYS 50 -12.177 18.570 -16.377 396 1HB LYS 50 1HB LYS 50 -11.828 15.550 -16.576 397 2HB LYS 50 2HB LYS 50 -12.146 16.411 -15.054 398 1HG LYS 50 1HG LYS 50 -14.230 17.354 -16.071 399 2HG LYS 50 2HG LYS 50 -13.985 16.344 -17.495 400 1HD LYS 50 1HD LYS 50 -14.401 15.327 -14.633 401 2HD LYS 50 2HD LYS 50 -15.628 15.443 -15.894 402 1HE LYS 50 1HE LYS 50 -15.064 13.203 -16.008 403 2HE LYS 50 2HE LYS 50 -14.103 13.895 -17.318 404 1HZ LYS 50 1HZ LYS 50 -13.171 13.234 -14.599 405 2HZ LYS 50 2HZ LYS 50 -12.868 12.366 -15.968 406 3HZ LYS 50 3HZ LYS 50 -12.221 13.867 -15.784 407 H MET 51 H MET 51 -9.573 16.248 -17.369 408 HA MET 51 HA MET 51 -7.750 16.753 -15.349 409 1HB MET 51 1HB MET 51 -7.591 15.051 -17.217 410 2HB MET 51 2HB MET 51 -7.146 16.360 -18.309 411 1HG MET 51 1HG MET 51 -5.283 16.826 -16.443 412 2HG MET 51 2HG MET 51 -5.655 15.164 -15.995 413 1HE MET 51 1HE MET 51 -5.428 16.863 -19.654 414 2HE MET 51 2HE MET 51 -4.232 17.641 -18.585 415 3HE MET 51 3HE MET 51 -3.695 16.607 -19.922 416 H ILE 52 H ILE 52 -7.990 18.455 -18.517 417 HA ILE 52 HA ILE 52 -6.028 20.418 -18.066 418 HB ILE 52 HB ILE 52 -8.552 20.353 -19.752 419 1HG1 ILE 52 1HG1 ILE 52 -5.582 20.395 -20.478 420 2HG1 ILE 52 2HG1 ILE 52 -6.535 18.920 -20.316 421 1HG2 ILE 52 1HG2 ILE 52 -8.236 22.736 -19.206 422 2HG2 ILE 52 2HG2 ILE 52 -6.532 22.634 -19.686 423 3HG2 ILE 52 3HG2 ILE 52 -7.827 22.432 -20.878 424 1HD1 ILE 52 1HD1 ILE 52 -6.926 21.100 -22.388 425 2HD1 ILE 52 2HD1 ILE 52 -6.418 19.428 -22.638 426 3HD1 ILE 52 3HD1 ILE 52 -8.080 19.775 -22.113 427 H SER 53 H SER 53 -9.561 20.546 -17.268 428 HA SER 53 HA SER 53 -9.408 23.167 -16.223 429 1HB SER 53 1HB SER 53 -11.589 22.854 -15.410 430 2HB SER 53 2HB SER 53 -11.516 21.723 -16.778 431 HG SER 53 HG SER 53 -11.013 20.090 -15.185 432 H GLU 54 H GLU 54 -8.985 20.052 -14.539 433 HA GLU 54 HA GLU 54 -8.609 21.106 -11.924 434 1HB GLU 54 1HB GLU 54 -7.601 18.560 -13.257 435 2HB GLU 54 2HB GLU 54 -7.422 18.907 -11.531 436 1HG GLU 54 1HG GLU 54 -9.815 18.981 -11.197 437 2HG GLU 54 2HG GLU 54 -10.136 18.881 -12.929 438 H ILE 55 H ILE 55 -6.255 20.447 -14.559 439 HA ILE 55 HA ILE 55 -3.979 21.283 -12.951 440 HB ILE 55 HB ILE 55 -4.318 20.917 -15.948 441 1HG1 ILE 55 1HG1 ILE 55 -4.611 18.800 -14.773 442 2HG1 ILE 55 2HG1 ILE 55 -3.092 18.821 -15.644 443 1HG2 ILE 55 1HG2 ILE 55 -2.452 22.395 -15.631 444 2HG2 ILE 55 2HG2 ILE 55 -1.792 21.405 -14.322 445 3HG2 ILE 55 3HG2 ILE 55 -1.814 20.795 -15.993 446 1HD1 ILE 55 1HD1 ILE 55 -3.496 19.134 -12.633 447 2HD1 ILE 55 2HD1 ILE 55 -2.795 17.762 -13.490 448 3HD1 ILE 55 3HD1 ILE 55 -1.922 19.302 -13.441 449 H ASP 56 H ASP 56 -6.250 22.996 -15.113 450 HA ASP 56 HA ASP 56 -4.541 25.318 -15.301 451 1HB ASP 56 1HB ASP 56 -6.086 24.574 -17.075 452 2HB ASP 56 2HB ASP 56 -7.461 24.996 -16.041 453 H LYS 57 H LYS 57 -4.344 25.255 -12.861 454 HA LYS 57 HA LYS 57 -6.179 26.069 -10.960 455 1HB LYS 57 1HB LYS 57 -3.361 27.203 -11.161 456 2HB LYS 57 2HB LYS 57 -4.327 26.954 -9.706 457 1HG LYS 57 1HG LYS 57 -2.968 24.850 -11.433 458 2HG LYS 57 2HG LYS 57 -2.622 25.295 -9.768 459 1HD LYS 57 1HD LYS 57 -4.864 24.434 -9.067 460 2HD LYS 57 2HD LYS 57 -5.177 23.937 -10.743 461 1HE LYS 57 1HE LYS 57 -3.155 22.490 -10.695 462 2HE LYS 57 2HE LYS 57 -2.904 22.910 -8.986 463 1HZ LYS 57 1HZ LYS 57 -5.270 21.596 -10.122 464 2HZ LYS 57 2HZ LYS 57 -4.078 20.846 -9.261 465 3HZ LYS 57 3HZ LYS 57 -5.054 21.954 -8.525 466 H ASP 58 H ASP 58 -4.862 28.055 -13.556 467 HA ASP 58 HA ASP 58 -5.710 30.601 -12.245 468 1HB ASP 58 1HB ASP 58 -3.948 30.060 -14.675 469 2HB ASP 58 2HB ASP 58 -4.285 31.644 -13.964 470 H GLY 59 H GLY 59 -7.173 28.283 -13.900 471 1HA GLY 59 1HA GLY 59 -8.513 27.973 -15.574 472 2HA GLY 59 2HA GLY 59 -9.393 29.341 -14.855 473 H SER 60 H SER 60 -6.315 29.240 -16.710 474 HA SER 60 HA SER 60 -7.180 31.612 -18.203 475 1HB SER 60 1HB SER 60 -4.528 30.132 -18.292 476 2HB SER 60 2HB SER 60 -4.858 31.809 -18.763 477 HG SER 60 HG SER 60 -5.724 31.542 -16.261 478 H GLY 61 H GLY 61 -8.210 28.738 -18.831 479 1HA GLY 61 1HA GLY 61 -8.779 27.486 -20.632 480 2HA GLY 61 2HA GLY 61 -8.556 28.942 -21.617 481 H THR 62 H THR 62 -5.794 27.720 -19.787 482 HA THR 62 HA THR 62 -4.538 26.305 -21.977 483 HB THR 62 HB THR 62 -2.721 28.003 -22.164 484 HG1 THR 62 HG1 THR 62 -4.573 29.803 -20.978 485 1HG2 THR 62 1HG2 THR 62 -3.683 29.522 -23.715 486 2HG2 THR 62 2HG2 THR 62 -4.560 27.994 -23.904 487 3HG2 THR 62 3HG2 THR 62 -5.304 29.348 -23.036 488 H ILE 63 H ILE 63 -2.324 25.668 -21.235 489 HA ILE 63 HA ILE 63 -2.172 25.513 -18.257 490 HB ILE 63 HB ILE 63 -0.590 23.914 -20.272 491 1HG1 ILE 63 1HG1 ILE 63 -2.821 23.275 -20.766 492 2HG1 ILE 63 2HG1 ILE 63 -2.101 22.030 -19.746 493 1HG2 ILE 63 1HG2 ILE 63 0.383 24.044 -18.050 494 2HG2 ILE 63 2HG2 ILE 63 -1.133 23.520 -17.309 495 3HG2 ILE 63 3HG2 ILE 63 -0.226 22.414 -18.360 496 1HD1 ILE 63 1HD1 ILE 63 -4.344 22.365 -19.018 497 2HD1 ILE 63 2HD1 ILE 63 -3.308 23.053 -17.759 498 3HD1 ILE 63 3HD1 ILE 63 -4.149 24.119 -18.909 499 H ASP 64 H ASP 64 -1.035 27.197 -17.455 500 HA ASP 64 HA ASP 64 1.195 28.493 -18.814 501 1HB ASP 64 1HB ASP 64 -0.125 29.754 -17.202 502 2HB ASP 64 2HB ASP 64 0.172 28.549 -15.941 503 H PHE 65 H PHE 65 3.405 28.438 -18.067 504 HA PHE 65 HA PHE 65 4.600 25.954 -17.861 505 1HB PHE 65 1HB PHE 65 5.858 27.931 -18.425 506 2HB PHE 65 2HB PHE 65 5.552 28.644 -16.840 507 HD1 PHE 65 HD1 PHE 65 6.871 25.341 -18.152 508 HD2 PHE 65 HD2 PHE 65 7.398 28.608 -15.378 509 HE1 PHE 65 HE1 PHE 65 8.877 24.236 -17.216 510 HE2 PHE 65 HE2 PHE 65 9.431 27.517 -14.489 511 HZ PHE 65 HZ PHE 65 10.181 25.329 -15.410 512 H GLU 66 H GLU 66 3.651 28.061 -15.069 513 HA GLU 66 HA GLU 66 4.801 26.333 -13.099 514 1HB GLU 66 1HB GLU 66 2.481 28.304 -12.871 515 2HB GLU 66 2HB GLU 66 3.340 27.543 -11.522 516 1HG GLU 66 1HG GLU 66 5.473 28.571 -12.286 517 2HG GLU 66 2HG GLU 66 4.618 29.382 -13.606 518 H GLU 67 H GLU 67 1.620 26.392 -14.698 519 HA GLU 67 HA GLU 67 0.388 24.421 -12.978 520 1HB GLU 67 1HB GLU 67 -0.315 25.328 -15.796 521 2HB GLU 67 2HB GLU 67 -1.331 24.342 -14.740 522 1HG GLU 67 1HG GLU 67 -1.481 26.133 -13.088 523 2HG GLU 67 2HG GLU 67 -0.387 27.163 -14.017 524 H PHE 68 H PHE 68 2.006 24.319 -16.171 525 HA PHE 68 HA PHE 68 1.855 21.522 -16.634 526 1HB PHE 68 1HB PHE 68 2.544 23.262 -18.276 527 2HB PHE 68 2HB PHE 68 4.039 23.503 -17.396 528 HD1 PHE 68 HD1 PHE 68 2.055 20.993 -19.342 529 HD2 PHE 68 HD2 PHE 68 5.942 22.124 -17.845 530 HE1 PHE 68 HE1 PHE 68 3.127 19.420 -20.929 531 HE2 PHE 68 HE2 PHE 68 7.005 20.571 -19.467 532 HZ PHE 68 HZ PHE 68 5.619 19.234 -21.002 533 H LEU 69 H LEU 69 4.373 23.455 -14.946 534 HA LEU 69 HA LEU 69 6.088 21.332 -14.248 535 1HB LEU 69 1HB LEU 69 6.708 23.690 -14.076 536 2HB LEU 69 2HB LEU 69 5.476 23.956 -12.839 537 HG LEU 69 HG LEU 69 6.681 22.479 -11.268 538 1HD1 LEU 69 1HD1 LEU 69 7.827 20.947 -12.794 539 2HD1 LEU 69 2HD1 LEU 69 8.744 22.293 -13.513 540 3HD1 LEU 69 3HD1 LEU 69 9.025 21.817 -11.827 541 1HD2 LEU 69 1HD2 LEU 69 8.409 24.663 -12.506 542 2HD2 LEU 69 2HD2 LEU 69 7.112 24.908 -11.315 543 3HD2 LEU 69 3HD2 LEU 69 8.565 24.000 -10.863 544 H THR 70 H THR 70 3.325 22.771 -12.443 545 HA THR 70 HA THR 70 3.405 21.045 -10.211 546 HB THR 70 HB THR 70 0.926 22.269 -11.502 547 HG1 THR 70 HG1 THR 70 2.500 23.834 -11.017 548 1HG2 THR 70 1HG2 THR 70 0.044 22.230 -9.197 549 2HG2 THR 70 2HG2 THR 70 0.369 20.586 -9.771 550 3HG2 THR 70 3HG2 THR 70 1.497 21.375 -8.644 551 H MET 71 H MET 71 1.652 20.660 -13.333 552 HA MET 71 HA MET 71 0.423 18.197 -12.850 553 1HB MET 71 1HB MET 71 0.043 19.720 -14.786 554 2HB MET 71 2HB MET 71 1.585 19.224 -15.478 555 1HG MET 71 1HG MET 71 0.798 16.909 -15.645 556 2HG MET 71 2HG MET 71 -0.765 17.385 -14.965 557 1HE MET 71 1HE MET 71 -1.804 16.141 -17.069 558 2HE MET 71 2HE MET 71 -1.452 16.588 -18.761 559 3HE MET 71 3HE MET 71 -0.191 15.833 -17.761 560 H MET 72 H MET 72 3.663 18.788 -14.344 561 HA MET 72 HA MET 72 4.450 16.065 -14.522 562 1HB MET 72 1HB MET 72 6.067 18.616 -14.131 563 2HB MET 72 2HB MET 72 6.803 17.032 -14.414 564 1HG MET 72 1HG MET 72 4.790 18.307 -16.312 565 2HG MET 72 2HG MET 72 6.540 18.438 -16.464 566 1HE MET 72 1HE MET 72 5.616 16.088 -19.426 567 2HE MET 72 2HE MET 72 4.670 17.458 -18.794 568 3HE MET 72 3HE MET 72 6.445 17.582 -18.931 569 H THR 73 H THR 73 4.969 18.395 -11.864 570 HA THR 73 HA THR 73 6.362 16.664 -10.128 571 HB THR 73 HB THR 73 4.482 18.911 -9.295 572 HG1 THR 73 HG1 THR 73 5.991 19.634 -10.837 573 1HG2 THR 73 1HG2 THR 73 6.997 17.753 -8.011 574 2HG2 THR 73 2HG2 THR 73 6.097 19.169 -7.438 575 3HG2 THR 73 3HG2 THR 73 5.337 17.567 -7.391 576 H ALA 74 H ALA 74 2.839 17.068 -10.630 577 HA ALA 74 HA ALA 74 2.077 15.276 -8.495 578 1HB ALA 74 1HB ALA 74 0.525 16.145 -10.967 579 2HB ALA 74 2HB ALA 74 -0.137 15.367 -9.517 580 3HB ALA 74 3HB ALA 74 0.565 16.994 -9.407 581 H LYS 75 H LYS 75 2.582 14.864 -12.032 582 HA LYS 75 HA LYS 75 1.669 12.159 -12.133 583 1HB LYS 75 1HB LYS 75 3.551 13.744 -13.907 584 2HB LYS 75 2HB LYS 75 3.053 12.080 -14.262 585 1HG LYS 75 1HG LYS 75 0.659 12.787 -14.201 586 2HG LYS 75 2HG LYS 75 1.173 14.465 -14.033 587 1HD LYS 75 1HD LYS 75 1.777 12.578 -16.362 588 2HD LYS 75 2HD LYS 75 0.639 13.934 -16.365 589 1HE LYS 75 1HE LYS 75 2.607 15.487 -15.911 590 2HE LYS 75 2HE LYS 75 3.683 14.094 -16.125 591 1HZ LYS 75 1HZ LYS 75 1.858 15.157 -18.153 592 2HZ LYS 75 2HZ LYS 75 3.495 15.339 -18.095 593 3HZ LYS 75 3HZ LYS 75 2.842 13.844 -18.331 594 H MET 76 H MET 76 5.006 13.484 -11.720 595 HA MET 76 HA MET 76 6.285 11.027 -12.098 596 1HB MET 76 1HB MET 76 8.240 11.953 -11.121 597 2HB MET 76 2HB MET 76 7.433 13.218 -12.060 598 1HG MET 76 1HG MET 76 6.455 14.107 -9.955 599 2HG MET 76 2HG MET 76 7.350 12.908 -9.019 600 1HE MET 76 1HE MET 76 11.064 14.084 -9.572 601 2HE MET 76 2HE MET 76 10.014 12.816 -8.900 602 3HE MET 76 3HE MET 76 10.216 12.979 -10.665 Start of MODEL 8 1 H ARG 1 H ARG 1 14.502 21.028 -6.717 2 HA ARG 1 HA ARG 1 16.788 19.204 -6.800 3 1HB ARG 1 1HB ARG 1 17.237 21.128 -5.446 4 2HB ARG 1 2HB ARG 1 15.649 21.057 -4.688 5 1HG ARG 1 1HG ARG 1 17.323 20.369 -3.135 6 2HG ARG 1 2HG ARG 1 16.274 18.997 -3.461 7 1HD ARG 1 1HD ARG 1 18.982 19.443 -4.800 8 2HD ARG 1 2HD ARG 1 18.743 18.525 -3.295 9 HE ARG 1 HE ARG 1 16.981 17.403 -5.160 10 1HH1 ARG 1 1HH1 ARG 1 20.472 17.719 -4.745 11 2HH1 ARG 1 2HH1 ARG 1 20.838 16.237 -5.587 12 1HH2 ARG 1 1HH2 ARG 1 17.415 15.510 -6.223 13 2HH2 ARG 1 2HH2 ARG 1 19.050 14.930 -6.434 14 H VAL 2 H VAL 2 13.690 19.775 -5.052 15 HA VAL 2 HA VAL 2 13.754 17.146 -3.909 16 HB VAL 2 HB VAL 2 11.514 19.202 -3.943 17 1HG1 VAL 2 1HG1 VAL 2 12.052 16.809 -2.119 18 2HG1 VAL 2 2HG1 VAL 2 10.779 18.023 -1.884 19 3HG1 VAL 2 3HG1 VAL 2 10.716 16.945 -3.282 20 1HG2 VAL 2 1HG2 VAL 2 13.573 20.155 -2.961 21 2HG2 VAL 2 2HG2 VAL 2 12.423 19.773 -1.678 22 3HG2 VAL 2 3HG2 VAL 2 13.804 18.697 -1.980 23 H GLY 3 H GLY 3 13.946 15.829 -5.770 24 1HA GLY 3 1HA GLY 3 12.935 14.080 -6.963 25 2HA GLY 3 2HA GLY 3 11.336 14.815 -6.747 26 H LEU 4 H LEU 4 11.298 17.177 -7.766 27 HA LEU 4 HA LEU 4 12.059 16.976 -10.611 28 1HB LEU 4 1HB LEU 4 10.856 19.283 -9.043 29 2HB LEU 4 2HB LEU 4 11.132 19.226 -10.789 30 HG LEU 4 HG LEU 4 9.190 17.519 -9.175 31 1HD1 LEU 4 1HD1 LEU 4 8.460 19.815 -9.699 32 2HD1 LEU 4 2HD1 LEU 4 8.828 19.553 -11.419 33 3HD1 LEU 4 3HD1 LEU 4 7.530 18.631 -10.639 34 1HD2 LEU 4 1HD2 LEU 4 9.950 17.297 -12.120 35 2HD2 LEU 4 2HD2 LEU 4 10.064 16.023 -10.882 36 3HD2 LEU 4 3HD2 LEU 4 8.481 16.592 -11.412 37 H THR 5 H THR 5 14.293 16.614 -10.325 38 HA THR 5 HA THR 5 16.101 18.408 -9.050 39 HB THR 5 HB THR 5 17.769 17.317 -10.570 40 HG1 THR 5 HG1 THR 5 16.805 15.667 -12.003 41 1HG2 THR 5 1HG2 THR 5 15.779 15.283 -9.467 42 2HG2 THR 5 2HG2 THR 5 17.504 15.043 -9.782 43 3HG2 THR 5 3HG2 THR 5 16.985 16.152 -8.499 44 H GLU 6 H GLU 6 17.734 19.784 -10.316 45 HA GLU 6 HA GLU 6 16.458 21.740 -11.964 46 1HB GLU 6 1HB GLU 6 19.392 21.016 -11.546 47 2HB GLU 6 2HB GLU 6 18.840 22.374 -12.532 48 1HG GLU 6 1HG GLU 6 19.435 23.118 -10.262 49 2HG GLU 6 2HG GLU 6 17.736 23.425 -10.638 50 H GLU 7 H GLU 7 18.288 18.780 -12.741 51 HA GLU 7 HA GLU 7 18.248 18.880 -15.540 52 1HB GLU 7 1HB GLU 7 19.604 17.345 -14.482 53 2HB GLU 7 2HB GLU 7 18.370 16.769 -13.373 54 1HG GLU 7 1HG GLU 7 18.119 16.296 -16.341 55 2HG GLU 7 2HG GLU 7 19.159 15.283 -15.321 56 H GLN 8 H GLN 8 15.760 17.414 -13.286 57 HA GLN 8 HA GLN 8 13.935 16.792 -15.377 58 1HB GLN 8 1HB GLN 8 13.518 17.460 -12.453 59 2HB GLN 8 2HB GLN 8 12.179 17.017 -13.508 60 1HG GLN 8 1HG GLN 8 14.599 15.206 -13.115 61 2HG GLN 8 2HG GLN 8 13.138 15.132 -12.128 62 1HE2 GLN 8 1HE2 GLN 8 14.501 14.407 -15.323 63 2HE2 GLN 8 2HE2 GLN 8 13.076 13.552 -15.888 64 H LYS 9 H LYS 9 14.182 19.804 -13.396 65 HA LYS 9 HA LYS 9 11.961 21.065 -14.648 66 1HB LYS 9 1HB LYS 9 14.371 22.239 -13.236 67 2HB LYS 9 2HB LYS 9 12.985 23.187 -13.810 68 1HG LYS 9 1HG LYS 9 11.450 21.686 -12.501 69 2HG LYS 9 2HG LYS 9 12.851 20.898 -11.787 70 1HD LYS 9 1HD LYS 9 12.102 23.859 -11.566 71 2HD LYS 9 2HD LYS 9 11.845 22.630 -10.323 72 1HE LYS 9 1HE LYS 9 14.546 23.631 -11.334 73 2HE LYS 9 2HE LYS 9 13.799 23.962 -9.766 74 1HZ LYS 9 1HZ LYS 9 15.393 22.234 -9.563 75 2HZ LYS 9 2HZ LYS 9 13.895 21.584 -9.316 76 3HZ LYS 9 3HZ LYS 9 14.665 21.338 -10.742 77 H GLN 10 H GLN 10 15.418 21.022 -15.616 78 HA GLN 10 HA GLN 10 15.156 22.735 -17.874 79 1HB GLN 10 1HB GLN 10 17.006 20.457 -17.119 80 2HB GLN 10 2HB GLN 10 17.030 21.032 -18.769 81 1HG GLN 10 1HG GLN 10 17.479 22.735 -16.286 82 2HG GLN 10 2HG GLN 10 18.739 22.123 -17.365 83 1HE2 GLN 10 1HE2 GLN 10 17.395 22.641 -19.954 84 2HE2 GLN 10 2HE2 GLN 10 17.376 24.388 -20.074 85 H GLU 11 H GLU 11 14.838 19.137 -17.713 86 HA GLU 11 HA GLU 11 14.066 18.812 -20.418 87 1HB GLU 11 1HB GLU 11 13.194 17.203 -17.973 88 2HB GLU 11 2HB GLU 11 12.961 16.708 -19.651 89 1HG GLU 11 1HG GLU 11 15.664 17.163 -18.305 90 2HG GLU 11 2HG GLU 11 14.921 15.605 -18.653 91 H ILE 12 H ILE 12 12.000 19.389 -17.561 92 HA ILE 12 HA ILE 12 9.508 19.339 -18.907 93 HB ILE 12 HB ILE 12 10.420 20.688 -16.350 94 1HG1 ILE 12 1HG1 ILE 12 8.664 18.223 -16.783 95 2HG1 ILE 12 2HG1 ILE 12 10.405 18.106 -16.619 96 1HG2 ILE 12 1HG2 ILE 12 7.565 20.311 -17.333 97 2HG2 ILE 12 2HG2 ILE 12 8.040 20.943 -15.746 98 3HG2 ILE 12 3HG2 ILE 12 8.392 21.870 -17.193 99 1HD1 ILE 12 1HD1 ILE 12 9.397 17.638 -14.495 100 2HD1 ILE 12 2HD1 ILE 12 10.295 19.163 -14.376 101 3HD1 ILE 12 3HD1 ILE 12 8.520 19.174 -14.482 102 H ARG 13 H ARG 13 11.688 22.133 -18.220 103 HA ARG 13 HA ARG 13 10.048 24.113 -19.437 104 1HB ARG 13 1HB ARG 13 11.885 24.722 -17.992 105 2HB ARG 13 2HB ARG 13 13.055 23.930 -19.048 106 1HG ARG 13 1HG ARG 13 13.117 26.364 -19.283 107 2HG ARG 13 2HG ARG 13 12.724 25.573 -20.805 108 1HD ARG 13 1HD ARG 13 11.333 27.586 -20.481 109 2HD ARG 13 2HD ARG 13 10.340 26.152 -20.539 110 HE ARG 13 HE ARG 13 9.689 26.445 -18.367 111 1HH1 ARG 13 1HH1 ARG 13 12.461 28.547 -18.971 112 2HH1 ARG 13 2HH1 ARG 13 12.298 29.423 -17.472 113 1HH2 ARG 13 1HH2 ARG 13 9.492 27.521 -16.420 114 2HH2 ARG 13 2HH2 ARG 13 10.560 28.828 -15.982 115 H GLU 14 H GLU 14 12.741 22.172 -20.812 116 HA GLU 14 HA GLU 14 12.655 23.249 -23.426 117 1HB GLU 14 1HB GLU 14 13.469 20.514 -22.370 118 2HB GLU 14 2HB GLU 14 13.755 21.035 -24.036 119 1HG GLU 14 1HG GLU 14 15.241 22.774 -23.380 120 2HG GLU 14 2HG GLU 14 14.725 22.729 -21.695 121 H ALA 15 H ALA 15 11.008 20.329 -22.130 122 HA ALA 15 HA ALA 15 9.547 19.645 -24.451 123 1HB ALA 15 1HB ALA 15 9.778 18.174 -22.494 124 2HB ALA 15 2HB ALA 15 8.784 19.278 -21.520 125 3HB ALA 15 3HB ALA 15 8.069 18.424 -22.904 126 H PHE 16 H PHE 16 8.587 21.710 -21.676 127 HA PHE 16 HA PHE 16 6.022 22.431 -22.484 128 1HB PHE 16 1HB PHE 16 6.966 23.010 -20.294 129 2HB PHE 16 2HB PHE 16 8.109 24.109 -21.030 130 HD1 PHE 16 HD1 PHE 16 7.476 26.369 -21.677 131 HD2 PHE 16 HD2 PHE 16 4.515 23.554 -20.305 132 HE1 PHE 16 HE1 PHE 16 5.824 28.204 -21.456 133 HE2 PHE 16 HE2 PHE 16 2.886 25.404 -20.028 134 HZ PHE 16 HZ PHE 16 3.539 27.729 -20.617 135 H ASP 17 H ASP 17 9.068 24.212 -23.114 136 HA ASP 17 HA ASP 17 8.036 26.232 -24.770 137 1HB ASP 17 1HB ASP 17 10.776 24.882 -24.869 138 2HB ASP 17 2HB ASP 17 10.357 26.401 -25.671 139 H LEU 18 H LEU 18 9.413 23.038 -25.738 140 HA LEU 18 HA LEU 18 9.039 23.384 -28.513 141 1HB LEU 18 1HB LEU 18 10.404 21.620 -27.613 142 2HB LEU 18 2HB LEU 18 9.020 20.831 -26.852 143 HG LEU 18 HG LEU 18 8.657 21.325 -29.775 144 1HD1 LEU 18 1HD1 LEU 18 10.812 19.395 -28.881 145 2HD1 LEU 18 2HD1 LEU 18 10.129 19.555 -30.520 146 3HD1 LEU 18 3HD1 LEU 18 11.042 20.900 -29.812 147 1HD2 LEU 18 1HD2 LEU 18 7.115 19.899 -28.435 148 2HD2 LEU 18 2HD2 LEU 18 7.891 18.982 -29.729 149 3HD2 LEU 18 3HD2 LEU 18 8.459 18.805 -28.057 150 H PHE 19 H PHE 19 6.795 21.817 -26.137 151 HA PHE 19 HA PHE 19 4.774 21.271 -28.065 152 1HB PHE 19 1HB PHE 19 4.492 21.907 -25.100 153 2HB PHE 19 2HB PHE 19 3.246 21.157 -26.096 154 HD1 PHE 19 HD1 PHE 19 4.694 20.210 -23.452 155 HD2 PHE 19 HD2 PHE 19 4.938 19.114 -27.619 156 HE1 PHE 19 HE1 PHE 19 5.146 17.856 -22.826 157 HE2 PHE 19 HE2 PHE 19 5.560 16.825 -26.985 158 HZ PHE 19 HZ PHE 19 5.686 16.177 -24.582 159 H ASP 20 H ASP 20 5.416 24.139 -26.086 160 HA ASP 20 HA ASP 20 2.902 25.392 -26.644 161 1HB ASP 20 1HB ASP 20 4.484 25.646 -24.585 162 2HB ASP 20 2HB ASP 20 5.447 26.697 -25.641 163 H THR 21 H THR 21 4.072 24.794 -29.108 164 HA THR 21 HA THR 21 5.751 26.490 -30.428 165 HB THR 21 HB THR 21 4.336 25.900 -32.471 166 HG1 THR 21 HG1 THR 21 2.813 24.456 -30.532 167 1HG2 THR 21 1HG2 THR 21 4.866 23.552 -32.444 168 2HG2 THR 21 2HG2 THR 21 6.158 24.377 -31.551 169 3HG2 THR 21 3HG2 THR 21 4.887 23.497 -30.680 170 H ASP 22 H ASP 22 2.239 26.852 -30.554 171 HA ASP 22 HA ASP 22 2.547 29.588 -31.702 172 1HB ASP 22 1HB ASP 22 1.091 27.938 -32.819 173 2HB ASP 22 2HB ASP 22 0.096 27.815 -31.356 174 H GLY 23 H GLY 23 1.502 27.998 -28.732 175 1HA GLY 23 1HA GLY 23 0.051 30.237 -27.638 176 2HA GLY 23 2HA GLY 23 0.689 28.861 -26.748 177 H SER 24 H SER 24 3.461 29.124 -27.463 178 HA SER 24 HA SER 24 5.348 30.105 -26.632 179 1HB SER 24 1HB SER 24 4.019 32.199 -28.382 180 2HB SER 24 2HB SER 24 5.622 32.415 -27.669 181 HG SER 24 HG SER 24 4.918 30.199 -29.344 182 H GLY 25 H GLY 25 4.070 29.954 -24.473 183 1HA GLY 25 1HA GLY 25 4.869 31.743 -22.604 184 2HA GLY 25 2HA GLY 25 3.376 32.501 -23.205 185 H THR 26 H THR 26 1.710 30.468 -23.768 186 HA THR 26 HA THR 26 1.536 28.717 -21.372 187 HB THR 26 HB THR 26 -0.733 29.313 -20.943 188 HG1 THR 26 HG1 THR 26 -1.806 30.803 -22.062 189 1HG2 THR 26 1HG2 THR 26 -0.491 31.469 -19.942 190 2HG2 THR 26 2HG2 THR 26 1.082 30.661 -19.803 191 3HG2 THR 26 3HG2 THR 26 0.833 31.915 -21.031 192 H ILE 27 H ILE 27 0.850 26.693 -21.846 193 HA ILE 27 HA ILE 27 0.643 25.973 -24.670 194 HB ILE 27 HB ILE 27 0.568 24.438 -22.059 195 1HG1 ILE 27 1HG1 ILE 27 2.478 24.514 -24.430 196 2HG1 ILE 27 2HG1 ILE 27 2.735 25.323 -22.875 197 1HG2 ILE 27 1HG2 ILE 27 0.471 23.170 -24.818 198 2HG2 ILE 27 2HG2 ILE 27 0.465 22.348 -23.256 199 3HG2 ILE 27 3HG2 ILE 27 -0.941 23.261 -23.739 200 1HD1 ILE 27 1HD1 ILE 27 2.668 22.326 -23.423 201 2HD1 ILE 27 2HD1 ILE 27 4.019 23.321 -22.885 202 3HD1 ILE 27 3HD1 ILE 27 2.651 23.027 -21.786 203 H ASP 28 H ASP 28 -1.227 26.350 -25.756 204 HA ASP 28 HA ASP 28 -3.828 26.533 -24.532 205 1HB ASP 28 1HB ASP 28 -3.270 27.534 -26.720 206 2HB ASP 28 2HB ASP 28 -3.062 25.914 -27.410 207 H ALA 29 H ALA 29 -5.453 24.985 -24.293 208 HA ALA 29 HA ALA 29 -5.139 22.371 -23.754 209 1HB ALA 29 1HB ALA 29 -7.415 23.563 -25.393 210 2HB ALA 29 2HB ALA 29 -7.478 22.025 -24.506 211 3HB ALA 29 3HB ALA 29 -7.279 23.551 -23.621 212 H LYS 30 H LYS 30 -5.536 23.556 -27.140 213 HA LYS 30 HA LYS 30 -5.478 21.003 -28.408 214 1HB LYS 30 1HB LYS 30 -4.600 23.741 -29.413 215 2HB LYS 30 2HB LYS 30 -4.821 22.307 -30.425 216 1HG LYS 30 1HG LYS 30 -7.199 22.187 -29.832 217 2HG LYS 30 2HG LYS 30 -7.034 23.577 -28.743 218 1HD LYS 30 1HD LYS 30 -6.323 24.998 -30.652 219 2HD LYS 30 2HD LYS 30 -6.532 23.618 -31.752 220 1HE LYS 30 1HE LYS 30 -8.944 23.500 -31.128 221 2HE LYS 30 2HE LYS 30 -8.726 24.882 -30.037 222 1HZ LYS 30 1HZ LYS 30 -8.317 24.916 -32.944 223 2HZ LYS 30 2HZ LYS 30 -9.608 25.546 -32.137 224 3HZ LYS 30 3HZ LYS 30 -8.109 26.199 -31.930 225 H GLU 31 H GLU 31 -2.832 23.245 -27.491 226 HA GLU 31 HA GLU 31 -0.728 21.719 -28.779 227 1HB GLU 31 1HB GLU 31 -0.698 23.830 -26.595 228 2HB GLU 31 2HB GLU 31 0.755 23.096 -27.293 229 1HG GLU 31 1HG GLU 31 0.248 23.975 -29.486 230 2HG GLU 31 2HG GLU 31 -1.335 24.571 -28.953 231 H LEU 32 H LEU 32 -2.230 21.794 -25.507 232 HA LEU 32 HA LEU 32 -0.443 19.842 -24.422 233 1HB LEU 32 1HB LEU 32 -2.261 21.318 -23.173 234 2HB LEU 32 2HB LEU 32 -3.313 19.933 -23.522 235 HG LEU 32 HG LEU 32 -1.458 18.466 -22.457 236 1HD1 LEU 32 1HD1 LEU 32 0.408 20.059 -22.390 237 2HD1 LEU 32 2HD1 LEU 32 -0.555 21.161 -21.375 238 3HD1 LEU 32 3HD1 LEU 32 -0.053 19.575 -20.763 239 1HD2 LEU 32 1HD2 LEU 32 -2.313 18.929 -20.180 240 2HD2 LEU 32 2HD2 LEU 32 -3.008 20.458 -20.757 241 3HD2 LEU 32 3HD2 LEU 32 -3.616 18.906 -21.377 242 H LYS 33 H LYS 33 -3.576 19.491 -26.157 243 HA LYS 33 HA LYS 33 -3.734 16.658 -25.998 244 1HB LYS 33 1HB LYS 33 -5.560 18.094 -26.667 245 2HB LYS 33 2HB LYS 33 -4.731 18.506 -28.184 246 1HG LYS 33 1HG LYS 33 -4.796 16.103 -28.846 247 2HG LYS 33 2HG LYS 33 -5.661 15.726 -27.340 248 1HD LYS 33 1HD LYS 33 -7.486 17.292 -28.015 249 2HD LYS 33 2HD LYS 33 -6.636 17.630 -29.530 250 1HE LYS 33 1HE LYS 33 -7.701 14.903 -28.645 251 2HE LYS 33 2HE LYS 33 -8.464 15.981 -29.822 252 1HZ LYS 33 1HZ LYS 33 -5.823 14.734 -30.118 253 2HZ LYS 33 2HZ LYS 33 -7.203 14.294 -30.900 254 3HZ LYS 33 3HZ LYS 33 -6.522 15.764 -31.199 255 H VAL 34 H VAL 34 -2.162 18.724 -28.501 256 HA VAL 34 HA VAL 34 -1.070 16.592 -30.034 257 HB VAL 34 HB VAL 34 -0.084 19.427 -29.519 258 1HG1 VAL 34 1HG1 VAL 34 1.356 19.113 -31.535 259 2HG1 VAL 34 2HG1 VAL 34 1.899 18.146 -30.162 260 3HG1 VAL 34 3HG1 VAL 34 1.004 17.373 -31.490 261 1HG2 VAL 34 1HG2 VAL 34 -2.246 19.155 -30.771 262 2HG2 VAL 34 2HG2 VAL 34 -0.959 19.835 -31.776 263 3HG2 VAL 34 3HG2 VAL 34 -1.407 18.126 -31.943 264 H ALA 35 H ALA 35 0.331 18.314 -27.190 265 HA ALA 35 HA ALA 35 2.736 16.883 -27.017 266 1HB ALA 35 1HB ALA 35 1.023 17.926 -24.711 267 2HB ALA 35 2HB ALA 35 2.718 17.485 -24.635 268 3HB ALA 35 3HB ALA 35 2.205 18.862 -25.638 269 H MET 36 H MET 36 -0.429 16.098 -25.523 270 HA MET 36 HA MET 36 0.401 13.656 -24.322 271 1HB MET 36 1HB MET 36 -2.277 14.837 -25.033 272 2HB MET 36 2HB MET 36 -2.137 13.246 -24.281 273 1HG MET 36 1HG MET 36 -0.762 14.164 -22.457 274 2HG MET 36 2HG MET 36 -0.923 15.784 -23.129 275 1HE MET 36 1HE MET 36 -4.609 16.660 -22.465 276 2HE MET 36 2HE MET 36 -3.052 17.121 -23.183 277 3HE MET 36 3HE MET 36 -4.031 15.865 -23.950 278 H ARG 37 H ARG 37 -0.986 14.255 -27.589 279 HA ARG 37 HA ARG 37 -0.908 11.485 -28.349 280 1HB ARG 37 1HB ARG 37 -0.623 14.031 -29.990 281 2HB ARG 37 2HB ARG 37 -0.644 12.423 -30.702 282 1HG ARG 37 1HG ARG 37 -2.890 13.610 -29.002 283 2HG ARG 37 2HG ARG 37 -2.856 13.550 -30.767 284 1HD ARG 37 1HD ARG 37 -2.979 11.187 -28.858 285 2HD ARG 37 2HD ARG 37 -4.233 11.746 -29.954 286 HE ARG 37 HE ARG 37 -2.692 11.234 -31.846 287 1HH1 ARG 37 1HH1 ARG 37 -2.404 9.272 -28.818 288 2HH1 ARG 37 2HH1 ARG 37 -1.722 7.942 -29.686 289 1HH2 ARG 37 1HH2 ARG 37 -1.798 9.463 -32.858 290 2HH2 ARG 37 2HH2 ARG 37 -1.389 8.023 -31.968 291 H ALA 38 H ALA 38 1.653 14.013 -28.551 292 HA ALA 38 HA ALA 38 3.628 12.288 -29.660 293 1HB ALA 38 1HB ALA 38 5.259 13.894 -28.872 294 2HB ALA 38 2HB ALA 38 3.848 14.750 -29.529 295 3HB ALA 38 3HB ALA 38 4.085 14.633 -27.773 296 H LEU 39 H LEU 39 2.637 12.816 -26.279 297 HA LEU 39 HA LEU 39 4.557 10.968 -25.133 298 1HB LEU 39 1HB LEU 39 1.949 12.099 -24.074 299 2HB LEU 39 2HB LEU 39 3.087 11.174 -23.115 300 HG LEU 39 HG LEU 39 3.960 13.749 -24.480 301 1HD1 LEU 39 1HD1 LEU 39 2.036 14.393 -23.101 302 2HD1 LEU 39 2HD1 LEU 39 2.646 13.427 -21.746 303 3HD1 LEU 39 3HD1 LEU 39 3.521 14.875 -22.289 304 1HD2 LEU 39 1HD2 LEU 39 4.966 12.245 -22.029 305 2HD2 LEU 39 2HD2 LEU 39 5.736 12.252 -23.631 306 3HD2 LEU 39 3HD2 LEU 39 5.642 13.747 -22.690 307 H GLY 40 H GLY 40 2.007 10.274 -27.199 308 1HA GLY 40 1HA GLY 40 1.254 8.240 -27.865 309 2HA GLY 40 2HA GLY 40 2.141 7.458 -26.551 310 H PHE 41 H PHE 41 -0.082 10.068 -25.748 311 HA PHE 41 HA PHE 41 -1.764 8.246 -24.177 312 1HB PHE 41 1HB PHE 41 -1.893 11.192 -24.846 313 2HB PHE 41 2HB PHE 41 -3.129 10.399 -23.913 314 HD1 PHE 41 HD1 PHE 41 0.491 9.548 -23.316 315 HD2 PHE 41 HD2 PHE 41 -2.919 11.897 -22.051 316 HE1 PHE 41 HE1 PHE 41 1.665 10.155 -21.255 317 HE2 PHE 41 HE2 PHE 41 -1.728 12.475 -19.966 318 HZ PHE 41 HZ PHE 41 0.577 11.624 -19.566 319 H GLU 42 H GLU 42 -4.070 8.143 -24.442 320 HA GLU 42 HA GLU 42 -5.132 8.487 -27.217 321 1HB GLU 42 1HB GLU 42 -5.172 6.179 -26.330 322 2HB GLU 42 2HB GLU 42 -6.107 6.732 -24.929 323 1HG GLU 42 1HG GLU 42 -7.923 7.495 -26.477 324 2HG GLU 42 2HG GLU 42 -6.974 6.904 -27.853 325 HA PRO 43 HA PRO 43 -6.822 12.037 -24.881 326 1HB PRO 43 1HB PRO 43 -8.038 12.407 -27.636 327 2HB PRO 43 2HB PRO 43 -7.482 13.661 -26.484 328 1HG PRO 43 1HG PRO 43 -5.850 12.867 -28.483 329 2HG PRO 43 2HG PRO 43 -5.182 13.009 -26.830 330 1HD PRO 43 1HD PRO 43 -6.053 10.491 -28.284 331 2HD PRO 43 2HD PRO 43 -4.629 10.793 -27.230 332 H LYS 44 H LYS 44 -8.024 10.265 -23.716 333 HA LYS 44 HA LYS 44 -10.802 9.760 -24.222 334 1HB LYS 44 1HB LYS 44 -9.103 9.873 -21.696 335 2HB LYS 44 2HB LYS 44 -10.784 9.364 -21.691 336 1HG LYS 44 1HG LYS 44 -8.492 8.013 -23.185 337 2HG LYS 44 2HG LYS 44 -9.229 7.464 -21.688 338 1HD LYS 44 1HD LYS 44 -10.478 7.525 -24.468 339 2HD LYS 44 2HD LYS 44 -10.084 6.124 -23.487 340 1HE LYS 44 1HE LYS 44 -12.306 8.153 -22.946 341 2HE LYS 44 2HE LYS 44 -12.482 6.468 -23.439 342 1HZ LYS 44 1HZ LYS 44 -12.841 6.725 -21.115 343 2HZ LYS 44 2HZ LYS 44 -11.483 5.821 -21.357 344 3HZ LYS 44 3HZ LYS 44 -11.357 7.399 -20.893 345 H LYS 45 H LYS 45 -11.323 11.851 -25.053 346 HA LYS 45 HA LYS 45 -11.176 14.270 -24.351 347 1HB LYS 45 1HB LYS 45 -13.442 14.792 -25.165 348 2HB LYS 45 2HB LYS 45 -12.534 13.639 -26.145 349 1HG LYS 45 1HG LYS 45 -13.856 11.755 -25.049 350 2HG LYS 45 2HG LYS 45 -14.811 12.993 -24.222 351 1HD LYS 45 1HD LYS 45 -16.061 12.301 -26.102 352 2HD LYS 45 2HD LYS 45 -15.481 13.938 -26.441 353 1HE LYS 45 1HE LYS 45 -13.715 13.020 -27.922 354 2HE LYS 45 2HE LYS 45 -14.170 11.366 -27.469 355 1HZ LYS 45 1HZ LYS 45 -15.874 13.295 -28.879 356 2HZ LYS 45 2HZ LYS 45 -15.089 12.016 -29.558 357 3HZ LYS 45 3HZ LYS 45 -16.299 11.755 -28.472 358 H GLU 46 H GLU 46 -13.639 12.406 -22.468 359 HA GLU 46 HA GLU 46 -14.334 14.650 -20.845 360 1HB GLU 46 1HB GLU 46 -15.585 13.164 -19.520 361 2HB GLU 46 2HB GLU 46 -15.770 12.666 -21.198 362 1HG GLU 46 1HG GLU 46 -14.114 11.300 -19.027 363 2HG GLU 46 2HG GLU 46 -15.615 10.731 -19.745 364 H GLU 47 H GLU 47 -11.906 12.082 -20.455 365 HA GLU 47 HA GLU 47 -11.174 12.788 -17.736 366 1HB GLU 47 1HB GLU 47 -10.875 10.515 -18.760 367 2HB GLU 47 2HB GLU 47 -9.647 11.198 -19.840 368 1HG GLU 47 1HG GLU 47 -8.252 11.815 -17.894 369 2HG GLU 47 2HG GLU 47 -9.509 11.219 -16.796 370 H ILE 48 H ILE 48 -9.981 13.439 -21.041 371 HA ILE 48 HA ILE 48 -7.745 15.075 -20.363 372 HB ILE 48 HB ILE 48 -9.614 15.111 -22.756 373 1HG1 ILE 48 1HG1 ILE 48 -8.197 13.027 -22.330 374 2HG1 ILE 48 2HG1 ILE 48 -8.059 13.812 -23.902 375 1HG2 ILE 48 1HG2 ILE 48 -8.651 17.285 -22.730 376 2HG2 ILE 48 2HG2 ILE 48 -7.046 16.657 -22.303 377 3HG2 ILE 48 3HG2 ILE 48 -7.739 16.349 -23.915 378 1HD1 ILE 48 1HD1 ILE 48 -5.864 13.076 -22.926 379 2HD1 ILE 48 2HD1 ILE 48 -5.938 14.794 -23.334 380 3HD1 ILE 48 3HD1 ILE 48 -6.063 14.275 -21.638 381 H LYS 49 H LYS 49 -11.205 15.998 -20.910 382 HA LYS 49 HA LYS 49 -10.794 18.752 -20.379 383 1HB LYS 49 1HB LYS 49 -13.225 16.966 -20.042 384 2HB LYS 49 2HB LYS 49 -13.295 18.709 -19.796 385 1HG LYS 49 1HG LYS 49 -12.108 17.749 -22.403 386 2HG LYS 49 2HG LYS 49 -13.826 17.495 -22.147 387 1HD LYS 49 1HD LYS 49 -13.505 19.592 -23.310 388 2HD LYS 49 2HD LYS 49 -14.218 19.865 -21.721 389 1HE LYS 49 1HE LYS 49 -12.536 21.566 -22.225 390 2HE LYS 49 2HE LYS 49 -12.021 20.608 -20.838 391 1HZ LYS 49 1HZ LYS 49 -10.246 20.961 -22.383 392 2HZ LYS 49 2HZ LYS 49 -10.613 19.355 -22.359 393 3HZ LYS 49 3HZ LYS 49 -11.104 20.293 -23.621 394 H LYS 50 H LYS 50 -11.746 16.113 -18.111 395 HA LYS 50 HA LYS 50 -11.866 17.744 -15.795 396 1HB LYS 50 1HB LYS 50 -11.084 14.826 -16.146 397 2HB LYS 50 2HB LYS 50 -11.294 15.582 -14.566 398 1HG LYS 50 1HG LYS 50 -13.497 15.543 -16.677 399 2HG LYS 50 2HG LYS 50 -13.270 14.271 -15.471 400 1HD LYS 50 1HD LYS 50 -13.505 15.970 -13.649 401 2HD LYS 50 2HD LYS 50 -13.834 17.214 -14.871 402 1HE LYS 50 1HE LYS 50 -15.803 15.922 -15.664 403 2HE LYS 50 2HE LYS 50 -15.485 14.685 -14.431 404 1HZ LYS 50 1HZ LYS 50 -17.142 16.226 -13.722 405 2HZ LYS 50 2HZ LYS 50 -15.811 16.359 -12.760 406 3HZ LYS 50 3HZ LYS 50 -16.117 17.504 -13.905 407 H MET 51 H MET 51 -9.053 15.845 -17.006 408 HA MET 51 HA MET 51 -7.100 16.616 -15.206 409 1HB MET 51 1HB MET 51 -6.787 14.885 -16.859 410 2HB MET 51 2HB MET 51 -7.054 16.012 -18.192 411 1HG MET 51 1HG MET 51 -4.998 17.219 -17.619 412 2HG MET 51 2HG MET 51 -4.700 16.066 -16.301 413 1HE MET 51 1HE MET 51 -2.714 16.914 -18.752 414 2HE MET 51 2HE MET 51 -2.252 15.837 -17.403 415 3HE MET 51 3HE MET 51 -1.979 15.330 -19.087 416 H ILE 52 H ILE 52 -7.747 18.173 -18.397 417 HA ILE 52 HA ILE 52 -5.969 20.315 -18.079 418 HB ILE 52 HB ILE 52 -8.537 20.012 -19.678 419 1HG1 ILE 52 1HG1 ILE 52 -5.576 20.162 -20.442 420 2HG1 ILE 52 2HG1 ILE 52 -6.488 18.663 -20.261 421 1HG2 ILE 52 1HG2 ILE 52 -7.969 22.073 -20.909 422 2HG2 ILE 52 2HG2 ILE 52 -8.295 22.442 -19.230 423 3HG2 ILE 52 3HG2 ILE 52 -6.615 22.375 -19.803 424 1HD1 ILE 52 1HD1 ILE 52 -8.046 19.487 -22.087 425 2HD1 ILE 52 2HD1 ILE 52 -6.888 20.806 -22.377 426 3HD1 ILE 52 3HD1 ILE 52 -6.379 19.130 -22.593 427 H SER 53 H SER 53 -9.452 20.172 -17.123 428 HA SER 53 HA SER 53 -9.533 22.841 -16.160 429 1HB SER 53 1HB SER 53 -11.123 20.440 -15.136 430 2HB SER 53 2HB SER 53 -11.533 22.155 -14.939 431 HG SER 53 HG SER 53 -11.388 20.664 -17.356 432 H GLU 54 H GLU 54 -8.775 19.800 -14.391 433 HA GLU 54 HA GLU 54 -8.421 20.987 -11.834 434 1HB GLU 54 1HB GLU 54 -7.214 18.503 -13.113 435 2HB GLU 54 2HB GLU 54 -6.969 18.945 -11.417 436 1HG GLU 54 1HG GLU 54 -9.346 18.826 -10.949 437 2HG GLU 54 2HG GLU 54 -9.735 18.565 -12.650 438 H ILE 55 H ILE 55 -6.068 20.469 -14.503 439 HA ILE 55 HA ILE 55 -3.871 21.641 -12.984 440 HB ILE 55 HB ILE 55 -4.189 21.126 -15.965 441 1HG1 ILE 55 1HG1 ILE 55 -4.330 19.001 -14.870 442 2HG1 ILE 55 2HG1 ILE 55 -2.715 19.154 -15.519 443 1HG2 ILE 55 1HG2 ILE 55 -1.708 21.762 -14.323 444 2HG2 ILE 55 2HG2 ILE 55 -1.701 21.202 -16.014 445 3HG2 ILE 55 3HG2 ILE 55 -2.427 22.749 -15.605 446 1HD1 ILE 55 1HD1 ILE 55 -1.945 19.802 -13.158 447 2HD1 ILE 55 2HD1 ILE 55 -3.589 19.415 -12.605 448 3HD1 ILE 55 3HD1 ILE 55 -2.586 18.157 -13.328 449 H ASP 56 H ASP 56 -6.338 22.944 -15.196 450 HA ASP 56 HA ASP 56 -4.970 25.462 -15.574 451 1HB ASP 56 1HB ASP 56 -6.459 24.465 -17.262 452 2HB ASP 56 2HB ASP 56 -7.834 24.628 -16.154 453 H LYS 57 H LYS 57 -4.633 25.703 -13.202 454 HA LYS 57 HA LYS 57 -6.648 26.457 -11.370 455 1HB LYS 57 1HB LYS 57 -3.903 27.764 -11.568 456 2HB LYS 57 2HB LYS 57 -4.924 27.590 -10.140 457 1HG LYS 57 1HG LYS 57 -3.377 25.410 -11.607 458 2HG LYS 57 2HG LYS 57 -3.108 26.043 -9.986 459 1HD LYS 57 1HD LYS 57 -5.348 25.129 -9.288 460 2HD LYS 57 2HD LYS 57 -5.521 24.412 -10.905 461 1HE LYS 57 1HE LYS 57 -3.410 23.140 -10.565 462 2HE LYS 57 2HE LYS 57 -3.292 23.790 -8.914 463 1HZ LYS 57 1HZ LYS 57 -5.463 22.141 -9.999 464 2HZ LYS 57 2HZ LYS 57 -4.291 21.632 -8.952 465 3HZ LYS 57 3HZ LYS 57 -5.411 22.740 -8.459 466 H ASP 58 H ASP 58 -4.918 28.411 -13.761 467 HA ASP 58 HA ASP 58 -6.927 30.614 -13.546 468 1HB ASP 58 1HB ASP 58 -5.149 31.082 -11.908 469 2HB ASP 58 2HB ASP 58 -3.919 30.916 -13.173 470 H GLY 59 H GLY 59 -4.464 28.940 -15.449 471 1HA GLY 59 1HA GLY 59 -3.930 30.813 -17.425 472 2HA GLY 59 2HA GLY 59 -3.823 29.070 -17.606 473 H SER 60 H SER 60 -6.960 29.185 -17.044 474 HA SER 60 HA SER 60 -8.906 29.264 -18.216 475 1HB SER 60 1HB SER 60 -7.710 31.904 -19.148 476 2HB SER 60 2HB SER 60 -9.424 31.459 -19.192 477 HG SER 60 HG SER 60 -7.786 31.666 -16.863 478 H GLY 61 H GLY 61 -7.977 27.401 -19.520 479 1HA GLY 61 1HA GLY 61 -8.392 26.412 -21.614 480 2HA GLY 61 2HA GLY 61 -8.384 27.989 -22.410 481 H THR 62 H THR 62 -5.779 28.622 -20.816 482 HA THR 62 HA THR 62 -3.925 26.896 -22.358 483 HB THR 62 HB THR 62 -2.348 28.633 -22.435 484 HG1 THR 62 HG1 THR 62 -4.135 30.129 -20.798 485 1HG2 THR 62 1HG2 THR 62 -3.421 30.324 -23.803 486 2HG2 THR 62 2HG2 THR 62 -4.163 28.758 -24.160 487 3HG2 THR 62 3HG2 THR 62 -5.018 29.933 -23.141 488 H ILE 63 H ILE 63 -1.964 26.345 -21.265 489 HA ILE 63 HA ILE 63 -2.193 26.129 -18.298 490 HB ILE 63 HB ILE 63 -0.846 24.298 -20.309 491 1HG1 ILE 63 1HG1 ILE 63 -3.245 24.069 -20.567 492 2HG1 ILE 63 2HG1 ILE 63 -2.548 22.648 -19.802 493 1HG2 ILE 63 1HG2 ILE 63 0.314 24.268 -18.177 494 2HG2 ILE 63 2HG2 ILE 63 -1.206 24.021 -17.306 495 3HG2 ILE 63 3HG2 ILE 63 -0.583 22.759 -18.388 496 1HD1 ILE 63 1HD1 ILE 63 -4.673 23.234 -18.761 497 2HD1 ILE 63 2HD1 ILE 63 -3.371 23.415 -17.586 498 3HD1 ILE 63 3HD1 ILE 63 -4.087 24.850 -18.350 499 H ASP 64 H ASP 64 -0.910 27.661 -17.463 500 HA ASP 64 HA ASP 64 1.454 28.733 -18.766 501 1HB ASP 64 1HB ASP 64 0.125 30.100 -17.213 502 2HB ASP 64 2HB ASP 64 0.385 28.928 -15.911 503 H PHE 65 H PHE 65 3.635 28.510 -18.001 504 HA PHE 65 HA PHE 65 4.614 25.961 -17.688 505 1HB PHE 65 1HB PHE 65 6.052 27.834 -18.222 506 2HB PHE 65 2HB PHE 65 5.792 28.551 -16.629 507 HD1 PHE 65 HD1 PHE 65 7.002 27.747 -14.681 508 HD2 PHE 65 HD2 PHE 65 7.122 25.510 -18.354 509 HE1 PHE 65 HE1 PHE 65 8.774 26.294 -13.735 510 HE2 PHE 65 HE2 PHE 65 8.942 24.090 -17.424 511 HZ PHE 65 HZ PHE 65 9.788 24.495 -15.129 512 H GLU 66 H GLU 66 3.722 28.180 -14.960 513 HA GLU 66 HA GLU 66 4.653 26.440 -12.898 514 1HB GLU 66 1HB GLU 66 2.392 28.493 -12.871 515 2HB GLU 66 2HB GLU 66 3.098 27.716 -11.444 516 1HG GLU 66 1HG GLU 66 5.326 28.651 -12.017 517 2HG GLU 66 2HG GLU 66 4.627 29.480 -13.416 518 H GLU 67 H GLU 67 1.542 26.600 -14.636 519 HA GLU 67 HA GLU 67 0.186 24.653 -12.976 520 1HB GLU 67 1HB GLU 67 -0.391 25.641 -15.795 521 2HB GLU 67 2HB GLU 67 -1.473 24.661 -14.801 522 1HG GLU 67 1HG GLU 67 -1.675 26.417 -13.134 523 2HG GLU 67 2HG GLU 67 -0.493 27.430 -13.972 524 H PHE 68 H PHE 68 2.024 24.563 -16.052 525 HA PHE 68 HA PHE 68 1.673 21.794 -16.624 526 1HB PHE 68 1HB PHE 68 2.582 23.548 -18.159 527 2HB PHE 68 2HB PHE 68 4.065 23.581 -17.224 528 HD1 PHE 68 HD1 PHE 68 1.848 21.303 -19.222 529 HD2 PHE 68 HD2 PHE 68 5.848 22.151 -17.842 530 HE1 PHE 68 HE1 PHE 68 2.766 19.712 -20.889 531 HE2 PHE 68 HE2 PHE 68 6.756 20.592 -19.547 532 HZ PHE 68 HZ PHE 68 5.227 19.370 -21.055 533 H LEU 69 H LEU 69 4.244 23.502 -14.787 534 HA LEU 69 HA LEU 69 5.698 21.214 -13.995 535 1HB LEU 69 1HB LEU 69 6.519 23.502 -13.885 536 2HB LEU 69 2HB LEU 69 5.399 23.901 -12.581 537 HG LEU 69 HG LEU 69 7.259 21.534 -12.227 538 1HD1 LEU 69 1HD1 LEU 69 9.040 23.032 -11.386 539 2HD1 LEU 69 2HD1 LEU 69 8.740 23.260 -13.116 540 3HD1 LEU 69 3HD1 LEU 69 8.112 24.442 -11.945 541 1HD2 LEU 69 1HD2 LEU 69 5.597 22.092 -10.430 542 2HD2 LEU 69 2HD2 LEU 69 7.258 22.298 -9.879 543 3HD2 LEU 69 3HD2 LEU 69 6.288 23.718 -10.319 544 H THR 70 H THR 70 2.879 22.867 -12.465 545 HA THR 70 HA THR 70 2.735 21.196 -10.182 546 HB THR 70 HB THR 70 0.388 22.455 -11.663 547 HG1 THR 70 HG1 THR 70 2.055 23.946 -11.060 548 1HG2 THR 70 1HG2 THR 70 -0.649 22.475 -9.429 549 2HG2 THR 70 2HG2 THR 70 -0.329 20.814 -9.960 550 3HG2 THR 70 3HG2 THR 70 0.737 21.588 -8.765 551 H MET 71 H MET 71 1.259 20.742 -13.452 552 HA MET 71 HA MET 71 0.060 18.233 -12.935 553 1HB MET 71 1HB MET 71 -0.325 19.647 -14.913 554 2HB MET 71 2HB MET 71 1.257 19.247 -15.553 555 1HG MET 71 1HG MET 71 -0.858 17.161 -14.919 556 2HG MET 71 2HG MET 71 -0.750 17.976 -16.477 557 1HE MET 71 1HE MET 71 1.138 17.685 -18.235 558 2HE MET 71 2HE MET 71 2.431 18.081 -17.074 559 3HE MET 71 3HE MET 71 2.524 16.591 -18.032 560 H MET 72 H MET 72 3.400 18.993 -14.056 561 HA MET 72 HA MET 72 4.271 16.282 -14.263 562 1HB MET 72 1HB MET 72 5.818 18.826 -13.619 563 2HB MET 72 2HB MET 72 6.574 17.261 -13.925 564 1HG MET 72 1HG MET 72 4.705 18.595 -15.922 565 2HG MET 72 2HG MET 72 6.451 18.820 -15.899 566 1HE MET 72 1HE MET 72 5.867 16.611 -19.067 567 2HE MET 72 2HE MET 72 4.806 17.891 -18.428 568 3HE MET 72 3HE MET 72 6.574 18.114 -18.435 569 H THR 73 H THR 73 4.346 18.539 -11.509 570 HA THR 73 HA THR 73 5.621 16.838 -9.641 571 HB THR 73 HB THR 73 3.500 18.946 -9.027 572 HG1 THR 73 HG1 THR 73 5.167 19.785 -10.351 573 1HG2 THR 73 1HG2 THR 73 4.171 17.575 -7.069 574 2HG2 THR 73 2HG2 THR 73 5.880 17.910 -7.425 575 3HG2 THR 73 3HG2 THR 73 4.795 19.230 -6.947 576 H ALA 74 H ALA 74 2.137 17.276 -10.413 577 HA ALA 74 HA ALA 74 1.140 15.449 -8.471 578 1HB ALA 74 1HB ALA 74 -0.253 17.123 -9.635 579 2HB ALA 74 2HB ALA 74 -0.052 16.239 -11.163 580 3HB ALA 74 3HB ALA 74 -0.914 15.485 -9.809 581 H LYS 75 H LYS 75 2.136 14.975 -11.889 582 HA LYS 75 HA LYS 75 1.407 12.207 -11.991 583 1HB LYS 75 1HB LYS 75 1.758 13.638 -13.972 584 2HB LYS 75 2HB LYS 75 3.493 13.733 -13.589 585 1HG LYS 75 1HG LYS 75 3.759 11.332 -13.944 586 2HG LYS 75 2HG LYS 75 2.012 11.114 -14.072 587 1HD LYS 75 1HD LYS 75 3.110 10.986 -16.243 588 2HD LYS 75 2HD LYS 75 1.948 12.314 -16.203 589 1HE LYS 75 1HE LYS 75 4.900 12.809 -15.618 590 2HE LYS 75 2HE LYS 75 4.322 12.663 -17.285 591 1HZ LYS 75 1HZ LYS 75 4.353 14.926 -16.542 592 2HZ LYS 75 2HZ LYS 75 2.829 14.439 -16.933 593 3HZ LYS 75 3HZ LYS 75 3.263 14.596 -15.357 594 H MET 76 H MET 76 4.516 13.856 -11.184 595 HA MET 76 HA MET 76 6.154 11.604 -11.156 596 1HB MET 76 1HB MET 76 6.847 13.986 -11.253 597 2HB MET 76 2HB MET 76 6.274 14.224 -9.601 598 1HG MET 76 1HG MET 76 8.664 14.003 -9.655 599 2HG MET 76 2HG MET 76 7.934 12.675 -8.754 600 1HE MET 76 1HE MET 76 8.275 12.964 -12.741 601 2HE MET 76 2HE MET 76 9.876 12.224 -12.941 602 3HE MET 76 3HE MET 76 9.721 13.767 -12.074 Start of MODEL 9 1 H ARG 1 H ARG 1 10.213 19.872 -6.854 2 HA ARG 1 HA ARG 1 9.613 19.036 -4.739 3 1HB ARG 1 1HB ARG 1 7.798 17.510 -5.858 4 2HB ARG 1 2HB ARG 1 9.120 16.368 -6.085 5 1HG ARG 1 1HG ARG 1 9.372 16.946 -3.378 6 2HG ARG 1 2HG ARG 1 7.655 17.248 -3.619 7 1HD ARG 1 1HD ARG 1 7.967 14.943 -2.952 8 2HD ARG 1 2HD ARG 1 7.472 14.958 -4.660 9 HE ARG 1 HE ARG 1 10.359 15.000 -4.396 10 1HH1 ARG 1 1HH1 ARG 1 7.607 12.794 -4.121 11 2HH1 ARG 1 2HH1 ARG 1 8.542 11.380 -4.528 12 1HH2 ARG 1 1HH2 ARG 1 11.554 13.252 -4.874 13 2HH2 ARG 1 2HH2 ARG 1 10.881 11.631 -4.955 14 H VAL 2 H VAL 2 11.215 17.793 -3.499 15 HA VAL 2 HA VAL 2 13.799 17.715 -4.487 16 HB VAL 2 HB VAL 2 14.318 16.207 -2.585 17 1HG1 VAL 2 1HG1 VAL 2 13.755 17.836 -0.853 18 2HG1 VAL 2 2HG1 VAL 2 14.233 18.663 -2.343 19 3HG1 VAL 2 3HG1 VAL 2 12.518 18.567 -1.891 20 1HG2 VAL 2 1HG2 VAL 2 12.580 15.694 -0.914 21 2HG2 VAL 2 2HG2 VAL 2 11.317 16.275 -2.006 22 3HG2 VAL 2 3HG2 VAL 2 12.270 14.835 -2.420 23 H GLY 3 H GLY 3 14.743 16.573 -6.009 24 1HA GLY 3 1HA GLY 3 15.197 14.181 -6.833 25 2HA GLY 3 2HA GLY 3 13.439 14.094 -7.051 26 H LEU 4 H LEU 4 12.890 16.757 -7.853 27 HA LEU 4 HA LEU 4 13.747 16.659 -10.655 28 1HB LEU 4 1HB LEU 4 12.067 18.702 -9.170 29 2HB LEU 4 2HB LEU 4 12.326 18.608 -10.917 30 HG LEU 4 HG LEU 4 10.851 16.597 -9.163 31 1HD1 LEU 4 1HD1 LEU 4 8.937 17.265 -10.554 32 2HD1 LEU 4 2HD1 LEU 4 9.649 18.688 -9.771 33 3HD1 LEU 4 3HD1 LEU 4 9.972 18.364 -11.487 34 1HD2 LEU 4 1HD2 LEU 4 12.001 15.266 -10.857 35 2HD2 LEU 4 2HD2 LEU 4 10.312 15.434 -11.332 36 3HD2 LEU 4 3HD2 LEU 4 11.549 16.425 -12.132 37 H THR 5 H THR 5 16.010 16.873 -10.402 38 HA THR 5 HA THR 5 17.293 19.135 -9.235 39 HB THR 5 HB THR 5 19.204 18.439 -10.705 40 HG1 THR 5 HG1 THR 5 18.930 16.709 -12.064 41 1HG2 THR 5 1HG2 THR 5 18.811 17.320 -8.520 42 2HG2 THR 5 2HG2 THR 5 17.819 16.090 -9.330 43 3HG2 THR 5 3HG2 THR 5 19.545 16.232 -9.712 44 H GLU 6 H GLU 6 18.420 20.877 -10.389 45 HA GLU 6 HA GLU 6 16.848 22.523 -11.945 46 1HB GLU 6 1HB GLU 6 19.864 22.279 -11.657 47 2HB GLU 6 2HB GLU 6 19.128 23.505 -12.692 48 1HG GLU 6 1HG GLU 6 19.625 24.396 -10.445 49 2HG GLU 6 2HG GLU 6 17.913 24.499 -10.869 50 H GLU 7 H GLU 7 19.103 20.030 -13.109 51 HA GLU 7 HA GLU 7 18.939 20.480 -15.894 52 1HB GLU 7 1HB GLU 7 19.195 17.884 -14.294 53 2HB GLU 7 2HB GLU 7 19.362 18.010 -16.046 54 1HG GLU 7 1HG GLU 7 21.567 18.002 -15.126 55 2HG GLU 7 2HG GLU 7 21.247 19.615 -15.771 56 H GLN 8 H GLN 8 16.827 18.478 -13.759 57 HA GLN 8 HA GLN 8 15.067 17.665 -15.895 58 1HB GLN 8 1HB GLN 8 14.791 17.665 -12.878 59 2HB GLN 8 2HB GLN 8 13.542 17.057 -13.970 60 1HG GLN 8 1HG GLN 8 14.957 15.356 -14.863 61 2HG GLN 8 2HG GLN 8 16.412 16.050 -14.136 62 1HE2 GLN 8 1HE2 GLN 8 16.822 15.805 -11.898 63 2HE2 GLN 8 2HE2 GLN 8 15.850 14.735 -10.882 64 H LYS 9 H LYS 9 15.046 20.391 -13.547 65 HA LYS 9 HA LYS 9 12.531 21.469 -14.349 66 1HB LYS 9 1HB LYS 9 14.986 23.047 -13.500 67 2HB LYS 9 2HB LYS 9 13.328 23.635 -13.580 68 1HG LYS 9 1HG LYS 9 12.636 21.999 -11.853 69 2HG LYS 9 2HG LYS 9 14.289 21.382 -11.765 70 1HD LYS 9 1HD LYS 9 15.060 23.732 -11.165 71 2HD LYS 9 2HD LYS 9 13.354 24.197 -11.058 72 1HE LYS 9 1HE LYS 9 12.997 22.493 -9.292 73 2HE LYS 9 2HE LYS 9 14.677 21.948 -9.457 74 1HZ LYS 9 1HZ LYS 9 14.359 23.433 -7.618 75 2HZ LYS 9 2HZ LYS 9 15.440 24.023 -8.707 76 3HZ LYS 9 3HZ LYS 9 13.911 24.652 -8.633 77 H GLN 10 H GLN 10 15.814 21.950 -15.785 78 HA GLN 10 HA GLN 10 14.938 23.739 -17.838 79 1HB GLN 10 1HB GLN 10 17.213 21.735 -18.152 80 2HB GLN 10 2HB GLN 10 16.904 23.202 -19.068 81 1HG GLN 10 1HG GLN 10 18.112 22.895 -16.353 82 2HG GLN 10 2HG GLN 10 18.612 23.876 -17.711 83 1HE2 GLN 10 1HE2 GLN 10 16.740 23.785 -14.792 84 2HE2 GLN 10 2HE2 GLN 10 16.196 25.468 -14.848 85 H GLU 11 H GLU 11 15.305 20.157 -17.859 86 HA GLU 11 HA GLU 11 14.409 19.708 -20.488 87 1HB GLU 11 1HB GLU 11 14.048 18.002 -17.997 88 2HB GLU 11 2HB GLU 11 13.727 17.440 -19.639 89 1HG GLU 11 1HG GLU 11 16.016 17.676 -20.302 90 2HG GLU 11 2HG GLU 11 16.447 18.573 -18.849 91 H ILE 12 H ILE 12 12.424 19.916 -17.496 92 HA ILE 12 HA ILE 12 9.896 19.514 -18.742 93 HB ILE 12 HB ILE 12 10.692 20.989 -16.209 94 1HG1 ILE 12 1HG1 ILE 12 9.316 18.280 -16.581 95 2HG1 ILE 12 2HG1 ILE 12 11.064 18.433 -16.460 96 1HG2 ILE 12 1HG2 ILE 12 8.318 20.869 -15.537 97 2HG2 ILE 12 2HG2 ILE 12 8.484 21.841 -16.990 98 3HG2 ILE 12 3HG2 ILE 12 7.900 20.168 -17.106 99 1HD1 ILE 12 1HD1 ILE 12 10.238 17.851 -14.298 100 2HD1 ILE 12 2HD1 ILE 12 10.800 19.531 -14.221 101 3HD1 ILE 12 3HD1 ILE 12 9.058 19.167 -14.298 102 H ARG 13 H ARG 13 11.752 22.560 -18.113 103 HA ARG 13 HA ARG 13 9.754 24.219 -19.255 104 1HB ARG 13 1HB ARG 13 11.546 25.095 -17.810 105 2HB ARG 13 2HB ARG 13 12.749 24.690 -19.044 106 1HG ARG 13 1HG ARG 13 12.326 27.037 -19.219 107 2HG ARG 13 2HG ARG 13 11.609 26.264 -20.622 108 1HD ARG 13 1HD ARG 13 9.391 26.302 -19.074 109 2HD ARG 13 2HD ARG 13 10.304 27.558 -18.230 110 HE ARG 13 HE ARG 13 10.177 27.841 -21.146 111 1HH1 ARG 13 1HH1 ARG 13 8.429 28.477 -18.136 112 2HH1 ARG 13 2HH1 ARG 13 7.432 29.737 -18.817 113 1HH2 ARG 13 1HH2 ARG 13 8.712 29.274 -22.094 114 2HH2 ARG 13 2HH2 ARG 13 7.657 30.270 -21.117 115 H GLU 14 H GLU 14 12.571 22.622 -20.786 116 HA GLU 14 HA GLU 14 12.232 23.677 -23.398 117 1HB GLU 14 1HB GLU 14 13.306 20.995 -22.434 118 2HB GLU 14 2HB GLU 14 13.378 21.534 -24.115 119 1HG GLU 14 1HG GLU 14 14.782 23.407 -23.572 120 2HG GLU 14 2HG GLU 14 14.557 23.184 -21.837 121 H ALA 15 H ALA 15 10.872 20.678 -21.926 122 HA ALA 15 HA ALA 15 9.293 19.876 -24.127 123 1HB ALA 15 1HB ALA 15 7.958 18.633 -22.488 124 2HB ALA 15 2HB ALA 15 9.691 18.477 -22.138 125 3HB ALA 15 3HB ALA 15 8.679 19.556 -21.156 126 H PHE 16 H PHE 16 8.419 22.004 -21.373 127 HA PHE 16 HA PHE 16 5.799 22.627 -22.101 128 1HB PHE 16 1HB PHE 16 6.790 23.264 -19.965 129 2HB PHE 16 2HB PHE 16 7.904 24.357 -20.752 130 HD1 PHE 16 HD1 PHE 16 7.295 26.591 -21.404 131 HD2 PHE 16 HD2 PHE 16 4.331 23.840 -19.904 132 HE1 PHE 16 HE1 PHE 16 5.729 28.473 -21.021 133 HE2 PHE 16 HE2 PHE 16 2.771 25.729 -19.527 134 HZ PHE 16 HZ PHE 16 3.527 28.061 -19.971 135 H ASP 17 H ASP 17 8.754 24.481 -22.946 136 HA ASP 17 HA ASP 17 7.480 26.386 -24.616 137 1HB ASP 17 1HB ASP 17 10.337 25.313 -24.594 138 2HB ASP 17 2HB ASP 17 9.796 26.632 -25.641 139 H LEU 18 H LEU 18 8.990 23.231 -25.468 140 HA LEU 18 HA LEU 18 8.571 23.410 -28.257 141 1HB LEU 18 1HB LEU 18 9.979 21.735 -27.251 142 2HB LEU 18 2HB LEU 18 8.620 20.959 -26.438 143 HG LEU 18 HG LEU 18 8.445 21.272 -29.437 144 1HD1 LEU 18 1HD1 LEU 18 9.765 19.248 -29.808 145 2HD1 LEU 18 2HD1 LEU 18 10.758 20.547 -29.128 146 3HD1 LEU 18 3HD1 LEU 18 10.214 19.208 -28.086 147 1HD2 LEU 18 1HD2 LEU 18 7.730 19.005 -27.506 148 2HD2 LEU 18 2HD2 LEU 18 6.579 20.125 -28.257 149 3HD2 LEU 18 3HD2 LEU 18 7.462 18.979 -29.258 150 H PHE 19 H PHE 19 6.438 21.950 -25.727 151 HA PHE 19 HA PHE 19 4.369 21.297 -27.562 152 1HB PHE 19 1HB PHE 19 4.211 21.956 -24.597 153 2HB PHE 19 2HB PHE 19 2.907 21.218 -25.530 154 HD1 PHE 19 HD1 PHE 19 4.422 19.173 -27.173 155 HD2 PHE 19 HD2 PHE 19 4.590 20.228 -22.986 156 HE1 PHE 19 HE1 PHE 19 5.164 16.906 -26.639 157 HE2 PHE 19 HE2 PHE 19 5.161 17.885 -22.444 158 HZ PHE 19 HZ PHE 19 5.581 16.243 -24.268 159 H ASP 20 H ASP 20 4.964 24.291 -25.704 160 HA ASP 20 HA ASP 20 2.648 25.640 -26.846 161 1HB ASP 20 1HB ASP 20 3.576 26.306 -24.683 162 2HB ASP 20 2HB ASP 20 5.115 26.719 -25.458 163 H THR 21 H THR 21 3.542 24.534 -29.003 164 HA THR 21 HA THR 21 5.557 25.655 -30.568 165 HB THR 21 HB THR 21 4.145 24.957 -32.504 166 HG1 THR 21 HG1 THR 21 2.198 24.710 -30.468 167 1HG2 THR 21 1HG2 THR 21 5.549 23.290 -31.272 168 2HG2 THR 21 2HG2 THR 21 4.137 22.876 -30.275 169 3HG2 THR 21 3HG2 THR 21 4.103 22.585 -32.019 170 H ASP 22 H ASP 22 2.289 26.904 -29.925 171 HA ASP 22 HA ASP 22 2.347 29.037 -31.825 172 1HB ASP 22 1HB ASP 22 0.296 28.152 -30.777 173 2HB ASP 22 2HB ASP 22 0.823 28.765 -29.202 174 H GLY 23 H GLY 23 3.967 28.697 -28.724 175 1HA GLY 23 1HA GLY 23 5.291 30.119 -27.547 176 2HA GLY 23 2HA GLY 23 5.277 31.236 -28.920 177 H SER 24 H SER 24 2.351 30.086 -27.164 178 HA SER 24 HA SER 24 1.392 32.742 -26.715 179 1HB SER 24 1HB SER 24 0.472 30.313 -25.153 180 2HB SER 24 2HB SER 24 -0.470 31.678 -25.757 181 HG SER 24 HG SER 24 0.078 30.819 -27.921 182 H GLY 25 H GLY 25 3.605 30.721 -24.965 183 1HA GLY 25 1HA GLY 25 4.859 31.270 -23.063 184 2HA GLY 25 2HA GLY 25 3.676 32.499 -22.584 185 H THR 26 H THR 26 2.018 29.756 -23.698 186 HA THR 26 HA THR 26 1.713 28.305 -21.182 187 HB THR 26 HB THR 26 -0.608 28.814 -21.015 188 HG1 THR 26 HG1 THR 26 -1.581 30.298 -22.286 189 1HG2 THR 26 1HG2 THR 26 -0.587 31.021 -20.109 190 2HG2 THR 26 2HG2 THR 26 1.007 30.320 -19.776 191 3HG2 THR 26 3HG2 THR 26 0.805 31.504 -21.082 192 H ILE 27 H ILE 27 0.635 26.280 -21.631 193 HA ILE 27 HA ILE 27 0.858 25.480 -24.494 194 HB ILE 27 HB ILE 27 0.194 23.819 -22.068 195 1HG1 ILE 27 1HG1 ILE 27 2.790 24.078 -23.665 196 2HG1 ILE 27 2HG1 ILE 27 2.507 24.750 -22.053 197 1HG2 ILE 27 1HG2 ILE 27 0.919 23.004 -24.918 198 2HG2 ILE 27 2HG2 ILE 27 0.525 21.905 -23.584 199 3HG2 ILE 27 3HG2 ILE 27 -0.719 22.937 -24.237 200 1HD1 ILE 27 1HD1 ILE 27 1.969 22.429 -21.237 201 2HD1 ILE 27 2HD1 ILE 27 2.536 21.812 -22.809 202 3HD1 ILE 27 3HD1 ILE 27 3.647 22.671 -21.751 203 H ASP 28 H ASP 28 -1.006 25.862 -25.766 204 HA ASP 28 HA ASP 28 -3.613 26.275 -24.585 205 1HB ASP 28 1HB ASP 28 -2.975 27.213 -26.776 206 2HB ASP 28 2HB ASP 28 -2.857 25.576 -27.444 207 H ALA 29 H ALA 29 -5.368 24.871 -24.343 208 HA ALA 29 HA ALA 29 -5.224 22.255 -23.734 209 1HB ALA 29 1HB ALA 29 -7.281 23.568 -23.618 210 2HB ALA 29 2HB ALA 29 -7.589 22.058 -24.500 211 3HB ALA 29 3HB ALA 29 -7.413 23.583 -25.391 212 H LYS 30 H LYS 30 -5.619 23.375 -27.136 213 HA LYS 30 HA LYS 30 -5.742 20.855 -28.395 214 1HB LYS 30 1HB LYS 30 -6.248 23.059 -29.427 215 2HB LYS 30 2HB LYS 30 -4.520 23.444 -29.432 216 1HG LYS 30 1HG LYS 30 -4.106 21.480 -30.923 217 2HG LYS 30 2HG LYS 30 -5.849 21.127 -30.899 218 1HD LYS 30 1HD LYS 30 -6.314 23.351 -31.919 219 2HD LYS 30 2HD LYS 30 -4.587 23.736 -31.866 220 1HE LYS 30 1HE LYS 30 -5.179 23.060 -34.118 221 2HE LYS 30 2HE LYS 30 -4.107 21.842 -33.412 222 1HZ LYS 30 1HZ LYS 30 -7.037 21.652 -33.593 223 2HZ LYS 30 2HZ LYS 30 -5.960 20.876 -34.569 224 3HZ LYS 30 3HZ LYS 30 -6.037 20.501 -32.967 225 H GLU 31 H GLU 31 -2.932 22.938 -27.672 226 HA GLU 31 HA GLU 31 -0.917 21.245 -28.807 227 1HB GLU 31 1HB GLU 31 -0.764 23.393 -26.657 228 2HB GLU 31 2HB GLU 31 0.614 22.607 -27.420 229 1HG GLU 31 1HG GLU 31 -0.014 23.488 -29.613 230 2HG GLU 31 2HG GLU 31 -1.487 24.211 -28.951 231 H LEU 32 H LEU 32 -2.442 21.474 -25.567 232 HA LEU 32 HA LEU 32 -0.613 19.638 -24.359 233 1HB LEU 32 1HB LEU 32 -2.228 21.273 -23.168 234 2HB LEU 32 2HB LEU 32 -3.460 20.034 -23.431 235 HG LEU 32 HG LEU 32 -1.723 18.396 -22.326 236 1HD1 LEU 32 1HD1 LEU 32 -0.619 21.073 -21.370 237 2HD1 LEU 32 2HD1 LEU 32 -0.238 19.494 -20.660 238 3HD1 LEU 32 3HD1 LEU 32 0.259 19.845 -22.311 239 1HD2 LEU 32 1HD2 LEU 32 -3.174 20.547 -20.750 240 2HD2 LEU 32 2HD2 LEU 32 -3.811 18.972 -21.273 241 3HD2 LEU 32 3HD2 LEU 32 -2.527 19.043 -20.054 242 H LYS 33 H LYS 33 -3.898 19.093 -25.853 243 HA LYS 33 HA LYS 33 -3.716 16.270 -25.367 244 1HB LYS 33 1HB LYS 33 -5.471 15.844 -26.846 245 2HB LYS 33 2HB LYS 33 -5.849 17.124 -25.680 246 1HG LYS 33 1HG LYS 33 -5.534 18.814 -27.306 247 2HG LYS 33 2HG LYS 33 -4.893 17.648 -28.487 248 1HD LYS 33 1HD LYS 33 -7.099 16.470 -28.517 249 2HD LYS 33 2HD LYS 33 -7.737 17.639 -27.350 250 1HE LYS 33 1HE LYS 33 -8.477 18.139 -29.650 251 2HE LYS 33 2HE LYS 33 -7.512 19.460 -28.981 252 1HZ LYS 33 1HZ LYS 33 -5.643 18.648 -30.220 253 2HZ LYS 33 2HZ LYS 33 -6.513 17.372 -30.798 254 3HZ LYS 33 3HZ LYS 33 -6.914 18.907 -31.238 255 H VAL 34 H VAL 34 -2.515 18.262 -28.077 256 HA VAL 34 HA VAL 34 -1.506 16.092 -29.647 257 HB VAL 34 HB VAL 34 -0.613 18.967 -29.296 258 1HG1 VAL 34 1HG1 VAL 34 0.578 16.873 -31.156 259 2HG1 VAL 34 2HG1 VAL 34 0.820 18.627 -31.308 260 3HG1 VAL 34 3HG1 VAL 34 1.435 17.780 -29.887 261 1HG2 VAL 34 1HG2 VAL 34 -1.879 17.478 -31.635 262 2HG2 VAL 34 2HG2 VAL 34 -2.776 18.488 -30.488 263 3HG2 VAL 34 3HG2 VAL 34 -1.549 19.220 -31.535 264 H ALA 35 H ALA 35 0.032 17.914 -26.936 265 HA ALA 35 HA ALA 35 2.458 16.510 -26.851 266 1HB ALA 35 1HB ALA 35 1.957 18.531 -25.501 267 2HB ALA 35 2HB ALA 35 0.873 17.587 -24.469 268 3HB ALA 35 3HB ALA 35 2.583 17.199 -24.505 269 H MET 36 H MET 36 -0.617 15.772 -25.155 270 HA MET 36 HA MET 36 0.260 13.348 -23.985 271 1HB MET 36 1HB MET 36 -2.336 14.707 -24.444 272 2HB MET 36 2HB MET 36 -2.451 12.967 -24.259 273 1HG MET 36 1HG MET 36 -1.122 13.048 -22.192 274 2HG MET 36 2HG MET 36 -0.971 14.802 -22.329 275 1HE MET 36 1HE MET 36 -3.732 15.938 -23.001 276 2HE MET 36 2HE MET 36 -4.460 16.088 -21.384 277 3HE MET 36 3HE MET 36 -2.738 16.462 -21.621 278 H ARG 37 H ARG 37 -1.306 13.842 -27.202 279 HA ARG 37 HA ARG 37 -1.278 11.105 -27.961 280 1HB ARG 37 1HB ARG 37 -0.884 13.620 -29.633 281 2HB ARG 37 2HB ARG 37 -1.023 12.017 -30.332 282 1HG ARG 37 1HG ARG 37 -3.213 12.874 -28.455 283 2HG ARG 37 2HG ARG 37 -3.105 13.689 -30.017 284 1HD ARG 37 1HD ARG 37 -4.610 11.806 -30.256 285 2HD ARG 37 2HD ARG 37 -3.144 11.529 -31.207 286 HE ARG 37 HE ARG 37 -2.963 10.392 -28.542 287 1HH1 ARG 37 1HH1 ARG 37 -4.440 9.770 -31.699 288 2HH1 ARG 37 2HH1 ARG 37 -4.416 8.037 -31.493 289 1HH2 ARG 37 1HH2 ARG 37 -2.899 8.234 -28.284 290 2HH2 ARG 37 2HH2 ARG 37 -3.533 7.113 -29.467 291 H ALA 38 H ALA 38 1.305 13.582 -28.359 292 HA ALA 38 HA ALA 38 3.211 11.851 -29.545 293 1HB ALA 38 1HB ALA 38 4.881 13.486 -28.855 294 2HB ALA 38 2HB ALA 38 3.430 14.312 -29.460 295 3HB ALA 38 3HB ALA 38 3.746 14.228 -27.715 296 H LEU 39 H LEU 39 2.478 12.469 -26.111 297 HA LEU 39 HA LEU 39 4.497 10.648 -25.083 298 1HB LEU 39 1HB LEU 39 2.036 11.933 -23.868 299 2HB LEU 39 2HB LEU 39 3.181 10.976 -22.942 300 HG LEU 39 HG LEU 39 4.037 13.457 -24.498 301 1HD1 LEU 39 1HD1 LEU 39 3.874 14.679 -22.358 302 2HD1 LEU 39 2HD1 LEU 39 2.285 14.111 -22.892 303 3HD1 LEU 39 3HD1 LEU 39 3.139 13.253 -21.592 304 1HD2 LEU 39 1HD2 LEU 39 5.876 11.945 -23.844 305 2HD2 LEU 39 2HD2 LEU 39 5.918 13.435 -22.893 306 3HD2 LEU 39 3HD2 LEU 39 5.290 11.942 -22.166 307 H GLY 40 H GLY 40 1.778 9.863 -26.866 308 1HA GLY 40 1HA GLY 40 1.040 7.769 -27.355 309 2HA GLY 40 2HA GLY 40 2.001 7.091 -26.036 310 H PHE 41 H PHE 41 -0.211 9.724 -25.297 311 HA PHE 41 HA PHE 41 -1.984 7.939 -23.735 312 1HB PHE 41 1HB PHE 41 -1.914 10.896 -24.330 313 2HB PHE 41 2HB PHE 41 -3.286 10.176 -23.548 314 HD1 PHE 41 HD1 PHE 41 -3.376 10.412 -21.221 315 HD2 PHE 41 HD2 PHE 41 0.487 10.201 -23.141 316 HE1 PHE 41 HE1 PHE 41 -2.269 10.831 -19.054 317 HE2 PHE 41 HE2 PHE 41 1.585 10.614 -20.965 318 HZ PHE 41 HZ PHE 41 0.218 10.938 -18.918 319 H GLU 42 H GLU 42 -4.305 7.992 -24.121 320 HA GLU 42 HA GLU 42 -5.177 8.357 -26.965 321 1HB GLU 42 1HB GLU 42 -6.177 6.571 -24.719 322 2HB GLU 42 2HB GLU 42 -7.096 6.891 -26.189 323 1HG GLU 42 1HG GLU 42 -4.291 5.675 -26.142 324 2HG GLU 42 2HG GLU 42 -5.793 4.751 -26.265 325 HA PRO 43 HA PRO 43 -6.926 11.965 -24.805 326 1HB PRO 43 1HB PRO 43 -7.882 12.327 -27.663 327 2HB PRO 43 2HB PRO 43 -7.398 13.587 -26.487 328 1HG PRO 43 1HG PRO 43 -5.627 12.728 -28.311 329 2HG PRO 43 2HG PRO 43 -5.099 12.862 -26.605 330 1HD PRO 43 1HD PRO 43 -5.909 10.359 -28.111 331 2HD PRO 43 2HD PRO 43 -4.565 10.631 -26.949 332 H LYS 44 H LYS 44 -8.292 10.226 -23.728 333 HA LYS 44 HA LYS 44 -11.041 9.891 -24.546 334 1HB LYS 44 1HB LYS 44 -9.858 9.876 -21.739 335 2HB LYS 44 2HB LYS 44 -11.436 9.247 -22.226 336 1HG LYS 44 1HG LYS 44 -8.688 8.159 -22.967 337 2HG LYS 44 2HG LYS 44 -9.905 7.423 -21.928 338 1HD LYS 44 1HD LYS 44 -11.446 7.253 -23.921 339 2HD LYS 44 2HD LYS 44 -10.118 7.856 -24.943 340 1HE LYS 44 1HE LYS 44 -8.696 5.948 -24.220 341 2HE LYS 44 2HE LYS 44 -10.040 5.322 -23.246 342 1HZ LYS 44 1HZ LYS 44 -10.068 5.697 -26.158 343 2HZ LYS 44 2HZ LYS 44 -9.911 4.261 -25.366 344 3HZ LYS 44 3HZ LYS 44 -11.315 5.115 -25.252 345 H LYS 45 H LYS 45 -11.411 11.950 -25.351 346 HA LYS 45 HA LYS 45 -11.211 14.385 -24.708 347 1HB LYS 45 1HB LYS 45 -13.952 13.258 -25.391 348 2HB LYS 45 2HB LYS 45 -13.481 14.962 -25.524 349 1HG LYS 45 1HG LYS 45 -11.659 14.321 -27.110 350 2HG LYS 45 2HG LYS 45 -12.214 12.638 -27.047 351 1HD LYS 45 1HD LYS 45 -14.432 13.312 -27.918 352 2HD LYS 45 2HD LYS 45 -13.925 15.009 -27.921 353 1HE LYS 45 1HE LYS 45 -13.769 14.099 -30.178 354 2HE LYS 45 2HE LYS 45 -12.152 14.503 -29.579 355 1HZ LYS 45 1HZ LYS 45 -11.819 12.190 -29.094 356 2HZ LYS 45 2HZ LYS 45 -13.340 11.813 -29.607 357 3HZ LYS 45 3HZ LYS 45 -12.225 12.383 -30.679 358 H GLU 46 H GLU 46 -13.988 12.758 -23.017 359 HA GLU 46 HA GLU 46 -14.581 14.997 -21.408 360 1HB GLU 46 1HB GLU 46 -15.766 13.459 -19.927 361 2HB GLU 46 2HB GLU 46 -16.160 13.199 -21.626 362 1HG GLU 46 1HG GLU 46 -14.751 11.181 -21.697 363 2HG GLU 46 2HG GLU 46 -14.220 11.450 -20.030 364 H GLU 47 H GLU 47 -12.224 12.383 -20.852 365 HA GLU 47 HA GLU 47 -11.702 13.215 -18.116 366 1HB GLU 47 1HB GLU 47 -11.484 10.820 -19.112 367 2HB GLU 47 2HB GLU 47 -9.973 11.391 -19.830 368 1HG GLU 47 1HG GLU 47 -9.532 10.256 -17.707 369 2HG GLU 47 2HG GLU 47 -9.128 11.972 -17.554 370 H ILE 48 H ILE 48 -10.250 13.637 -21.340 371 HA ILE 48 HA ILE 48 -7.964 15.160 -20.554 372 HB ILE 48 HB ILE 48 -9.705 15.305 -23.037 373 1HG1 ILE 48 1HG1 ILE 48 -8.356 13.178 -22.566 374 2HG1 ILE 48 2HG1 ILE 48 -8.161 13.969 -24.129 375 1HG2 ILE 48 1HG2 ILE 48 -7.111 16.762 -22.455 376 2HG2 ILE 48 2HG2 ILE 48 -7.774 16.509 -24.090 377 3HG2 ILE 48 3HG2 ILE 48 -8.686 17.449 -22.911 378 1HD1 ILE 48 1HD1 ILE 48 -6.022 14.904 -23.507 379 2HD1 ILE 48 2HD1 ILE 48 -6.228 14.382 -21.814 380 3HD1 ILE 48 3HD1 ILE 48 -6.003 13.187 -23.095 381 H LYS 49 H LYS 49 -11.354 16.234 -21.242 382 HA LYS 49 HA LYS 49 -10.870 18.965 -20.605 383 1HB LYS 49 1HB LYS 49 -13.404 17.295 -20.447 384 2HB LYS 49 2HB LYS 49 -13.372 19.020 -20.129 385 1HG LYS 49 1HG LYS 49 -12.565 17.669 -22.743 386 2HG LYS 49 2HG LYS 49 -14.085 18.494 -22.433 387 1HD LYS 49 1HD LYS 49 -11.303 19.718 -22.665 388 2HD LYS 49 2HD LYS 49 -12.687 19.953 -23.721 389 1HE LYS 49 1HE LYS 49 -12.404 20.978 -20.855 390 2HE LYS 49 2HE LYS 49 -12.381 21.929 -22.341 391 1HZ LYS 49 1HZ LYS 49 -14.643 21.276 -22.740 392 2HZ LYS 49 2HZ LYS 49 -14.673 20.388 -21.351 393 3HZ LYS 49 3HZ LYS 49 -14.499 22.025 -21.279 394 H LYS 50 H LYS 50 -12.030 16.311 -18.433 395 HA LYS 50 HA LYS 50 -12.216 17.870 -16.083 396 1HB LYS 50 1HB LYS 50 -11.262 14.988 -16.358 397 2HB LYS 50 2HB LYS 50 -11.656 15.787 -14.832 398 1HG LYS 50 1HG LYS 50 -13.996 16.140 -15.620 399 2HG LYS 50 2HG LYS 50 -13.598 15.285 -17.108 400 1HD LYS 50 1HD LYS 50 -12.735 13.387 -15.415 401 2HD LYS 50 2HD LYS 50 -13.790 14.228 -14.280 402 1HE LYS 50 1HE LYS 50 -15.081 12.462 -15.248 403 2HE LYS 50 2HE LYS 50 -15.669 13.948 -16.016 404 1HZ LYS 50 1HZ LYS 50 -15.294 12.176 -17.594 405 2HZ LYS 50 2HZ LYS 50 -14.247 13.417 -17.888 406 3HZ LYS 50 3HZ LYS 50 -13.713 12.050 -17.137 407 H MET 51 H MET 51 -9.364 15.991 -17.221 408 HA MET 51 HA MET 51 -7.501 16.714 -15.300 409 1HB MET 51 1HB MET 51 -7.125 14.954 -16.887 410 2HB MET 51 2HB MET 51 -7.305 16.046 -18.264 411 1HG MET 51 1HG MET 51 -5.266 17.213 -17.687 412 2HG MET 51 2HG MET 51 -5.053 16.189 -16.251 413 1HE MET 51 1HE MET 51 -2.551 15.920 -17.273 414 2HE MET 51 2HE MET 51 -2.221 15.246 -18.889 415 3HE MET 51 3HE MET 51 -3.005 16.832 -18.738 416 H ILE 52 H ILE 52 -7.952 18.271 -18.525 417 HA ILE 52 HA ILE 52 -6.124 20.363 -18.139 418 HB ILE 52 HB ILE 52 -8.650 20.134 -19.821 419 1HG1 ILE 52 1HG1 ILE 52 -5.670 20.230 -20.495 420 2HG1 ILE 52 2HG1 ILE 52 -6.611 18.744 -20.347 421 1HG2 ILE 52 1HG2 ILE 52 -8.377 22.552 -19.358 422 2HG2 ILE 52 2HG2 ILE 52 -6.676 22.459 -19.857 423 3HG2 ILE 52 3HG2 ILE 52 -7.985 22.191 -21.024 424 1HD1 ILE 52 1HD1 ILE 52 -6.905 20.900 -22.462 425 2HD1 ILE 52 2HD1 ILE 52 -6.439 19.212 -22.674 426 3HD1 ILE 52 3HD1 ILE 52 -8.108 19.615 -22.211 427 H SER 53 H SER 53 -9.641 20.306 -17.310 428 HA SER 53 HA SER 53 -9.682 22.982 -16.365 429 1HB SER 53 1HB SER 53 -11.391 20.642 -15.394 430 2HB SER 53 2HB SER 53 -11.756 22.370 -15.235 431 HG SER 53 HG SER 53 -11.548 20.842 -17.625 432 H GLU 54 H GLU 54 -9.073 19.929 -14.548 433 HA GLU 54 HA GLU 54 -8.768 21.176 -12.006 434 1HB GLU 54 1HB GLU 54 -7.512 18.640 -13.144 435 2HB GLU 54 2HB GLU 54 -7.401 19.132 -11.451 436 1HG GLU 54 1HG GLU 54 -10.016 18.565 -12.926 437 2HG GLU 54 2HG GLU 54 -9.194 17.464 -11.821 438 H ILE 55 H ILE 55 -6.329 20.550 -14.578 439 HA ILE 55 HA ILE 55 -4.180 21.690 -12.970 440 HB ILE 55 HB ILE 55 -4.325 21.156 -15.954 441 1HG1 ILE 55 1HG1 ILE 55 -4.663 19.056 -14.824 442 2HG1 ILE 55 2HG1 ILE 55 -3.035 19.108 -15.448 443 1HG2 ILE 55 1HG2 ILE 55 -1.826 21.090 -15.795 444 2HG2 ILE 55 2HG2 ILE 55 -2.521 22.679 -15.487 445 3HG2 ILE 55 3HG2 ILE 55 -1.945 21.701 -14.129 446 1HD1 ILE 55 1HD1 ILE 55 -3.050 18.105 -13.239 447 2HD1 ILE 55 2HD1 ILE 55 -2.221 19.664 -13.110 448 3HD1 ILE 55 3HD1 ILE 55 -3.897 19.486 -12.542 449 H ASP 56 H ASP 56 -6.509 23.027 -15.303 450 HA ASP 56 HA ASP 56 -5.039 25.494 -15.670 451 1HB ASP 56 1HB ASP 56 -6.442 24.493 -17.428 452 2HB ASP 56 2HB ASP 56 -7.880 24.716 -16.414 453 H LYS 57 H LYS 57 -4.845 25.819 -13.293 454 HA LYS 57 HA LYS 57 -7.018 26.738 -11.688 455 1HB LYS 57 1HB LYS 57 -4.151 27.766 -11.599 456 2HB LYS 57 2HB LYS 57 -5.348 27.812 -10.308 457 1HG LYS 57 1HG LYS 57 -3.997 25.330 -11.459 458 2HG LYS 57 2HG LYS 57 -3.713 26.084 -9.890 459 1HD LYS 57 1HD LYS 57 -6.146 25.631 -9.307 460 2HD LYS 57 2HD LYS 57 -6.268 24.675 -10.797 461 1HE LYS 57 1HE LYS 57 -4.314 24.142 -8.506 462 2HE LYS 57 2HE LYS 57 -5.821 23.262 -8.816 463 1HZ LYS 57 1HZ LYS 57 -3.940 22.108 -9.694 464 2HZ LYS 57 2HZ LYS 57 -4.964 22.572 -10.901 465 3HZ LYS 57 3HZ LYS 57 -3.546 23.382 -10.665 466 H ASP 58 H ASP 58 -4.845 28.511 -13.884 467 HA ASP 58 HA ASP 58 -6.660 30.901 -13.792 468 1HB ASP 58 1HB ASP 58 -4.745 31.181 -12.260 469 2HB ASP 58 2HB ASP 58 -3.624 30.854 -13.594 470 H GLY 59 H GLY 59 -4.323 28.999 -15.675 471 1HA GLY 59 1HA GLY 59 -3.788 30.727 -17.738 472 2HA GLY 59 2HA GLY 59 -3.738 28.975 -17.839 473 H SER 60 H SER 60 -6.897 29.344 -17.278 474 HA SER 60 HA SER 60 -8.816 29.381 -18.504 475 1HB SER 60 1HB SER 60 -7.533 31.966 -19.468 476 2HB SER 60 2HB SER 60 -9.262 31.579 -19.507 477 HG SER 60 HG SER 60 -7.614 31.765 -17.183 478 H GLY 61 H GLY 61 -7.913 27.476 -19.776 479 1HA GLY 61 1HA GLY 61 -8.415 26.500 -21.878 480 2HA GLY 61 2HA GLY 61 -8.230 28.056 -22.695 481 H THR 62 H THR 62 -5.647 28.450 -20.960 482 HA THR 62 HA THR 62 -3.909 26.515 -22.386 483 HB THR 62 HB THR 62 -2.171 28.113 -22.475 484 HG1 THR 62 HG1 THR 62 -3.903 29.815 -20.975 485 1HG2 THR 62 1HG2 THR 62 -3.980 28.375 -24.262 486 2HG2 THR 62 2HG2 THR 62 -4.693 29.659 -23.280 487 3HG2 THR 62 3HG2 THR 62 -3.064 29.850 -23.942 488 H ILE 63 H ILE 63 -1.998 25.882 -21.168 489 HA ILE 63 HA ILE 63 -2.439 25.819 -18.221 490 HB ILE 63 HB ILE 63 -0.700 24.060 -19.983 491 1HG1 ILE 63 1HG1 ILE 63 -2.984 23.515 -20.504 492 2HG1 ILE 63 2HG1 ILE 63 -2.303 22.262 -19.469 493 1HG2 ILE 63 1HG2 ILE 63 -1.355 23.949 -17.021 494 2HG2 ILE 63 2HG2 ILE 63 -0.558 22.641 -17.924 495 3HG2 ILE 63 3HG2 ILE 63 0.222 24.218 -17.768 496 1HD1 ILE 63 1HD1 ILE 63 -4.254 24.447 -18.624 497 2HD1 ILE 63 2HD1 ILE 63 -4.560 22.709 -18.753 498 3HD1 ILE 63 3HD1 ILE 63 -3.479 23.316 -17.495 499 H ASP 64 H ASP 64 -1.169 27.091 -17.048 500 HA ASP 64 HA ASP 64 0.963 28.676 -18.249 501 1HB ASP 64 1HB ASP 64 0.178 28.398 -15.320 502 2HB ASP 64 2HB ASP 64 1.169 29.677 -16.025 503 H PHE 65 H PHE 65 3.192 28.739 -17.346 504 HA PHE 65 HA PHE 65 4.384 26.194 -17.393 505 1HB PHE 65 1HB PHE 65 5.633 28.193 -17.957 506 2HB PHE 65 2HB PHE 65 5.499 28.793 -16.301 507 HD1 PHE 65 HD1 PHE 65 6.546 25.552 -17.977 508 HD2 PHE 65 HD2 PHE 65 7.508 28.600 -15.070 509 HE1 PHE 65 HE1 PHE 65 8.513 24.242 -17.241 510 HE2 PHE 65 HE2 PHE 65 9.538 27.338 -14.437 511 HZ PHE 65 HZ PHE 65 10.041 25.152 -15.512 512 H GLU 66 H GLU 66 3.621 28.199 -14.508 513 HA GLU 66 HA GLU 66 4.687 26.402 -12.597 514 1HB GLU 66 1HB GLU 66 2.320 28.316 -12.363 515 2HB GLU 66 2HB GLU 66 3.122 27.502 -11.011 516 1HG GLU 66 1HG GLU 66 5.268 28.589 -11.589 517 2HG GLU 66 2HG GLU 66 4.497 29.436 -12.938 518 H GLU 67 H GLU 67 1.426 26.538 -14.066 519 HA GLU 67 HA GLU 67 0.248 24.421 -12.559 520 1HB GLU 67 1HB GLU 67 -0.314 25.402 -15.382 521 2HB GLU 67 2HB GLU 67 -1.357 24.321 -14.452 522 1HG GLU 67 1HG GLU 67 -1.802 26.004 -12.787 523 2HG GLU 67 2HG GLU 67 -0.657 27.135 -13.515 524 H PHE 68 H PHE 68 1.830 24.443 -15.785 525 HA PHE 68 HA PHE 68 1.709 21.686 -16.327 526 1HB PHE 68 1HB PHE 68 2.380 23.416 -17.962 527 2HB PHE 68 2HB PHE 68 3.872 23.694 -17.080 528 HD1 PHE 68 HD1 PHE 68 5.817 22.412 -17.623 529 HD2 PHE 68 HD2 PHE 68 1.926 21.032 -18.881 530 HE1 PHE 68 HE1 PHE 68 6.880 20.740 -19.122 531 HE2 PHE 68 HE2 PHE 68 3.001 19.271 -20.257 532 HZ PHE 68 HZ PHE 68 5.485 19.126 -20.370 533 H LEU 69 H LEU 69 4.350 23.534 -14.715 534 HA LEU 69 HA LEU 69 6.048 21.368 -14.189 535 1HB LEU 69 1HB LEU 69 6.728 23.694 -13.944 536 2HB LEU 69 2HB LEU 69 5.566 23.937 -12.636 537 HG LEU 69 HG LEU 69 6.814 22.391 -11.179 538 1HD1 LEU 69 1HD1 LEU 69 9.078 21.608 -11.860 539 2HD1 LEU 69 2HD1 LEU 69 7.811 20.855 -12.831 540 3HD1 LEU 69 3HD1 LEU 69 8.777 22.189 -13.510 541 1HD2 LEU 69 1HD2 LEU 69 8.786 23.826 -10.855 542 2HD2 LEU 69 2HD2 LEU 69 8.559 24.531 -12.470 543 3HD2 LEU 69 3HD2 LEU 69 7.346 24.801 -11.199 544 H THR 70 H THR 70 3.393 22.728 -12.167 545 HA THR 70 HA THR 70 3.637 20.909 -10.016 546 HB THR 70 HB THR 70 1.074 22.192 -11.060 547 HG1 THR 70 HG1 THR 70 2.661 23.744 -10.672 548 1HG2 THR 70 1HG2 THR 70 1.883 21.208 -8.287 549 2HG2 THR 70 2HG2 THR 70 0.661 20.454 -9.338 550 3HG2 THR 70 3HG2 THR 70 0.390 22.080 -8.686 551 H MET 71 H MET 71 1.646 20.662 -13.008 552 HA MET 71 HA MET 71 0.427 18.182 -12.498 553 1HB MET 71 1HB MET 71 -0.143 19.771 -14.341 554 2HB MET 71 2HB MET 71 1.355 19.336 -15.156 555 1HG MET 71 1HG MET 71 0.519 16.921 -15.197 556 2HG MET 71 2HG MET 71 -1.016 17.544 -14.587 557 1HE MET 71 1HE MET 71 1.450 17.195 -17.554 558 2HE MET 71 2HE MET 71 0.764 18.273 -18.788 559 3HE MET 71 3HE MET 71 1.545 18.959 -17.350 560 H MET 72 H MET 72 3.488 18.864 -14.264 561 HA MET 72 HA MET 72 4.188 16.148 -14.757 562 1HB MET 72 1HB MET 72 5.899 18.658 -14.463 563 2HB MET 72 2HB MET 72 6.529 17.102 -14.998 564 1HG MET 72 1HG MET 72 4.380 18.741 -16.408 565 2HG MET 72 2HG MET 72 6.057 18.567 -16.899 566 1HE MET 72 1HE MET 72 6.121 14.816 -18.109 567 2HE MET 72 2HE MET 72 7.100 16.260 -17.757 568 3HE MET 72 3HE MET 72 6.409 15.293 -16.425 569 H THR 73 H THR 73 5.024 18.317 -12.036 570 HA THR 73 HA THR 73 6.685 16.477 -10.648 571 HB THR 73 HB THR 73 4.919 18.689 -9.507 572 HG1 THR 73 HG1 THR 73 6.350 19.460 -11.064 573 1HG2 THR 73 1HG2 THR 73 6.613 18.771 -7.713 574 2HG2 THR 73 2HG2 THR 73 5.788 17.204 -7.726 575 3HG2 THR 73 3HG2 THR 73 7.426 17.349 -8.404 576 H ALA 74 H ALA 74 3.124 17.000 -10.491 577 HA ALA 74 HA ALA 74 2.648 15.051 -8.450 578 1HB ALA 74 1HB ALA 74 0.809 16.020 -10.685 579 2HB ALA 74 2HB ALA 74 0.320 15.118 -9.237 580 3HB ALA 74 3HB ALA 74 0.994 16.753 -9.080 581 H LYS 75 H LYS 75 2.325 14.800 -12.039 582 HA LYS 75 HA LYS 75 2.111 11.861 -11.858 583 1HB LYS 75 1HB LYS 75 2.169 13.670 -14.284 584 2HB LYS 75 2HB LYS 75 1.725 11.950 -14.214 585 1HG LYS 75 1HG LYS 75 -0.084 12.740 -12.480 586 2HG LYS 75 2HG LYS 75 0.190 14.350 -13.157 587 1HD LYS 75 1HD LYS 75 -0.688 11.835 -14.662 588 2HD LYS 75 2HD LYS 75 -1.717 13.210 -14.235 589 1HE LYS 75 1HE LYS 75 -0.357 14.691 -15.701 590 2HE LYS 75 2HE LYS 75 0.676 13.318 -16.139 591 1HZ LYS 75 1HZ LYS 75 -0.985 13.692 -17.774 592 2HZ LYS 75 2HZ LYS 75 -1.248 12.238 -17.049 593 3HZ LYS 75 3HZ LYS 75 -2.201 13.529 -16.674 594 H MET 76 H MET 76 4.452 12.585 -10.791 595 HA MET 76 HA MET 76 6.646 12.567 -12.687 596 1HB MET 76 1HB MET 76 8.072 12.059 -10.735 597 2HB MET 76 2HB MET 76 7.063 13.497 -10.553 598 1HG MET 76 1HG MET 76 5.575 12.355 -9.019 599 2HG MET 76 2HG MET 76 6.301 10.790 -9.389 600 1HE MET 76 1HE MET 76 8.226 14.188 -8.696 601 2HE MET 76 2HE MET 76 6.874 14.257 -7.535 602 3HE MET 76 3HE MET 76 8.539 14.025 -6.959 Start of MODEL 10 1 H ARG 1 H ARG 1 15.555 17.467 0.245 2 HA ARG 1 HA ARG 1 17.604 16.905 -0.767 3 1HB ARG 1 1HB ARG 1 16.510 15.319 0.786 4 2HB ARG 1 2HB ARG 1 15.735 14.503 -0.579 5 1HG ARG 1 1HG ARG 1 18.011 13.975 -1.510 6 2HG ARG 1 2HG ARG 1 18.740 14.764 -0.103 7 1HD ARG 1 1HD ARG 1 16.891 12.333 -0.076 8 2HD ARG 1 2HD ARG 1 18.635 12.269 0.135 9 HE ARG 1 HE ARG 1 16.612 12.959 2.098 10 1HH1 ARG 1 1HH1 ARG 1 19.997 13.495 1.250 11 2HH1 ARG 1 2HH1 ARG 1 20.510 13.801 2.887 12 1HH2 ARG 1 1HH2 ARG 1 17.258 13.362 4.240 13 2HH2 ARG 1 2HH2 ARG 1 18.918 13.733 4.616 14 H VAL 2 H VAL 2 14.887 15.345 -2.589 15 HA VAL 2 HA VAL 2 16.016 16.079 -5.130 16 HB VAL 2 HB VAL 2 17.388 14.096 -4.577 17 1HG1 VAL 2 1HG1 VAL 2 14.772 12.534 -4.430 18 2HG1 VAL 2 2HG1 VAL 2 16.411 11.865 -4.361 19 3HG1 VAL 2 3HG1 VAL 2 15.833 12.909 -3.056 20 1HG2 VAL 2 1HG2 VAL 2 16.728 14.544 -6.935 21 2HG2 VAL 2 2HG2 VAL 2 17.056 12.838 -6.589 22 3HG2 VAL 2 3HG2 VAL 2 15.383 13.390 -6.750 23 H GLY 3 H GLY 3 14.416 15.532 -6.830 24 1HA GLY 3 1HA GLY 3 12.007 14.308 -6.688 25 2HA GLY 3 2HA GLY 3 11.676 15.824 -5.822 26 H LEU 4 H LEU 4 12.910 17.753 -7.005 27 HA LEU 4 HA LEU 4 12.469 17.692 -9.963 28 1HB LEU 4 1HB LEU 4 11.634 19.831 -7.996 29 2HB LEU 4 2HB LEU 4 11.677 20.024 -9.754 30 HG LEU 4 HG LEU 4 9.939 17.994 -8.265 31 1HD1 LEU 4 1HD1 LEU 4 9.326 20.640 -9.618 32 2HD1 LEU 4 2HD1 LEU 4 8.117 19.539 -8.915 33 3HD1 LEU 4 3HD1 LEU 4 9.306 20.338 -7.866 34 1HD2 LEU 4 1HD2 LEU 4 10.069 18.791 -11.219 35 2HD2 LEU 4 2HD2 LEU 4 10.415 17.183 -10.542 36 3HD2 LEU 4 3HD2 LEU 4 8.775 17.824 -10.485 37 H THR 5 H THR 5 14.761 17.286 -10.080 38 HA THR 5 HA THR 5 16.701 19.122 -8.992 39 HB THR 5 HB THR 5 18.193 18.105 -10.720 40 HG1 THR 5 HG1 THR 5 16.028 16.443 -11.406 41 1HG2 THR 5 1HG2 THR 5 17.909 16.966 -8.556 42 2HG2 THR 5 2HG2 THR 5 16.523 16.058 -9.189 43 3HG2 THR 5 3HG2 THR 5 18.139 15.806 -9.876 44 H GLU 6 H GLU 6 17.984 20.689 -10.257 45 HA GLU 6 HA GLU 6 16.540 22.514 -11.803 46 1HB GLU 6 1HB GLU 6 18.807 22.790 -10.622 47 2HB GLU 6 2HB GLU 6 19.540 21.945 -12.001 48 1HG GLU 6 1HG GLU 6 18.556 23.726 -13.503 49 2HG GLU 6 2HG GLU 6 17.933 24.531 -12.055 50 H GLU 7 H GLU 7 18.363 19.587 -12.743 51 HA GLU 7 HA GLU 7 18.231 19.985 -15.571 52 1HB GLU 7 1HB GLU 7 18.417 17.442 -13.867 53 2HB GLU 7 2HB GLU 7 18.525 17.475 -15.627 54 1HG GLU 7 1HG GLU 7 20.763 17.405 -14.701 55 2HG GLU 7 2HG GLU 7 20.502 18.939 -15.536 56 H GLN 8 H GLN 8 16.043 18.139 -13.328 57 HA GLN 8 HA GLN 8 14.114 17.490 -15.307 58 1HB GLN 8 1HB GLN 8 13.831 18.049 -12.343 59 2HB GLN 8 2HB GLN 8 12.468 17.560 -13.350 60 1HG GLN 8 1HG GLN 8 13.433 15.443 -13.884 61 2HG GLN 8 2HG GLN 8 15.027 15.921 -13.298 62 1HE2 GLN 8 1HE2 GLN 8 11.734 14.980 -12.271 63 2HE2 GLN 8 2HE2 GLN 8 12.119 14.882 -10.562 64 H LYS 9 H LYS 9 14.382 20.492 -13.291 65 HA LYS 9 HA LYS 9 12.062 21.727 -14.358 66 1HB LYS 9 1HB LYS 9 14.648 23.025 -13.411 67 2HB LYS 9 2HB LYS 9 13.138 23.886 -13.743 68 1HG LYS 9 1HG LYS 9 11.962 22.560 -12.016 69 2HG LYS 9 2HG LYS 9 13.453 21.676 -11.666 70 1HD LYS 9 1HD LYS 9 14.555 23.923 -11.150 71 2HD LYS 9 2HD LYS 9 12.940 24.653 -11.270 72 1HE LYS 9 1HE LYS 9 12.151 23.060 -9.479 73 2HE LYS 9 2HE LYS 9 13.805 22.423 -9.367 74 1HZ LYS 9 1HZ LYS 9 13.381 24.049 -7.700 75 2HZ LYS 9 2HZ LYS 9 14.538 24.602 -8.734 76 3HZ LYS 9 3HZ LYS 9 13.001 25.192 -8.825 77 H GLN 10 H GLN 10 15.448 21.872 -15.591 78 HA GLN 10 HA GLN 10 14.926 23.523 -17.842 79 1HB GLN 10 1HB GLN 10 16.986 21.329 -17.397 80 2HB GLN 10 2HB GLN 10 16.962 22.366 -18.828 81 1HG GLN 10 1HG GLN 10 17.324 24.354 -17.538 82 2HG GLN 10 2HG GLN 10 17.039 23.502 -16.015 83 1HE2 GLN 10 1HE2 GLN 10 18.559 22.084 -15.180 84 2HE2 GLN 10 2HE2 GLN 10 20.257 22.153 -15.673 85 H GLU 11 H GLU 11 14.875 19.934 -17.605 86 HA GLU 11 HA GLU 11 14.143 19.383 -20.280 87 1HB GLU 11 1HB GLU 11 13.491 17.912 -17.694 88 2HB GLU 11 2HB GLU 11 13.193 17.252 -19.304 89 1HG GLU 11 1HG GLU 11 15.518 17.178 -19.840 90 2HG GLU 11 2HG GLU 11 15.972 18.180 -18.465 91 H ILE 12 H ILE 12 12.022 19.873 -17.420 92 HA ILE 12 HA ILE 12 9.552 19.594 -18.804 93 HB ILE 12 HB ILE 12 10.280 21.068 -16.250 94 1HG1 ILE 12 1HG1 ILE 12 8.885 18.383 -16.743 95 2HG1 ILE 12 2HG1 ILE 12 10.586 18.551 -16.326 96 1HG2 ILE 12 1HG2 ILE 12 7.490 20.312 -17.214 97 2HG2 ILE 12 2HG2 ILE 12 7.914 21.148 -15.714 98 3HG2 ILE 12 3HG2 ILE 12 8.127 21.966 -17.248 99 1HD1 ILE 12 1HD1 ILE 12 9.912 19.701 -14.188 100 2HD1 ILE 12 2HD1 ILE 12 8.222 19.266 -14.561 101 3HD1 ILE 12 3HD1 ILE 12 9.430 17.999 -14.329 102 H ARG 13 H ARG 13 11.530 22.537 -18.108 103 HA ARG 13 HA ARG 13 9.736 24.343 -19.336 104 1HB ARG 13 1HB ARG 13 11.640 25.004 -17.850 105 2HB ARG 13 2HB ARG 13 12.769 24.536 -19.128 106 1HG ARG 13 1HG ARG 13 12.546 26.904 -19.264 107 2HG ARG 13 2HG ARG 13 11.674 26.238 -20.632 108 1HD ARG 13 1HD ARG 13 9.638 26.416 -18.752 109 2HD ARG 13 2HD ARG 13 10.700 27.724 -18.234 110 HE ARG 13 HE ARG 13 10.199 27.733 -21.096 111 1HH1 ARG 13 1HH1 ARG 13 8.731 28.572 -17.987 112 2HH1 ARG 13 2HH1 ARG 13 7.733 29.842 -18.645 113 1HH2 ARG 13 1HH2 ARG 13 8.729 29.180 -21.991 114 2HH2 ARG 13 2HH2 ARG 13 7.784 30.258 -20.984 115 H GLU 14 H GLU 14 12.523 22.554 -20.768 116 HA GLU 14 HA GLU 14 12.331 23.594 -23.357 117 1HB GLU 14 1HB GLU 14 14.169 22.184 -22.380 118 2HB GLU 14 2HB GLU 14 13.125 20.760 -22.524 119 1HG GLU 14 1HG GLU 14 12.982 21.139 -24.976 120 2HG GLU 14 2HG GLU 14 13.996 22.586 -24.794 121 H ALA 15 H ALA 15 10.807 20.626 -21.987 122 HA ALA 15 HA ALA 15 9.305 19.879 -24.258 123 1HB ALA 15 1HB ALA 15 9.598 18.450 -22.275 124 2HB ALA 15 2HB ALA 15 8.589 19.549 -21.312 125 3HB ALA 15 3HB ALA 15 7.878 18.654 -22.671 126 H PHE 16 H PHE 16 8.397 22.018 -21.537 127 HA PHE 16 HA PHE 16 5.796 22.645 -22.294 128 1HB PHE 16 1HB PHE 16 6.742 23.270 -20.139 129 2HB PHE 16 2HB PHE 16 7.887 24.353 -20.893 130 HD1 PHE 16 HD1 PHE 16 7.344 26.626 -21.391 131 HD2 PHE 16 HD2 PHE 16 4.245 23.819 -20.338 132 HE1 PHE 16 HE1 PHE 16 5.722 28.486 -21.176 133 HE2 PHE 16 HE2 PHE 16 2.635 25.688 -20.096 134 HZ PHE 16 HZ PHE 16 3.407 28.034 -20.434 135 H ASP 17 H ASP 17 8.778 24.488 -23.040 136 HA ASP 17 HA ASP 17 7.583 26.440 -24.713 137 1HB ASP 17 1HB ASP 17 10.420 25.312 -24.669 138 2HB ASP 17 2HB ASP 17 9.920 26.700 -25.644 139 H LEU 18 H LEU 18 9.100 23.284 -25.582 140 HA LEU 18 HA LEU 18 8.726 23.518 -28.373 141 1HB LEU 18 1HB LEU 18 10.093 21.806 -27.359 142 2HB LEU 18 2HB LEU 18 8.700 21.021 -26.615 143 HG LEU 18 HG LEU 18 8.652 21.429 -29.612 144 1HD1 LEU 18 1HD1 LEU 18 10.929 20.630 -29.213 145 2HD1 LEU 18 2HD1 LEU 18 10.296 19.276 -28.242 146 3HD1 LEU 18 3HD1 LEU 18 9.933 19.381 -29.982 147 1HD2 LEU 18 1HD2 LEU 18 7.778 19.139 -27.775 148 2HD2 LEU 18 2HD2 LEU 18 6.703 20.304 -28.574 149 3HD2 LEU 18 3HD2 LEU 18 7.612 19.151 -29.541 150 H PHE 19 H PHE 19 6.533 22.027 -25.917 151 HA PHE 19 HA PHE 19 4.495 21.424 -27.801 152 1HB PHE 19 1HB PHE 19 4.296 22.003 -24.828 153 2HB PHE 19 2HB PHE 19 2.999 21.300 -25.797 154 HD1 PHE 19 HD1 PHE 19 4.706 19.305 -27.466 155 HD2 PHE 19 HD2 PHE 19 4.443 20.217 -23.259 156 HE1 PHE 19 HE1 PHE 19 5.323 16.997 -26.938 157 HE2 PHE 19 HE2 PHE 19 4.891 17.828 -22.737 158 HZ PHE 19 HZ PHE 19 5.449 16.238 -24.567 159 H ASP 20 H ASP 20 5.070 24.408 -25.907 160 HA ASP 20 HA ASP 20 2.724 25.724 -27.062 161 1HB ASP 20 1HB ASP 20 3.645 26.423 -24.882 162 2HB ASP 20 2HB ASP 20 5.153 26.897 -25.675 163 H THR 21 H THR 21 3.604 24.646 -29.193 164 HA THR 21 HA THR 21 5.721 25.644 -30.687 165 HB THR 21 HB THR 21 4.356 24.988 -32.677 166 HG1 THR 21 HG1 THR 21 2.327 24.872 -30.714 167 1HG2 THR 21 1HG2 THR 21 4.176 22.620 -32.143 168 2HG2 THR 21 2HG2 THR 21 5.647 23.279 -31.406 169 3HG2 THR 21 3HG2 THR 21 4.217 22.953 -30.407 170 H ASP 22 H ASP 22 2.487 27.080 -30.236 171 HA ASP 22 HA ASP 22 2.811 29.171 -32.169 172 1HB ASP 22 1HB ASP 22 0.634 28.433 -31.255 173 2HB ASP 22 2HB ASP 22 1.079 29.077 -29.667 174 H GLY 23 H GLY 23 4.183 28.766 -28.969 175 1HA GLY 23 1HA GLY 23 5.500 30.104 -27.697 176 2HA GLY 23 2HA GLY 23 5.680 31.195 -29.080 177 H SER 24 H SER 24 2.559 30.287 -27.541 178 HA SER 24 HA SER 24 1.750 33.009 -27.291 179 1HB SER 24 1HB SER 24 0.548 30.682 -25.757 180 2HB SER 24 2HB SER 24 -0.250 32.126 -26.394 181 HG SER 24 HG SER 24 0.394 31.250 -28.536 182 H GLY 25 H GLY 25 3.533 30.871 -25.170 183 1HA GLY 25 1HA GLY 25 4.741 31.703 -23.241 184 2HA GLY 25 2HA GLY 25 3.400 32.800 -22.875 185 H THR 26 H THR 26 1.563 30.454 -23.849 186 HA THR 26 HA THR 26 1.612 28.631 -21.523 187 HB THR 26 HB THR 26 -0.712 29.056 -21.155 188 HG1 THR 26 HG1 THR 26 -1.781 30.619 -22.237 189 1HG2 THR 26 1HG2 THR 26 -0.593 31.145 -20.006 190 2HG2 THR 26 2HG2 THR 26 1.040 30.454 -19.925 191 3HG2 THR 26 3HG2 THR 26 0.685 31.755 -21.070 192 H ILE 27 H ILE 27 0.621 26.626 -22.012 193 HA ILE 27 HA ILE 27 0.726 25.929 -24.884 194 HB ILE 27 HB ILE 27 0.250 24.330 -22.365 195 1HG1 ILE 27 1HG1 ILE 27 2.539 24.349 -24.386 196 2HG1 ILE 27 2HG1 ILE 27 2.566 25.201 -22.836 197 1HG2 ILE 27 1HG2 ILE 27 -1.017 23.313 -24.278 198 2HG2 ILE 27 2HG2 ILE 27 0.500 23.274 -25.208 199 3HG2 ILE 27 3HG2 ILE 27 0.296 22.305 -23.742 200 1HD1 ILE 27 1HD1 ILE 27 3.717 23.133 -22.580 201 2HD1 ILE 27 2HD1 ILE 27 2.195 23.013 -21.671 202 3HD1 ILE 27 3HD1 ILE 27 2.389 22.190 -23.242 203 H ASP 28 H ASP 28 -1.122 26.101 -26.178 204 HA ASP 28 HA ASP 28 -3.750 26.552 -24.996 205 1HB ASP 28 1HB ASP 28 -3.137 27.461 -27.205 206 2HB ASP 28 2HB ASP 28 -2.944 25.818 -27.839 207 H ALA 29 H ALA 29 -5.458 25.067 -24.744 208 HA ALA 29 HA ALA 29 -5.152 22.476 -24.057 209 1HB ALA 29 1HB ALA 29 -7.482 23.625 -25.645 210 2HB ALA 29 2HB ALA 29 -7.523 22.147 -24.661 211 3HB ALA 29 3HB ALA 29 -7.256 23.720 -23.884 212 H LYS 30 H LYS 30 -5.607 23.527 -27.484 213 HA LYS 30 HA LYS 30 -5.681 20.888 -28.598 214 1HB LYS 30 1HB LYS 30 -4.806 23.537 -29.824 215 2HB LYS 30 2HB LYS 30 -5.098 22.031 -30.709 216 1HG LYS 30 1HG LYS 30 -7.457 22.020 -30.018 217 2HG LYS 30 2HG LYS 30 -7.206 23.434 -28.999 218 1HD LYS 30 1HD LYS 30 -8.280 24.096 -31.074 219 2HD LYS 30 2HD LYS 30 -6.692 24.846 -30.910 220 1HE LYS 30 1HE LYS 30 -7.146 24.071 -33.221 221 2HE LYS 30 2HE LYS 30 -5.726 23.279 -32.537 222 1HZ LYS 30 1HZ LYS 30 -7.090 21.372 -32.073 223 2HZ LYS 30 2HZ LYS 30 -7.162 21.751 -33.674 224 3HZ LYS 30 3HZ LYS 30 -8.426 22.121 -32.683 225 H GLU 31 H GLU 31 -2.982 23.145 -27.921 226 HA GLU 31 HA GLU 31 -0.917 21.515 -29.129 227 1HB GLU 31 1HB GLU 31 -0.812 23.692 -27.008 228 2HB GLU 31 2HB GLU 31 0.596 22.895 -27.708 229 1HG GLU 31 1HG GLU 31 0.025 23.729 -29.938 230 2HG GLU 31 2HG GLU 31 -1.452 24.481 -29.317 231 H LEU 32 H LEU 32 -2.414 21.751 -25.868 232 HA LEU 32 HA LEU 32 -0.650 19.848 -24.673 233 1HB LEU 32 1HB LEU 32 -2.438 21.402 -23.508 234 2HB LEU 32 2HB LEU 32 -3.537 20.047 -23.825 235 HG LEU 32 HG LEU 32 -1.738 18.553 -22.679 236 1HD1 LEU 32 1HD1 LEU 32 -0.810 21.275 -21.682 237 2HD1 LEU 32 2HD1 LEU 32 -0.361 19.711 -20.978 238 3HD1 LEU 32 3HD1 LEU 32 0.155 20.104 -22.613 239 1HD2 LEU 32 1HD2 LEU 32 -2.635 19.143 -20.428 240 2HD2 LEU 32 2HD2 LEU 32 -3.351 20.610 -21.127 241 3HD2 LEU 32 3HD2 LEU 32 -3.896 19.009 -21.663 242 H LYS 33 H LYS 33 -3.781 19.444 -26.404 243 HA LYS 33 HA LYS 33 -3.955 16.629 -26.093 244 1HB LYS 33 1HB LYS 33 -5.773 18.047 -26.854 245 2HB LYS 33 2HB LYS 33 -4.942 18.338 -28.396 246 1HG LYS 33 1HG LYS 33 -5.043 15.897 -28.893 247 2HG LYS 33 2HG LYS 33 -5.882 15.631 -27.349 248 1HD LYS 33 1HD LYS 33 -7.738 17.097 -28.098 249 2HD LYS 33 2HD LYS 33 -6.879 17.416 -29.620 250 1HE LYS 33 1HE LYS 33 -6.981 14.983 -30.176 251 2HE LYS 33 2HE LYS 33 -7.869 14.687 -28.669 252 1HZ LYS 33 1HZ LYS 33 -9.593 16.126 -29.477 253 2HZ LYS 33 2HZ LYS 33 -8.771 16.389 -30.881 254 3HZ LYS 33 3HZ LYS 33 -9.329 14.880 -30.525 255 H VAL 34 H VAL 34 -2.362 18.556 -28.688 256 HA VAL 34 HA VAL 34 -1.274 16.343 -30.111 257 HB VAL 34 HB VAL 34 -0.257 19.189 -29.727 258 1HG1 VAL 34 1HG1 VAL 34 1.706 17.849 -30.302 259 2HG1 VAL 34 2HG1 VAL 34 0.800 17.030 -31.596 260 3HG1 VAL 34 3HG1 VAL 34 1.180 18.760 -31.720 261 1HG2 VAL 34 1HG2 VAL 34 -1.123 19.500 -32.003 262 2HG2 VAL 34 2HG2 VAL 34 -1.609 17.794 -32.080 263 3HG2 VAL 34 3HG2 VAL 34 -2.420 18.902 -30.961 264 H ALA 35 H ALA 35 0.132 18.195 -27.354 265 HA ALA 35 HA ALA 35 2.522 16.760 -27.085 266 1HB ALA 35 1HB ALA 35 0.801 17.927 -24.849 267 2HB ALA 35 2HB ALA 35 2.498 17.496 -24.746 268 3HB ALA 35 3HB ALA 35 1.985 18.815 -25.824 269 H MET 36 H MET 36 -0.674 16.051 -25.618 270 HA MET 36 HA MET 36 0.162 13.678 -24.267 271 1HB MET 36 1HB MET 36 -2.525 14.797 -25.045 272 2HB MET 36 2HB MET 36 -2.357 13.269 -24.174 273 1HG MET 36 1HG MET 36 -0.980 14.362 -22.433 274 2HG MET 36 2HG MET 36 -1.188 15.917 -23.231 275 1HE MET 36 1HE MET 36 -3.365 17.185 -23.386 276 2HE MET 36 2HE MET 36 -4.291 15.826 -24.038 277 3HE MET 36 3HE MET 36 -4.906 16.730 -22.631 278 H ARG 37 H ARG 37 -1.215 14.121 -27.557 279 HA ARG 37 HA ARG 37 -1.144 11.312 -28.184 280 1HB ARG 37 1HB ARG 37 -0.833 13.776 -29.944 281 2HB ARG 37 2HB ARG 37 -0.861 12.134 -30.574 282 1HG ARG 37 1HG ARG 37 -3.109 13.421 -28.950 283 2HG ARG 37 2HG ARG 37 -3.065 13.274 -30.708 284 1HD ARG 37 1HD ARG 37 -3.224 11.009 -28.686 285 2HD ARG 37 2HD ARG 37 -4.461 11.528 -29.819 286 HE ARG 37 HE ARG 37 -2.909 10.908 -31.670 287 1HH1 ARG 37 1HH1 ARG 37 -2.661 9.096 -28.551 288 2HH1 ARG 37 2HH1 ARG 37 -2.003 7.708 -29.348 289 1HH2 ARG 37 1HH2 ARG 37 -2.033 9.076 -32.590 290 2HH2 ARG 37 2HH2 ARG 37 -1.662 7.672 -31.629 291 H ALA 38 H ALA 38 1.423 13.829 -28.461 292 HA ALA 38 HA ALA 38 3.410 12.049 -29.456 293 1HB ALA 38 1HB ALA 38 5.034 13.689 -28.738 294 2HB ALA 38 2HB ALA 38 3.633 14.515 -29.446 295 3HB ALA 38 3HB ALA 38 3.858 14.486 -27.685 296 H LEU 39 H LEU 39 2.384 12.746 -26.107 297 HA LEU 39 HA LEU 39 4.278 10.940 -24.859 298 1HB LEU 39 1HB LEU 39 1.639 12.082 -23.884 299 2HB LEU 39 2HB LEU 39 2.764 11.191 -22.880 300 HG LEU 39 HG LEU 39 3.643 13.739 -24.287 301 1HD1 LEU 39 1HD1 LEU 39 3.173 14.900 -22.115 302 2HD1 LEU 39 2HD1 LEU 39 1.702 14.405 -22.945 303 3HD1 LEU 39 3HD1 LEU 39 2.291 13.457 -21.568 304 1HD2 LEU 39 1HD2 LEU 39 4.626 12.288 -21.795 305 2HD2 LEU 39 2HD2 LEU 39 5.420 12.276 -23.384 306 3HD2 LEU 39 3HD2 LEU 39 5.299 13.785 -22.471 307 H GLY 40 H GLY 40 1.772 10.165 -26.953 308 1HA GLY 40 1HA GLY 40 1.055 8.106 -27.578 309 2HA GLY 40 2HA GLY 40 1.917 7.370 -26.220 310 H PHE 41 H PHE 41 -0.313 9.996 -25.512 311 HA PHE 41 HA PHE 41 -2.004 8.187 -23.933 312 1HB PHE 41 1HB PHE 41 -2.138 11.138 -24.588 313 2HB PHE 41 2HB PHE 41 -3.301 10.335 -23.570 314 HD1 PHE 41 HD1 PHE 41 0.137 9.124 -22.983 315 HD2 PHE 41 HD2 PHE 41 -2.746 12.186 -21.963 316 HE1 PHE 41 HE1 PHE 41 1.487 9.753 -21.049 317 HE2 PHE 41 HE2 PHE 41 -1.374 12.798 -19.999 318 HZ PHE 41 HZ PHE 41 0.752 11.587 -19.535 319 H GLU 42 H GLU 42 -4.323 8.105 -24.193 320 HA GLU 42 HA GLU 42 -5.347 8.490 -26.976 321 1HB GLU 42 1HB GLU 42 -5.376 6.174 -26.132 322 2HB GLU 42 2HB GLU 42 -6.395 6.681 -24.772 323 1HG GLU 42 1HG GLU 42 -8.152 7.421 -26.358 324 2HG GLU 42 2HG GLU 42 -7.109 7.000 -27.728 325 HA PRO 43 HA PRO 43 -7.100 12.020 -24.679 326 1HB PRO 43 1HB PRO 43 -8.209 12.358 -27.484 327 2HB PRO 43 2HB PRO 43 -7.724 13.634 -26.323 328 1HG PRO 43 1HG PRO 43 -5.981 12.846 -28.229 329 2HG PRO 43 2HG PRO 43 -5.403 13.002 -26.543 330 1HD PRO 43 1HD PRO 43 -6.151 10.473 -28.030 331 2HD PRO 43 2HD PRO 43 -4.805 10.805 -26.883 332 H LYS 44 H LYS 44 -8.353 10.219 -23.561 333 HA LYS 44 HA LYS 44 -11.124 9.777 -24.149 334 1HB LYS 44 1HB LYS 44 -9.553 9.870 -21.542 335 2HB LYS 44 2HB LYS 44 -11.235 9.347 -21.653 336 1HG LYS 44 1HG LYS 44 -8.886 7.996 -23.065 337 2HG LYS 44 2HG LYS 44 -9.624 7.499 -21.541 338 1HD LYS 44 1HD LYS 44 -11.861 7.322 -22.829 339 2HD LYS 44 2HD LYS 44 -10.900 7.514 -24.307 340 1HE LYS 44 1HE LYS 44 -11.198 5.166 -23.980 341 2HE LYS 44 2HE LYS 44 -9.509 5.524 -23.589 342 1HZ LYS 44 1HZ LYS 44 -11.691 5.199 -21.642 343 2HZ LYS 44 2HZ LYS 44 -10.534 4.077 -21.989 344 3HZ LYS 44 3HZ LYS 44 -10.114 5.499 -21.272 345 H LYS 45 H LYS 45 -11.696 11.803 -24.957 346 HA LYS 45 HA LYS 45 -11.577 14.271 -24.366 347 1HB LYS 45 1HB LYS 45 -14.260 12.914 -24.809 348 2HB LYS 45 2HB LYS 45 -13.989 14.664 -24.912 349 1HG LYS 45 1HG LYS 45 -12.367 14.359 -26.732 350 2HG LYS 45 2HG LYS 45 -12.490 12.608 -26.606 351 1HD LYS 45 1HD LYS 45 -13.806 13.382 -28.489 352 2HD LYS 45 2HD LYS 45 -14.832 12.626 -27.270 353 1HE LYS 45 1HE LYS 45 -15.866 14.649 -28.237 354 2HE LYS 45 2HE LYS 45 -15.623 14.825 -26.499 355 1HZ LYS 45 1HZ LYS 45 -13.658 16.109 -26.974 356 2HZ LYS 45 2HZ LYS 45 -13.877 15.923 -28.597 357 3HZ LYS 45 3HZ LYS 45 -14.974 16.774 -27.709 358 H GLU 46 H GLU 46 -14.099 12.510 -22.444 359 HA GLU 46 HA GLU 46 -14.646 14.704 -20.766 360 1HB GLU 46 1HB GLU 46 -15.774 13.191 -19.310 361 2HB GLU 46 2HB GLU 46 -16.154 12.820 -20.986 362 1HG GLU 46 1HG GLU 46 -14.267 11.240 -19.170 363 2HG GLU 46 2HG GLU 46 -15.912 10.806 -19.603 364 H GLU 47 H GLU 47 -12.167 12.154 -20.376 365 HA GLU 47 HA GLU 47 -11.416 12.988 -17.688 366 1HB GLU 47 1HB GLU 47 -9.893 11.291 -19.709 367 2HB GLU 47 2HB GLU 47 -9.496 11.523 -18.004 368 1HG GLU 47 1HG GLU 47 -11.741 10.545 -17.393 369 2HG GLU 47 2HG GLU 47 -11.999 10.171 -19.105 370 H ILE 48 H ILE 48 -10.264 13.552 -21.021 371 HA ILE 48 HA ILE 48 -8.012 15.202 -20.423 372 HB ILE 48 HB ILE 48 -9.953 15.139 -22.757 373 1HG1 ILE 48 1HG1 ILE 48 -8.423 13.144 -22.299 374 2HG1 ILE 48 2HG1 ILE 48 -8.401 13.865 -23.907 375 1HG2 ILE 48 1HG2 ILE 48 -8.223 16.426 -24.034 376 2HG2 ILE 48 2HG2 ILE 48 -9.103 17.361 -22.825 377 3HG2 ILE 48 3HG2 ILE 48 -7.449 16.818 -22.480 378 1HD1 ILE 48 1HD1 ILE 48 -6.120 13.283 -22.986 379 2HD1 ILE 48 2HD1 ILE 48 -6.313 14.960 -23.510 380 3HD1 ILE 48 3HD1 ILE 48 -6.328 14.558 -21.777 381 H LYS 49 H LYS 49 -11.432 16.163 -21.024 382 HA LYS 49 HA LYS 49 -11.087 18.926 -20.537 383 1HB LYS 49 1HB LYS 49 -13.477 17.081 -20.185 384 2HB LYS 49 2HB LYS 49 -13.557 18.837 -19.960 385 1HG LYS 49 1HG LYS 49 -12.922 19.263 -22.250 386 2HG LYS 49 2HG LYS 49 -12.509 17.574 -22.523 387 1HD LYS 49 1HD LYS 49 -14.672 18.119 -23.546 388 2HD LYS 49 2HD LYS 49 -14.816 16.864 -22.313 389 1HE LYS 49 1HE LYS 49 -16.672 18.502 -22.207 390 2HE LYS 49 2HE LYS 49 -15.747 18.469 -20.705 391 1HZ LYS 49 1HZ LYS 49 -15.444 20.452 -22.857 392 2HZ LYS 49 2HZ LYS 49 -16.231 20.692 -21.429 393 3HZ LYS 49 3HZ LYS 49 -14.604 20.435 -21.438 394 H LYS 50 H LYS 50 -12.096 16.331 -18.227 395 HA LYS 50 HA LYS 50 -12.293 17.979 -15.938 396 1HB LYS 50 1HB LYS 50 -11.520 15.059 -16.261 397 2HB LYS 50 2HB LYS 50 -11.735 15.842 -14.685 398 1HG LYS 50 1HG LYS 50 -14.045 16.316 -15.098 399 2HG LYS 50 2HG LYS 50 -13.908 15.918 -16.812 400 1HD LYS 50 1HD LYS 50 -15.039 14.120 -15.624 401 2HD LYS 50 2HD LYS 50 -13.505 13.556 -16.299 402 1HE LYS 50 1HE LYS 50 -12.431 13.718 -14.076 403 2HE LYS 50 2HE LYS 50 -13.915 14.406 -13.389 404 1HZ LYS 50 1HZ LYS 50 -15.018 12.352 -13.901 405 2HZ LYS 50 2HZ LYS 50 -13.640 11.724 -14.553 406 3HZ LYS 50 3HZ LYS 50 -13.704 12.082 -12.946 407 H MET 51 H MET 51 -9.436 16.016 -16.970 408 HA MET 51 HA MET 51 -7.691 16.853 -14.992 409 1HB MET 51 1HB MET 51 -7.440 14.954 -16.547 410 2HB MET 51 2HB MET 51 -7.084 16.054 -17.879 411 1HG MET 51 1HG MET 51 -5.514 15.952 -15.282 412 2HG MET 51 2HG MET 51 -5.137 14.906 -16.649 413 1HE MET 51 1HE MET 51 -4.022 15.622 -18.853 414 2HE MET 51 2HE MET 51 -5.371 16.729 -19.227 415 3HE MET 51 3HE MET 51 -3.693 17.307 -19.309 416 H ILE 52 H ILE 52 -8.054 18.237 -18.308 417 HA ILE 52 HA ILE 52 -6.222 20.356 -18.023 418 HB ILE 52 HB ILE 52 -8.753 20.027 -19.671 419 1HG1 ILE 52 1HG1 ILE 52 -5.776 20.195 -20.363 420 2HG1 ILE 52 2HG1 ILE 52 -6.689 18.695 -20.190 421 1HG2 ILE 52 1HG2 ILE 52 -6.882 22.428 -19.749 422 2HG2 ILE 52 2HG2 ILE 52 -8.168 22.080 -20.921 423 3HG2 ILE 52 3HG2 ILE 52 -8.590 22.451 -19.266 424 1HD1 ILE 52 1HD1 ILE 52 -6.520 19.134 -22.523 425 2HD1 ILE 52 2HD1 ILE 52 -8.200 19.490 -22.066 426 3HD1 ILE 52 3HD1 ILE 52 -7.040 20.810 -22.344 427 H SER 53 H SER 53 -9.741 20.322 -17.183 428 HA SER 53 HA SER 53 -9.781 23.010 -16.278 429 1HB SER 53 1HB SER 53 -11.485 20.684 -15.276 430 2HB SER 53 2HB SER 53 -11.846 22.414 -15.127 431 HG SER 53 HG SER 53 -11.628 20.890 -17.520 432 H GLU 54 H GLU 54 -9.117 19.993 -14.448 433 HA GLU 54 HA GLU 54 -8.828 21.201 -11.887 434 1HB GLU 54 1HB GLU 54 -7.576 18.708 -13.104 435 2HB GLU 54 2HB GLU 54 -7.411 19.159 -11.402 436 1HG GLU 54 1HG GLU 54 -9.788 19.000 -11.022 437 2HG GLU 54 2HG GLU 54 -10.130 18.798 -12.741 438 H ILE 55 H ILE 55 -6.405 20.624 -14.480 439 HA ILE 55 HA ILE 55 -4.223 21.776 -12.936 440 HB ILE 55 HB ILE 55 -4.562 21.209 -15.906 441 1HG1 ILE 55 1HG1 ILE 55 -4.636 19.140 -14.625 442 2HG1 ILE 55 2HG1 ILE 55 -3.138 19.270 -15.533 443 1HG2 ILE 55 1HG2 ILE 55 -2.054 21.301 -15.995 444 2HG2 ILE 55 2HG2 ILE 55 -2.849 22.850 -15.733 445 3HG2 ILE 55 3HG2 ILE 55 -2.070 22.021 -14.369 446 1HD1 ILE 55 1HD1 ILE 55 -1.970 19.948 -13.397 447 2HD1 ILE 55 2HD1 ILE 55 -3.501 19.667 -12.535 448 3HD1 ILE 55 3HD1 ILE 55 -2.694 18.332 -13.368 449 H ASP 56 H ASP 56 -6.623 23.079 -15.216 450 HA ASP 56 HA ASP 56 -5.212 25.573 -15.595 451 1HB ASP 56 1HB ASP 56 -6.610 24.571 -17.343 452 2HB ASP 56 2HB ASP 56 -8.044 24.748 -16.312 453 H LYS 57 H LYS 57 -4.954 26.005 -13.285 454 HA LYS 57 HA LYS 57 -7.253 27.015 -11.765 455 1HB LYS 57 1HB LYS 57 -4.287 27.543 -11.318 456 2HB LYS 57 2HB LYS 57 -5.596 27.766 -10.161 457 1HG LYS 57 1HG LYS 57 -4.488 25.150 -11.271 458 2HG LYS 57 2HG LYS 57 -4.388 25.742 -9.619 459 1HD LYS 57 1HD LYS 57 -6.916 24.812 -11.065 460 2HD LYS 57 2HD LYS 57 -6.017 23.936 -9.835 461 1HE LYS 57 1HE LYS 57 -6.515 25.724 -8.168 462 2HE LYS 57 2HE LYS 57 -7.474 26.586 -9.385 463 1HZ LYS 57 1HZ LYS 57 -8.842 25.253 -7.991 464 2HZ LYS 57 2HZ LYS 57 -8.895 24.687 -9.538 465 3HZ LYS 57 3HZ LYS 57 -8.019 23.883 -8.396 466 H ASP 58 H ASP 58 -4.520 28.452 -13.518 467 HA ASP 58 HA ASP 58 -5.868 31.133 -13.546 468 1HB ASP 58 1HB ASP 58 -3.648 32.105 -13.565 469 2HB ASP 58 2HB ASP 58 -3.835 31.051 -12.158 470 H GLY 59 H GLY 59 -4.405 28.604 -15.482 471 1HA GLY 59 1HA GLY 59 -3.388 30.029 -17.623 472 2HA GLY 59 2HA GLY 59 -3.955 28.362 -17.642 473 H SER 60 H SER 60 -6.779 29.333 -17.013 474 HA SER 60 HA SER 60 -8.694 29.966 -18.075 475 1HB SER 60 1HB SER 60 -6.921 32.231 -19.090 476 2HB SER 60 2HB SER 60 -8.689 32.244 -18.957 477 HG SER 60 HG SER 60 -6.801 32.023 -16.828 478 H GLY 61 H GLY 61 -7.947 27.889 -19.436 479 1HA GLY 61 1HA GLY 61 -8.689 27.022 -21.500 480 2HA GLY 61 2HA GLY 61 -8.454 28.579 -22.298 481 H THR 62 H THR 62 -5.703 28.825 -20.922 482 HA THR 62 HA THR 62 -4.222 26.834 -22.588 483 HB THR 62 HB THR 62 -2.339 28.352 -22.559 484 HG1 THR 62 HG1 THR 62 -4.014 29.991 -20.943 485 1HG2 THR 62 1HG2 THR 62 -4.122 28.663 -24.331 486 2HG2 THR 62 2HG2 THR 62 -4.841 29.937 -23.333 487 3HG2 THR 62 3HG2 THR 62 -3.202 30.130 -23.976 488 H ILE 63 H ILE 63 -2.054 26.295 -21.460 489 HA ILE 63 HA ILE 63 -2.415 25.961 -18.509 490 HB ILE 63 HB ILE 63 -0.786 24.253 -20.413 491 1HG1 ILE 63 1HG1 ILE 63 -3.145 23.877 -20.920 492 2HG1 ILE 63 2HG1 ILE 63 -2.399 22.487 -20.142 493 1HG2 ILE 63 1HG2 ILE 63 -1.448 23.941 -17.464 494 2HG2 ILE 63 2HG2 ILE 63 -0.660 22.704 -18.467 495 3HG2 ILE 63 3HG2 ILE 63 0.134 24.258 -18.184 496 1HD1 ILE 63 1HD1 ILE 63 -3.468 23.047 -17.998 497 2HD1 ILE 63 2HD1 ILE 63 -4.205 24.494 -18.723 498 3HD1 ILE 63 3HD1 ILE 63 -4.657 22.880 -19.292 499 H ASP 64 H ASP 64 -1.094 27.236 -17.397 500 HA ASP 64 HA ASP 64 1.122 28.694 -18.580 501 1HB ASP 64 1HB ASP 64 -0.238 29.738 -16.845 502 2HB ASP 64 2HB ASP 64 0.083 28.403 -15.729 503 H PHE 65 H PHE 65 3.329 28.586 -17.808 504 HA PHE 65 HA PHE 65 4.520 26.084 -17.867 505 1HB PHE 65 1HB PHE 65 5.808 28.080 -18.228 506 2HB PHE 65 2HB PHE 65 5.478 28.658 -16.590 507 HD1 PHE 65 HD1 PHE 65 6.725 25.402 -18.079 508 HD2 PHE 65 HD2 PHE 65 7.353 28.536 -15.174 509 HE1 PHE 65 HE1 PHE 65 8.676 24.181 -17.163 510 HE2 PHE 65 HE2 PHE 65 9.306 27.317 -14.287 511 HZ PHE 65 HZ PHE 65 9.993 25.145 -15.295 512 H GLU 66 H GLU 66 3.667 27.922 -14.840 513 HA GLU 66 HA GLU 66 4.792 25.872 -13.169 514 1HB GLU 66 1HB GLU 66 2.693 27.992 -12.537 515 2HB GLU 66 2HB GLU 66 3.536 26.996 -11.346 516 1HG GLU 66 1HG GLU 66 4.865 28.979 -13.256 517 2HG GLU 66 2HG GLU 66 4.562 29.229 -11.534 518 H GLU 67 H GLU 67 1.537 26.357 -14.514 519 HA GLU 67 HA GLU 67 0.232 24.280 -13.016 520 1HB GLU 67 1HB GLU 67 -0.344 25.406 -15.785 521 2HB GLU 67 2HB GLU 67 -1.408 24.330 -14.876 522 1HG GLU 67 1HG GLU 67 -1.687 25.952 -13.094 523 2HG GLU 67 2HG GLU 67 -0.572 27.082 -13.876 524 H PHE 68 H PHE 68 1.838 24.329 -16.226 525 HA PHE 68 HA PHE 68 1.577 21.572 -16.846 526 1HB PHE 68 1HB PHE 68 2.245 23.295 -18.454 527 2HB PHE 68 2HB PHE 68 3.735 23.586 -17.579 528 HD1 PHE 68 HD1 PHE 68 1.886 21.097 -19.649 529 HD2 PHE 68 HD2 PHE 68 5.669 22.186 -17.883 530 HE1 PHE 68 HE1 PHE 68 3.057 19.574 -21.212 531 HE2 PHE 68 HE2 PHE 68 6.834 20.665 -19.465 532 HZ PHE 68 HZ PHE 68 5.554 19.402 -21.143 533 H LEU 69 H LEU 69 4.150 23.329 -15.099 534 HA LEU 69 HA LEU 69 5.910 21.214 -14.572 535 1HB LEU 69 1HB LEU 69 5.981 23.828 -14.109 536 2HB LEU 69 2HB LEU 69 5.371 23.379 -12.518 537 HG LEU 69 HG LEU 69 7.980 22.565 -13.860 538 1HD1 LEU 69 1HD1 LEU 69 8.990 23.914 -12.076 539 2HD1 LEU 69 2HD1 LEU 69 7.821 24.887 -12.988 540 3HD1 LEU 69 3HD1 LEU 69 7.384 24.253 -11.392 541 1HD2 LEU 69 1HD2 LEU 69 7.303 20.649 -12.515 542 2HD2 LEU 69 2HD2 LEU 69 8.576 21.528 -11.670 543 3HD2 LEU 69 3HD2 LEU 69 6.889 21.708 -11.141 544 H THR 70 H THR 70 3.131 22.426 -12.654 545 HA THR 70 HA THR 70 3.256 20.502 -10.587 546 HB THR 70 HB THR 70 0.753 21.875 -11.661 547 HG1 THR 70 HG1 THR 70 2.379 23.385 -11.168 548 1HG2 THR 70 1HG2 THR 70 0.278 20.081 -10.016 549 2HG2 THR 70 2HG2 THR 70 1.474 20.785 -8.905 550 3HG2 THR 70 3HG2 THR 70 0.001 21.684 -9.316 551 H MET 71 H MET 71 1.402 20.455 -13.676 552 HA MET 71 HA MET 71 0.121 17.984 -13.342 553 1HB MET 71 1HB MET 71 -0.332 19.692 -15.081 554 2HB MET 71 2HB MET 71 1.131 19.236 -15.937 555 1HG MET 71 1HG MET 71 -1.146 17.313 -15.313 556 2HG MET 71 2HG MET 71 -1.069 18.276 -16.786 557 1HE MET 71 1HE MET 71 0.636 17.956 -18.735 558 2HE MET 71 2HE MET 71 2.042 18.100 -17.650 559 3HE MET 71 3HE MET 71 1.905 16.710 -18.745 560 H MET 72 H MET 72 3.309 18.654 -14.884 561 HA MET 72 HA MET 72 4.039 15.942 -15.329 562 1HB MET 72 1HB MET 72 5.684 18.452 -14.822 563 2HB MET 72 2HB MET 72 6.426 16.878 -15.143 564 1HG MET 72 1HG MET 72 4.447 18.231 -17.014 565 2HG MET 72 2HG MET 72 6.202 18.296 -17.166 566 1HE MET 72 1HE MET 72 6.125 17.462 -19.638 567 2HE MET 72 2HE MET 72 5.241 16.011 -20.168 568 3HE MET 72 3HE MET 72 4.342 17.414 -19.538 569 H THR 73 H THR 73 4.748 18.025 -12.507 570 HA THR 73 HA THR 73 6.171 16.153 -10.989 571 HB THR 73 HB THR 73 4.277 18.281 -9.913 572 HG1 THR 73 HG1 THR 73 5.800 19.141 -11.358 573 1HG2 THR 73 1HG2 THR 73 5.859 18.319 -8.007 574 2HG2 THR 73 2HG2 THR 73 5.078 16.736 -8.148 575 3HG2 THR 73 3HG2 THR 73 6.750 16.956 -8.712 576 H ALA 74 H ALA 74 2.617 16.647 -11.149 577 HA ALA 74 HA ALA 74 1.879 14.783 -9.180 578 1HB ALA 74 1HB ALA 74 0.355 16.440 -10.207 579 2HB ALA 74 2HB ALA 74 0.360 15.502 -11.717 580 3HB ALA 74 3HB ALA 74 -0.315 14.796 -10.238 581 H LYS 75 H LYS 75 3.073 14.141 -12.470 582 HA LYS 75 HA LYS 75 2.052 11.379 -12.447 583 1HB LYS 75 1HB LYS 75 3.961 12.793 -14.334 584 2HB LYS 75 2HB LYS 75 3.313 11.159 -14.534 585 1HG LYS 75 1HG LYS 75 0.986 12.118 -14.464 586 2HG LYS 75 2HG LYS 75 1.684 13.740 -14.503 587 1HD LYS 75 1HD LYS 75 2.113 11.580 -16.629 588 2HD LYS 75 2HD LYS 75 0.929 12.896 -16.731 589 1HE LYS 75 1HE LYS 75 2.755 14.568 -16.601 590 2HE LYS 75 2HE LYS 75 3.959 13.266 -16.567 591 1HZ LYS 75 1HZ LYS 75 3.669 14.159 -18.736 592 2HZ LYS 75 2HZ LYS 75 3.185 12.584 -18.716 593 3HZ LYS 75 3HZ LYS 75 2.064 13.794 -18.742 594 H MET 76 H MET 76 4.745 12.973 -10.963 595 HA MET 76 HA MET 76 6.619 10.753 -11.322 596 1HB MET 76 1HB MET 76 6.742 13.148 -9.449 597 2HB MET 76 2HB MET 76 8.056 12.021 -9.819 598 1HG MET 76 1HG MET 76 7.942 12.680 -12.213 599 2HG MET 76 2HG MET 76 6.666 13.843 -11.827 600 1HE MET 76 1HE MET 76 9.592 16.192 -12.720 601 2HE MET 76 2HE MET 76 9.154 14.645 -13.483 602 3HE MET 76 3HE MET 76 7.881 15.792 -12.994 Start of MODEL 11 1 H ARG 1 H ARG 1 15.237 14.710 -10.108 2 HA ARG 1 HA ARG 1 15.755 12.557 -9.753 3 1HB ARG 1 1HB ARG 1 17.856 11.695 -9.109 4 2HB ARG 1 2HB ARG 1 17.983 12.503 -10.664 5 1HG ARG 1 1HG ARG 1 18.979 13.694 -8.034 6 2HG ARG 1 2HG ARG 1 19.934 12.715 -9.122 7 1HD ARG 1 1HD ARG 1 18.673 15.373 -9.879 8 2HD ARG 1 2HD ARG 1 20.355 15.136 -9.447 9 HE ARG 1 HE ARG 1 19.071 14.573 -11.986 10 1HH1 ARG 1 1HH1 ARG 1 21.764 13.570 -9.927 11 2HH1 ARG 1 2HH1 ARG 1 22.748 13.016 -11.254 12 1HH2 ARG 1 1HH2 ARG 1 20.353 13.917 -13.714 13 2HH2 ARG 1 2HH2 ARG 1 21.902 13.157 -13.449 14 H VAL 2 H VAL 2 17.214 15.164 -7.788 15 HA VAL 2 HA VAL 2 15.985 14.031 -5.319 16 HB VAL 2 HB VAL 2 16.989 16.031 -4.223 17 1HG1 VAL 2 1HG1 VAL 2 19.216 15.001 -4.075 18 2HG1 VAL 2 2HG1 VAL 2 17.947 13.769 -4.077 19 3HG1 VAL 2 3HG1 VAL 2 18.900 14.062 -5.547 20 1HG2 VAL 2 1HG2 VAL 2 17.504 17.512 -6.140 21 2HG2 VAL 2 2HG2 VAL 2 18.954 17.099 -5.237 22 3HG2 VAL 2 3HG2 VAL 2 18.641 16.300 -6.781 23 H GLY 3 H GLY 3 13.963 14.053 -6.299 24 1HA GLY 3 1HA GLY 3 11.867 14.913 -6.755 25 2HA GLY 3 2HA GLY 3 12.342 16.425 -5.949 26 H LEU 4 H LEU 4 11.421 17.753 -7.642 27 HA LEU 4 HA LEU 4 12.617 17.562 -10.343 28 1HB LEU 4 1HB LEU 4 10.835 19.721 -9.141 29 2HB LEU 4 2HB LEU 4 11.400 19.603 -10.812 30 HG LEU 4 HG LEU 4 9.389 17.820 -9.404 31 1HD1 LEU 4 1HD1 LEU 4 7.979 18.589 -11.294 32 2HD1 LEU 4 2HD1 LEU 4 8.658 19.971 -10.403 33 3HD1 LEU 4 3HD1 LEU 4 9.348 19.493 -11.961 34 1HD2 LEU 4 1HD2 LEU 4 10.751 16.248 -10.672 35 2HD2 LEU 4 2HD2 LEU 4 9.260 16.545 -11.566 36 3HD2 LEU 4 3HD2 LEU 4 10.765 17.332 -12.084 37 H THR 5 H THR 5 14.677 17.408 -9.457 38 HA THR 5 HA THR 5 16.090 19.681 -8.540 39 HB THR 5 HB THR 5 17.144 17.570 -10.481 40 HG1 THR 5 HG1 THR 5 16.182 17.231 -7.855 41 1HG2 THR 5 1HG2 THR 5 19.097 17.657 -8.944 42 2HG2 THR 5 2HG2 THR 5 18.754 19.229 -9.692 43 3HG2 THR 5 3HG2 THR 5 18.269 18.924 -8.005 44 H GLU 6 H GLU 6 17.480 21.092 -9.854 45 HA GLU 6 HA GLU 6 16.239 22.549 -11.782 46 1HB GLU 6 1HB GLU 6 19.247 22.068 -11.513 47 2HB GLU 6 2HB GLU 6 18.497 23.371 -12.446 48 1HG GLU 6 1HG GLU 6 17.396 24.228 -10.384 49 2HG GLU 6 2HG GLU 6 18.203 22.976 -9.427 50 H GLU 7 H GLU 7 18.505 19.834 -12.534 51 HA GLU 7 HA GLU 7 18.396 19.924 -15.289 52 1HB GLU 7 1HB GLU 7 19.796 18.416 -13.830 53 2HB GLU 7 2HB GLU 7 18.350 17.437 -13.506 54 1HG GLU 7 1HG GLU 7 18.165 17.033 -15.988 55 2HG GLU 7 2HG GLU 7 19.671 17.944 -16.195 56 H GLN 8 H GLN 8 15.980 18.396 -13.070 57 HA GLN 8 HA GLN 8 14.432 17.301 -15.280 58 1HB GLN 8 1HB GLN 8 13.639 17.732 -12.375 59 2HB GLN 8 2HB GLN 8 12.710 16.881 -13.620 60 1HG GLN 8 1HG GLN 8 14.974 15.500 -13.914 61 2HG GLN 8 2HG GLN 8 15.254 16.020 -12.249 62 1HE2 GLN 8 1HE2 GLN 8 13.411 15.385 -10.606 63 2HE2 GLN 8 2HE2 GLN 8 12.508 13.948 -11.021 64 H LYS 9 H LYS 9 14.308 20.280 -13.256 65 HA LYS 9 HA LYS 9 11.879 21.241 -14.454 66 1HB LYS 9 1HB LYS 9 14.148 22.794 -13.171 67 2HB LYS 9 2HB LYS 9 12.562 23.451 -13.623 68 1HG LYS 9 1HG LYS 9 11.484 21.644 -12.210 69 2HG LYS 9 2HG LYS 9 13.090 21.229 -11.596 70 1HD LYS 9 1HD LYS 9 11.698 23.936 -11.322 71 2HD LYS 9 2HD LYS 9 11.810 22.682 -10.072 72 1HE LYS 9 1HE LYS 9 14.297 22.850 -10.136 73 2HE LYS 9 2HE LYS 9 14.155 24.195 -11.296 74 1HZ LYS 9 1HZ LYS 9 12.927 25.399 -9.645 75 2HZ LYS 9 2HZ LYS 9 13.074 24.159 -8.569 76 3HZ LYS 9 3HZ LYS 9 14.413 24.976 -9.072 77 H GLN 10 H GLN 10 15.283 21.550 -15.466 78 HA GLN 10 HA GLN 10 14.852 23.259 -17.713 79 1HB GLN 10 1HB GLN 10 16.948 21.122 -17.190 80 2HB GLN 10 2HB GLN 10 16.993 22.233 -18.558 81 1HG GLN 10 1HG GLN 10 17.276 24.141 -17.168 82 2HG GLN 10 2HG GLN 10 16.826 23.264 -15.705 83 1HE2 GLN 10 1HE2 GLN 10 18.951 24.396 -15.037 84 2HE2 GLN 10 2HE2 GLN 10 20.399 23.434 -15.283 85 H GLU 11 H GLU 11 15.026 19.642 -17.520 86 HA GLU 11 HA GLU 11 14.325 19.124 -20.203 87 1HB GLU 11 1HB GLU 11 13.725 17.546 -17.672 88 2HB GLU 11 2HB GLU 11 13.457 16.929 -19.307 89 1HG GLU 11 1HG GLU 11 15.809 17.099 -19.857 90 2HG GLU 11 2HG GLU 11 16.182 17.915 -18.341 91 H ILE 12 H ILE 12 12.144 19.495 -17.389 92 HA ILE 12 HA ILE 12 9.684 19.171 -18.761 93 HB ILE 12 HB ILE 12 10.456 20.641 -16.227 94 1HG1 ILE 12 1HG1 ILE 12 8.913 18.029 -16.623 95 2HG1 ILE 12 2HG1 ILE 12 10.658 18.063 -16.447 96 1HG2 ILE 12 1HG2 ILE 12 8.315 21.613 -17.116 97 2HG2 ILE 12 2HG2 ILE 12 7.635 19.972 -17.127 98 3HG2 ILE 12 3HG2 ILE 12 8.101 20.748 -15.605 99 1HD1 ILE 12 1HD1 ILE 12 8.648 18.979 -14.360 100 2HD1 ILE 12 2HD1 ILE 12 9.708 17.566 -14.313 101 3HD1 ILE 12 3HD1 ILE 12 10.411 19.190 -14.230 102 H ARG 13 H ARG 13 11.663 22.142 -18.197 103 HA ARG 13 HA ARG 13 9.816 23.885 -19.471 104 1HB ARG 13 1HB ARG 13 11.573 24.677 -17.982 105 2HB ARG 13 2HB ARG 13 12.821 24.146 -19.120 106 1HG ARG 13 1HG ARG 13 12.514 26.531 -19.291 107 2HG ARG 13 2HG ARG 13 11.990 25.781 -20.802 108 1HD ARG 13 1HD ARG 13 9.618 26.008 -20.095 109 2HD ARG 13 2HD ARG 13 10.155 26.668 -18.529 110 HE ARG 13 HE ARG 13 11.258 28.170 -20.703 111 1HH1 ARG 13 1HH1 ARG 13 8.227 27.625 -18.973 112 2HH1 ARG 13 2HH1 ARG 13 7.551 29.179 -19.382 113 1HH2 ARG 13 1HH2 ARG 13 10.397 30.209 -21.233 114 2HH2 ARG 13 2HH2 ARG 13 8.815 30.683 -20.678 115 H GLU 14 H GLU 14 12.613 22.050 -20.799 116 HA GLU 14 HA GLU 14 12.415 23.000 -23.477 117 1HB GLU 14 1HB GLU 14 13.301 20.294 -22.389 118 2HB GLU 14 2HB GLU 14 13.467 20.791 -24.076 119 1HG GLU 14 1HG GLU 14 14.937 22.624 -23.483 120 2HG GLU 14 2HG GLU 14 14.685 22.357 -21.757 121 H ALA 15 H ALA 15 10.862 20.151 -21.919 122 HA ALA 15 HA ALA 15 9.313 19.317 -24.131 123 1HB ALA 15 1HB ALA 15 8.591 19.165 -21.169 124 2HB ALA 15 2HB ALA 15 7.885 18.203 -22.483 125 3HB ALA 15 3HB ALA 15 9.595 18.003 -22.061 126 H PHE 16 H PHE 16 8.412 21.559 -21.478 127 HA PHE 16 HA PHE 16 5.872 22.299 -22.302 128 1HB PHE 16 1HB PHE 16 6.896 22.989 -20.182 129 2HB PHE 16 2HB PHE 16 8.030 24.022 -21.026 130 HD1 PHE 16 HD1 PHE 16 4.468 23.600 -20.106 131 HD2 PHE 16 HD2 PHE 16 7.421 26.244 -21.806 132 HE1 PHE 16 HE1 PHE 16 2.898 25.505 -19.869 133 HE2 PHE 16 HE2 PHE 16 5.833 28.138 -21.594 134 HZ PHE 16 HZ PHE 16 3.585 27.774 -20.615 135 H ASP 17 H ASP 17 8.975 23.862 -23.210 136 HA ASP 17 HA ASP 17 7.938 25.810 -24.957 137 1HB ASP 17 1HB ASP 17 10.239 25.834 -24.112 138 2HB ASP 17 2HB ASP 17 10.628 24.381 -25.043 139 H LEU 18 H LEU 18 9.163 22.504 -25.737 140 HA LEU 18 HA LEU 18 8.686 22.555 -28.511 141 1HB LEU 18 1HB LEU 18 9.864 20.712 -27.250 142 2HB LEU 18 2HB LEU 18 8.300 20.194 -26.627 143 HG LEU 18 HG LEU 18 7.655 20.127 -29.250 144 1HD1 LEU 18 1HD1 LEU 18 10.653 19.598 -29.250 145 2HD1 LEU 18 2HD1 LEU 18 9.533 19.378 -30.611 146 3HD1 LEU 18 3HD1 LEU 18 9.857 21.005 -29.986 147 1HD2 LEU 18 1HD2 LEU 18 8.207 17.749 -29.259 148 2HD2 LEU 18 2HD2 LEU 18 9.224 17.965 -27.813 149 3HD2 LEU 18 3HD2 LEU 18 7.465 18.243 -27.735 150 H PHE 19 H PHE 19 6.502 21.449 -25.882 151 HA PHE 19 HA PHE 19 4.288 20.845 -27.559 152 1HB PHE 19 1HB PHE 19 4.326 21.755 -24.667 153 2HB PHE 19 2HB PHE 19 2.980 20.939 -25.466 154 HD1 PHE 19 HD1 PHE 19 4.434 20.129 -22.868 155 HD2 PHE 19 HD2 PHE 19 4.869 18.835 -26.972 156 HE1 PHE 19 HE1 PHE 19 5.055 17.857 -22.112 157 HE2 PHE 19 HE2 PHE 19 5.570 16.616 -26.197 158 HZ PHE 19 HZ PHE 19 5.714 16.121 -23.763 159 H ASP 20 H ASP 20 5.231 23.926 -26.009 160 HA ASP 20 HA ASP 20 2.842 25.295 -26.933 161 1HB ASP 20 1HB ASP 20 4.160 26.018 -24.951 162 2HB ASP 20 2HB ASP 20 5.505 26.434 -26.020 163 H THR 21 H THR 21 3.274 24.135 -29.175 164 HA THR 21 HA THR 21 5.300 25.020 -30.938 165 HB THR 21 HB THR 21 3.622 24.276 -32.702 166 HG1 THR 21 HG1 THR 21 1.741 23.276 -31.849 167 1HG2 THR 21 1HG2 THR 21 3.734 21.913 -32.077 168 2HG2 THR 21 2HG2 THR 21 5.250 22.703 -31.607 169 3HG2 THR 21 3HG2 THR 21 4.025 22.331 -30.380 170 H ASP 22 H ASP 22 2.157 26.439 -30.096 171 HA ASP 22 HA ASP 22 2.168 28.496 -32.114 172 1HB ASP 22 1HB ASP 22 0.823 28.385 -29.375 173 2HB ASP 22 2HB ASP 22 0.511 29.611 -30.608 174 H GLY 23 H GLY 23 4.024 28.148 -29.158 175 1HA GLY 23 1HA GLY 23 5.419 29.554 -28.049 176 2HA GLY 23 2HA GLY 23 5.483 30.560 -29.505 177 H SER 24 H SER 24 2.493 29.777 -27.596 178 HA SER 24 HA SER 24 1.742 32.544 -27.459 179 1HB SER 24 1HB SER 24 0.061 31.201 -25.785 180 2HB SER 24 2HB SER 24 -0.097 31.225 -27.549 181 HG SER 24 HG SER 24 0.432 29.106 -25.958 182 H GLY 25 H GLY 25 3.558 30.370 -25.397 183 1HA GLY 25 1HA GLY 25 4.888 31.147 -23.561 184 2HA GLY 25 2HA GLY 25 3.715 32.427 -23.220 185 H THR 26 H THR 26 1.464 30.418 -23.810 186 HA THR 26 HA THR 26 1.568 28.691 -21.396 187 HB THR 26 HB THR 26 -0.749 29.353 -20.981 188 HG1 THR 26 HG1 THR 26 -1.714 30.885 -22.180 189 1HG2 THR 26 1HG2 THR 26 1.192 30.655 -19.930 190 2HG2 THR 26 2HG2 THR 26 0.942 31.881 -21.181 191 3HG2 THR 26 3HG2 THR 26 -0.355 31.521 -20.030 192 H ILE 27 H ILE 27 0.670 26.645 -21.740 193 HA ILE 27 HA ILE 27 0.536 25.851 -24.565 194 HB ILE 27 HB ILE 27 0.438 24.348 -21.941 195 1HG1 ILE 27 1HG1 ILE 27 2.455 24.470 -24.237 196 2HG1 ILE 27 2HG1 ILE 27 2.619 25.306 -22.688 197 1HG2 ILE 27 1HG2 ILE 27 -0.964 23.160 -23.722 198 2HG2 ILE 27 2HG2 ILE 27 0.516 23.082 -24.703 199 3HG2 ILE 27 3HG2 ILE 27 0.412 22.262 -23.140 200 1HD1 ILE 27 1HD1 ILE 27 2.598 22.291 -23.140 201 2HD1 ILE 27 2HD1 ILE 27 3.939 23.315 -22.637 202 3HD1 ILE 27 3HD1 ILE 27 2.562 23.062 -21.537 203 H ASP 28 H ASP 28 -1.350 26.204 -25.651 204 HA ASP 28 HA ASP 28 -3.936 26.424 -24.416 205 1HB ASP 28 1HB ASP 28 -3.417 27.358 -26.636 206 2HB ASP 28 2HB ASP 28 -3.163 25.727 -27.277 207 H ALA 29 H ALA 29 -5.583 24.916 -24.157 208 HA ALA 29 HA ALA 29 -5.219 22.359 -23.439 209 1HB ALA 29 1HB ALA 29 -7.560 23.398 -25.101 210 2HB ALA 29 2HB ALA 29 -7.588 21.938 -24.092 211 3HB ALA 29 3HB ALA 29 -7.378 23.533 -23.339 212 H LYS 30 H LYS 30 -5.705 23.291 -26.880 213 HA LYS 30 HA LYS 30 -5.674 20.642 -27.955 214 1HB LYS 30 1HB LYS 30 -4.854 23.296 -29.199 215 2HB LYS 30 2HB LYS 30 -5.111 21.783 -30.085 216 1HG LYS 30 1HG LYS 30 -7.461 21.703 -29.233 217 2HG LYS 30 2HG LYS 30 -7.245 23.287 -28.491 218 1HD LYS 30 1HD LYS 30 -7.033 22.612 -31.465 219 2HD LYS 30 2HD LYS 30 -8.382 23.435 -30.679 220 1HE LYS 30 1HE LYS 30 -5.541 24.517 -31.008 221 2HE LYS 30 2HE LYS 30 -6.993 25.051 -31.854 222 1HZ LYS 30 1HZ LYS 30 -6.514 25.285 -28.968 223 2HZ LYS 30 2HZ LYS 30 -6.472 26.507 -30.071 224 3HZ LYS 30 3HZ LYS 30 -7.895 25.745 -29.742 225 H GLU 31 H GLU 31 -3.048 22.969 -27.251 226 HA GLU 31 HA GLU 31 -0.942 21.414 -28.487 227 1HB GLU 31 1HB GLU 31 -0.893 23.614 -26.388 228 2HB GLU 31 2HB GLU 31 0.535 22.882 -27.124 229 1HG GLU 31 1HG GLU 31 -0.135 23.671 -29.337 230 2HG GLU 31 2HG GLU 31 -1.641 24.341 -28.689 231 H LEU 32 H LEU 32 -2.414 21.621 -25.215 232 HA LEU 32 HA LEU 32 -0.541 19.792 -24.041 233 1HB LEU 32 1HB LEU 32 -2.260 21.362 -22.843 234 2HB LEU 32 2HB LEU 32 -3.394 20.033 -23.095 235 HG LEU 32 HG LEU 32 -1.509 18.544 -22.001 236 1HD1 LEU 32 1HD1 LEU 32 -0.648 21.295 -21.027 237 2HD1 LEU 32 2HD1 LEU 32 -0.117 19.745 -20.350 238 3HD1 LEU 32 3HD1 LEU 32 0.326 20.165 -21.999 239 1HD2 LEU 32 1HD2 LEU 32 -2.376 19.096 -19.734 240 2HD2 LEU 32 2HD2 LEU 32 -3.129 20.560 -20.405 241 3HD2 LEU 32 3HD2 LEU 32 -3.658 18.957 -20.948 242 H LYS 33 H LYS 33 -3.686 19.273 -25.696 243 HA LYS 33 HA LYS 33 -3.729 16.417 -25.429 244 1HB LYS 33 1HB LYS 33 -5.640 17.556 -26.024 245 2HB LYS 33 2HB LYS 33 -4.944 18.274 -27.485 246 1HG LYS 33 1HG LYS 33 -5.106 15.260 -27.170 247 2HG LYS 33 2HG LYS 33 -6.536 16.193 -27.632 248 1HD LYS 33 1HD LYS 33 -5.319 17.141 -29.578 249 2HD LYS 33 2HD LYS 33 -3.911 16.136 -29.200 250 1HE LYS 33 1HE LYS 33 -5.286 14.088 -29.433 251 2HE LYS 33 2HE LYS 33 -6.695 15.085 -29.845 252 1HZ LYS 33 1HZ LYS 33 -4.181 14.957 -31.356 253 2HZ LYS 33 2HZ LYS 33 -5.608 14.250 -31.780 254 3HZ LYS 33 3HZ LYS 33 -5.483 15.892 -31.739 255 H VAL 34 H VAL 34 -2.223 18.477 -27.987 256 HA VAL 34 HA VAL 34 -1.033 16.327 -29.420 257 HB VAL 34 HB VAL 34 -0.119 19.198 -28.977 258 1HG1 VAL 34 1HG1 VAL 34 1.458 18.838 -30.876 259 2HG1 VAL 34 2HG1 VAL 34 1.946 17.972 -29.421 260 3HG1 VAL 34 3HG1 VAL 34 1.168 17.092 -30.757 261 1HG2 VAL 34 1HG2 VAL 34 -0.862 19.488 -31.286 262 2HG2 VAL 34 2HG2 VAL 34 -1.261 17.762 -31.408 263 3HG2 VAL 34 3HG2 VAL 34 -2.188 18.817 -30.326 264 H ALA 35 H ALA 35 0.254 18.159 -26.600 265 HA ALA 35 HA ALA 35 2.677 16.826 -26.319 266 1HB ALA 35 1HB ALA 35 1.984 18.804 -24.987 267 2HB ALA 35 2HB ALA 35 0.889 17.791 -24.035 268 3HB ALA 35 3HB ALA 35 2.611 17.483 -23.973 269 H MET 36 H MET 36 -0.421 15.951 -24.713 270 HA MET 36 HA MET 36 0.456 13.538 -23.518 271 1HB MET 36 1HB MET 36 -2.163 14.745 -24.298 272 2HB MET 36 2HB MET 36 -2.176 13.008 -24.039 273 1HG MET 36 1HG MET 36 -1.230 13.202 -21.833 274 2HG MET 36 2HG MET 36 -0.974 14.940 -22.027 275 1HE MET 36 1HE MET 36 -4.412 16.501 -21.721 276 2HE MET 36 2HE MET 36 -2.668 16.662 -22.038 277 3HE MET 36 3HE MET 36 -3.741 15.986 -23.282 278 H ARG 37 H ARG 37 -1.018 14.033 -26.759 279 HA ARG 37 HA ARG 37 -1.009 11.309 -27.429 280 1HB ARG 37 1HB ARG 37 -2.191 13.207 -28.653 281 2HB ARG 37 2HB ARG 37 -0.629 13.668 -29.326 282 1HG ARG 37 1HG ARG 37 -1.711 12.456 -31.006 283 2HG ARG 37 2HG ARG 37 -0.497 11.340 -30.379 284 1HD ARG 37 1HD ARG 37 -3.431 11.381 -29.508 285 2HD ARG 37 2HD ARG 37 -2.856 10.396 -30.847 286 HE ARG 37 HE ARG 37 -2.540 9.862 -27.999 287 1HH1 ARG 37 1HH1 ARG 37 -1.075 9.229 -31.153 288 2HH1 ARG 37 2HH1 ARG 37 -0.265 7.779 -30.620 289 1HH2 ARG 37 1HH2 ARG 37 -1.492 8.097 -27.298 290 2HH2 ARG 37 2HH2 ARG 37 -0.517 7.086 -28.347 291 H ALA 38 H ALA 38 1.497 13.796 -28.008 292 HA ALA 38 HA ALA 38 3.377 12.139 -29.350 293 1HB ALA 38 1HB ALA 38 5.001 13.888 -28.756 294 2HB ALA 38 2HB ALA 38 3.481 14.602 -29.330 295 3HB ALA 38 3HB ALA 38 3.855 14.588 -27.594 296 H LEU 39 H LEU 39 2.967 12.898 -25.872 297 HA LEU 39 HA LEU 39 5.123 11.295 -24.890 298 1HB LEU 39 1HB LEU 39 2.488 12.191 -23.698 299 2HB LEU 39 2HB LEU 39 3.685 11.299 -22.760 300 HG LEU 39 HG LEU 39 4.375 13.914 -24.157 301 1HD1 LEU 39 1HD1 LEU 39 2.452 14.373 -22.676 302 2HD1 LEU 39 2HD1 LEU 39 3.261 13.529 -21.342 303 3HD1 LEU 39 3HD1 LEU 39 3.935 15.041 -21.987 304 1HD2 LEU 39 1HD2 LEU 39 5.573 12.448 -21.763 305 2HD2 LEU 39 2HD2 LEU 39 6.285 12.545 -23.387 306 3HD2 LEU 39 3HD2 LEU 39 6.126 14.005 -22.405 307 H GLY 40 H GLY 40 1.849 10.483 -25.951 308 1HA GLY 40 1HA GLY 40 1.686 8.317 -27.032 309 2HA GLY 40 2HA GLY 40 2.522 7.568 -25.673 310 H PHE 41 H PHE 41 0.291 10.002 -24.671 311 HA PHE 41 HA PHE 41 -1.353 7.991 -23.347 312 1HB PHE 41 1HB PHE 41 -1.388 11.011 -23.505 313 2HB PHE 41 2HB PHE 41 -2.650 10.151 -22.662 314 HD1 PHE 41 HD1 PHE 41 0.795 11.312 -22.505 315 HD2 PHE 41 HD2 PHE 41 -2.051 8.626 -20.704 316 HE1 PHE 41 HE1 PHE 41 2.335 10.968 -20.587 317 HE2 PHE 41 HE2 PHE 41 -0.515 8.280 -18.794 318 HZ PHE 41 HZ PHE 41 1.703 9.412 -18.754 319 H GLU 42 H GLU 42 -3.727 8.139 -23.443 320 HA GLU 42 HA GLU 42 -4.768 8.314 -26.229 321 1HB GLU 42 1HB GLU 42 -6.569 6.877 -25.354 322 2HB GLU 42 2HB GLU 42 -4.975 6.138 -25.478 323 1HG GLU 42 1HG GLU 42 -6.130 7.125 -22.828 324 2HG GLU 42 2HG GLU 42 -6.327 5.498 -23.462 325 HA PRO 43 HA PRO 43 -6.362 11.918 -23.890 326 1HB PRO 43 1HB PRO 43 -6.516 13.788 -25.898 327 2HB PRO 43 2HB PRO 43 -5.007 13.330 -25.063 328 1HG PRO 43 1HG PRO 43 -6.028 12.249 -27.691 329 2HG PRO 43 2HG PRO 43 -4.405 12.915 -27.287 330 1HD PRO 43 1HD PRO 43 -4.831 10.250 -27.273 331 2HD PRO 43 2HD PRO 43 -3.845 11.038 -25.997 332 H LYS 44 H LYS 44 -8.207 10.315 -23.762 333 HA LYS 44 HA LYS 44 -10.495 10.557 -25.468 334 1HB LYS 44 1HB LYS 44 -10.264 9.820 -22.522 335 2HB LYS 44 2HB LYS 44 -11.739 9.702 -23.510 336 1HG LYS 44 1HG LYS 44 -10.709 8.083 -25.000 337 2HG LYS 44 2HG LYS 44 -9.134 8.305 -24.236 338 1HD LYS 44 1HD LYS 44 -10.033 6.241 -23.503 339 2HD LYS 44 2HD LYS 44 -9.966 7.329 -22.123 340 1HE LYS 44 1HE LYS 44 -12.527 6.877 -23.750 341 2HE LYS 44 2HE LYS 44 -12.037 5.822 -22.415 342 1HZ LYS 44 1HZ LYS 44 -12.651 8.669 -22.194 343 2HZ LYS 44 2HZ LYS 44 -13.499 7.403 -21.592 344 3HZ LYS 44 3HZ LYS 44 -12.003 7.753 -20.985 345 H LYS 45 H LYS 45 -11.558 12.359 -25.851 346 HA LYS 45 HA LYS 45 -11.218 14.852 -24.919 347 1HB LYS 45 1HB LYS 45 -13.834 13.623 -25.867 348 2HB LYS 45 2HB LYS 45 -13.532 15.363 -25.708 349 1HG LYS 45 1HG LYS 45 -11.639 15.194 -27.304 350 2HG LYS 45 2HG LYS 45 -11.964 13.466 -27.523 351 1HD LYS 45 1HD LYS 45 -14.253 13.993 -28.332 352 2HD LYS 45 2HD LYS 45 -13.921 15.727 -28.133 353 1HE LYS 45 1HE LYS 45 -12.056 15.561 -29.768 354 2HE LYS 45 2HE LYS 45 -12.376 13.828 -29.964 355 1HZ LYS 45 1HZ LYS 45 -14.545 14.382 -30.784 356 2HZ LYS 45 2HZ LYS 45 -14.250 15.995 -30.606 357 3HZ LYS 45 3HZ LYS 45 -13.377 15.111 -31.688 358 H GLU 46 H GLU 46 -13.637 12.618 -23.560 359 HA GLU 46 HA GLU 46 -14.831 14.304 -21.681 360 1HB GLU 46 1HB GLU 46 -14.246 11.398 -20.989 361 2HB GLU 46 2HB GLU 46 -15.625 12.406 -20.574 362 1HG GLU 46 1HG GLU 46 -16.538 11.035 -22.188 363 2HG GLU 46 2HG GLU 46 -16.070 12.412 -23.192 364 H GLU 47 H GLU 47 -11.967 12.208 -21.229 365 HA GLU 47 HA GLU 47 -11.549 12.952 -18.456 366 1HB GLU 47 1HB GLU 47 -9.712 11.583 -20.480 367 2HB GLU 47 2HB GLU 47 -9.410 11.755 -18.744 368 1HG GLU 47 1HG GLU 47 -11.465 10.457 -18.241 369 2HG GLU 47 2HG GLU 47 -11.787 10.275 -19.974 370 H ILE 48 H ILE 48 -10.156 13.847 -21.607 371 HA ILE 48 HA ILE 48 -8.123 15.578 -20.698 372 HB ILE 48 HB ILE 48 -9.823 15.521 -23.216 373 1HG1 ILE 48 1HG1 ILE 48 -8.221 13.607 -22.708 374 2HG1 ILE 48 2HG1 ILE 48 -8.024 14.430 -24.257 375 1HG2 ILE 48 1HG2 ILE 48 -8.079 16.961 -24.287 376 2HG2 ILE 48 2HG2 ILE 48 -9.097 17.803 -23.116 377 3HG2 ILE 48 3HG2 ILE 48 -7.451 17.313 -22.662 378 1HD1 ILE 48 1HD1 ILE 48 -6.073 15.603 -23.493 379 2HD1 ILE 48 2HD1 ILE 48 -6.335 15.097 -21.805 380 3HD1 ILE 48 3HD1 ILE 48 -5.870 13.914 -23.013 381 H LYS 49 H LYS 49 -11.506 16.414 -21.589 382 HA LYS 49 HA LYS 49 -11.333 19.171 -21.002 383 1HB LYS 49 1HB LYS 49 -13.645 17.199 -20.880 384 2HB LYS 49 2HB LYS 49 -13.837 18.941 -20.605 385 1HG LYS 49 1HG LYS 49 -13.095 19.496 -22.818 386 2HG LYS 49 2HG LYS 49 -12.513 17.858 -23.120 387 1HD LYS 49 1HD LYS 49 -14.595 18.203 -24.305 388 2HD LYS 49 2HD LYS 49 -14.810 16.973 -23.050 389 1HE LYS 49 1HE LYS 49 -15.919 18.630 -21.584 390 2HE LYS 49 2HE LYS 49 -15.602 19.916 -22.765 391 1HZ LYS 49 1HZ LYS 49 -17.281 17.548 -23.209 392 2HZ LYS 49 2HZ LYS 49 -17.819 19.078 -22.918 393 3HZ LYS 49 3HZ LYS 49 -16.998 18.746 -24.307 394 H LYS 50 H LYS 50 -12.366 16.459 -18.848 395 HA LYS 50 HA LYS 50 -12.795 18.061 -16.542 396 1HB LYS 50 1HB LYS 50 -11.927 15.161 -16.863 397 2HB LYS 50 2HB LYS 50 -12.310 15.868 -15.304 398 1HG LYS 50 1HG LYS 50 -14.214 15.652 -17.681 399 2HG LYS 50 2HG LYS 50 -14.194 14.596 -16.273 400 1HD LYS 50 1HD LYS 50 -14.950 17.553 -16.340 401 2HD LYS 50 2HD LYS 50 -16.003 16.166 -16.075 402 1HE LYS 50 1HE LYS 50 -14.726 15.637 -13.962 403 2HE LYS 50 2HE LYS 50 -13.800 17.135 -14.188 404 1HZ LYS 50 1HZ LYS 50 -15.625 17.450 -12.725 405 2HZ LYS 50 2HZ LYS 50 -15.836 18.352 -14.087 406 3HZ LYS 50 3HZ LYS 50 -16.707 16.968 -13.872 407 H MET 51 H MET 51 -9.824 16.162 -17.351 408 HA MET 51 HA MET 51 -8.318 16.998 -15.170 409 1HB MET 51 1HB MET 51 -7.799 15.159 -16.850 410 2HB MET 51 2HB MET 51 -7.264 16.416 -17.973 411 1HG MET 51 1HG MET 51 -5.669 17.180 -16.075 412 2HG MET 51 2HG MET 51 -6.172 15.713 -15.232 413 1HE MET 51 1HE MET 51 -4.190 17.317 -18.139 414 2HE MET 51 2HE MET 51 -3.540 15.916 -19.015 415 3HE MET 51 3HE MET 51 -5.273 16.298 -19.122 416 H ILE 52 H ILE 52 -8.369 18.415 -18.492 417 HA ILE 52 HA ILE 52 -6.524 20.492 -17.930 418 HB ILE 52 HB ILE 52 -8.734 20.248 -20.006 419 1HG1 ILE 52 1HG1 ILE 52 -5.676 20.066 -20.063 420 2HG1 ILE 52 2HG1 ILE 52 -6.784 18.697 -20.158 421 1HG2 ILE 52 1HG2 ILE 52 -8.366 22.673 -19.572 422 2HG2 ILE 52 2HG2 ILE 52 -6.625 22.439 -19.833 423 3HG2 ILE 52 3HG2 ILE 52 -7.788 22.197 -21.152 424 1HD1 ILE 52 1HD1 ILE 52 -6.363 20.871 -22.224 425 2HD1 ILE 52 2HD1 ILE 52 -6.013 19.152 -22.374 426 3HD1 ILE 52 3HD1 ILE 52 -7.704 19.709 -22.301 427 H SER 53 H SER 53 -10.154 20.518 -17.691 428 HA SER 53 HA SER 53 -10.254 23.231 -16.866 429 1HB SER 53 1HB SER 53 -12.140 20.955 -16.080 430 2HB SER 53 2HB SER 53 -12.484 22.695 -15.977 431 HG SER 53 HG SER 53 -12.025 21.139 -18.305 432 H GLU 54 H GLU 54 -9.870 20.263 -14.886 433 HA GLU 54 HA GLU 54 -9.938 21.542 -12.344 434 1HB GLU 54 1HB GLU 54 -8.472 19.067 -13.329 435 2HB GLU 54 2HB GLU 54 -8.538 19.551 -11.632 436 1HG GLU 54 1HG GLU 54 -10.884 19.227 -11.485 437 2HG GLU 54 2HG GLU 54 -11.100 19.205 -13.235 438 H ILE 55 H ILE 55 -7.161 20.939 -14.564 439 HA ILE 55 HA ILE 55 -5.272 22.194 -12.735 440 HB ILE 55 HB ILE 55 -5.062 21.450 -15.673 441 1HG1 ILE 55 1HG1 ILE 55 -5.481 19.486 -14.197 442 2HG1 ILE 55 2HG1 ILE 55 -3.930 19.452 -15.019 443 1HG2 ILE 55 1HG2 ILE 55 -3.341 23.060 -15.229 444 2HG2 ILE 55 2HG2 ILE 55 -2.897 22.279 -13.704 445 3HG2 ILE 55 3HG2 ILE 55 -2.578 21.467 -15.255 446 1HD1 ILE 55 1HD1 ILE 55 -2.791 20.122 -12.920 447 2HD1 ILE 55 2HD1 ILE 55 -4.366 20.216 -12.094 448 3HD1 ILE 55 3HD1 ILE 55 -3.767 18.666 -12.701 449 H ASP 56 H ASP 56 -7.209 23.368 -15.463 450 HA ASP 56 HA ASP 56 -5.590 25.715 -15.946 451 1HB ASP 56 1HB ASP 56 -6.771 24.393 -17.682 452 2HB ASP 56 2HB ASP 56 -8.325 24.859 -16.970 453 H LYS 57 H LYS 57 -6.267 25.884 -13.260 454 HA LYS 57 HA LYS 57 -8.728 27.068 -12.682 455 1HB LYS 57 1HB LYS 57 -7.267 25.960 -11.059 456 2HB LYS 57 2HB LYS 57 -6.019 27.177 -11.323 457 1HG LYS 57 1HG LYS 57 -6.947 27.680 -9.310 458 2HG LYS 57 2HG LYS 57 -7.577 28.921 -10.377 459 1HD LYS 57 1HD LYS 57 -9.095 26.386 -9.534 460 2HD LYS 57 2HD LYS 57 -9.146 27.890 -8.618 461 1HE LYS 57 1HE LYS 57 -10.361 27.377 -11.355 462 2HE LYS 57 2HE LYS 57 -11.146 27.796 -9.845 463 1HZ LYS 57 1HZ LYS 57 -11.039 29.681 -11.204 464 2HZ LYS 57 2HZ LYS 57 -10.008 29.934 -9.942 465 3HZ LYS 57 3HZ LYS 57 -9.421 29.546 -11.440 466 H ASP 58 H ASP 58 -5.531 28.563 -13.220 467 HA ASP 58 HA ASP 58 -6.709 31.291 -13.458 468 1HB ASP 58 1HB ASP 58 -4.425 32.054 -13.229 469 2HB ASP 58 2HB ASP 58 -4.801 30.956 -11.894 470 H GLY 59 H GLY 59 -5.040 28.718 -15.156 471 1HA GLY 59 1HA GLY 59 -3.789 29.898 -17.219 472 2HA GLY 59 2HA GLY 59 -4.529 28.293 -17.258 473 H SER 60 H SER 60 -7.298 29.473 -17.047 474 HA SER 60 HA SER 60 -9.000 30.051 -18.457 475 1HB SER 60 1HB SER 60 -7.041 32.282 -19.149 476 2HB SER 60 2HB SER 60 -8.800 32.321 -19.350 477 HG SER 60 HG SER 60 -7.342 32.109 -16.910 478 H GLY 61 H GLY 61 -8.102 27.986 -19.637 479 1HA GLY 61 1HA GLY 61 -8.414 27.023 -21.754 480 2HA GLY 61 2HA GLY 61 -8.059 28.559 -22.553 481 H THR 62 H THR 62 -5.586 28.831 -20.639 482 HA THR 62 HA THR 62 -3.828 27.010 -22.209 483 HB THR 62 HB THR 62 -2.310 28.743 -22.514 484 HG1 THR 62 HG1 THR 62 -3.920 30.129 -20.679 485 1HG2 THR 62 1HG2 THR 62 -5.040 29.889 -23.237 486 2HG2 THR 62 2HG2 THR 62 -3.480 30.263 -23.992 487 3HG2 THR 62 3HG2 THR 62 -4.176 28.645 -24.167 488 H ILE 63 H ILE 63 -2.533 25.767 -21.048 489 HA ILE 63 HA ILE 63 -2.295 26.080 -18.148 490 HB ILE 63 HB ILE 63 -0.880 24.183 -20.062 491 1HG1 ILE 63 1HG1 ILE 63 -3.178 23.745 -20.436 492 2HG1 ILE 63 2HG1 ILE 63 -2.573 22.504 -19.344 493 1HG2 ILE 63 1HG2 ILE 63 -0.525 22.757 -18.142 494 2HG2 ILE 63 2HG2 ILE 63 0.155 24.356 -17.817 495 3HG2 ILE 63 3HG2 ILE 63 -1.387 23.881 -17.082 496 1HD1 ILE 63 1HD1 ILE 63 -4.300 24.896 -18.586 497 2HD1 ILE 63 2HD1 ILE 63 -4.759 23.187 -18.603 498 3HD1 ILE 63 3HD1 ILE 63 -3.595 23.769 -17.410 499 H ASP 64 H ASP 64 -1.030 27.794 -17.468 500 HA ASP 64 HA ASP 64 1.353 28.617 -18.941 501 1HB ASP 64 1HB ASP 64 0.241 30.332 -17.702 502 2HB ASP 64 2HB ASP 64 0.240 29.390 -16.226 503 H PHE 65 H PHE 65 3.495 28.534 -18.073 504 HA PHE 65 HA PHE 65 4.443 25.998 -17.650 505 1HB PHE 65 1HB PHE 65 5.810 27.897 -18.359 506 2HB PHE 65 2HB PHE 65 5.708 28.602 -16.742 507 HD1 PHE 65 HD1 PHE 65 7.569 28.221 -15.320 508 HD2 PHE 65 HD2 PHE 65 6.583 25.271 -18.311 509 HE1 PHE 65 HE1 PHE 65 9.507 26.860 -14.623 510 HE2 PHE 65 HE2 PHE 65 8.500 23.893 -17.572 511 HZ PHE 65 HZ PHE 65 9.978 24.685 -15.740 512 H GLU 66 H GLU 66 3.458 28.298 -15.035 513 HA GLU 66 HA GLU 66 4.546 26.618 -12.971 514 1HB GLU 66 1HB GLU 66 2.372 28.747 -12.877 515 2HB GLU 66 2HB GLU 66 3.060 27.945 -11.455 516 1HG GLU 66 1HG GLU 66 4.676 29.554 -13.489 517 2HG GLU 66 2HG GLU 66 4.160 30.122 -11.896 518 H GLU 67 H GLU 67 1.194 26.793 -14.320 519 HA GLU 67 HA GLU 67 0.175 24.677 -12.701 520 1HB GLU 67 1HB GLU 67 -0.593 25.361 -15.570 521 2HB GLU 67 2HB GLU 67 -1.473 24.308 -14.450 522 1HG GLU 67 1HG GLU 67 -2.670 26.238 -14.171 523 2HG GLU 67 2HG GLU 67 -1.474 26.461 -12.886 524 H PHE 68 H PHE 68 1.815 24.621 -15.903 525 HA PHE 68 HA PHE 68 1.620 21.833 -16.342 526 1HB PHE 68 1HB PHE 68 2.351 23.483 -18.040 527 2HB PHE 68 2HB PHE 68 3.850 23.738 -17.158 528 HD1 PHE 68 HD1 PHE 68 5.752 22.440 -17.739 529 HD2 PHE 68 HD2 PHE 68 1.808 21.026 -18.778 530 HE1 PHE 68 HE1 PHE 68 6.746 20.630 -19.126 531 HE2 PHE 68 HE2 PHE 68 2.820 19.132 -20.021 532 HZ PHE 68 HZ PHE 68 5.301 18.909 -20.135 533 H LEU 69 H LEU 69 4.225 23.693 -14.793 534 HA LEU 69 HA LEU 69 5.950 21.631 -14.013 535 1HB LEU 69 1HB LEU 69 6.554 23.975 -13.989 536 2HB LEU 69 2HB LEU 69 5.288 24.340 -12.815 537 HG LEU 69 HG LEU 69 6.471 23.091 -11.069 538 1HD1 LEU 69 1HD1 LEU 69 8.820 22.364 -11.467 539 2HD1 LEU 69 2HD1 LEU 69 7.668 21.414 -12.419 540 3HD1 LEU 69 3HD1 LEU 69 8.626 22.695 -13.200 541 1HD2 LEU 69 1HD2 LEU 69 6.845 25.522 -11.432 542 2HD2 LEU 69 2HD2 LEU 69 8.304 24.719 -10.816 543 3HD2 LEU 69 3HD2 LEU 69 8.182 25.150 -12.534 544 H THR 70 H THR 70 3.170 23.105 -12.228 545 HA THR 70 HA THR 70 3.414 21.506 -9.905 546 HB THR 70 HB THR 70 0.853 22.645 -11.112 547 HG1 THR 70 HG1 THR 70 2.429 24.241 -10.816 548 1HG2 THR 70 1HG2 THR 70 0.414 21.058 -9.257 549 2HG2 THR 70 2HG2 THR 70 1.602 21.912 -8.246 550 3HG2 THR 70 3HG2 THR 70 0.112 22.729 -8.755 551 H MET 71 H MET 71 1.428 20.949 -12.862 552 HA MET 71 HA MET 71 0.312 18.469 -12.100 553 1HB MET 71 1HB MET 71 -0.395 19.851 -14.053 554 2HB MET 71 2HB MET 71 1.106 19.420 -14.883 555 1HG MET 71 1HG MET 71 0.428 17.000 -14.769 556 2HG MET 71 2HG MET 71 -1.061 17.494 -13.957 557 1HE MET 71 1HE MET 71 1.011 17.487 -17.264 558 2HE MET 71 2HE MET 71 -0.085 18.306 -18.398 559 3HE MET 71 3HE MET 71 0.717 19.239 -17.118 560 H MET 72 H MET 72 3.335 19.190 -13.907 561 HA MET 72 HA MET 72 4.193 16.523 -14.253 562 1HB MET 72 1HB MET 72 5.760 19.117 -13.982 563 2HB MET 72 2HB MET 72 6.496 17.588 -14.455 564 1HG MET 72 1HG MET 72 4.086 18.366 -16.049 565 2HG MET 72 2HG MET 72 5.473 19.433 -16.189 566 1HE MET 72 1HE MET 72 5.731 15.482 -15.657 567 2HE MET 72 2HE MET 72 4.242 15.715 -16.618 568 3HE MET 72 3HE MET 72 5.679 14.965 -17.352 569 H THR 73 H THR 73 4.840 18.809 -11.569 570 HA THR 73 HA THR 73 6.518 17.123 -10.037 571 HB THR 73 HB THR 73 4.482 19.110 -8.918 572 HG1 THR 73 HG1 THR 73 5.848 20.060 -10.509 573 1HG2 THR 73 1HG2 THR 73 5.592 17.700 -7.198 574 2HG2 THR 73 2HG2 THR 73 7.177 18.132 -7.882 575 3HG2 THR 73 3HG2 THR 73 6.161 19.378 -7.134 576 H ALA 74 H ALA 74 2.937 17.500 -9.918 577 HA ALA 74 HA ALA 74 2.478 15.534 -7.923 578 1HB ALA 74 1HB ALA 74 0.163 15.544 -8.744 579 2HB ALA 74 2HB ALA 74 0.803 17.196 -8.631 580 3HB ALA 74 3HB ALA 74 0.664 16.402 -10.215 581 H LYS 75 H LYS 75 2.666 15.245 -11.479 582 HA LYS 75 HA LYS 75 1.927 12.490 -11.593 583 1HB LYS 75 1HB LYS 75 1.846 14.231 -13.427 584 2HB LYS 75 2HB LYS 75 3.601 14.062 -13.595 585 1HG LYS 75 1HG LYS 75 3.277 11.640 -14.142 586 2HG LYS 75 2HG LYS 75 1.529 11.848 -13.917 587 1HD LYS 75 1HD LYS 75 1.557 13.607 -15.739 588 2HD LYS 75 2HD LYS 75 3.279 13.279 -15.976 589 1HE LYS 75 1HE LYS 75 2.011 12.091 -17.669 590 2HE LYS 75 2HE LYS 75 2.724 10.904 -16.563 591 1HZ LYS 75 1HZ LYS 75 0.601 10.735 -15.483 592 2HZ LYS 75 2HZ LYS 75 -0.046 11.893 -16.463 593 3HZ LYS 75 3HZ LYS 75 0.426 10.447 -17.095 594 H MET 76 H MET 76 5.072 14.140 -11.333 595 HA MET 76 HA MET 76 6.589 11.604 -11.490 596 1HB MET 76 1HB MET 76 7.459 14.516 -11.294 597 2HB MET 76 2HB MET 76 8.543 13.125 -11.467 598 1HG MET 76 1HG MET 76 7.627 12.597 -13.652 599 2HG MET 76 2HG MET 76 6.362 13.810 -13.476 600 1HE MET 76 1HE MET 76 10.787 14.881 -14.206 601 2HE MET 76 2HE MET 76 10.246 14.264 -12.632 602 3HE MET 76 3HE MET 76 10.189 13.213 -14.072 Start of MODEL 12 1 H ARG 1 H ARG 1 15.444 21.215 -6.024 2 HA ARG 1 HA ARG 1 16.038 19.803 -4.211 3 1HB ARG 1 1HB ARG 1 13.765 19.111 -3.533 4 2HB ARG 1 2HB ARG 1 13.815 20.740 -4.201 5 1HG ARG 1 1HG ARG 1 12.884 19.989 -6.316 6 2HG ARG 1 2HG ARG 1 13.019 18.288 -5.832 7 1HD ARG 1 1HD ARG 1 10.719 19.018 -5.607 8 2HD ARG 1 2HD ARG 1 11.392 18.682 -3.999 9 HE ARG 1 HE ARG 1 11.780 21.435 -4.591 10 1HH1 ARG 1 1HH1 ARG 1 9.137 19.185 -3.926 11 2HH1 ARG 1 2HH1 ARG 1 8.073 20.399 -3.274 12 1HH2 ARG 1 1HH2 ARG 1 10.410 23.034 -3.711 13 2HH2 ARG 1 2HH2 ARG 1 8.818 22.622 -3.138 14 H VAL 2 H VAL 2 15.182 17.533 -3.278 15 HA VAL 2 HA VAL 2 16.731 15.554 -4.690 16 HB VAL 2 HB VAL 2 16.057 14.090 -2.781 17 1HG1 VAL 2 1HG1 VAL 2 17.421 15.297 -1.140 18 2HG1 VAL 2 2HG1 VAL 2 18.116 15.431 -2.763 19 3HG1 VAL 2 3HG1 VAL 2 17.237 16.804 -2.058 20 1HG2 VAL 2 1HG2 VAL 2 13.853 15.211 -2.198 21 2HG2 VAL 2 2HG2 VAL 2 14.957 14.999 -0.837 22 3HG2 VAL 2 3HG2 VAL 2 14.774 16.592 -1.577 23 H GLY 3 H GLY 3 15.310 15.895 -6.642 24 1HA GLY 3 1HA GLY 3 14.175 13.604 -7.545 25 2HA GLY 3 2HA GLY 3 12.784 14.397 -6.769 26 H LEU 4 H LEU 4 12.373 16.698 -7.378 27 HA LEU 4 HA LEU 4 12.756 17.231 -10.237 28 1HB LEU 4 1HB LEU 4 11.625 18.990 -8.056 29 2HB LEU 4 2HB LEU 4 11.629 19.314 -9.795 30 HG LEU 4 HG LEU 4 10.156 17.041 -8.378 31 1HD1 LEU 4 1HD1 LEU 4 9.204 19.302 -8.063 32 2HD1 LEU 4 2HD1 LEU 4 9.203 19.547 -9.825 33 3HD1 LEU 4 3HD1 LEU 4 8.169 18.301 -9.098 34 1HD2 LEU 4 1HD2 LEU 4 10.788 16.225 -10.596 35 2HD2 LEU 4 2HD2 LEU 4 9.088 16.692 -10.633 36 3HD2 LEU 4 3HD2 LEU 4 10.308 17.768 -11.345 37 H THR 5 H THR 5 15.111 16.991 -10.083 38 HA THR 5 HA THR 5 16.739 18.977 -8.778 39 HB THR 5 HB THR 5 18.487 18.204 -10.343 40 HG1 THR 5 HG1 THR 5 17.826 16.534 -11.841 41 1HG2 THR 5 1HG2 THR 5 16.840 15.838 -9.343 42 2HG2 THR 5 2HG2 THR 5 18.578 15.872 -9.686 43 3HG2 THR 5 3HG2 THR 5 17.924 16.822 -8.339 44 H GLU 6 H GLU 6 18.044 20.638 -10.018 45 HA GLU 6 HA GLU 6 16.461 22.426 -11.537 46 1HB GLU 6 1HB GLU 6 19.502 22.073 -11.619 47 2HB GLU 6 2HB GLU 6 18.587 23.487 -12.157 48 1HG GLU 6 1HG GLU 6 18.823 22.469 -9.282 49 2HG GLU 6 2HG GLU 6 19.526 23.934 -9.963 50 H GLU 7 H GLU 7 18.638 19.770 -12.550 51 HA GLU 7 HA GLU 7 18.388 20.119 -15.340 52 1HB GLU 7 1HB GLU 7 18.773 17.561 -13.712 53 2HB GLU 7 2HB GLU 7 18.890 17.680 -15.467 54 1HG GLU 7 1HG GLU 7 21.117 17.762 -14.613 55 2HG GLU 7 2HG GLU 7 20.715 19.357 -15.254 56 H GLN 8 H GLN 8 16.280 18.179 -13.080 57 HA GLN 8 HA GLN 8 14.466 17.379 -15.150 58 1HB GLN 8 1HB GLN 8 14.027 17.852 -12.178 59 2HB GLN 8 2HB GLN 8 12.769 17.250 -13.258 60 1HG GLN 8 1HG GLN 8 15.425 15.847 -12.748 61 2HG GLN 8 2HG GLN 8 13.861 15.417 -12.053 62 1HE2 GLN 8 1HE2 GLN 8 15.930 15.058 -14.826 63 2HE2 GLN 8 2HE2 GLN 8 14.783 14.145 -15.791 64 H LYS 9 H LYS 9 14.425 20.317 -13.059 65 HA LYS 9 HA LYS 9 12.039 21.401 -14.159 66 1HB LYS 9 1HB LYS 9 14.469 22.866 -13.074 67 2HB LYS 9 2HB LYS 9 12.897 23.597 -13.423 68 1HG LYS 9 1HG LYS 9 11.805 22.078 -11.802 69 2HG LYS 9 2HG LYS 9 13.371 21.345 -11.421 70 1HD LYS 9 1HD LYS 9 14.203 23.689 -10.812 71 2HD LYS 9 2HD LYS 9 12.517 24.228 -10.918 72 1HE LYS 9 1HE LYS 9 13.686 22.088 -9.076 73 2HE LYS 9 2HE LYS 9 13.130 23.700 -8.599 74 1HZ LYS 9 1HZ LYS 9 10.917 23.063 -9.257 75 2HZ LYS 9 2HZ LYS 9 11.440 21.554 -9.672 76 3HZ LYS 9 3HZ LYS 9 11.508 22.045 -8.102 77 H GLN 10 H GLN 10 15.418 21.716 -15.285 78 HA GLN 10 HA GLN 10 14.944 23.469 -17.469 79 1HB GLN 10 1HB GLN 10 17.048 21.319 -17.035 80 2HB GLN 10 2HB GLN 10 17.072 22.456 -18.382 81 1HG GLN 10 1HG GLN 10 17.473 24.317 -16.999 82 2HG GLN 10 2HG GLN 10 16.871 23.521 -15.551 83 1HE2 GLN 10 1HE2 GLN 10 19.362 22.505 -17.983 84 2HE2 GLN 10 2HE2 GLN 10 20.619 22.297 -16.776 85 H GLU 11 H GLU 11 15.054 19.849 -17.402 86 HA GLU 11 HA GLU 11 14.323 19.493 -20.121 87 1HB GLU 11 1HB GLU 11 13.791 17.736 -17.689 88 2HB GLU 11 2HB GLU 11 13.506 17.228 -19.353 89 1HG GLU 11 1HG GLU 11 16.223 18.088 -18.247 90 2HG GLU 11 2HG GLU 11 15.681 16.421 -18.446 91 H ILE 12 H ILE 12 12.224 19.726 -17.224 92 HA ILE 12 HA ILE 12 9.730 19.424 -18.540 93 HB ILE 12 HB ILE 12 10.542 20.916 -16.024 94 1HG1 ILE 12 1HG1 ILE 12 8.965 18.324 -16.385 95 2HG1 ILE 12 2HG1 ILE 12 10.713 18.344 -16.200 96 1HG2 ILE 12 1HG2 ILE 12 8.142 20.996 -15.428 97 2HG2 ILE 12 2HG2 ILE 12 8.462 21.958 -16.860 98 3HG2 ILE 12 3HG2 ILE 12 7.731 20.351 -17.026 99 1HD1 ILE 12 1HD1 ILE 12 9.747 17.875 -14.061 100 2HD1 ILE 12 2HD1 ILE 12 10.455 19.498 -13.993 101 3HD1 ILE 12 3HD1 ILE 12 8.692 19.290 -14.131 102 H ARG 13 H ARG 13 11.695 22.399 -17.951 103 HA ARG 13 HA ARG 13 9.838 24.112 -19.225 104 1HB ARG 13 1HB ARG 13 11.642 24.935 -17.734 105 2HB ARG 13 2HB ARG 13 12.850 24.444 -18.930 106 1HG ARG 13 1HG ARG 13 12.541 26.803 -19.177 107 2HG ARG 13 2HG ARG 13 11.823 26.024 -20.576 108 1HD ARG 13 1HD ARG 13 9.575 26.203 -19.090 109 2HD ARG 13 2HD ARG 13 10.520 27.435 -18.249 110 HE ARG 13 HE ARG 13 10.475 27.656 -21.173 111 1HH1 ARG 13 1HH1 ARG 13 8.684 28.427 -18.216 112 2HH1 ARG 13 2HH1 ARG 13 7.766 29.719 -18.940 113 1HH2 ARG 13 1HH2 ARG 13 9.074 29.115 -22.187 114 2HH2 ARG 13 2HH2 ARG 13 8.024 30.157 -21.257 115 H GLU 14 H GLU 14 12.675 22.368 -20.583 116 HA GLU 14 HA GLU 14 12.463 23.358 -23.235 117 1HB GLU 14 1HB GLU 14 13.389 20.653 -22.182 118 2HB GLU 14 2HB GLU 14 13.546 21.161 -23.867 119 1HG GLU 14 1HG GLU 14 14.984 23.011 -23.281 120 2HG GLU 14 2HG GLU 14 14.718 22.767 -21.554 121 H ALA 15 H ALA 15 10.946 20.445 -21.766 122 HA ALA 15 HA ALA 15 9.436 19.625 -24.005 123 1HB ALA 15 1HB ALA 15 9.729 18.261 -21.978 124 2HB ALA 15 2HB ALA 15 8.726 19.392 -21.047 125 3HB ALA 15 3HB ALA 15 8.010 18.458 -22.377 126 H PHE 16 H PHE 16 8.489 21.816 -21.317 127 HA PHE 16 HA PHE 16 5.930 22.511 -22.164 128 1HB PHE 16 1HB PHE 16 6.877 23.235 -20.026 129 2HB PHE 16 2HB PHE 16 8.018 24.287 -20.832 130 HD1 PHE 16 HD1 PHE 16 7.420 26.517 -21.535 131 HD2 PHE 16 HD2 PHE 16 4.386 23.728 -20.281 132 HE1 PHE 16 HE1 PHE 16 5.710 28.303 -21.686 133 HE2 PHE 16 HE2 PHE 16 2.690 25.539 -20.350 134 HZ PHE 16 HZ PHE 16 3.339 27.811 -21.104 135 H ASP 17 H ASP 17 8.947 24.334 -22.895 136 HA ASP 17 HA ASP 17 7.813 26.196 -24.666 137 1HB ASP 17 1HB ASP 17 10.631 25.056 -24.504 138 2HB ASP 17 2HB ASP 17 10.174 26.345 -25.624 139 H LEU 18 H LEU 18 9.243 22.980 -25.423 140 HA LEU 18 HA LEU 18 8.937 23.166 -28.226 141 1HB LEU 18 1HB LEU 18 10.258 21.440 -27.188 142 2HB LEU 18 2HB LEU 18 8.843 20.702 -26.434 143 HG LEU 18 HG LEU 18 8.654 21.084 -29.406 144 1HD1 LEU 18 1HD1 LEU 18 10.997 20.471 -29.231 145 2HD1 LEU 18 2HD1 LEU 18 10.570 19.050 -28.240 146 3HD1 LEU 18 3HD1 LEU 18 10.031 19.162 -29.936 147 1HD2 LEU 18 1HD2 LEU 18 8.123 18.701 -27.563 148 2HD2 LEU 18 2HD2 LEU 18 6.902 19.840 -28.164 149 3HD2 LEU 18 3HD2 LEU 18 7.740 18.779 -29.294 150 H PHE 19 H PHE 19 6.626 21.767 -25.792 151 HA PHE 19 HA PHE 19 4.640 21.210 -27.775 152 1HB PHE 19 1HB PHE 19 4.300 21.854 -24.826 153 2HB PHE 19 2HB PHE 19 3.071 21.097 -25.843 154 HD1 PHE 19 HD1 PHE 19 4.767 19.049 -27.329 155 HD2 PHE 19 HD2 PHE 19 4.538 20.167 -23.164 156 HE1 PHE 19 HE1 PHE 19 5.556 16.810 -26.687 157 HE2 PHE 19 HE2 PHE 19 5.111 17.843 -22.536 158 HZ PHE 19 HZ PHE 19 5.752 16.193 -24.283 159 H ASP 20 H ASP 20 5.325 24.067 -25.866 160 HA ASP 20 HA ASP 20 2.965 25.584 -26.383 161 1HB ASP 20 1HB ASP 20 4.652 25.725 -24.464 162 2HB ASP 20 2HB ASP 20 5.762 26.467 -25.639 163 H THR 21 H THR 21 4.226 24.615 -28.888 164 HA THR 21 HA THR 21 5.822 26.183 -30.395 165 HB THR 21 HB THR 21 4.414 25.414 -32.347 166 HG1 THR 21 HG1 THR 21 2.769 24.394 -30.243 167 1HG2 THR 21 1HG2 THR 21 6.142 23.893 -31.212 168 2HG2 THR 21 2HG2 THR 21 4.768 23.133 -30.373 169 3HG2 THR 21 3HG2 THR 21 4.856 23.085 -32.131 170 H ASP 22 H ASP 22 2.327 26.549 -30.378 171 HA ASP 22 HA ASP 22 2.486 29.376 -31.380 172 1HB ASP 22 1HB ASP 22 1.080 27.843 -32.669 173 2HB ASP 22 2HB ASP 22 0.193 27.376 -31.209 174 H GLY 23 H GLY 23 1.667 27.379 -28.626 175 1HA GLY 23 1HA GLY 23 0.014 28.973 -27.075 176 2HA GLY 23 2HA GLY 23 1.262 27.874 -26.462 177 H SER 24 H SER 24 3.538 29.192 -27.528 178 HA SER 24 HA SER 24 5.082 30.780 -26.942 179 1HB SER 24 1HB SER 24 3.945 31.537 -29.010 180 2HB SER 24 2HB SER 24 2.789 32.452 -28.020 181 HG SER 24 HG SER 24 4.565 33.643 -27.212 182 H GLY 25 H GLY 25 4.008 30.120 -24.586 183 1HA GLY 25 1HA GLY 25 4.525 31.728 -22.571 184 2HA GLY 25 2HA GLY 25 3.066 32.555 -23.146 185 H THR 26 H THR 26 1.453 30.442 -23.972 186 HA THR 26 HA THR 26 0.969 28.861 -21.451 187 HB THR 26 HB THR 26 -1.397 29.514 -21.686 188 HG1 THR 26 HG1 THR 26 -0.973 30.183 -23.993 189 1HG2 THR 26 1HG2 THR 26 0.374 31.958 -21.378 190 2HG2 THR 26 2HG2 THR 26 -1.275 31.723 -20.765 191 3HG2 THR 26 3HG2 THR 26 0.056 30.749 -20.110 192 H ILE 27 H ILE 27 0.623 26.715 -21.942 193 HA ILE 27 HA ILE 27 0.555 25.923 -24.742 194 HB ILE 27 HB ILE 27 0.494 24.493 -22.093 195 1HG1 ILE 27 1HG1 ILE 27 2.342 24.367 -24.511 196 2HG1 ILE 27 2HG1 ILE 27 2.619 25.337 -23.060 197 1HG2 ILE 27 1HG2 ILE 27 -1.079 23.207 -23.592 198 2HG2 ILE 27 2HG2 ILE 27 0.253 23.065 -24.762 199 3HG2 ILE 27 3HG2 ILE 27 0.361 22.322 -23.163 200 1HD1 ILE 27 1HD1 ILE 27 3.909 23.343 -22.853 201 2HD1 ILE 27 2HD1 ILE 27 2.555 22.298 -23.279 202 3HD1 ILE 27 3HD1 ILE 27 2.544 23.162 -21.726 203 H ASP 28 H ASP 28 -1.218 25.787 -25.982 204 HA ASP 28 HA ASP 28 -3.889 26.134 -24.868 205 1HB ASP 28 1HB ASP 28 -3.211 27.075 -27.063 206 2HB ASP 28 2HB ASP 28 -2.992 25.435 -27.694 207 H ALA 29 H ALA 29 -5.507 24.596 -24.727 208 HA ALA 29 HA ALA 29 -5.254 22.003 -24.063 209 1HB ALA 29 1HB ALA 29 -7.395 23.179 -25.895 210 2HB ALA 29 2HB ALA 29 -7.550 21.676 -24.966 211 3HB ALA 29 3HB ALA 29 -7.388 23.230 -24.120 212 H LYS 30 H LYS 30 -5.453 23.105 -27.482 213 HA LYS 30 HA LYS 30 -5.386 20.594 -28.770 214 1HB LYS 30 1HB LYS 30 -4.297 23.300 -29.617 215 2HB LYS 30 2HB LYS 30 -4.418 21.881 -30.672 216 1HG LYS 30 1HG LYS 30 -6.827 21.818 -30.478 217 2HG LYS 30 2HG LYS 30 -6.828 23.039 -29.203 218 1HD LYS 30 1HD LYS 30 -7.518 24.053 -31.280 219 2HD LYS 30 2HD LYS 30 -5.978 24.745 -30.752 220 1HE LYS 30 1HE LYS 30 -4.759 23.363 -32.400 221 2HE LYS 30 2HE LYS 30 -6.264 22.539 -32.854 222 1HZ LYS 30 1HZ LYS 30 -5.697 25.399 -33.192 223 2HZ LYS 30 2HZ LYS 30 -5.682 24.259 -34.383 224 3HZ LYS 30 3HZ LYS 30 -7.095 24.639 -33.625 225 H GLU 31 H GLU 31 -2.676 22.768 -27.874 226 HA GLU 31 HA GLU 31 -0.558 21.099 -28.856 227 1HB GLU 31 1HB GLU 31 -0.658 23.273 -26.744 228 2HB GLU 31 2HB GLU 31 0.838 22.502 -27.286 229 1HG GLU 31 1HG GLU 31 0.556 23.340 -29.533 230 2HG GLU 31 2HG GLU 31 -1.072 23.947 -29.178 231 H LEU 32 H LEU 32 -2.222 21.396 -25.677 232 HA LEU 32 HA LEU 32 -0.489 19.546 -24.382 233 1HB LEU 32 1HB LEU 32 -2.192 21.172 -23.285 234 2HB LEU 32 2HB LEU 32 -3.382 19.907 -23.599 235 HG LEU 32 HG LEU 32 -1.659 18.316 -22.409 236 1HD1 LEU 32 1HD1 LEU 32 0.281 19.831 -22.312 237 2HD1 LEU 32 2HD1 LEU 32 -0.671 21.006 -21.379 238 3HD1 LEU 32 3HD1 LEU 32 -0.270 19.424 -20.689 239 1HD2 LEU 32 1HD2 LEU 32 -3.192 20.442 -20.877 240 2HD2 LEU 32 2HD2 LEU 32 -3.830 18.893 -21.459 241 3HD2 LEU 32 3HD2 LEU 32 -2.595 18.917 -20.187 242 H LYS 33 H LYS 33 -3.667 18.968 -26.050 243 HA LYS 33 HA LYS 33 -3.553 16.153 -25.522 244 1HB LYS 33 1HB LYS 33 -5.268 15.762 -27.075 245 2HB LYS 33 2HB LYS 33 -5.637 17.089 -25.957 246 1HG LYS 33 1HG LYS 33 -5.077 18.706 -27.628 247 2HG LYS 33 2HG LYS 33 -4.561 17.453 -28.762 248 1HD LYS 33 1HD LYS 33 -6.754 18.247 -29.426 249 2HD LYS 33 2HD LYS 33 -6.896 16.577 -28.853 250 1HE LYS 33 1HE LYS 33 -7.789 17.357 -26.696 251 2HE LYS 33 2HE LYS 33 -7.490 19.048 -27.145 252 1HZ LYS 33 1HZ LYS 33 -9.761 18.422 -27.443 253 2HZ LYS 33 2HZ LYS 33 -9.084 18.784 -28.902 254 3HZ LYS 33 3HZ LYS 33 -9.350 17.211 -28.482 255 H VAL 34 H VAL 34 -2.193 18.104 -28.196 256 HA VAL 34 HA VAL 34 -1.193 15.890 -29.709 257 HB VAL 34 HB VAL 34 -0.252 18.754 -29.372 258 1HG1 VAL 34 1HG1 VAL 34 1.780 17.512 -29.913 259 2HG1 VAL 34 2HG1 VAL 34 0.929 16.622 -31.198 260 3HG1 VAL 34 3HG1 VAL 34 1.215 18.368 -31.347 261 1HG2 VAL 34 1HG2 VAL 34 -1.482 17.260 -31.730 262 2HG2 VAL 34 2HG2 VAL 34 -2.399 18.285 -30.615 263 3HG2 VAL 34 3HG2 VAL 34 -1.137 18.999 -31.632 264 H ALA 35 H ALA 35 0.294 17.716 -26.977 265 HA ALA 35 HA ALA 35 2.679 16.240 -26.788 266 1HB ALA 35 1HB ALA 35 1.057 17.468 -24.507 267 2HB ALA 35 2HB ALA 35 2.748 16.991 -24.455 268 3HB ALA 35 3HB ALA 35 2.229 18.313 -25.527 269 H MET 36 H MET 36 -0.410 15.675 -25.031 270 HA MET 36 HA MET 36 0.322 13.255 -23.783 271 1HB MET 36 1HB MET 36 -2.191 14.700 -24.400 272 2HB MET 36 2HB MET 36 -2.395 12.973 -24.195 273 1HG MET 36 1HG MET 36 -1.208 13.022 -22.053 274 2HG MET 36 2HG MET 36 -0.956 14.764 -22.202 275 1HE MET 36 1HE MET 36 -2.658 16.510 -21.591 276 2HE MET 36 2HE MET 36 -3.503 16.060 -23.090 277 3HE MET 36 3HE MET 36 -4.421 16.269 -21.582 278 H ARG 37 H ARG 37 -1.141 13.735 -27.026 279 HA ARG 37 HA ARG 37 -1.367 11.008 -27.678 280 1HB ARG 37 1HB ARG 37 -2.326 12.974 -28.950 281 2HB ARG 37 2HB ARG 37 -0.714 13.295 -29.590 282 1HG ARG 37 1HG ARG 37 -2.003 12.091 -31.211 283 2HG ARG 37 2HG ARG 37 -0.704 11.032 -30.662 284 1HD ARG 37 1HD ARG 37 -2.169 9.669 -29.389 285 2HD ARG 37 2HD ARG 37 -3.433 10.893 -29.319 286 HE ARG 37 HE ARG 37 -2.986 8.921 -31.383 287 1HH1 ARG 37 1HH1 ARG 37 -4.252 12.167 -30.830 288 2HH1 ARG 37 2HH1 ARG 37 -5.420 12.099 -32.125 289 1HH2 ARG 37 1HH2 ARG 37 -4.488 8.813 -33.098 290 2HH2 ARG 37 2HH2 ARG 37 -5.548 10.153 -33.440 291 H ALA 38 H ALA 38 1.377 13.280 -28.243 292 HA ALA 38 HA ALA 38 3.160 11.396 -29.403 293 1HB ALA 38 1HB ALA 38 3.834 13.814 -27.673 294 2HB ALA 38 2HB ALA 38 4.926 12.961 -28.780 295 3HB ALA 38 3HB ALA 38 3.522 13.840 -29.422 296 H LEU 39 H LEU 39 2.507 12.203 -25.988 297 HA LEU 39 HA LEU 39 4.398 10.299 -24.889 298 1HB LEU 39 1HB LEU 39 1.987 11.729 -23.729 299 2HB LEU 39 2HB LEU 39 3.069 10.735 -22.774 300 HG LEU 39 HG LEU 39 4.065 13.143 -24.362 301 1HD1 LEU 39 1HD1 LEU 39 3.099 13.035 -21.473 302 2HD1 LEU 39 2HD1 LEU 39 3.930 14.408 -22.236 303 3HD1 LEU 39 3HD1 LEU 39 2.325 13.925 -22.800 304 1HD2 LEU 39 1HD2 LEU 39 5.204 11.617 -21.977 305 2HD2 LEU 39 2HD2 LEU 39 5.817 11.556 -23.643 306 3HD2 LEU 39 3HD2 LEU 39 5.917 13.061 -22.723 307 H GLY 40 H GLY 40 1.688 9.584 -26.701 308 1HA GLY 40 1HA GLY 40 0.901 7.501 -27.157 309 2HA GLY 40 2HA GLY 40 1.766 6.833 -25.769 310 H PHE 41 H PHE 41 -0.335 9.583 -25.174 311 HA PHE 41 HA PHE 41 -2.231 7.929 -23.637 312 1HB PHE 41 1HB PHE 41 -2.051 10.856 -24.350 313 2HB PHE 41 2HB PHE 41 -3.462 10.215 -23.574 314 HD1 PHE 41 HD1 PHE 41 -3.609 10.557 -21.271 315 HD2 PHE 41 HD2 PHE 41 0.301 10.057 -23.044 316 HE1 PHE 41 HE1 PHE 41 -2.553 10.916 -19.068 317 HE2 PHE 41 HE2 PHE 41 1.340 10.377 -20.833 318 HZ PHE 41 HZ PHE 41 -0.083 10.795 -18.832 319 H GLU 42 H GLU 42 -4.568 8.176 -24.044 320 HA GLU 42 HA GLU 42 -5.351 8.299 -26.934 321 1HB GLU 42 1HB GLU 42 -6.667 6.926 -24.567 322 2HB GLU 42 2HB GLU 42 -7.314 7.015 -26.214 323 1HG GLU 42 1HG GLU 42 -5.272 5.819 -27.044 324 2HG GLU 42 2HG GLU 42 -4.713 5.644 -25.374 325 HA PRO 43 HA PRO 43 -6.832 12.253 -25.152 326 1HB PRO 43 1HB PRO 43 -7.590 12.481 -28.079 327 2HB PRO 43 2HB PRO 43 -7.034 13.771 -26.973 328 1HG PRO 43 1HG PRO 43 -5.267 12.588 -28.630 329 2HG PRO 43 2HG PRO 43 -4.818 12.805 -26.911 330 1HD PRO 43 1HD PRO 43 -5.830 10.290 -28.270 331 2HD PRO 43 2HD PRO 43 -4.515 10.513 -27.068 332 H LYS 44 H LYS 44 -8.442 10.643 -24.088 333 HA LYS 44 HA LYS 44 -11.161 10.603 -25.069 334 1HB LYS 44 1HB LYS 44 -9.993 10.322 -22.271 335 2HB LYS 44 2HB LYS 44 -11.700 10.077 -22.691 336 1HG LYS 44 1HG LYS 44 -11.042 8.290 -24.296 337 2HG LYS 44 2HG LYS 44 -9.344 8.515 -23.837 338 1HD LYS 44 1HD LYS 44 -9.896 7.897 -21.488 339 2HD LYS 44 2HD LYS 44 -11.598 7.717 -21.937 340 1HE LYS 44 1HE LYS 44 -10.549 5.525 -21.835 341 2HE LYS 44 2HE LYS 44 -11.003 5.884 -23.508 342 1HZ LYS 44 1HZ LYS 44 -8.806 4.952 -23.350 343 2HZ LYS 44 2HZ LYS 44 -8.729 6.491 -23.922 344 3HZ LYS 44 3HZ LYS 44 -8.312 6.173 -22.360 345 H LYS 45 H LYS 45 -11.298 12.705 -25.857 346 HA LYS 45 HA LYS 45 -10.906 15.116 -25.180 347 1HB LYS 45 1HB LYS 45 -12.428 14.329 -26.994 348 2HB LYS 45 2HB LYS 45 -13.761 14.298 -25.823 349 1HG LYS 45 1HG LYS 45 -13.189 16.809 -25.418 350 2HG LYS 45 2HG LYS 45 -12.200 16.687 -26.875 351 1HD LYS 45 1HD LYS 45 -15.218 16.222 -26.619 352 2HD LYS 45 2HD LYS 45 -14.405 17.603 -27.355 353 1HE LYS 45 1HE LYS 45 -15.035 16.370 -29.213 354 2HE LYS 45 2HE LYS 45 -13.347 15.878 -29.008 355 1HZ LYS 45 1HZ LYS 45 -15.730 14.406 -28.084 356 2HZ LYS 45 2HZ LYS 45 -14.827 14.038 -29.412 357 3HZ LYS 45 3HZ LYS 45 -14.175 13.894 -27.909 358 H GLU 46 H GLU 46 -13.746 13.560 -23.581 359 HA GLU 46 HA GLU 46 -14.432 15.803 -21.976 360 1HB GLU 46 1HB GLU 46 -14.931 12.819 -21.537 361 2HB GLU 46 2HB GLU 46 -15.654 14.121 -20.592 362 1HG GLU 46 1HG GLU 46 -17.257 13.418 -22.243 363 2HG GLU 46 2HG GLU 46 -16.719 15.057 -22.622 364 H GLU 47 H GLU 47 -12.302 13.012 -21.323 365 HA GLU 47 HA GLU 47 -11.770 13.707 -18.553 366 1HB GLU 47 1HB GLU 47 -10.235 11.904 -20.473 367 2HB GLU 47 2HB GLU 47 -10.019 12.007 -18.724 368 1HG GLU 47 1HG GLU 47 -12.329 11.206 -18.359 369 2HG GLU 47 2HG GLU 47 -12.607 11.137 -20.108 370 H ILE 48 H ILE 48 -10.170 14.173 -21.712 371 HA ILE 48 HA ILE 48 -7.825 15.494 -20.815 372 HB ILE 48 HB ILE 48 -9.458 15.779 -23.359 373 1HG1 ILE 48 1HG1 ILE 48 -8.343 13.546 -22.858 374 2HG1 ILE 48 2HG1 ILE 48 -7.988 14.314 -24.405 375 1HG2 ILE 48 1HG2 ILE 48 -6.778 17.033 -22.717 376 2HG2 ILE 48 2HG2 ILE 48 -7.391 16.777 -24.368 377 3HG2 ILE 48 3HG2 ILE 48 -8.276 17.822 -23.261 378 1HD1 ILE 48 1HD1 ILE 48 -6.158 14.497 -21.979 379 2HD1 ILE 48 2HD1 ILE 48 -5.983 13.315 -23.279 380 3HD1 ILE 48 3HD1 ILE 48 -5.803 15.035 -23.642 381 H LYS 49 H LYS 49 -10.996 16.927 -21.749 382 HA LYS 49 HA LYS 49 -10.343 19.618 -21.112 383 1HB LYS 49 1HB LYS 49 -12.985 18.113 -21.140 384 2HB LYS 49 2HB LYS 49 -12.848 19.856 -20.847 385 1HG LYS 49 1HG LYS 49 -11.877 20.245 -23.027 386 2HG LYS 49 2HG LYS 49 -11.689 18.521 -23.325 387 1HD LYS 49 1HD LYS 49 -13.616 19.400 -24.563 388 2HD LYS 49 2HD LYS 49 -14.095 18.171 -23.388 389 1HE LYS 49 1HE LYS 49 -15.674 20.076 -23.449 390 2HE LYS 49 2HE LYS 49 -14.943 19.887 -21.853 391 1HZ LYS 49 1HZ LYS 49 -13.436 21.658 -22.401 392 2HZ LYS 49 2HZ LYS 49 -14.093 21.816 -23.905 393 3HZ LYS 49 3HZ LYS 49 -14.994 22.163 -22.569 394 H LYS 50 H LYS 50 -11.879 17.064 -19.090 395 HA LYS 50 HA LYS 50 -12.246 18.601 -16.781 396 1HB LYS 50 1HB LYS 50 -12.885 16.111 -17.397 397 2HB LYS 50 2HB LYS 50 -11.378 15.702 -16.581 398 1HG LYS 50 1HG LYS 50 -13.835 17.123 -15.462 399 2HG LYS 50 2HG LYS 50 -13.251 15.499 -15.084 400 1HD LYS 50 1HD LYS 50 -11.124 16.618 -14.161 401 2HD LYS 50 2HD LYS 50 -11.985 18.163 -14.334 402 1HE LYS 50 1HE LYS 50 -12.290 17.514 -12.073 403 2HE LYS 50 2HE LYS 50 -13.835 17.214 -12.879 404 1HZ LYS 50 1HZ LYS 50 -11.762 15.212 -12.283 405 2HZ LYS 50 2HZ LYS 50 -13.176 15.410 -11.464 406 3HZ LYS 50 3HZ LYS 50 -13.198 14.895 -13.029 407 H MET 51 H MET 51 -9.401 16.541 -17.635 408 HA MET 51 HA MET 51 -7.822 17.175 -15.423 409 1HB MET 51 1HB MET 51 -7.463 15.358 -17.200 410 2HB MET 51 2HB MET 51 -6.747 16.621 -18.213 411 1HG MET 51 1HG MET 51 -5.220 17.114 -16.156 412 2HG MET 51 2HG MET 51 -5.889 15.631 -15.473 413 1HE MET 51 1HE MET 51 -3.559 17.294 -18.060 414 2HE MET 51 2HE MET 51 -3.010 15.928 -19.058 415 3HE MET 51 3HE MET 51 -4.686 16.511 -19.195 416 H ILE 52 H ILE 52 -7.830 18.717 -18.690 417 HA ILE 52 HA ILE 52 -5.910 20.704 -18.234 418 HB ILE 52 HB ILE 52 -8.430 20.617 -19.921 419 1HG1 ILE 52 1HG1 ILE 52 -5.494 20.775 -20.712 420 2HG1 ILE 52 2HG1 ILE 52 -6.320 19.240 -20.427 421 1HG2 ILE 52 1HG2 ILE 52 -6.458 22.942 -19.857 422 2HG2 ILE 52 2HG2 ILE 52 -7.726 22.705 -21.067 423 3HG2 ILE 52 3HG2 ILE 52 -8.170 23.012 -19.404 424 1HD1 ILE 52 1HD1 ILE 52 -6.329 19.658 -22.791 425 2HD1 ILE 52 2HD1 ILE 52 -7.994 19.858 -22.194 426 3HD1 ILE 52 3HD1 ILE 52 -7.001 21.279 -22.572 427 H SER 53 H SER 53 -9.426 20.818 -17.492 428 HA SER 53 HA SER 53 -9.365 23.436 -16.396 429 1HB SER 53 1HB SER 53 -11.233 21.157 -15.587 430 2HB SER 53 2HB SER 53 -11.514 22.897 -15.414 431 HG SER 53 HG SER 53 -11.240 21.427 -17.846 432 H GLU 54 H GLU 54 -8.986 20.254 -14.738 433 HA GLU 54 HA GLU 54 -8.675 21.313 -12.108 434 1HB GLU 54 1HB GLU 54 -7.507 18.810 -13.394 435 2HB GLU 54 2HB GLU 54 -7.390 19.190 -11.670 436 1HG GLU 54 1HG GLU 54 -9.826 19.215 -11.442 437 2HG GLU 54 2HG GLU 54 -10.025 18.910 -13.170 438 H ILE 55 H ILE 55 -6.247 20.744 -14.679 439 HA ILE 55 HA ILE 55 -4.015 21.577 -13.022 440 HB ILE 55 HB ILE 55 -4.324 21.226 -16.021 441 1HG1 ILE 55 1HG1 ILE 55 -4.605 19.111 -14.818 442 2HG1 ILE 55 2HG1 ILE 55 -3.113 19.139 -15.742 443 1HG2 ILE 55 1HG2 ILE 55 -1.812 21.731 -14.385 444 2HG2 ILE 55 2HG2 ILE 55 -1.822 21.125 -16.059 445 3HG2 ILE 55 3HG2 ILE 55 -2.485 22.714 -15.695 446 1HD1 ILE 55 1HD1 ILE 55 -3.410 19.453 -12.717 447 2HD1 ILE 55 2HD1 ILE 55 -2.748 18.075 -13.597 448 3HD1 ILE 55 3HD1 ILE 55 -1.866 19.608 -13.586 449 H ASP 56 H ASP 56 -6.230 23.288 -15.253 450 HA ASP 56 HA ASP 56 -4.523 25.610 -15.375 451 1HB ASP 56 1HB ASP 56 -5.970 24.900 -17.224 452 2HB ASP 56 2HB ASP 56 -7.403 25.267 -16.247 453 H LYS 57 H LYS 57 -4.425 25.601 -12.931 454 HA LYS 57 HA LYS 57 -6.388 26.455 -11.163 455 1HB LYS 57 1HB LYS 57 -3.496 27.412 -11.228 456 2HB LYS 57 2HB LYS 57 -4.565 27.399 -9.824 457 1HG LYS 57 1HG LYS 57 -3.432 24.968 -11.276 458 2HG LYS 57 2HG LYS 57 -2.991 25.581 -9.686 459 1HD LYS 57 1HD LYS 57 -5.342 25.162 -8.894 460 2HD LYS 57 2HD LYS 57 -5.703 24.393 -10.453 461 1HE LYS 57 1HE LYS 57 -3.512 23.469 -8.538 462 2HE LYS 57 2HE LYS 57 -5.132 22.764 -8.662 463 1HZ LYS 57 1HZ LYS 57 -4.704 22.233 -10.924 464 2HZ LYS 57 2HZ LYS 57 -3.182 22.867 -10.848 465 3HZ LYS 57 3HZ LYS 57 -3.566 21.537 -9.950 466 H ASP 58 H ASP 58 -4.895 28.446 -13.675 467 HA ASP 58 HA ASP 58 -5.855 30.949 -12.382 468 1HB ASP 58 1HB ASP 58 -4.614 32.155 -14.009 469 2HB ASP 58 2HB ASP 58 -3.566 30.959 -13.244 470 H GLY 59 H GLY 59 -6.774 28.563 -14.657 471 1HA GLY 59 1HA GLY 59 -8.646 28.186 -15.620 472 2HA GLY 59 2HA GLY 59 -9.343 29.658 -14.917 473 H SER 60 H SER 60 -6.538 30.251 -16.889 474 HA SER 60 HA SER 60 -8.185 31.721 -18.794 475 1HB SER 60 1HB SER 60 -6.054 32.592 -17.844 476 2HB SER 60 2HB SER 60 -5.170 31.324 -18.724 477 HG SER 60 HG SER 60 -6.084 32.179 -20.649 478 H GLY 61 H GLY 61 -8.735 28.952 -19.007 479 1HA GLY 61 1HA GLY 61 -8.875 27.178 -20.427 480 2HA GLY 61 2HA GLY 61 -8.967 28.440 -21.662 481 H THR 62 H THR 62 -6.013 27.717 -19.742 482 HA THR 62 HA THR 62 -4.689 26.311 -21.928 483 HB THR 62 HB THR 62 -2.921 28.071 -22.113 484 HG1 THR 62 HG1 THR 62 -4.876 29.773 -20.957 485 1HG2 THR 62 1HG2 THR 62 -4.726 27.927 -23.874 486 2HG2 THR 62 2HG2 THR 62 -5.568 29.244 -23.045 487 3HG2 THR 62 3HG2 THR 62 -3.951 29.513 -23.704 488 H ILE 63 H ILE 63 -2.439 25.779 -21.238 489 HA ILE 63 HA ILE 63 -2.249 25.559 -18.268 490 HB ILE 63 HB ILE 63 -0.711 24.019 -20.364 491 1HG1 ILE 63 1HG1 ILE 63 -2.911 23.321 -20.794 492 2HG1 ILE 63 2HG1 ILE 63 -2.166 22.105 -19.758 493 1HG2 ILE 63 1HG2 ILE 63 0.347 24.146 -18.176 494 2HG2 ILE 63 2HG2 ILE 63 -1.127 23.567 -17.390 495 3HG2 ILE 63 3HG2 ILE 63 -0.230 22.505 -18.494 496 1HD1 ILE 63 1HD1 ILE 63 -3.371 23.182 -17.780 497 2HD1 ILE 63 2HD1 ILE 63 -4.260 24.160 -18.969 498 3HD1 ILE 63 3HD1 ILE 63 -4.388 22.400 -18.996 499 H ASP 64 H ASP 64 -1.208 27.332 -17.520 500 HA ASP 64 HA ASP 64 0.996 28.676 -18.849 501 1HB ASP 64 1HB ASP 64 -0.303 29.858 -17.169 502 2HB ASP 64 2HB ASP 64 0.018 28.607 -15.963 503 H PHE 65 H PHE 65 3.239 28.556 -18.241 504 HA PHE 65 HA PHE 65 4.455 26.105 -18.089 505 1HB PHE 65 1HB PHE 65 5.743 28.044 -18.594 506 2HB PHE 65 2HB PHE 65 5.392 28.773 -17.024 507 HD1 PHE 65 HD1 PHE 65 7.205 28.772 -15.520 508 HD2 PHE 65 HD2 PHE 65 6.746 25.447 -18.239 509 HE1 PHE 65 HE1 PHE 65 9.151 27.656 -14.492 510 HE2 PHE 65 HE2 PHE 65 8.663 24.310 -17.152 511 HZ PHE 65 HZ PHE 65 9.902 25.431 -15.317 512 H GLU 66 H GLU 66 3.637 28.077 -15.145 513 HA GLU 66 HA GLU 66 4.811 26.120 -13.389 514 1HB GLU 66 1HB GLU 66 2.709 28.257 -12.846 515 2HB GLU 66 2HB GLU 66 3.564 27.327 -11.611 516 1HG GLU 66 1HG GLU 66 4.880 29.207 -13.632 517 2HG GLU 66 2HG GLU 66 4.571 29.558 -11.928 518 H GLU 67 H GLU 67 1.621 26.395 -14.885 519 HA GLU 67 HA GLU 67 0.339 24.447 -13.139 520 1HB GLU 67 1HB GLU 67 -0.427 25.468 -15.898 521 2HB GLU 67 2HB GLU 67 -1.437 24.497 -14.826 522 1HG GLU 67 1HG GLU 67 -1.473 26.226 -13.127 523 2HG GLU 67 2HG GLU 67 -0.365 27.248 -14.050 524 H PHE 68 H PHE 68 1.963 24.430 -16.329 525 HA PHE 68 HA PHE 68 1.714 21.626 -16.848 526 1HB PHE 68 1HB PHE 68 2.425 23.246 -18.553 527 2HB PHE 68 2HB PHE 68 3.895 23.585 -17.659 528 HD1 PHE 68 HD1 PHE 68 2.044 20.896 -19.488 529 HD2 PHE 68 HD2 PHE 68 5.845 22.219 -17.928 530 HE1 PHE 68 HE1 PHE 68 3.191 19.068 -20.714 531 HE2 PHE 68 HE2 PHE 68 6.985 20.446 -19.244 532 HZ PHE 68 HZ PHE 68 5.672 18.828 -20.548 533 H LEU 69 H LEU 69 4.233 23.503 -15.133 534 HA LEU 69 HA LEU 69 5.946 21.414 -14.386 535 1HB LEU 69 1HB LEU 69 6.006 24.052 -14.068 536 2HB LEU 69 2HB LEU 69 5.347 23.682 -12.475 537 HG LEU 69 HG LEU 69 7.985 22.751 -13.684 538 1HD1 LEU 69 1HD1 LEU 69 8.971 24.207 -11.962 539 2HD1 LEU 69 2HD1 LEU 69 7.861 25.136 -12.988 540 3HD1 LEU 69 3HD1 LEU 69 7.352 24.631 -11.367 541 1HD2 LEU 69 1HD2 LEU 69 6.785 22.113 -10.952 542 2HD2 LEU 69 2HD2 LEU 69 7.260 20.955 -12.220 543 3HD2 LEU 69 3HD2 LEU 69 8.495 21.890 -11.374 544 H THR 70 H THR 70 3.040 22.713 -12.719 545 HA THR 70 HA THR 70 3.029 20.909 -10.546 546 HB THR 70 HB THR 70 0.605 22.187 -11.878 547 HG1 THR 70 HG1 THR 70 2.225 23.703 -11.269 548 1HG2 THR 70 1HG2 THR 70 -0.016 20.445 -10.237 549 2HG2 THR 70 2HG2 THR 70 1.072 21.187 -9.040 550 3HG2 THR 70 3HG2 THR 70 -0.356 22.069 -9.614 551 H MET 71 H MET 71 1.387 20.594 -13.762 552 HA MET 71 HA MET 71 0.205 18.075 -13.320 553 1HB MET 71 1HB MET 71 -0.152 19.583 -15.319 554 2HB MET 71 2HB MET 71 1.422 19.073 -15.927 555 1HG MET 71 1HG MET 71 0.544 16.658 -15.812 556 2HG MET 71 2HG MET 71 -1.033 17.351 -15.438 557 1HE MET 71 1HE MET 71 1.138 17.676 -19.509 558 2HE MET 71 2HE MET 71 1.730 18.574 -18.096 559 3HE MET 71 3HE MET 71 1.765 16.794 -18.099 560 H MET 72 H MET 72 3.427 18.845 -14.699 561 HA MET 72 HA MET 72 4.338 16.196 -15.050 562 1HB MET 72 1HB MET 72 5.844 18.767 -14.434 563 2HB MET 72 2HB MET 72 6.641 17.265 -14.894 564 1HG MET 72 1HG MET 72 4.452 18.094 -16.747 565 2HG MET 72 2HG MET 72 5.779 19.229 -16.621 566 1HE MET 72 1HE MET 72 4.775 15.541 -17.517 567 2HE MET 72 2HE MET 72 6.332 14.871 -18.055 568 3HE MET 72 3HE MET 72 6.087 15.259 -16.341 569 H THR 73 H THR 73 4.702 18.367 -12.228 570 HA THR 73 HA THR 73 6.106 16.617 -10.529 571 HB THR 73 HB THR 73 4.003 18.694 -9.763 572 HG1 THR 73 HG1 THR 73 5.666 19.562 -11.013 573 1HG2 THR 73 1HG2 THR 73 4.505 17.303 -7.836 574 2HG2 THR 73 2HG2 THR 73 6.246 17.409 -8.157 575 3HG2 THR 73 3HG2 THR 73 5.339 18.857 -7.666 576 H ALA 74 H ALA 74 2.546 16.972 -10.972 577 HA ALA 74 HA ALA 74 1.825 14.995 -9.051 578 1HB ALA 74 1HB ALA 74 0.309 15.910 -11.531 579 2HB ALA 74 2HB ALA 74 -0.367 15.040 -10.141 580 3HB ALA 74 3HB ALA 74 0.263 16.686 -9.933 581 H LYS 75 H LYS 75 2.503 14.752 -12.562 582 HA LYS 75 HA LYS 75 1.776 11.968 -12.757 583 1HB LYS 75 1HB LYS 75 3.464 13.780 -14.520 584 2HB LYS 75 2HB LYS 75 3.074 12.094 -14.910 585 1HG LYS 75 1HG LYS 75 0.679 12.562 -14.890 586 2HG LYS 75 2HG LYS 75 0.958 14.210 -14.328 587 1HD LYS 75 1HD LYS 75 0.463 14.238 -16.694 588 2HD LYS 75 2HD LYS 75 2.134 14.769 -16.428 589 1HE LYS 75 1HE LYS 75 2.999 12.609 -17.171 590 2HE LYS 75 2HE LYS 75 1.368 11.915 -17.199 591 1HZ LYS 75 1HZ LYS 75 2.127 12.515 -19.369 592 2HZ LYS 75 2HZ LYS 75 0.822 13.430 -18.958 593 3HZ LYS 75 3HZ LYS 75 2.334 14.088 -18.922 594 H MET 76 H MET 76 4.921 13.617 -12.209 595 HA MET 76 HA MET 76 6.501 11.218 -12.323 596 1HB MET 76 1HB MET 76 6.969 13.940 -11.042 597 2HB MET 76 2HB MET 76 8.167 12.636 -11.029 598 1HG MET 76 1HG MET 76 8.175 12.553 -13.477 599 2HG MET 76 2HG MET 76 6.988 13.859 -13.550 600 1HE MET 76 1HE MET 76 8.554 15.175 -15.240 601 2HE MET 76 2HE MET 76 10.271 15.517 -14.914 602 3HE MET 76 3HE MET 76 9.736 13.840 -15.155 Start of MODEL 13 1 H ARG 1 H ARG 1 8.609 21.291 -10.461 2 HA ARG 1 HA ARG 1 9.501 22.854 -9.057 3 1HB ARG 1 1HB ARG 1 6.972 22.413 -8.954 4 2HB ARG 1 2HB ARG 1 7.285 21.566 -7.430 5 1HG ARG 1 1HG ARG 1 8.527 23.764 -6.719 6 2HG ARG 1 2HG ARG 1 7.731 24.503 -8.112 7 1HD ARG 1 1HD ARG 1 6.386 23.129 -5.738 8 2HD ARG 1 2HD ARG 1 6.528 24.880 -6.007 9 HE ARG 1 HE ARG 1 5.231 23.659 -8.251 10 1HH1 ARG 1 1HH1 ARG 1 4.681 24.528 -4.874 11 2HH1 ARG 1 2HH1 ARG 1 2.963 24.756 -5.059 12 1HH2 ARG 1 1HH2 ARG 1 2.963 23.907 -8.504 13 2HH2 ARG 1 2HH2 ARG 1 1.978 24.416 -7.156 14 H VAL 2 H VAL 2 9.258 19.660 -7.464 15 HA VAL 2 HA VAL 2 11.603 20.254 -5.835 16 HB VAL 2 HB VAL 2 9.722 21.027 -4.437 17 1HG1 VAL 2 1HG1 VAL 2 8.010 19.485 -3.599 18 2HG1 VAL 2 2HG1 VAL 2 7.889 19.641 -5.355 19 3HG1 VAL 2 3HG1 VAL 2 8.622 18.188 -4.640 20 1HG2 VAL 2 1HG2 VAL 2 10.815 18.403 -3.351 21 2HG2 VAL 2 2HG2 VAL 2 11.699 19.948 -3.378 22 3HG2 VAL 2 3HG2 VAL 2 10.210 19.789 -2.432 23 H GLY 3 H GLY 3 12.539 18.201 -5.066 24 1HA GLY 3 1HA GLY 3 13.040 15.957 -5.263 25 2HA GLY 3 2HA GLY 3 11.484 15.656 -6.051 26 H LEU 4 H LEU 4 11.395 17.044 -8.247 27 HA LEU 4 HA LEU 4 13.139 16.014 -10.211 28 1HB LEU 4 1HB LEU 4 11.609 18.627 -10.169 29 2HB LEU 4 2HB LEU 4 12.309 17.868 -11.603 30 HG LEU 4 HG LEU 4 10.090 16.665 -9.862 31 1HD1 LEU 4 1HD1 LEU 4 10.136 17.935 -12.606 32 2HD1 LEU 4 2HD1 LEU 4 8.712 17.163 -11.875 33 3HD1 LEU 4 3HD1 LEU 4 9.410 18.630 -11.151 34 1HD2 LEU 4 1HD2 LEU 4 9.858 15.049 -11.746 35 2HD2 LEU 4 2HD2 LEU 4 11.345 15.691 -12.475 36 3HD2 LEU 4 3HD2 LEU 4 11.395 14.846 -10.908 37 H THR 5 H THR 5 15.242 16.428 -10.648 38 HA THR 5 HA THR 5 16.786 18.434 -9.289 39 HB THR 5 HB THR 5 18.533 17.805 -10.975 40 HG1 THR 5 HG1 THR 5 16.646 15.963 -11.976 41 1HG2 THR 5 1HG2 THR 5 18.761 15.449 -10.333 42 2HG2 THR 5 2HG2 THR 5 18.266 16.432 -8.943 43 3HG2 THR 5 3HG2 THR 5 17.080 15.402 -9.765 44 H GLU 6 H GLU 6 17.906 20.257 -10.321 45 HA GLU 6 HA GLU 6 16.325 22.030 -11.816 46 1HB GLU 6 1HB GLU 6 19.362 21.789 -11.562 47 2HB GLU 6 2HB GLU 6 18.537 23.112 -12.385 48 1HG GLU 6 1HG GLU 6 19.086 23.821 -10.143 49 2HG GLU 6 2HG GLU 6 17.333 23.722 -10.324 50 H GLU 7 H GLU 7 18.661 19.563 -12.917 51 HA GLU 7 HA GLU 7 18.604 20.102 -15.692 52 1HB GLU 7 1HB GLU 7 18.879 17.445 -14.202 53 2HB GLU 7 2HB GLU 7 19.237 17.694 -15.917 54 1HG GLU 7 1HG GLU 7 20.993 19.323 -15.364 55 2HG GLU 7 2HG GLU 7 20.639 19.183 -13.637 56 H GLN 8 H GLN 8 16.517 17.847 -13.761 57 HA GLN 8 HA GLN 8 14.803 17.147 -15.931 58 1HB GLN 8 1HB GLN 8 14.356 17.230 -12.938 59 2HB GLN 8 2HB GLN 8 13.122 16.670 -14.074 60 1HG GLN 8 1HG GLN 8 14.471 14.858 -14.854 61 2HG GLN 8 2HG GLN 8 15.925 15.497 -14.088 62 1HE2 GLN 8 1HE2 GLN 8 13.206 13.396 -13.609 63 2HE2 GLN 8 2HE2 GLN 8 13.494 13.109 -11.901 64 H LYS 9 H LYS 9 14.575 19.887 -13.582 65 HA LYS 9 HA LYS 9 12.114 20.895 -14.575 66 1HB LYS 9 1HB LYS 9 14.455 22.465 -13.418 67 2HB LYS 9 2HB LYS 9 12.830 23.093 -13.700 68 1HG LYS 9 1HG LYS 9 11.887 21.404 -12.146 69 2HG LYS 9 2HG LYS 9 13.515 20.797 -11.818 70 1HD LYS 9 1HD LYS 9 14.167 23.139 -11.072 71 2HD LYS 9 2HD LYS 9 12.459 23.596 -11.244 72 1HE LYS 9 1HE LYS 9 11.890 21.714 -9.641 73 2HE LYS 9 2HE LYS 9 13.626 21.451 -9.400 74 1HZ LYS 9 1HZ LYS 9 13.812 23.612 -8.500 75 2HZ LYS 9 2HZ LYS 9 12.254 23.995 -8.883 76 3HZ LYS 9 3HZ LYS 9 12.551 22.859 -7.738 77 H GLN 10 H GLN 10 15.474 21.611 -15.665 78 HA GLN 10 HA GLN 10 14.793 23.445 -17.726 79 1HB GLN 10 1HB GLN 10 17.109 21.479 -17.506 80 2HB GLN 10 2HB GLN 10 16.950 22.688 -18.782 81 1HG GLN 10 1HG GLN 10 17.039 24.510 -17.178 82 2HG GLN 10 2HG GLN 10 16.976 23.391 -15.816 83 1HE2 GLN 10 1HE2 GLN 10 18.958 23.793 -18.831 84 2HE2 GLN 10 2HE2 GLN 10 20.484 23.528 -18.005 85 H GLU 11 H GLU 11 15.190 19.858 -17.889 86 HA GLU 11 HA GLU 11 14.527 19.550 -20.622 87 1HB GLU 11 1HB GLU 11 13.986 17.704 -18.260 88 2HB GLU 11 2HB GLU 11 13.783 17.243 -19.953 89 1HG GLU 11 1HG GLU 11 16.129 17.532 -20.421 90 2HG GLU 11 2HG GLU 11 16.437 18.268 -18.849 91 H ILE 12 H ILE 12 12.340 19.494 -17.778 92 HA ILE 12 HA ILE 12 9.915 19.138 -19.212 93 HB ILE 12 HB ILE 12 10.516 20.389 -16.512 94 1HG1 ILE 12 1HG1 ILE 12 9.345 17.647 -17.201 95 2HG1 ILE 12 2HG1 ILE 12 11.071 17.892 -17.026 96 1HG2 ILE 12 1HG2 ILE 12 8.140 20.059 -15.952 97 2HG2 ILE 12 2HG2 ILE 12 8.280 21.163 -17.310 98 3HG2 ILE 12 3HG2 ILE 12 7.819 19.465 -17.585 99 1HD1 ILE 12 1HD1 ILE 12 9.050 18.382 -14.813 100 2HD1 ILE 12 2HD1 ILE 12 10.207 17.047 -14.954 101 3HD1 ILE 12 3HD1 ILE 12 10.795 18.707 -14.730 102 H ARG 13 H ARG 13 11.653 22.120 -18.260 103 HA ARG 13 HA ARG 13 9.750 23.981 -19.279 104 1HB ARG 13 1HB ARG 13 11.661 24.400 -17.710 105 2HB ARG 13 2HB ARG 13 12.763 24.361 -19.086 106 1HG ARG 13 1HG ARG 13 10.354 26.236 -18.938 107 2HG ARG 13 2HG ARG 13 11.913 26.637 -18.203 108 1HD ARG 13 1HD ARG 13 13.061 26.470 -20.348 109 2HD ARG 13 2HD ARG 13 11.552 25.940 -21.123 110 HE ARG 13 HE ARG 13 11.221 28.482 -19.839 111 1HH1 ARG 13 1HH1 ARG 13 12.632 26.947 -22.718 112 2HH1 ARG 13 2HH1 ARG 13 11.905 28.088 -23.830 113 1HH2 ARG 13 1HH2 ARG 13 10.555 30.147 -21.289 114 2HH2 ARG 13 2HH2 ARG 13 10.902 30.018 -22.995 115 H GLU 14 H GLU 14 12.622 22.498 -20.909 116 HA GLU 14 HA GLU 14 12.019 23.852 -23.374 117 1HB GLU 14 1HB GLU 14 13.652 21.336 -22.865 118 2HB GLU 14 2HB GLU 14 13.595 22.227 -24.398 119 1HG GLU 14 1HG GLU 14 14.573 23.365 -21.730 120 2HG GLU 14 2HG GLU 14 15.581 22.861 -23.084 121 H ALA 15 H ALA 15 11.034 20.620 -22.186 122 HA ALA 15 HA ALA 15 9.598 19.826 -24.506 123 1HB ALA 15 1HB ALA 15 8.287 18.415 -22.982 124 2HB ALA 15 2HB ALA 15 10.018 18.335 -22.591 125 3HB ALA 15 3HB ALA 15 8.921 19.298 -21.579 126 H PHE 16 H PHE 16 8.472 21.669 -21.637 127 HA PHE 16 HA PHE 16 5.883 22.247 -22.439 128 1HB PHE 16 1HB PHE 16 6.750 22.791 -20.222 129 2HB PHE 16 2HB PHE 16 7.820 24.002 -20.879 130 HD1 PHE 16 HD1 PHE 16 7.059 26.222 -21.494 131 HD2 PHE 16 HD2 PHE 16 4.267 23.178 -20.284 132 HE1 PHE 16 HE1 PHE 16 5.264 27.922 -21.341 133 HE2 PHE 16 HE2 PHE 16 2.503 24.901 -20.003 134 HZ PHE 16 HZ PHE 16 2.994 27.266 -20.553 135 H ASP 17 H ASP 17 8.823 24.191 -23.055 136 HA ASP 17 HA ASP 17 7.710 26.251 -24.584 137 1HB ASP 17 1HB ASP 17 10.020 26.160 -23.668 138 2HB ASP 17 2HB ASP 17 10.464 24.982 -24.908 139 H LEU 18 H LEU 18 9.133 23.141 -25.763 140 HA LEU 18 HA LEU 18 8.581 23.564 -28.499 141 1HB LEU 18 1HB LEU 18 10.051 21.824 -27.727 142 2HB LEU 18 2HB LEU 18 8.741 20.954 -26.927 143 HG LEU 18 HG LEU 18 8.346 21.549 -29.851 144 1HD1 LEU 18 1HD1 LEU 18 10.339 19.468 -28.907 145 2HD1 LEU 18 2HD1 LEU 18 9.724 19.674 -30.566 146 3HD1 LEU 18 3HD1 LEU 18 10.708 20.949 -29.827 147 1HD2 LEU 18 1HD2 LEU 18 7.935 19.040 -28.146 148 2HD2 LEU 18 2HD2 LEU 18 6.665 20.183 -28.619 149 3HD2 LEU 18 3HD2 LEU 18 7.476 19.218 -29.849 150 H PHE 19 H PHE 19 6.551 21.862 -26.034 151 HA PHE 19 HA PHE 19 4.433 21.299 -27.845 152 1HB PHE 19 1HB PHE 19 4.339 21.830 -24.855 153 2HB PHE 19 2HB PHE 19 3.030 21.093 -25.784 154 HD1 PHE 19 HD1 PHE 19 4.702 20.062 -23.291 155 HD2 PHE 19 HD2 PHE 19 4.638 19.148 -27.514 156 HE1 PHE 19 HE1 PHE 19 5.265 17.706 -22.812 157 HE2 PHE 19 HE2 PHE 19 5.334 16.851 -27.033 158 HZ PHE 19 HZ PHE 19 5.704 16.114 -24.677 159 H ASP 20 H ASP 20 5.081 24.173 -25.852 160 HA ASP 20 HA ASP 20 2.694 25.581 -26.745 161 1HB ASP 20 1HB ASP 20 3.747 26.078 -24.570 162 2HB ASP 20 2HB ASP 20 5.226 26.576 -25.400 163 H THR 21 H THR 21 3.422 24.712 -29.016 164 HA THR 21 HA THR 21 5.299 26.119 -30.596 165 HB THR 21 HB THR 21 3.813 25.501 -32.486 166 HG1 THR 21 HG1 THR 21 2.012 25.013 -30.376 167 1HG2 THR 21 1HG2 THR 21 3.968 23.094 -32.229 168 2HG2 THR 21 2HG2 THR 21 5.401 23.827 -31.483 169 3HG2 THR 21 3HG2 THR 21 4.078 23.224 -30.468 170 H ASP 22 H ASP 22 2.245 27.190 -29.213 171 HA ASP 22 HA ASP 22 1.817 29.461 -30.919 172 1HB ASP 22 1HB ASP 22 0.043 28.367 -29.626 173 2HB ASP 22 2HB ASP 22 0.862 28.762 -28.109 174 H GLY 23 H GLY 23 4.076 28.799 -28.348 175 1HA GLY 23 1HA GLY 23 5.754 30.015 -27.472 176 2HA GLY 23 2HA GLY 23 5.536 31.140 -28.821 177 H SER 24 H SER 24 2.794 30.661 -26.602 178 HA SER 24 HA SER 24 2.913 33.469 -25.865 179 1HB SER 24 1HB SER 24 0.706 32.665 -24.822 180 2HB SER 24 2HB SER 24 0.877 32.599 -26.582 181 HG SER 24 HG SER 24 0.340 30.578 -26.318 182 H GLY 25 H GLY 25 4.064 30.555 -24.483 183 1HA GLY 25 1HA GLY 25 5.163 30.257 -22.433 184 2HA GLY 25 2HA GLY 25 4.429 31.728 -21.776 185 H THR 26 H THR 26 2.332 29.629 -23.602 186 HA THR 26 HA THR 26 1.112 28.353 -21.222 187 HB THR 26 HB THR 26 -1.059 29.439 -22.351 188 HG1 THR 26 HG1 THR 26 0.325 30.570 -23.897 189 1HG2 THR 26 1HG2 THR 26 0.736 30.985 -20.434 190 2HG2 THR 26 2HG2 THR 26 -0.997 31.250 -20.696 191 3HG2 THR 26 3HG2 THR 26 -0.442 29.729 -19.979 192 H ILE 27 H ILE 27 0.645 26.287 -21.830 193 HA ILE 27 HA ILE 27 0.548 25.525 -24.689 194 HB ILE 27 HB ILE 27 0.380 24.004 -22.078 195 1HG1 ILE 27 1HG1 ILE 27 2.399 24.016 -24.374 196 2HG1 ILE 27 2HG1 ILE 27 2.609 24.838 -22.825 197 1HG2 ILE 27 1HG2 ILE 27 0.359 22.775 -24.858 198 2HG2 ILE 27 2HG2 ILE 27 0.262 21.932 -23.310 199 3HG2 ILE 27 3HG2 ILE 27 -1.089 22.899 -23.828 200 1HD1 ILE 27 1HD1 ILE 27 2.361 22.574 -21.692 201 2HD1 ILE 27 2HD1 ILE 27 2.443 21.835 -23.309 202 3HD1 ILE 27 3HD1 ILE 27 3.799 22.787 -22.713 203 H ASP 28 H ASP 28 -1.389 25.911 -25.765 204 HA ASP 28 HA ASP 28 -3.932 26.142 -24.396 205 1HB ASP 28 1HB ASP 28 -3.521 27.146 -26.609 206 2HB ASP 28 2HB ASP 28 -3.327 25.532 -27.315 207 H ALA 29 H ALA 29 -5.601 24.597 -24.156 208 HA ALA 29 HA ALA 29 -5.235 21.998 -23.557 209 1HB ALA 29 1HB ALA 29 -7.376 23.172 -23.358 210 2HB ALA 29 2HB ALA 29 -7.579 23.161 -25.124 211 3HB ALA 29 3HB ALA 29 -7.606 21.635 -24.218 212 H LYS 30 H LYS 30 -5.766 23.133 -26.937 213 HA LYS 30 HA LYS 30 -5.761 20.562 -28.175 214 1HB LYS 30 1HB LYS 30 -4.923 23.291 -29.242 215 2HB LYS 30 2HB LYS 30 -5.188 21.847 -30.232 216 1HG LYS 30 1HG LYS 30 -7.538 21.739 -29.552 217 2HG LYS 30 2HG LYS 30 -7.330 23.123 -28.464 218 1HD LYS 30 1HD LYS 30 -6.696 24.555 -30.391 219 2HD LYS 30 2HD LYS 30 -6.948 23.182 -31.489 220 1HE LYS 30 1HE LYS 30 -9.333 23.060 -30.776 221 2HE LYS 30 2HE LYS 30 -9.074 24.426 -29.675 222 1HZ LYS 30 1HZ LYS 30 -10.038 25.118 -31.729 223 2HZ LYS 30 2HZ LYS 30 -8.778 24.504 -32.595 224 3HZ LYS 30 3HZ LYS 30 -8.536 25.773 -31.569 225 H GLU 31 H GLU 31 -3.103 22.829 -27.385 226 HA GLU 31 HA GLU 31 -1.030 21.316 -28.726 227 1HB GLU 31 1HB GLU 31 -0.926 23.439 -26.552 228 2HB GLU 31 2HB GLU 31 0.489 22.713 -27.324 229 1HG GLU 31 1HG GLU 31 -0.194 23.581 -29.505 230 2HG GLU 31 2HG GLU 31 -1.685 24.244 -28.817 231 H LEU 32 H LEU 32 -2.388 21.417 -25.380 232 HA LEU 32 HA LEU 32 -0.502 19.526 -24.355 233 1HB LEU 32 1HB LEU 32 -2.248 20.987 -23.019 234 2HB LEU 32 2HB LEU 32 -3.323 19.609 -23.306 235 HG LEU 32 HG LEU 32 -1.374 18.149 -22.343 236 1HD1 LEU 32 1HD1 LEU 32 0.049 19.272 -20.683 237 2HD1 LEU 32 2HD1 LEU 32 0.442 19.776 -22.323 238 3HD1 LEU 32 3HD1 LEU 32 -0.509 20.852 -21.265 239 1HD2 LEU 32 1HD2 LEU 32 -2.940 20.063 -20.574 240 2HD2 LEU 32 2HD2 LEU 32 -3.514 18.506 -21.193 241 3HD2 LEU 32 3HD2 LEU 32 -2.177 18.553 -20.035 242 H LYS 33 H LYS 33 -3.746 19.068 -25.839 243 HA LYS 33 HA LYS 33 -3.875 16.235 -25.666 244 1HB LYS 33 1HB LYS 33 -5.728 17.577 -26.185 245 2HB LYS 33 2HB LYS 33 -5.024 18.183 -27.687 246 1HG LYS 33 1HG LYS 33 -5.649 15.235 -27.212 247 2HG LYS 33 2HG LYS 33 -6.825 16.397 -27.835 248 1HD LYS 33 1HD LYS 33 -5.205 16.946 -29.715 249 2HD LYS 33 2HD LYS 33 -4.249 15.536 -29.216 250 1HE LYS 33 1HE LYS 33 -6.249 14.084 -29.497 251 2HE LYS 33 2HE LYS 33 -7.170 15.488 -30.069 252 1HZ LYS 33 1HZ LYS 33 -6.301 14.215 -31.870 253 2HZ LYS 33 2HZ LYS 33 -5.597 15.705 -31.856 254 3HZ LYS 33 3HZ LYS 33 -4.755 14.389 -31.328 255 H VAL 34 H VAL 34 -2.467 18.275 -28.296 256 HA VAL 34 HA VAL 34 -1.439 16.081 -29.801 257 HB VAL 34 HB VAL 34 -0.524 18.975 -29.485 258 1HG1 VAL 34 1HG1 VAL 34 0.848 18.621 -31.541 259 2HG1 VAL 34 2HG1 VAL 34 1.492 17.763 -30.140 260 3HG1 VAL 34 3HG1 VAL 34 0.587 16.871 -31.387 261 1HG2 VAL 34 1HG2 VAL 34 -1.888 17.496 -31.781 262 2HG2 VAL 34 2HG2 VAL 34 -2.720 18.547 -30.619 263 3HG2 VAL 34 3HG2 VAL 34 -1.510 19.229 -31.716 264 H ALA 35 H ALA 35 0.110 17.951 -27.136 265 HA ALA 35 HA ALA 35 2.584 16.651 -27.124 266 1HB ALA 35 1HB ALA 35 2.063 18.643 -25.766 267 2HB ALA 35 2HB ALA 35 1.006 17.683 -24.718 268 3HB ALA 35 3HB ALA 35 2.724 17.333 -24.761 269 H MET 36 H MET 36 -0.332 15.798 -25.228 270 HA MET 36 HA MET 36 0.633 13.364 -24.099 271 1HB MET 36 1HB MET 36 -2.115 14.452 -24.681 272 2HB MET 36 2HB MET 36 -1.860 12.892 -23.890 273 1HG MET 36 1HG MET 36 -0.432 13.954 -22.167 274 2HG MET 36 2HG MET 36 -0.713 15.533 -22.891 275 1HE MET 36 1HE MET 36 -3.832 15.394 -23.591 276 2HE MET 36 2HE MET 36 -4.377 16.283 -22.140 277 3HE MET 36 3HE MET 36 -2.865 16.723 -22.956 278 H ARG 37 H ARG 37 -1.041 13.988 -27.217 279 HA ARG 37 HA ARG 37 -1.174 11.259 -27.852 280 1HB ARG 37 1HB ARG 37 -2.399 13.126 -29.030 281 2HB ARG 37 2HB ARG 37 -0.896 13.548 -29.860 282 1HG ARG 37 1HG ARG 37 -2.439 12.154 -31.225 283 2HG ARG 37 2HG ARG 37 -0.863 11.373 -30.997 284 1HD ARG 37 1HD ARG 37 -1.716 9.877 -29.353 285 2HD ARG 37 2HD ARG 37 -3.228 10.816 -29.172 286 HE ARG 37 HE ARG 37 -3.148 9.959 -31.823 287 1HH1 ARG 37 1HH1 ARG 37 -3.089 8.421 -28.603 288 2HH1 ARG 37 2HH1 ARG 37 -3.776 6.929 -29.179 289 1HH2 ARG 37 1HH2 ARG 37 -4.096 8.005 -32.537 290 2HH2 ARG 37 2HH2 ARG 37 -4.395 6.698 -31.425 291 H ALA 38 H ALA 38 1.388 13.659 -28.520 292 HA ALA 38 HA ALA 38 3.182 11.914 -29.895 293 1HB ALA 38 1HB ALA 38 4.888 13.577 -29.374 294 2HB ALA 38 2HB ALA 38 3.390 14.377 -29.893 295 3HB ALA 38 3HB ALA 38 3.833 14.344 -28.173 296 H LEU 39 H LEU 39 2.685 12.583 -26.421 297 HA LEU 39 HA LEU 39 4.746 10.795 -25.473 298 1HB LEU 39 1HB LEU 39 2.222 11.838 -24.149 299 2HB LEU 39 2HB LEU 39 3.479 10.950 -23.317 300 HG LEU 39 HG LEU 39 4.174 13.527 -24.769 301 1HD1 LEU 39 1HD1 LEU 39 2.993 13.235 -21.974 302 2HD1 LEU 39 2HD1 LEU 39 3.903 14.658 -22.520 303 3HD1 LEU 39 3HD1 LEU 39 2.380 14.249 -23.290 304 1HD2 LEU 39 1HD2 LEU 39 5.367 12.101 -22.358 305 2HD2 LEU 39 2HD2 LEU 39 6.016 12.057 -24.010 306 3HD2 LEU 39 3HD2 LEU 39 5.981 13.583 -23.117 307 H GLY 40 H GLY 40 2.014 10.006 -27.267 308 1HA GLY 40 1HA GLY 40 1.470 7.908 -27.957 309 2HA GLY 40 2HA GLY 40 2.358 7.187 -26.608 310 H PHE 41 H PHE 41 0.123 9.727 -25.715 311 HA PHE 41 HA PHE 41 -1.439 7.765 -24.209 312 1HB PHE 41 1HB PHE 41 -1.731 10.756 -24.552 313 2HB PHE 41 2HB PHE 41 -2.687 9.793 -23.452 314 HD1 PHE 41 HD1 PHE 41 0.755 8.582 -23.359 315 HD2 PHE 41 HD2 PHE 41 -1.923 11.635 -21.864 316 HE1 PHE 41 HE1 PHE 41 2.395 9.189 -21.663 317 HE2 PHE 41 HE2 PHE 41 -0.265 12.202 -20.119 318 HZ PHE 41 HZ PHE 41 1.916 11.009 -20.033 319 H GLU 42 H GLU 42 -3.772 7.713 -24.265 320 HA GLU 42 HA GLU 42 -5.032 8.181 -26.939 321 1HB GLU 42 1HB GLU 42 -5.833 6.357 -24.645 322 2HB GLU 42 2HB GLU 42 -6.725 6.601 -26.153 323 1HG GLU 42 1HG GLU 42 -4.748 5.777 -27.441 324 2HG GLU 42 2HG GLU 42 -3.891 5.472 -25.921 325 HA PRO 43 HA PRO 43 -6.341 11.469 -24.031 326 1HB PRO 43 1HB PRO 43 -7.042 13.444 -25.846 327 2HB PRO 43 2HB PRO 43 -5.397 13.111 -25.244 328 1HG PRO 43 1HG PRO 43 -6.656 12.151 -27.812 329 2HG PRO 43 2HG PRO 43 -5.028 12.867 -27.555 330 1HD PRO 43 1HD PRO 43 -5.393 10.185 -27.758 331 2HD PRO 43 2HD PRO 43 -4.215 10.867 -26.591 332 H LYS 44 H LYS 44 -7.999 9.938 -23.479 333 HA LYS 44 HA LYS 44 -10.622 9.898 -24.536 334 1HB LYS 44 1HB LYS 44 -9.714 9.672 -21.645 335 2HB LYS 44 2HB LYS 44 -11.300 9.203 -22.290 336 1HG LYS 44 1HG LYS 44 -10.088 7.616 -23.865 337 2HG LYS 44 2HG LYS 44 -8.615 7.918 -22.936 338 1HD LYS 44 1HD LYS 44 -11.237 6.774 -21.864 339 2HD LYS 44 2HD LYS 44 -9.743 5.878 -22.184 340 1HE LYS 44 1HE LYS 44 -8.569 7.302 -20.464 341 2HE LYS 44 2HE LYS 44 -10.129 8.057 -20.075 342 1HZ LYS 44 1HZ LYS 44 -9.516 5.203 -19.833 343 2HZ LYS 44 2HZ LYS 44 -9.628 6.286 -18.596 344 3HZ LYS 44 3HZ LYS 44 -10.963 5.912 -19.485 345 H LYS 45 H LYS 45 -11.041 11.939 -25.231 346 HA LYS 45 HA LYS 45 -10.846 14.356 -24.545 347 1HB LYS 45 1HB LYS 45 -13.587 13.250 -25.272 348 2HB LYS 45 2HB LYS 45 -13.098 14.950 -25.387 349 1HG LYS 45 1HG LYS 45 -11.262 14.295 -26.958 350 2HG LYS 45 2HG LYS 45 -11.857 12.624 -26.931 351 1HD LYS 45 1HD LYS 45 -14.067 13.387 -27.765 352 2HD LYS 45 2HD LYS 45 -13.461 15.056 -27.830 353 1HE LYS 45 1HE LYS 45 -11.706 14.358 -29.450 354 2HE LYS 45 2HE LYS 45 -12.304 12.689 -29.381 355 1HZ LYS 45 1HZ LYS 45 -14.388 13.467 -30.245 356 2HZ LYS 45 2HZ LYS 45 -13.831 15.017 -30.312 357 3HZ LYS 45 3HZ LYS 45 -13.154 13.856 -31.264 358 H GLU 46 H GLU 46 -13.667 12.717 -22.934 359 HA GLU 46 HA GLU 46 -14.266 14.979 -21.351 360 1HB GLU 46 1HB GLU 46 -15.760 13.621 -20.128 361 2HB GLU 46 2HB GLU 46 -15.821 13.123 -21.816 362 1HG GLU 46 1HG GLU 46 -14.551 11.649 -19.474 363 2HG GLU 46 2HG GLU 46 -15.946 11.162 -20.431 364 H GLU 47 H GLU 47 -12.155 12.178 -20.594 365 HA GLU 47 HA GLU 47 -11.684 12.995 -17.870 366 1HB GLU 47 1HB GLU 47 -11.456 10.647 -18.722 367 2HB GLU 47 2HB GLU 47 -10.063 11.154 -19.686 368 1HG GLU 47 1HG GLU 47 -9.354 10.061 -17.603 369 2HG GLU 47 2HG GLU 47 -8.827 11.746 -17.631 370 H ILE 48 H ILE 48 -10.055 13.435 -20.997 371 HA ILE 48 HA ILE 48 -7.771 14.864 -20.059 372 HB ILE 48 HB ILE 48 -9.312 14.902 -22.673 373 1HG1 ILE 48 1HG1 ILE 48 -8.076 12.800 -21.934 374 2HG1 ILE 48 2HG1 ILE 48 -7.691 13.480 -23.514 375 1HG2 ILE 48 1HG2 ILE 48 -6.764 16.393 -22.008 376 2HG2 ILE 48 2HG2 ILE 48 -7.271 15.987 -23.667 377 3HG2 ILE 48 3HG2 ILE 48 -8.282 17.033 -22.669 378 1HD1 ILE 48 1HD1 ILE 48 -5.687 12.703 -22.179 379 2HD1 ILE 48 2HD1 ILE 48 -5.623 14.371 -22.753 380 3HD1 ILE 48 3HD1 ILE 48 -5.978 14.029 -21.048 381 H LYS 49 H LYS 49 -10.997 16.125 -21.095 382 HA LYS 49 HA LYS 49 -10.354 18.844 -20.516 383 1HB LYS 49 1HB LYS 49 -13.015 17.380 -20.609 384 2HB LYS 49 2HB LYS 49 -12.878 19.117 -20.369 385 1HG LYS 49 1HG LYS 49 -11.935 17.556 -22.811 386 2HG LYS 49 2HG LYS 49 -13.350 18.598 -22.704 387 1HD LYS 49 1HD LYS 49 -10.418 19.442 -22.638 388 2HD LYS 49 2HD LYS 49 -11.612 19.743 -23.893 389 1HE LYS 49 1HE LYS 49 -12.935 21.148 -22.286 390 2HE LYS 49 2HE LYS 49 -11.653 20.931 -21.077 391 1HZ LYS 49 1HZ LYS 49 -11.391 22.957 -22.257 392 2HZ LYS 49 2HZ LYS 49 -10.128 21.954 -22.590 393 3HZ LYS 49 3HZ LYS 49 -11.321 22.177 -23.707 394 H LYS 50 H LYS 50 -11.857 16.317 -18.428 395 HA LYS 50 HA LYS 50 -12.210 17.960 -16.143 396 1HB LYS 50 1HB LYS 50 -11.522 15.008 -16.387 397 2HB LYS 50 2HB LYS 50 -11.864 15.825 -14.849 398 1HG LYS 50 1HG LYS 50 -14.095 16.373 -15.493 399 2HG LYS 50 2HG LYS 50 -13.810 15.935 -17.176 400 1HD LYS 50 1HD LYS 50 -15.156 14.258 -16.046 401 2HD LYS 50 2HD LYS 50 -13.644 13.561 -16.618 402 1HE LYS 50 1HE LYS 50 -13.967 14.531 -13.741 403 2HE LYS 50 2HE LYS 50 -14.518 12.928 -14.252 404 1HZ LYS 50 1HZ LYS 50 -11.757 13.879 -14.484 405 2HZ LYS 50 2HZ LYS 50 -12.340 12.818 -13.372 406 3HZ LYS 50 3HZ LYS 50 -12.321 12.411 -14.966 407 H MET 51 H MET 51 -9.332 15.909 -16.961 408 HA MET 51 HA MET 51 -7.730 16.713 -14.839 409 1HB MET 51 1HB MET 51 -7.326 14.842 -16.494 410 2HB MET 51 2HB MET 51 -6.805 16.062 -17.664 411 1HG MET 51 1HG MET 51 -5.098 16.814 -15.882 412 2HG MET 51 2HG MET 51 -5.620 15.410 -14.947 413 1HE MET 51 1HE MET 51 -3.776 16.777 -18.073 414 2HE MET 51 2HE MET 51 -3.240 15.293 -18.895 415 3HE MET 51 3HE MET 51 -4.958 15.732 -18.903 416 H ILE 52 H ILE 52 -7.839 18.115 -18.154 417 HA ILE 52 HA ILE 52 -5.990 20.199 -17.803 418 HB ILE 52 HB ILE 52 -8.450 19.873 -19.540 419 1HG1 ILE 52 1HG1 ILE 52 -5.461 20.050 -20.163 420 2HG1 ILE 52 2HG1 ILE 52 -6.340 18.537 -19.942 421 1HG2 ILE 52 1HG2 ILE 52 -8.294 22.307 -19.160 422 2HG2 ILE 52 2HG2 ILE 52 -6.580 22.274 -19.621 423 3HG2 ILE 52 3HG2 ILE 52 -7.846 21.896 -20.801 424 1HD1 ILE 52 1HD1 ILE 52 -7.850 19.214 -21.858 425 2HD1 ILE 52 2HD1 ILE 52 -6.730 20.559 -22.171 426 3HD1 ILE 52 3HD1 ILE 52 -6.154 18.895 -22.289 427 H SER 53 H SER 53 -9.531 20.218 -17.090 428 HA SER 53 HA SER 53 -9.574 22.895 -16.136 429 1HB SER 53 1HB SER 53 -11.349 20.581 -15.244 430 2HB SER 53 2HB SER 53 -11.686 22.315 -15.095 431 HG SER 53 HG SER 53 -11.397 20.805 -17.491 432 H GLU 54 H GLU 54 -8.996 19.816 -14.367 433 HA GLU 54 HA GLU 54 -8.787 20.962 -11.770 434 1HB GLU 54 1HB GLU 54 -7.504 18.480 -12.971 435 2HB GLU 54 2HB GLU 54 -7.426 18.903 -11.258 436 1HG GLU 54 1HG GLU 54 -9.801 18.727 -10.982 437 2HG GLU 54 2HG GLU 54 -10.086 18.626 -12.721 438 H ILE 55 H ILE 55 -6.278 20.490 -14.302 439 HA ILE 55 HA ILE 55 -4.172 21.621 -12.614 440 HB ILE 55 HB ILE 55 -4.301 21.084 -15.603 441 1HG1 ILE 55 1HG1 ILE 55 -4.537 18.985 -14.451 442 2HG1 ILE 55 2HG1 ILE 55 -2.911 19.097 -15.094 443 1HG2 ILE 55 1HG2 ILE 55 -1.908 21.751 -13.844 444 2HG2 ILE 55 2HG2 ILE 55 -1.814 21.124 -15.507 445 3HG2 ILE 55 3HG2 ILE 55 -2.559 22.692 -15.196 446 1HD1 ILE 55 1HD1 ILE 55 -2.124 19.747 -12.756 447 2HD1 ILE 55 2HD1 ILE 55 -3.778 19.428 -12.189 448 3HD1 ILE 55 3HD1 ILE 55 -2.818 18.125 -12.896 449 H ASP 56 H ASP 56 -6.448 22.920 -15.011 450 HA ASP 56 HA ASP 56 -5.009 25.396 -15.365 451 1HB ASP 56 1HB ASP 56 -6.340 24.425 -17.159 452 2HB ASP 56 2HB ASP 56 -7.808 24.542 -16.166 453 H LYS 57 H LYS 57 -4.811 25.984 -13.112 454 HA LYS 57 HA LYS 57 -7.203 27.016 -11.711 455 1HB LYS 57 1HB LYS 57 -4.258 27.207 -11.069 456 2HB LYS 57 2HB LYS 57 -5.570 27.715 -10.002 457 1HG LYS 57 1HG LYS 57 -5.255 24.827 -11.003 458 2HG LYS 57 2HG LYS 57 -4.486 25.464 -9.569 459 1HD LYS 57 1HD LYS 57 -6.370 24.345 -8.804 460 2HD LYS 57 2HD LYS 57 -6.691 26.069 -8.596 461 1HE LYS 57 1HE LYS 57 -8.612 24.564 -9.340 462 2HE LYS 57 2HE LYS 57 -8.402 26.047 -10.250 463 1HZ LYS 57 1HZ LYS 57 -7.281 24.777 -11.937 464 2HZ LYS 57 2HZ LYS 57 -7.413 23.389 -11.069 465 3HZ LYS 57 3HZ LYS 57 -8.760 24.130 -11.663 466 H ASP 58 H ASP 58 -4.368 28.317 -13.413 467 HA ASP 58 HA ASP 58 -5.609 31.053 -13.391 468 1HB ASP 58 1HB ASP 58 -3.373 31.965 -13.406 469 2HB ASP 58 2HB ASP 58 -3.597 30.919 -12.000 470 H GLY 59 H GLY 59 -4.309 28.476 -15.374 471 1HA GLY 59 1HA GLY 59 -3.289 29.975 -17.507 472 2HA GLY 59 2HA GLY 59 -3.788 28.290 -17.537 473 H SER 60 H SER 60 -6.642 29.259 -16.805 474 HA SER 60 HA SER 60 -8.583 29.918 -17.819 475 1HB SER 60 1HB SER 60 -7.550 32.109 -17.372 476 2HB SER 60 2HB SER 60 -6.741 32.068 -18.951 477 HG SER 60 HG SER 60 -8.783 31.987 -19.926 478 H GLY 61 H GLY 61 -7.926 27.748 -19.080 479 1HA GLY 61 1HA GLY 61 -8.807 26.794 -21.065 480 2HA GLY 61 2HA GLY 61 -8.463 28.268 -21.977 481 H THR 62 H THR 62 -5.713 28.347 -20.494 482 HA THR 62 HA THR 62 -4.353 26.246 -22.126 483 HB THR 62 HB THR 62 -2.521 27.704 -22.356 484 HG1 THR 62 HG1 THR 62 -3.843 29.521 -20.613 485 1HG2 THR 62 1HG2 THR 62 -3.372 29.625 -23.552 486 2HG2 THR 62 2HG2 THR 62 -4.468 28.268 -23.866 487 3HG2 THR 62 3HG2 THR 62 -4.931 29.540 -22.721 488 H ILE 63 H ILE 63 -2.130 25.776 -21.102 489 HA ILE 63 HA ILE 63 -2.273 25.578 -18.129 490 HB ILE 63 HB ILE 63 -0.730 23.811 -20.058 491 1HG1 ILE 63 1HG1 ILE 63 -3.076 23.328 -20.432 492 2HG1 ILE 63 2HG1 ILE 63 -2.270 22.016 -19.579 493 1HG2 ILE 63 1HG2 ILE 63 -1.232 23.614 -17.062 494 2HG2 ILE 63 2HG2 ILE 63 -0.435 22.373 -18.054 495 3HG2 ILE 63 3HG2 ILE 63 0.297 23.973 -17.869 496 1HD1 ILE 63 1HD1 ILE 63 -4.501 22.405 -18.674 497 2HD1 ILE 63 2HD1 ILE 63 -3.283 22.736 -17.442 498 3HD1 ILE 63 3HD1 ILE 63 -4.095 24.079 -18.275 499 H ASP 64 H ASP 64 -0.987 27.107 -17.301 500 HA ASP 64 HA ASP 64 1.179 28.441 -18.717 501 1HB ASP 64 1HB ASP 64 -0.020 29.713 -17.097 502 2HB ASP 64 2HB ASP 64 0.088 28.435 -15.882 503 H PHE 65 H PHE 65 3.439 28.425 -17.971 504 HA PHE 65 HA PHE 65 4.588 25.875 -17.943 505 1HB PHE 65 1HB PHE 65 5.902 27.769 -18.586 506 2HB PHE 65 2HB PHE 65 5.692 28.537 -17.019 507 HD1 PHE 65 HD1 PHE 65 6.829 25.141 -18.263 508 HD2 PHE 65 HD2 PHE 65 7.601 28.491 -15.650 509 HE1 PHE 65 HE1 PHE 65 8.771 23.945 -17.286 510 HE2 PHE 65 HE2 PHE 65 9.599 27.329 -14.765 511 HZ PHE 65 HZ PHE 65 10.172 25.043 -15.560 512 H GLU 66 H GLU 66 4.099 28.017 -15.055 513 HA GLU 66 HA GLU 66 5.159 26.165 -13.216 514 1HB GLU 66 1HB GLU 66 2.966 28.229 -12.692 515 2HB GLU 66 2HB GLU 66 3.917 27.354 -11.494 516 1HG GLU 66 1HG GLU 66 5.073 29.334 -11.578 517 2HG GLU 66 2HG GLU 66 6.016 28.358 -12.705 518 H GLU 67 H GLU 67 1.802 26.497 -14.406 519 HA GLU 67 HA GLU 67 0.626 24.482 -12.761 520 1HB GLU 67 1HB GLU 67 -0.105 25.359 -15.585 521 2HB GLU 67 2HB GLU 67 -1.090 24.332 -14.538 522 1HG GLU 67 1HG GLU 67 -1.309 26.117 -12.880 523 2HG GLU 67 2HG GLU 67 -0.300 27.195 -13.855 524 H PHE 68 H PHE 68 2.056 24.288 -16.055 525 HA PHE 68 HA PHE 68 1.758 21.501 -16.432 526 1HB PHE 68 1HB PHE 68 2.366 23.050 -18.226 527 2HB PHE 68 2HB PHE 68 3.906 23.391 -17.456 528 HD1 PHE 68 HD1 PHE 68 1.878 20.650 -19.023 529 HD2 PHE 68 HD2 PHE 68 5.813 22.012 -17.892 530 HE1 PHE 68 HE1 PHE 68 2.900 18.926 -20.483 531 HE2 PHE 68 HE2 PHE 68 6.820 20.356 -19.447 532 HZ PHE 68 HZ PHE 68 5.386 18.798 -20.705 533 H LEU 69 H LEU 69 4.528 23.321 -15.017 534 HA LEU 69 HA LEU 69 6.164 21.066 -14.542 535 1HB LEU 69 1HB LEU 69 6.998 23.357 -14.484 536 2HB LEU 69 2HB LEU 69 5.972 23.736 -13.095 537 HG LEU 69 HG LEU 69 7.231 22.176 -11.680 538 1HD1 LEU 69 1HD1 LEU 69 8.932 21.695 -14.172 539 2HD1 LEU 69 2HD1 LEU 69 9.390 21.208 -12.531 540 3HD1 LEU 69 3HD1 LEU 69 7.977 20.479 -13.290 541 1HD2 LEU 69 1HD2 LEU 69 9.014 24.110 -13.215 542 2HD2 LEU 69 2HD2 LEU 69 7.947 24.525 -11.857 543 3HD2 LEU 69 3HD2 LEU 69 9.337 23.456 -11.596 544 H THR 70 H THR 70 3.682 22.646 -12.483 545 HA THR 70 HA THR 70 4.017 20.963 -10.213 546 HB THR 70 HB THR 70 1.470 22.341 -11.169 547 HG1 THR 70 HG1 THR 70 3.158 23.800 -10.974 548 1HG2 THR 70 1HG2 THR 70 1.064 20.711 -9.342 549 2HG2 THR 70 2HG2 THR 70 2.380 21.440 -8.397 550 3HG2 THR 70 3HG2 THR 70 0.914 22.376 -8.763 551 H MET 71 H MET 71 1.727 20.689 -12.989 552 HA MET 71 HA MET 71 0.497 18.247 -12.367 553 1HB MET 71 1HB MET 71 -0.244 19.622 -14.211 554 2HB MET 71 2HB MET 71 1.312 19.497 -15.019 555 1HG MET 71 1HG MET 71 0.968 17.072 -15.367 556 2HG MET 71 2HG MET 71 -0.637 17.212 -14.626 557 1HE MET 71 1HE MET 71 -1.143 16.588 -18.513 558 2HE MET 71 2HE MET 71 0.221 16.001 -17.537 559 3HE MET 71 3HE MET 71 -1.433 15.944 -16.874 560 H MET 72 H MET 72 3.476 18.780 -14.305 561 HA MET 72 HA MET 72 4.098 16.105 -14.769 562 1HB MET 72 1HB MET 72 5.118 18.180 -15.819 563 2HB MET 72 2HB MET 72 6.084 18.386 -14.361 564 1HG MET 72 1HG MET 72 7.370 17.293 -16.091 565 2HG MET 72 2HG MET 72 7.145 16.200 -14.729 566 1HE MET 72 1HE MET 72 5.044 15.773 -18.838 567 2HE MET 72 2HE MET 72 4.510 16.982 -17.657 568 3HE MET 72 3HE MET 72 6.125 17.118 -18.401 569 H THR 73 H THR 73 5.211 18.214 -12.089 570 HA THR 73 HA THR 73 6.783 16.297 -10.720 571 HB THR 73 HB THR 73 5.162 18.563 -9.473 572 HG1 THR 73 HG1 THR 73 6.502 19.305 -11.153 573 1HG2 THR 73 1HG2 THR 73 6.169 17.027 -7.797 574 2HG2 THR 73 2HG2 THR 73 7.747 17.197 -8.599 575 3HG2 THR 73 3HG2 THR 73 6.991 18.596 -7.813 576 H ALA 74 H ALA 74 3.278 17.045 -10.421 577 HA ALA 74 HA ALA 74 2.774 15.201 -8.301 578 1HB ALA 74 1HB ALA 74 1.278 17.073 -8.877 579 2HB ALA 74 2HB ALA 74 0.873 16.289 -10.420 580 3HB ALA 74 3HB ALA 74 0.415 15.521 -8.886 581 H LYS 75 H LYS 75 2.599 14.844 -11.861 582 HA LYS 75 HA LYS 75 1.505 12.177 -11.803 583 1HB LYS 75 1HB LYS 75 3.031 13.744 -13.917 584 2HB LYS 75 2HB LYS 75 2.348 12.144 -14.210 585 1HG LYS 75 1HG LYS 75 0.659 14.512 -13.289 586 2HG LYS 75 2HG LYS 75 0.970 14.125 -14.986 587 1HD LYS 75 1HD LYS 75 -0.025 11.851 -14.635 588 2HD LYS 75 2HD LYS 75 -0.421 12.307 -12.966 589 1HE LYS 75 1HE LYS 75 -1.816 14.185 -13.804 590 2HE LYS 75 2HE LYS 75 -1.428 13.726 -15.475 591 1HZ LYS 75 1HZ LYS 75 -3.524 12.860 -14.794 592 2HZ LYS 75 2HZ LYS 75 -2.476 11.619 -15.070 593 3HZ LYS 75 3HZ LYS 75 -2.849 12.056 -13.525 594 H MET 76 H MET 76 4.867 13.427 -12.061 595 HA MET 76 HA MET 76 6.019 10.784 -12.327 596 1HB MET 76 1HB MET 76 7.222 13.479 -11.581 597 2HB MET 76 2HB MET 76 8.154 11.988 -11.800 598 1HG MET 76 1HG MET 76 7.344 11.782 -14.119 599 2HG MET 76 2HG MET 76 6.371 13.239 -13.927 600 1HE MET 76 1HE MET 76 10.981 13.242 -14.167 601 2HE MET 76 2HE MET 76 10.153 12.664 -12.706 602 3HE MET 76 3HE MET 76 9.985 11.769 -14.239 Start of MODEL 14 1 H ARG 1 H ARG 1 13.847 21.331 -7.475 2 HA ARG 1 HA ARG 1 15.633 19.242 -6.495 3 1HB ARG 1 1HB ARG 1 14.088 21.397 -4.983 4 2HB ARG 1 2HB ARG 1 15.107 20.145 -4.255 5 1HG ARG 1 1HG ARG 1 17.077 21.059 -5.523 6 2HG ARG 1 2HG ARG 1 16.047 22.391 -6.087 7 1HD ARG 1 1HD ARG 1 15.600 23.051 -3.747 8 2HD ARG 1 2HD ARG 1 16.642 21.722 -3.175 9 HE ARG 1 HE ARG 1 18.114 23.304 -5.011 10 1HH1 ARG 1 1HH1 ARG 1 16.730 23.541 -1.773 11 2HH1 ARG 1 2HH1 ARG 1 17.909 24.684 -1.191 12 1HH2 ARG 1 1HH2 ARG 1 19.667 24.802 -4.272 13 2HH2 ARG 1 2HH2 ARG 1 19.611 25.415 -2.642 14 H VAL 2 H VAL 2 14.375 18.107 -4.559 15 HA VAL 2 HA VAL 2 12.836 16.559 -4.012 16 HB VAL 2 HB VAL 2 10.753 18.405 -5.249 17 1HG1 VAL 2 1HG1 VAL 2 9.905 16.165 -4.571 18 2HG1 VAL 2 2HG1 VAL 2 9.299 17.438 -3.509 19 3HG1 VAL 2 3HG1 VAL 2 10.620 16.387 -2.962 20 1HG2 VAL 2 1HG2 VAL 2 12.035 18.477 -2.481 21 2HG2 VAL 2 2HG2 VAL 2 12.140 19.744 -3.725 22 3HG2 VAL 2 3HG2 VAL 2 10.589 19.386 -2.965 23 H GLY 3 H GLY 3 14.077 15.350 -5.694 24 1HA GLY 3 1HA GLY 3 13.943 13.582 -7.166 25 2HA GLY 3 2HA GLY 3 12.224 13.909 -7.424 26 H LEU 4 H LEU 4 11.983 16.290 -8.483 27 HA LEU 4 HA LEU 4 13.212 16.165 -11.124 28 1HB LEU 4 1HB LEU 4 11.470 18.272 -9.816 29 2HB LEU 4 2HB LEU 4 11.978 18.248 -11.511 30 HG LEU 4 HG LEU 4 10.198 16.184 -10.128 31 1HD1 LEU 4 1HD1 LEU 4 9.120 18.310 -10.579 32 2HD1 LEU 4 2HD1 LEU 4 9.723 18.318 -12.246 33 3HD1 LEU 4 3HD1 LEU 4 8.525 17.108 -11.750 34 1HD2 LEU 4 1HD2 LEU 4 11.263 16.277 -12.986 35 2HD2 LEU 4 2HD2 LEU 4 11.472 14.965 -11.801 36 3HD2 LEU 4 3HD2 LEU 4 9.877 15.294 -12.474 37 H THR 5 H THR 5 15.439 16.246 -10.607 38 HA THR 5 HA THR 5 16.706 18.417 -9.273 39 HB THR 5 HB THR 5 18.711 17.695 -10.622 40 HG1 THR 5 HG1 THR 5 18.572 16.131 -12.058 41 1HG2 THR 5 1HG2 THR 5 17.152 15.389 -9.359 42 2HG2 THR 5 2HG2 THR 5 18.904 15.457 -9.629 43 3HG2 THR 5 3HG2 THR 5 18.143 16.568 -8.477 44 H GLU 6 H GLU 6 18.106 20.063 -10.345 45 HA GLU 6 HA GLU 6 16.643 21.868 -11.826 46 1HB GLU 6 1HB GLU 6 19.667 21.698 -11.996 47 2HB GLU 6 2HB GLU 6 18.626 23.116 -12.148 48 1HG GLU 6 1HG GLU 6 19.265 21.515 -9.646 49 2HG GLU 6 2HG GLU 6 19.602 23.210 -9.975 50 H GLU 7 H GLU 7 19.031 19.564 -13.033 51 HA GLU 7 HA GLU 7 18.917 19.791 -15.772 52 1HB GLU 7 1HB GLU 7 18.689 17.131 -14.265 53 2HB GLU 7 2HB GLU 7 19.371 17.407 -15.877 54 1HG GLU 7 1HG GLU 7 21.294 17.238 -14.616 55 2HG GLU 7 2HG GLU 7 21.054 18.989 -14.519 56 H GLN 8 H GLN 8 16.550 17.948 -13.754 57 HA GLN 8 HA GLN 8 14.985 17.121 -16.045 58 1HB GLN 8 1HB GLN 8 14.455 17.093 -13.061 59 2HB GLN 8 2HB GLN 8 13.335 16.449 -14.270 60 1HG GLN 8 1HG GLN 8 14.901 14.796 -15.020 61 2HG GLN 8 2HG GLN 8 16.230 15.511 -14.098 62 1HE2 GLN 8 1HE2 GLN 8 16.451 15.072 -11.895 63 2HE2 GLN 8 2HE2 GLN 8 15.301 14.081 -10.989 64 H LYS 9 H LYS 9 14.801 19.820 -13.671 65 HA LYS 9 HA LYS 9 12.286 20.808 -14.655 66 1HB LYS 9 1HB LYS 9 14.543 22.273 -13.266 67 2HB LYS 9 2HB LYS 9 12.933 22.937 -13.597 68 1HG LYS 9 1HG LYS 9 11.918 20.989 -12.350 69 2HG LYS 9 2HG LYS 9 13.537 20.492 -11.859 70 1HD LYS 9 1HD LYS 9 12.235 23.183 -11.217 71 2HD LYS 9 2HD LYS 9 12.334 21.786 -10.126 72 1HE LYS 9 1HE LYS 9 14.811 21.864 -10.234 73 2HE LYS 9 2HE LYS 9 14.723 23.318 -11.253 74 1HZ LYS 9 1HZ LYS 9 13.709 23.096 -8.515 75 2HZ LYS 9 2HZ LYS 9 15.084 23.869 -9.003 76 3HZ LYS 9 3HZ LYS 9 13.608 24.432 -9.478 77 H GLN 10 H GLN 10 15.663 21.414 -15.718 78 HA GLN 10 HA GLN 10 15.017 23.287 -17.780 79 1HB GLN 10 1HB GLN 10 17.269 21.240 -17.664 80 2HB GLN 10 2HB GLN 10 17.105 22.503 -18.879 81 1HG GLN 10 1HG GLN 10 17.333 24.251 -17.207 82 2HG GLN 10 2HG GLN 10 17.272 23.076 -15.891 83 1HE2 GLN 10 1HE2 GLN 10 19.179 23.496 -18.955 84 2HE2 GLN 10 2HE2 GLN 10 20.713 23.145 -18.179 85 H GLU 11 H GLU 11 15.296 19.680 -17.902 86 HA GLU 11 HA GLU 11 14.492 19.356 -20.584 87 1HB GLU 11 1HB GLU 11 13.946 17.555 -18.191 88 2HB GLU 11 2HB GLU 11 13.677 17.096 -19.872 89 1HG GLU 11 1HG GLU 11 16.014 17.272 -20.413 90 2HG GLU 11 2HG GLU 11 16.403 18.015 -18.863 91 H ILE 12 H ILE 12 12.397 19.530 -17.673 92 HA ILE 12 HA ILE 12 9.906 19.286 -19.007 93 HB ILE 12 HB ILE 12 10.700 20.614 -16.399 94 1HG1 ILE 12 1HG1 ILE 12 9.162 18.026 -16.988 95 2HG1 ILE 12 2HG1 ILE 12 10.905 18.057 -16.759 96 1HG2 ILE 12 1HG2 ILE 12 8.346 20.682 -15.765 97 2HG2 ILE 12 2HG2 ILE 12 8.571 21.652 -17.209 98 3HG2 ILE 12 3HG2 ILE 12 7.878 20.022 -17.336 99 1HD1 ILE 12 1HD1 ILE 12 8.830 18.816 -14.669 100 2HD1 ILE 12 2HD1 ILE 12 9.876 17.393 -14.703 101 3HD1 ILE 12 3HD1 ILE 12 10.592 19.002 -14.476 102 H ARG 13 H ARG 13 11.847 22.251 -18.248 103 HA ARG 13 HA ARG 13 9.952 24.026 -19.382 104 1HB ARG 13 1HB ARG 13 11.746 24.819 -17.941 105 2HB ARG 13 2HB ARG 13 12.966 24.314 -19.117 106 1HG ARG 13 1HG ARG 13 12.631 26.715 -19.240 107 2HG ARG 13 2HG ARG 13 12.118 25.967 -20.752 108 1HD ARG 13 1HD ARG 13 9.723 26.115 -19.960 109 2HD ARG 13 2HD ARG 13 10.316 26.914 -18.483 110 HE ARG 13 HE ARG 13 11.260 28.231 -20.862 111 1HH1 ARG 13 1HH1 ARG 13 8.387 27.806 -18.860 112 2HH1 ARG 13 2HH1 ARG 13 7.627 29.289 -19.372 113 1HH2 ARG 13 1HH2 ARG 13 10.272 30.162 -21.576 114 2HH2 ARG 13 2HH2 ARG 13 8.717 30.650 -20.961 115 H GLU 14 H GLU 14 12.746 22.347 -20.888 116 HA GLU 14 HA GLU 14 12.487 23.468 -23.486 117 1HB GLU 14 1HB GLU 14 13.509 20.756 -22.554 118 2HB GLU 14 2HB GLU 14 13.658 21.345 -24.213 119 1HG GLU 14 1HG GLU 14 15.059 23.176 -23.562 120 2HG GLU 14 2HG GLU 14 14.725 22.946 -21.846 121 H ALA 15 H ALA 15 11.089 20.424 -22.165 122 HA ALA 15 HA ALA 15 9.568 19.692 -24.432 123 1HB ALA 15 1HB ALA 15 8.211 18.382 -22.849 124 2HB ALA 15 2HB ALA 15 9.943 18.217 -22.496 125 3HB ALA 15 3HB ALA 15 8.925 19.260 -21.481 126 H PHE 16 H PHE 16 8.617 21.670 -21.600 127 HA PHE 16 HA PHE 16 6.018 22.295 -22.331 128 1HB PHE 16 1HB PHE 16 6.983 22.882 -20.156 129 2HB PHE 16 2HB PHE 16 8.056 24.049 -20.905 130 HD1 PHE 16 HD1 PHE 16 7.281 26.261 -21.590 131 HD2 PHE 16 HD2 PHE 16 4.510 23.304 -20.124 132 HE1 PHE 16 HE1 PHE 16 5.492 27.961 -21.518 133 HE2 PHE 16 HE2 PHE 16 2.761 25.045 -19.914 134 HZ PHE 16 HZ PHE 16 3.234 27.363 -20.623 135 H ASP 17 H ASP 17 8.987 24.150 -23.088 136 HA ASP 17 HA ASP 17 7.812 26.180 -24.644 137 1HB ASP 17 1HB ASP 17 10.108 26.290 -23.802 138 2HB ASP 17 2HB ASP 17 10.587 24.932 -24.831 139 H LEU 18 H LEU 18 9.206 23.015 -25.699 140 HA LEU 18 HA LEU 18 8.681 23.358 -28.453 141 1HB LEU 18 1HB LEU 18 10.094 21.599 -27.625 142 2HB LEU 18 2HB LEU 18 8.757 20.798 -26.799 143 HG LEU 18 HG LEU 18 8.341 21.314 -29.729 144 1HD1 LEU 18 1HD1 LEU 18 10.697 20.703 -29.743 145 2HD1 LEU 18 2HD1 LEU 18 10.343 19.244 -28.780 146 3HD1 LEU 18 3HD1 LEU 18 9.689 19.417 -30.429 147 1HD2 LEU 18 1HD2 LEU 18 6.684 19.998 -28.411 148 2HD2 LEU 18 2HD2 LEU 18 7.443 19.002 -29.652 149 3HD2 LEU 18 3HD2 LEU 18 7.954 18.846 -27.962 150 H PHE 19 H PHE 19 6.587 21.793 -25.946 151 HA PHE 19 HA PHE 19 4.459 21.272 -27.759 152 1HB PHE 19 1HB PHE 19 4.346 21.840 -24.774 153 2HB PHE 19 2HB PHE 19 3.036 21.122 -25.714 154 HD1 PHE 19 HD1 PHE 19 4.719 20.092 -23.195 155 HD2 PHE 19 HD2 PHE 19 4.553 19.101 -27.400 156 HE1 PHE 19 HE1 PHE 19 5.304 17.747 -22.689 157 HE2 PHE 19 HE2 PHE 19 5.311 16.827 -26.895 158 HZ PHE 19 HZ PHE 19 5.715 16.129 -24.537 159 H ASP 20 H ASP 20 5.144 24.131 -25.748 160 HA ASP 20 HA ASP 20 2.795 25.590 -26.662 161 1HB ASP 20 1HB ASP 20 3.818 25.995 -24.440 162 2HB ASP 20 2HB ASP 20 5.295 26.557 -25.232 163 H THR 21 H THR 21 3.547 24.806 -28.939 164 HA THR 21 HA THR 21 5.572 26.148 -30.373 165 HB THR 21 HB THR 21 4.198 25.651 -32.374 166 HG1 THR 21 HG1 THR 21 2.230 25.161 -30.410 167 1HG2 THR 21 1HG2 THR 21 5.622 23.874 -31.324 168 2HG2 THR 21 2HG2 THR 21 4.209 23.321 -30.402 169 3HG2 THR 21 3HG2 THR 21 4.201 23.233 -32.168 170 H ASP 22 H ASP 22 2.559 27.443 -29.104 171 HA ASP 22 HA ASP 22 2.416 29.740 -30.876 172 1HB ASP 22 1HB ASP 22 0.429 28.848 -29.782 173 2HB ASP 22 2HB ASP 22 1.161 29.057 -28.183 174 H GLY 23 H GLY 23 4.259 28.862 -28.015 175 1HA GLY 23 1HA GLY 23 6.070 29.894 -27.145 176 2HA GLY 23 2HA GLY 23 5.832 31.269 -28.225 177 H SER 24 H SER 24 2.878 31.151 -26.788 178 HA SER 24 HA SER 24 3.686 33.459 -25.169 179 1HB SER 24 1HB SER 24 0.887 32.387 -25.622 180 2HB SER 24 2HB SER 24 1.382 33.935 -24.916 181 HG SER 24 HG SER 24 1.668 33.045 -27.581 182 H GLY 25 H GLY 25 4.730 31.285 -24.005 183 1HA GLY 25 1HA GLY 25 5.039 30.214 -21.981 184 2HA GLY 25 2HA GLY 25 4.292 31.662 -21.298 185 H THR 26 H THR 26 2.488 29.423 -23.384 186 HA THR 26 HA THR 26 1.016 28.193 -21.142 187 HB THR 26 HB THR 26 -1.133 28.987 -22.292 188 HG1 THR 26 HG1 THR 26 0.552 31.120 -23.061 189 1HG2 THR 26 1HG2 THR 26 -1.307 30.999 -20.917 190 2HG2 THR 26 2HG2 THR 26 -0.501 29.712 -20.006 191 3HG2 THR 26 3HG2 THR 26 0.449 31.048 -20.693 192 H ILE 27 H ILE 27 0.724 26.092 -21.726 193 HA ILE 27 HA ILE 27 0.785 25.326 -24.599 194 HB ILE 27 HB ILE 27 0.417 23.691 -22.088 195 1HG1 ILE 27 1HG1 ILE 27 2.697 23.802 -24.128 196 2HG1 ILE 27 2HG1 ILE 27 2.721 24.649 -22.583 197 1HG2 ILE 27 1HG2 ILE 27 0.733 22.783 -24.983 198 2HG2 ILE 27 2HG2 ILE 27 0.504 21.738 -23.582 199 3HG2 ILE 27 3HG2 ILE 27 -0.810 22.765 -24.100 200 1HD1 ILE 27 1HD1 ILE 27 2.388 22.454 -21.411 201 2HD1 ILE 27 2HD1 ILE 27 2.566 21.634 -22.983 202 3HD1 ILE 27 3HD1 ILE 27 3.898 22.578 -22.333 203 H ASP 28 H ASP 28 -1.112 25.869 -25.671 204 HA ASP 28 HA ASP 28 -3.683 26.159 -24.383 205 1HB ASP 28 1HB ASP 28 -3.167 27.225 -26.537 206 2HB ASP 28 2HB ASP 28 -2.958 25.639 -27.297 207 H ALA 29 H ALA 29 -5.398 24.668 -24.240 208 HA ALA 29 HA ALA 29 -5.119 22.056 -23.695 209 1HB ALA 29 1HB ALA 29 -7.501 21.769 -24.391 210 2HB ALA 29 2HB ALA 29 -7.237 23.282 -23.500 211 3HB ALA 29 3HB ALA 29 -7.414 23.311 -25.268 212 H LYS 30 H LYS 30 -5.538 23.256 -27.058 213 HA LYS 30 HA LYS 30 -5.630 20.693 -28.323 214 1HB LYS 30 1HB LYS 30 -4.658 23.388 -29.365 215 2HB LYS 30 2HB LYS 30 -4.977 21.958 -30.360 216 1HG LYS 30 1HG LYS 30 -7.341 21.958 -29.677 217 2HG LYS 30 2HG LYS 30 -7.070 23.359 -28.626 218 1HD LYS 30 1HD LYS 30 -6.365 24.708 -30.586 219 2HD LYS 30 2HD LYS 30 -6.669 23.317 -31.650 220 1HE LYS 30 1HE LYS 30 -9.062 23.315 -30.945 221 2HE LYS 30 2HE LYS 30 -8.750 24.709 -29.892 222 1HZ LYS 30 1HZ LYS 30 -9.673 25.365 -31.977 223 2HZ LYS 30 2HZ LYS 30 -8.144 25.960 -31.832 224 3HZ LYS 30 3HZ LYS 30 -8.437 24.666 -32.811 225 H GLU 31 H GLU 31 -2.897 22.864 -27.513 226 HA GLU 31 HA GLU 31 -0.860 21.281 -28.818 227 1HB GLU 31 1HB GLU 31 -0.718 23.364 -26.607 228 2HB GLU 31 2HB GLU 31 0.679 22.631 -27.402 229 1HG GLU 31 1HG GLU 31 0.018 23.581 -29.553 230 2HG GLU 31 2HG GLU 31 -1.468 24.241 -28.854 231 H LEU 32 H LEU 32 -2.244 21.444 -25.500 232 HA LEU 32 HA LEU 32 -0.440 19.509 -24.413 233 1HB LEU 32 1HB LEU 32 -2.156 21.098 -23.173 234 2HB LEU 32 2HB LEU 32 -3.268 19.747 -23.410 235 HG LEU 32 HG LEU 32 -1.362 18.284 -22.336 236 1HD1 LEU 32 1HD1 LEU 32 -0.449 21.033 -21.436 237 2HD1 LEU 32 2HD1 LEU 32 0.026 19.498 -20.687 238 3HD1 LEU 32 3HD1 LEU 32 0.494 19.824 -22.349 239 1HD2 LEU 32 1HD2 LEU 32 -2.976 20.328 -20.773 240 2HD2 LEU 32 2HD2 LEU 32 -3.496 18.703 -21.243 241 3HD2 LEU 32 3HD2 LEU 32 -2.196 18.900 -20.053 242 H LYS 33 H LYS 33 -3.678 19.147 -25.942 243 HA LYS 33 HA LYS 33 -3.890 16.326 -25.706 244 1HB LYS 33 1HB LYS 33 -5.735 17.657 -26.273 245 2HB LYS 33 2HB LYS 33 -4.983 18.260 -27.766 246 1HG LYS 33 1HG LYS 33 -4.985 15.957 -28.702 247 2HG LYS 33 2HG LYS 33 -5.753 15.358 -27.237 248 1HD LYS 33 1HD LYS 33 -6.885 17.378 -29.235 249 2HD LYS 33 2HD LYS 33 -7.352 15.682 -29.100 250 1HE LYS 33 1HE LYS 33 -7.876 17.879 -27.043 251 2HE LYS 33 2HE LYS 33 -9.055 17.079 -28.086 252 1HZ LYS 33 1HZ LYS 33 -8.561 15.014 -26.955 253 2HZ LYS 33 2HZ LYS 33 -7.503 15.794 -25.961 254 3HZ LYS 33 3HZ LYS 33 -9.103 16.169 -25.911 255 H VAL 34 H VAL 34 -2.408 18.286 -28.350 256 HA VAL 34 HA VAL 34 -1.446 16.085 -29.867 257 HB VAL 34 HB VAL 34 -0.388 18.912 -29.490 258 1HG1 VAL 34 1HG1 VAL 34 1.565 17.594 -30.131 259 2HG1 VAL 34 2HG1 VAL 34 0.629 16.771 -31.401 260 3HG1 VAL 34 3HG1 VAL 34 0.991 18.504 -31.530 261 1HG2 VAL 34 1HG2 VAL 34 -1.327 19.251 -31.724 262 2HG2 VAL 34 2HG2 VAL 34 -1.783 17.539 -31.830 263 3HG2 VAL 34 3HG2 VAL 34 -2.589 18.603 -30.666 264 H ALA 35 H ALA 35 0.144 17.841 -27.148 265 HA ALA 35 HA ALA 35 2.518 16.366 -27.069 266 1HB ALA 35 1HB ALA 35 2.088 18.401 -25.726 267 2HB ALA 35 2HB ALA 35 0.994 17.490 -24.673 268 3HB ALA 35 3HB ALA 35 2.695 17.056 -24.734 269 H MET 36 H MET 36 -0.491 15.701 -25.205 270 HA MET 36 HA MET 36 0.364 13.261 -24.033 271 1HB MET 36 1HB MET 36 -2.306 14.506 -24.623 272 2HB MET 36 2HB MET 36 -2.226 12.878 -23.953 273 1HG MET 36 1HG MET 36 -0.856 13.598 -22.081 274 2HG MET 36 2HG MET 36 -0.808 15.253 -22.701 275 1HE MET 36 1HE MET 36 -3.919 15.663 -23.602 276 2HE MET 36 2HE MET 36 -4.350 16.568 -22.133 277 3HE MET 36 3HE MET 36 -2.745 16.760 -22.873 278 H ARG 37 H ARG 37 -1.316 13.829 -27.156 279 HA ARG 37 HA ARG 37 -1.579 11.100 -27.791 280 1HB ARG 37 1HB ARG 37 -2.666 13.043 -28.994 281 2HB ARG 37 2HB ARG 37 -1.105 13.405 -29.725 282 1HG ARG 37 1HG ARG 37 -2.337 12.246 -31.344 283 2HG ARG 37 2HG ARG 37 -1.136 11.088 -30.777 284 1HD ARG 37 1HD ARG 37 -4.015 11.229 -29.749 285 2HD ARG 37 2HD ARG 37 -3.559 10.241 -31.128 286 HE ARG 37 HE ARG 37 -3.100 9.653 -28.314 287 1HH1 ARG 37 1HH1 ARG 37 -1.835 9.016 -31.557 288 2HH1 ARG 37 2HH1 ARG 37 -1.082 7.511 -31.094 289 1HH2 ARG 37 1HH2 ARG 37 -2.118 7.825 -27.708 290 2HH2 ARG 37 2HH2 ARG 37 -1.254 6.782 -28.828 291 H ALA 38 H ALA 38 1.066 13.398 -28.603 292 HA ALA 38 HA ALA 38 2.784 11.562 -29.909 293 1HB ALA 38 1HB ALA 38 4.555 13.191 -29.429 294 2HB ALA 38 2HB ALA 38 3.074 14.013 -29.961 295 3HB ALA 38 3HB ALA 38 3.522 14.011 -28.244 296 H LEU 39 H LEU 39 2.462 12.372 -26.452 297 HA LEU 39 HA LEU 39 4.544 10.630 -25.502 298 1HB LEU 39 1HB LEU 39 2.103 11.845 -24.189 299 2HB LEU 39 2HB LEU 39 3.319 10.941 -23.293 300 HG LEU 39 HG LEU 39 4.079 13.389 -24.934 301 1HD1 LEU 39 1HD1 LEU 39 2.300 14.140 -23.387 302 2HD1 LEU 39 2HD1 LEU 39 3.097 13.309 -22.043 303 3HD1 LEU 39 3HD1 LEU 39 3.872 14.702 -22.826 304 1HD2 LEU 39 1HD2 LEU 39 5.944 13.481 -23.336 305 2HD2 LEU 39 2HD2 LEU 39 5.322 12.048 -22.495 306 3HD2 LEU 39 3HD2 LEU 39 5.913 11.918 -24.165 307 H GLY 40 H GLY 40 1.479 9.846 -26.875 308 1HA GLY 40 1HA GLY 40 0.965 7.682 -27.459 309 2HA GLY 40 2HA GLY 40 1.908 7.025 -26.122 310 H PHE 41 H PHE 41 -0.212 9.616 -25.187 311 HA PHE 41 HA PHE 41 -1.888 7.755 -23.641 312 1HB PHE 41 1HB PHE 41 -1.844 10.752 -24.022 313 2HB PHE 41 2HB PHE 41 -3.106 9.973 -23.104 314 HD1 PHE 41 HD1 PHE 41 0.609 10.428 -23.234 315 HD2 PHE 41 HD2 PHE 41 -2.799 9.402 -20.803 316 HE1 PHE 41 HE1 PHE 41 2.028 10.523 -21.200 317 HE2 PHE 41 HE2 PHE 41 -1.382 9.499 -18.779 318 HZ PHE 41 HZ PHE 41 1.032 10.065 -18.968 319 H GLU 42 H GLU 42 -4.271 7.917 -23.780 320 HA GLU 42 HA GLU 42 -5.330 8.264 -26.560 321 1HB GLU 42 1HB GLU 42 -6.440 6.771 -24.157 322 2HB GLU 42 2HB GLU 42 -7.229 6.951 -25.733 323 1HG GLU 42 1HG GLU 42 -5.284 5.796 -26.809 324 2HG GLU 42 2HG GLU 42 -4.572 5.533 -25.209 325 HA PRO 43 HA PRO 43 -6.487 11.859 -23.990 326 1HB PRO 43 1HB PRO 43 -6.630 13.843 -25.826 327 2HB PRO 43 2HB PRO 43 -5.100 13.187 -25.193 328 1HG PRO 43 1HG PRO 43 -6.493 12.402 -27.769 329 2HG PRO 43 2HG PRO 43 -4.778 12.865 -27.516 330 1HD PRO 43 1HD PRO 43 -5.522 10.255 -27.602 331 2HD PRO 43 2HD PRO 43 -4.285 10.839 -26.443 332 H LYS 44 H LYS 44 -8.441 10.486 -23.724 333 HA LYS 44 HA LYS 44 -10.846 10.857 -25.191 334 1HB LYS 44 1HB LYS 44 -10.418 10.271 -22.236 335 2HB LYS 44 2HB LYS 44 -11.960 10.140 -23.104 336 1HG LYS 44 1HG LYS 44 -10.983 8.447 -24.620 337 2HG LYS 44 2HG LYS 44 -9.434 8.565 -23.765 338 1HD LYS 44 1HD LYS 44 -10.549 7.831 -21.654 339 2HD LYS 44 2HD LYS 44 -12.088 7.717 -22.518 340 1HE LYS 44 1HE LYS 44 -11.098 5.493 -22.325 341 2HE LYS 44 2HE LYS 44 -11.115 5.982 -24.028 342 1HZ LYS 44 1HZ LYS 44 -8.802 6.122 -22.216 343 2HZ LYS 44 2HZ LYS 44 -9.032 5.003 -23.404 344 3HZ LYS 44 3HZ LYS 44 -8.804 6.580 -23.798 345 H LYS 45 H LYS 45 -11.187 12.910 -25.765 346 HA LYS 45 HA LYS 45 -10.825 15.301 -24.911 347 1HB LYS 45 1HB LYS 45 -12.154 14.684 -26.893 348 2HB LYS 45 2HB LYS 45 -13.558 14.380 -25.854 349 1HG LYS 45 1HG LYS 45 -13.572 16.791 -25.188 350 2HG LYS 45 2HG LYS 45 -12.110 17.056 -26.138 351 1HD LYS 45 1HD LYS 45 -14.108 17.832 -27.336 352 2HD LYS 45 2HD LYS 45 -13.277 16.549 -28.219 353 1HE LYS 45 1HE LYS 45 -15.761 16.329 -28.255 354 2HE LYS 45 2HE LYS 45 -14.965 14.910 -27.574 355 1HZ LYS 45 1HZ LYS 45 -16.198 17.082 -26.022 356 2HZ LYS 45 2HZ LYS 45 -16.857 15.596 -26.294 357 3HZ LYS 45 3HZ LYS 45 -15.485 15.732 -25.395 358 H GLU 46 H GLU 46 -13.634 13.537 -23.561 359 HA GLU 46 HA GLU 46 -14.519 15.658 -21.870 360 1HB GLU 46 1HB GLU 46 -15.578 13.687 -20.545 361 2HB GLU 46 2HB GLU 46 -16.185 14.128 -22.135 362 1HG GLU 46 1HG GLU 46 -14.133 11.906 -21.867 363 2HG GLU 46 2HG GLU 46 -15.842 11.621 -21.545 364 H GLU 47 H GLU 47 -12.436 12.840 -21.065 365 HA GLU 47 HA GLU 47 -12.071 13.651 -18.299 366 1HB GLU 47 1HB GLU 47 -10.564 11.717 -20.121 367 2HB GLU 47 2HB GLU 47 -10.077 12.075 -18.461 368 1HG GLU 47 1HG GLU 47 -11.371 10.059 -18.415 369 2HG GLU 47 2HG GLU 47 -12.292 11.336 -17.615 370 H ILE 48 H ILE 48 -10.286 14.078 -21.345 371 HA ILE 48 HA ILE 48 -8.010 15.382 -20.253 372 HB ILE 48 HB ILE 48 -9.359 15.495 -22.971 373 1HG1 ILE 48 1HG1 ILE 48 -8.359 13.304 -22.167 374 2HG1 ILE 48 2HG1 ILE 48 -7.741 13.965 -23.682 375 1HG2 ILE 48 1HG2 ILE 48 -7.132 16.381 -23.811 376 2HG2 ILE 48 2HG2 ILE 48 -8.152 17.524 -22.935 377 3HG2 ILE 48 3HG2 ILE 48 -6.754 16.787 -22.121 378 1HD1 ILE 48 1HD1 ILE 48 -6.270 14.356 -21.036 379 2HD1 ILE 48 2HD1 ILE 48 -5.988 12.994 -22.119 380 3HD1 ILE 48 3HD1 ILE 48 -5.703 14.638 -22.694 381 H LYS 49 H LYS 49 -11.079 16.840 -21.502 382 HA LYS 49 HA LYS 49 -10.383 19.513 -20.999 383 1HB LYS 49 1HB LYS 49 -12.277 18.760 -22.371 384 2HB LYS 49 2HB LYS 49 -13.076 18.096 -20.923 385 1HG LYS 49 1HG LYS 49 -13.323 20.300 -19.971 386 2HG LYS 49 2HG LYS 49 -12.277 21.005 -21.211 387 1HD LYS 49 1HD LYS 49 -14.636 21.533 -21.595 388 2HD LYS 49 2HD LYS 49 -13.956 20.632 -22.949 389 1HE LYS 49 1HE LYS 49 -15.480 19.215 -20.715 390 2HE LYS 49 2HE LYS 49 -16.333 20.018 -22.041 391 1HZ LYS 49 1HZ LYS 49 -15.190 18.666 -23.596 392 2HZ LYS 49 2HZ LYS 49 -14.353 17.891 -22.411 393 3HZ LYS 49 3HZ LYS 49 -15.989 17.726 -22.503 394 H LYS 50 H LYS 50 -12.040 17.077 -18.928 395 HA LYS 50 HA LYS 50 -12.494 18.702 -16.693 396 1HB LYS 50 1HB LYS 50 -13.128 16.207 -17.288 397 2HB LYS 50 2HB LYS 50 -11.689 15.792 -16.363 398 1HG LYS 50 1HG LYS 50 -14.122 17.385 -15.415 399 2HG LYS 50 2HG LYS 50 -13.769 15.686 -15.077 400 1HD LYS 50 1HD LYS 50 -11.646 16.429 -13.895 401 2HD LYS 50 2HD LYS 50 -12.216 18.108 -14.068 402 1HE LYS 50 1HE LYS 50 -14.313 17.510 -12.860 403 2HE LYS 50 2HE LYS 50 -13.722 15.848 -12.661 404 1HZ LYS 50 1HZ LYS 50 -12.479 18.271 -11.574 405 2HZ LYS 50 2HZ LYS 50 -13.322 17.137 -10.727 406 3HZ LYS 50 3HZ LYS 50 -11.877 16.741 -11.416 407 H MET 51 H MET 51 -9.669 16.527 -17.274 408 HA MET 51 HA MET 51 -8.152 17.224 -15.052 409 1HB MET 51 1HB MET 51 -7.850 15.299 -16.557 410 2HB MET 51 2HB MET 51 -7.251 16.348 -17.840 411 1HG MET 51 1HG MET 51 -6.009 16.175 -15.078 412 2HG MET 51 2HG MET 51 -5.562 15.072 -16.379 413 1HE MET 51 1HE MET 51 -4.142 15.658 -18.458 414 2HE MET 51 2HE MET 51 -5.353 16.853 -18.991 415 3HE MET 51 3HE MET 51 -3.639 17.307 -18.885 416 H ILE 52 H ILE 52 -7.935 18.592 -18.378 417 HA ILE 52 HA ILE 52 -5.986 20.552 -17.900 418 HB ILE 52 HB ILE 52 -8.346 20.426 -19.798 419 1HG1 ILE 52 1HG1 ILE 52 -5.326 20.335 -20.254 420 2HG1 ILE 52 2HG1 ILE 52 -6.317 18.896 -20.022 421 1HG2 ILE 52 1HG2 ILE 52 -6.236 22.627 -19.718 422 2HG2 ILE 52 2HG2 ILE 52 -7.418 22.376 -21.014 423 3HG2 ILE 52 3HG2 ILE 52 -7.974 22.833 -19.420 424 1HD1 ILE 52 1HD1 ILE 52 -6.504 20.864 -22.321 425 2HD1 ILE 52 2HD1 ILE 52 -6.008 19.171 -22.376 426 3HD1 ILE 52 3HD1 ILE 52 -7.700 19.590 -22.015 427 H SER 53 H SER 53 -9.547 20.772 -17.386 428 HA SER 53 HA SER 53 -9.460 23.492 -16.536 429 1HB SER 53 1HB SER 53 -11.490 21.353 -15.757 430 2HB SER 53 2HB SER 53 -11.699 23.111 -15.666 431 HG SER 53 HG SER 53 -11.303 21.540 -18.006 432 H GLU 54 H GLU 54 -9.156 20.437 -14.646 433 HA GLU 54 HA GLU 54 -9.026 21.747 -12.093 434 1HB GLU 54 1HB GLU 54 -7.696 19.155 -13.010 435 2HB GLU 54 2HB GLU 54 -7.794 19.717 -11.341 436 1HG GLU 54 1HG GLU 54 -10.167 19.023 -13.118 437 2HG GLU 54 2HG GLU 54 -9.527 18.044 -11.798 438 H ILE 55 H ILE 55 -6.434 20.913 -14.441 439 HA ILE 55 HA ILE 55 -4.361 21.979 -12.706 440 HB ILE 55 HB ILE 55 -4.339 21.354 -15.676 441 1HG1 ILE 55 1HG1 ILE 55 -4.850 19.341 -14.371 442 2HG1 ILE 55 2HG1 ILE 55 -3.255 19.268 -15.103 443 1HG2 ILE 55 1HG2 ILE 55 -2.493 22.813 -15.207 444 2HG2 ILE 55 2HG2 ILE 55 -2.040 21.905 -13.757 445 3HG2 ILE 55 3HG2 ILE 55 -1.850 21.178 -15.369 446 1HD1 ILE 55 1HD1 ILE 55 -2.222 19.792 -12.898 447 2HD1 ILE 55 2HD1 ILE 55 -3.847 19.840 -12.170 448 3HD1 ILE 55 3HD1 ILE 55 -3.227 18.338 -12.868 449 H ASP 56 H ASP 56 -6.373 23.390 -15.278 450 HA ASP 56 HA ASP 56 -4.746 25.814 -15.436 451 1HB ASP 56 1HB ASP 56 -5.770 24.871 -17.437 452 2HB ASP 56 2HB ASP 56 -7.382 25.066 -16.731 453 H LYS 57 H LYS 57 -4.874 26.762 -13.370 454 HA LYS 57 HA LYS 57 -7.148 27.183 -11.813 455 1HB LYS 57 1HB LYS 57 -4.796 27.408 -11.123 456 2HB LYS 57 2HB LYS 57 -4.591 28.794 -12.203 457 1HG LYS 57 1HG LYS 57 -4.772 29.473 -9.910 458 2HG LYS 57 2HG LYS 57 -6.102 30.135 -10.871 459 1HD LYS 57 1HD LYS 57 -7.651 28.444 -9.959 460 2HD LYS 57 2HD LYS 57 -6.315 27.649 -9.096 461 1HE LYS 57 1HE LYS 57 -5.984 29.714 -7.742 462 2HE LYS 57 2HE LYS 57 -7.300 30.507 -8.632 463 1HZ LYS 57 1HZ LYS 57 -8.789 28.847 -7.789 464 2HZ LYS 57 2HZ LYS 57 -7.568 28.104 -6.966 465 3HZ LYS 57 3HZ LYS 57 -8.036 29.629 -6.549 466 H ASP 58 H ASP 58 -6.396 28.671 -14.898 467 HA ASP 58 HA ASP 58 -7.952 31.141 -14.300 468 1HB ASP 58 1HB ASP 58 -6.317 30.372 -16.749 469 2HB ASP 58 2HB ASP 58 -7.084 31.927 -16.432 470 H GLY 59 H GLY 59 -8.284 27.966 -15.509 471 1HA GLY 59 1HA GLY 59 -9.692 26.864 -16.754 472 2HA GLY 59 2HA GLY 59 -10.917 28.009 -16.168 473 H SER 60 H SER 60 -8.214 28.999 -18.275 474 HA SER 60 HA SER 60 -10.037 29.853 -20.400 475 1HB SER 60 1HB SER 60 -7.686 30.778 -21.160 476 2HB SER 60 2HB SER 60 -8.524 31.480 -19.765 477 HG SER 60 HG SER 60 -6.255 29.840 -19.779 478 H GLY 61 H GLY 61 -8.369 26.995 -19.716 479 1HA GLY 61 1HA GLY 61 -8.182 25.091 -21.037 480 2HA GLY 61 2HA GLY 61 -8.615 26.011 -22.487 481 H THR 62 H THR 62 -6.121 26.819 -20.051 482 HA THR 62 HA THR 62 -3.919 26.314 -22.004 483 HB THR 62 HB THR 62 -3.004 28.514 -21.217 484 HG1 THR 62 HG1 THR 62 -4.473 28.565 -19.380 485 1HG2 THR 62 1HG2 THR 62 -5.698 28.762 -22.654 486 2HG2 THR 62 2HG2 THR 62 -4.377 29.944 -22.672 487 3HG2 THR 62 3HG2 THR 62 -4.152 28.359 -23.434 488 H ILE 63 H ILE 63 -2.245 25.279 -21.009 489 HA ILE 63 HA ILE 63 -2.121 25.258 -18.021 490 HB ILE 63 HB ILE 63 -0.479 23.624 -19.973 491 1HG1 ILE 63 1HG1 ILE 63 -2.674 22.871 -20.431 492 2HG1 ILE 63 2HG1 ILE 63 -1.925 21.714 -19.325 493 1HG2 ILE 63 1HG2 ILE 63 -0.043 22.237 -17.995 494 2HG2 ILE 63 2HG2 ILE 63 0.464 23.912 -17.736 495 3HG2 ILE 63 3HG2 ILE 63 -1.023 23.325 -16.992 496 1HD1 ILE 63 1HD1 ILE 63 -4.030 23.799 -18.628 497 2HD1 ILE 63 2HD1 ILE 63 -4.202 22.040 -18.649 498 3HD1 ILE 63 3HD1 ILE 63 -3.186 22.804 -17.422 499 H ASP 64 H ASP 64 -1.029 27.048 -17.307 500 HA ASP 64 HA ASP 64 1.089 28.318 -18.859 501 1HB ASP 64 1HB ASP 64 -0.468 29.433 -17.163 502 2HB ASP 64 2HB ASP 64 0.526 28.693 -15.901 503 H PHE 65 H PHE 65 3.367 28.466 -18.023 504 HA PHE 65 HA PHE 65 4.539 25.924 -17.860 505 1HB PHE 65 1HB PHE 65 5.811 27.814 -18.596 506 2HB PHE 65 2HB PHE 65 5.636 28.621 -17.039 507 HD1 PHE 65 HD1 PHE 65 7.572 28.591 -15.698 508 HD2 PHE 65 HD2 PHE 65 6.766 25.205 -18.257 509 HE1 PHE 65 HE1 PHE 65 9.601 27.456 -14.853 510 HE2 PHE 65 HE2 PHE 65 8.751 24.042 -17.325 511 HZ PHE 65 HZ PHE 65 10.186 25.175 -15.653 512 H GLU 66 H GLU 66 4.059 28.203 -15.110 513 HA GLU 66 HA GLU 66 5.046 26.543 -13.103 514 1HB GLU 66 1HB GLU 66 2.647 28.432 -12.892 515 2HB GLU 66 2HB GLU 66 3.542 27.715 -11.550 516 1HG GLU 66 1HG GLU 66 4.493 29.818 -11.686 517 2HG GLU 66 2HG GLU 66 5.658 28.831 -12.573 518 H GLU 67 H GLU 67 1.761 26.524 -14.505 519 HA GLU 67 HA GLU 67 0.660 24.587 -12.693 520 1HB GLU 67 1HB GLU 67 -0.197 25.301 -15.528 521 2HB GLU 67 2HB GLU 67 -1.146 24.417 -14.326 522 1HG GLU 67 1HG GLU 67 -1.181 26.353 -12.834 523 2HG GLU 67 2HG GLU 67 -0.202 27.298 -13.967 524 H PHE 68 H PHE 68 2.087 24.368 -15.971 525 HA PHE 68 HA PHE 68 1.876 21.569 -16.333 526 1HB PHE 68 1HB PHE 68 2.549 23.168 -18.106 527 2HB PHE 68 2HB PHE 68 4.068 23.456 -17.284 528 HD1 PHE 68 HD1 PHE 68 2.009 20.779 -18.917 529 HD2 PHE 68 HD2 PHE 68 5.958 22.093 -17.772 530 HE1 PHE 68 HE1 PHE 68 3.014 19.033 -20.362 531 HE2 PHE 68 HE2 PHE 68 6.945 20.439 -19.349 532 HZ PHE 68 HZ PHE 68 5.497 18.873 -20.575 533 H LEU 69 H LEU 69 4.603 23.468 -14.946 534 HA LEU 69 HA LEU 69 6.254 21.296 -14.293 535 1HB LEU 69 1HB LEU 69 7.014 23.614 -14.293 536 2HB LEU 69 2HB LEU 69 5.928 24.010 -12.958 537 HG LEU 69 HG LEU 69 7.201 22.542 -11.436 538 1HD1 LEU 69 1HD1 LEU 69 8.068 20.839 -12.996 539 2HD1 LEU 69 2HD1 LEU 69 9.040 22.078 -13.830 540 3HD1 LEU 69 3HD1 LEU 69 9.400 21.629 -12.151 541 1HD2 LEU 69 1HD2 LEU 69 8.946 24.505 -12.983 542 2HD2 LEU 69 2HD2 LEU 69 7.810 24.920 -11.681 543 3HD2 LEU 69 3HD2 LEU 69 9.234 23.924 -11.328 544 H THR 70 H THR 70 3.694 22.903 -12.332 545 HA THR 70 HA THR 70 3.989 21.290 -10.026 546 HB THR 70 HB THR 70 1.421 22.539 -11.094 547 HG1 THR 70 HG1 THR 70 3.073 24.068 -10.877 548 1HG2 THR 70 1HG2 THR 70 0.813 22.641 -8.697 549 2HG2 THR 70 2HG2 THR 70 1.017 20.961 -9.221 550 3HG2 THR 70 3HG2 THR 70 2.294 21.760 -8.274 551 H MET 71 H MET 71 1.873 20.796 -12.912 552 HA MET 71 HA MET 71 0.673 18.381 -12.093 553 1HB MET 71 1HB MET 71 -0.001 19.783 -14.048 554 2HB MET 71 2HB MET 71 1.449 19.251 -14.904 555 1HG MET 71 1HG MET 71 0.629 16.878 -14.723 556 2HG MET 71 2HG MET 71 -0.826 17.485 -13.932 557 1HE MET 71 1HE MET 71 0.228 18.192 -18.383 558 2HE MET 71 2HE MET 71 1.044 19.120 -17.109 559 3HE MET 71 3HE MET 71 1.290 17.358 -17.224 560 H MET 72 H MET 72 3.650 18.889 -14.053 561 HA MET 72 HA MET 72 4.394 16.169 -14.320 562 1HB MET 72 1HB MET 72 6.099 18.686 -14.167 563 2HB MET 72 2HB MET 72 6.734 17.095 -14.571 564 1HG MET 72 1HG MET 72 4.613 18.620 -16.142 565 2HG MET 72 2HG MET 72 6.301 18.430 -16.581 566 1HE MET 72 1HE MET 72 7.377 16.086 -17.290 567 2HE MET 72 2HE MET 72 6.684 15.213 -15.896 568 3HE MET 72 3HE MET 72 6.417 14.609 -17.545 569 H THR 73 H THR 73 5.308 18.510 -11.764 570 HA THR 73 HA THR 73 6.877 16.759 -10.197 571 HB THR 73 HB THR 73 5.113 19.014 -9.163 572 HG1 THR 73 HG1 THR 73 6.485 19.734 -10.828 573 1HG2 THR 73 1HG2 THR 73 7.705 17.786 -8.118 574 2HG2 THR 73 2HG2 THR 73 6.884 19.207 -7.444 575 3HG2 THR 73 3HG2 THR 73 6.104 17.618 -7.365 576 H ALA 74 H ALA 74 3.346 17.375 -10.082 577 HA ALA 74 HA ALA 74 2.775 15.673 -7.888 578 1HB ALA 74 1HB ALA 74 0.460 15.771 -8.669 579 2HB ALA 74 2HB ALA 74 1.214 17.375 -8.762 580 3HB ALA 74 3HB ALA 74 0.979 16.415 -10.237 581 H LYS 75 H LYS 75 2.914 14.993 -11.420 582 HA LYS 75 HA LYS 75 2.150 12.220 -11.153 583 1HB LYS 75 1HB LYS 75 3.742 13.670 -13.295 584 2HB LYS 75 2HB LYS 75 3.226 11.979 -13.400 585 1HG LYS 75 1HG LYS 75 0.854 12.688 -13.099 586 2HG LYS 75 2HG LYS 75 1.357 14.378 -13.136 587 1HD LYS 75 1HD LYS 75 1.709 12.338 -15.386 588 2HD LYS 75 2HD LYS 75 0.485 13.615 -15.310 589 1HE LYS 75 1HE LYS 75 2.346 15.326 -15.258 590 2HE LYS 75 2HE LYS 75 3.506 14.012 -15.525 591 1HZ LYS 75 1HZ LYS 75 1.312 14.736 -17.325 592 2HZ LYS 75 2HZ LYS 75 2.912 15.073 -17.541 593 3HZ LYS 75 3HZ LYS 75 2.389 13.510 -17.561 594 H MET 76 H MET 76 5.375 13.832 -11.286 595 HA MET 76 HA MET 76 6.524 11.742 -9.633 596 1HB MET 76 1HB MET 76 8.263 11.063 -11.250 597 2HB MET 76 2HB MET 76 6.643 10.578 -11.756 598 1HG MET 76 1HG MET 76 6.570 12.552 -13.303 599 2HG MET 76 2HG MET 76 8.246 12.918 -12.859 600 1HE MET 76 1HE MET 76 7.251 12.609 -15.840 601 2HE MET 76 2HE MET 76 8.932 12.976 -15.371 602 3HE MET 76 3HE MET 76 8.593 11.659 -16.519 Start of MODEL 15 1 H ARG 1 H ARG 1 17.181 19.820 -7.314 2 HA ARG 1 HA ARG 1 16.808 18.717 -5.325 3 1HB ARG 1 1HB ARG 1 18.285 20.731 -5.316 4 2HB ARG 1 2HB ARG 1 16.911 21.716 -4.783 5 1HG ARG 1 1HG ARG 1 16.751 20.362 -2.702 6 2HG ARG 1 2HG ARG 1 18.077 19.327 -3.273 7 1HD ARG 1 1HD ARG 1 19.589 21.296 -3.295 8 2HD ARG 1 2HD ARG 1 18.252 22.320 -2.713 9 HE ARG 1 HE ARG 1 18.531 20.129 -0.943 10 1HH1 ARG 1 1HH1 ARG 1 20.318 23.009 -1.921 11 2HH1 ARG 1 2HH1 ARG 1 21.140 23.201 -0.396 12 1HH2 ARG 1 1HH2 ARG 1 19.594 20.356 1.061 13 2HH2 ARG 1 2HH2 ARG 1 20.718 21.660 1.332 14 H VAL 2 H VAL 2 14.325 21.111 -6.055 15 HA VAL 2 HA VAL 2 12.800 20.630 -3.606 16 HB VAL 2 HB VAL 2 12.004 22.107 -6.148 17 1HG1 VAL 2 1HG1 VAL 2 10.069 21.512 -4.691 18 2HG1 VAL 2 2HG1 VAL 2 10.909 22.212 -3.295 19 3HG1 VAL 2 3HG1 VAL 2 10.395 23.246 -4.641 20 1HG2 VAL 2 1HG2 VAL 2 12.611 24.154 -4.867 21 2HG2 VAL 2 2HG2 VAL 2 13.264 23.142 -3.566 22 3HG2 VAL 2 3HG2 VAL 2 14.029 23.147 -5.166 23 H GLY 3 H GLY 3 13.031 18.263 -4.040 24 1HA GLY 3 1HA GLY 3 11.937 16.256 -4.420 25 2HA GLY 3 2HA GLY 3 10.594 17.105 -5.206 26 H LEU 4 H LEU 4 11.322 18.254 -7.321 27 HA LEU 4 HA LEU 4 12.578 16.288 -9.142 28 1HB LEU 4 1HB LEU 4 11.470 19.082 -9.564 29 2HB LEU 4 2HB LEU 4 12.092 18.030 -10.841 30 HG LEU 4 HG LEU 4 9.685 17.395 -9.056 31 1HD1 LEU 4 1HD1 LEU 4 9.985 18.299 -11.932 32 2HD1 LEU 4 2HD1 LEU 4 8.453 17.761 -11.209 33 3HD1 LEU 4 3HD1 LEU 4 9.258 19.225 -10.599 34 1HD2 LEU 4 1HD2 LEU 4 10.863 15.917 -11.460 35 2HD2 LEU 4 2HD2 LEU 4 10.734 15.289 -9.798 36 3HD2 LEU 4 3HD2 LEU 4 9.276 15.582 -10.743 37 H THR 5 H THR 5 14.551 16.309 -9.867 38 HA THR 5 HA THR 5 16.562 18.018 -8.738 39 HB THR 5 HB THR 5 16.833 16.264 -11.216 40 HG1 THR 5 HG1 THR 5 15.854 14.935 -9.736 41 1HG2 THR 5 1HG2 THR 5 18.662 16.920 -8.877 42 2HG2 THR 5 2HG2 THR 5 19.067 15.865 -10.248 43 3HG2 THR 5 3HG2 THR 5 18.809 17.603 -10.517 44 H GLU 6 H GLU 6 17.728 19.728 -9.834 45 HA GLU 6 HA GLU 6 16.374 21.498 -11.463 46 1HB GLU 6 1HB GLU 6 19.347 20.958 -11.117 47 2HB GLU 6 2HB GLU 6 18.749 22.223 -12.189 48 1HG GLU 6 1HG GLU 6 19.295 23.129 -9.969 49 2HG GLU 6 2HG GLU 6 17.603 23.372 -10.412 50 H GLU 7 H GLU 7 18.489 18.825 -12.585 51 HA GLU 7 HA GLU 7 18.251 19.342 -15.337 52 1HB GLU 7 1HB GLU 7 18.359 16.539 -14.176 53 2HB GLU 7 2HB GLU 7 18.968 17.127 -15.725 54 1HG GLU 7 1HG GLU 7 20.117 17.595 -12.950 55 2HG GLU 7 2HG GLU 7 20.883 16.850 -14.347 56 H GLN 8 H GLN 8 15.950 17.667 -13.183 57 HA GLN 8 HA GLN 8 14.232 16.747 -15.342 58 1HB GLN 8 1HB GLN 8 13.650 17.143 -12.382 59 2HB GLN 8 2HB GLN 8 12.581 16.370 -13.554 60 1HG GLN 8 1HG GLN 8 14.190 14.575 -13.941 61 2HG GLN 8 2HG GLN 8 15.397 15.376 -12.931 62 1HE2 GLN 8 1HE2 GLN 8 12.244 13.694 -12.852 63 2HE2 GLN 8 2HE2 GLN 8 12.303 13.355 -11.131 64 H LYS 9 H LYS 9 14.342 19.583 -13.118 65 HA LYS 9 HA LYS 9 11.967 20.833 -14.073 66 1HB LYS 9 1HB LYS 9 14.516 22.249 -13.176 67 2HB LYS 9 2HB LYS 9 12.896 22.939 -13.272 68 1HG LYS 9 1HG LYS 9 12.110 21.367 -11.512 69 2HG LYS 9 2HG LYS 9 13.740 20.683 -11.404 70 1HD LYS 9 1HD LYS 9 14.610 23.024 -10.908 71 2HD LYS 9 2HD LYS 9 12.922 23.552 -10.789 72 1HE LYS 9 1HE LYS 9 12.549 21.903 -8.955 73 2HE LYS 9 2HE LYS 9 14.230 21.355 -9.116 74 1HZ LYS 9 1HZ LYS 9 14.986 23.473 -8.469 75 2HZ LYS 9 2HZ LYS 9 13.454 24.090 -8.408 76 3HZ LYS 9 3HZ LYS 9 13.921 22.927 -7.340 77 H GLN 10 H GLN 10 15.341 21.124 -15.230 78 HA GLN 10 HA GLN 10 14.929 22.936 -17.360 79 1HB GLN 10 1HB GLN 10 16.890 20.643 -17.054 80 2HB GLN 10 2HB GLN 10 17.001 21.862 -18.323 81 1HG GLN 10 1HG GLN 10 17.642 23.557 -16.859 82 2HG GLN 10 2HG GLN 10 16.859 22.819 -15.462 83 1HE2 GLN 10 1HE2 GLN 10 19.110 21.146 -17.717 84 2HE2 GLN 10 2HE2 GLN 10 20.257 20.749 -16.445 85 H GLU 11 H GLU 11 14.936 19.320 -17.439 86 HA GLU 11 HA GLU 11 14.179 18.988 -20.135 87 1HB GLU 11 1HB GLU 11 13.568 17.319 -17.666 88 2HB GLU 11 2HB GLU 11 13.183 16.800 -19.310 89 1HG GLU 11 1HG GLU 11 15.488 16.767 -19.967 90 2HG GLU 11 2HG GLU 11 16.016 17.574 -18.492 91 H ILE 12 H ILE 12 12.066 19.364 -17.246 92 HA ILE 12 HA ILE 12 9.606 19.166 -18.670 93 HB ILE 12 HB ILE 12 10.331 20.441 -16.015 94 1HG1 ILE 12 1HG1 ILE 12 8.776 17.883 -16.651 95 2HG1 ILE 12 2HG1 ILE 12 10.521 17.898 -16.412 96 1HG2 ILE 12 1HG2 ILE 12 7.879 20.415 -15.537 97 2HG2 ILE 12 2HG2 ILE 12 8.280 21.548 -16.818 98 3HG2 ILE 12 3HG2 ILE 12 7.579 19.970 -17.221 99 1HD1 ILE 12 1HD1 ILE 12 10.200 18.900 -14.155 100 2HD1 ILE 12 2HD1 ILE 12 8.446 18.642 -14.329 101 3HD1 ILE 12 3HD1 ILE 12 9.548 17.259 -14.344 102 H ARG 13 H ARG 13 11.660 22.022 -17.918 103 HA ARG 13 HA ARG 13 9.885 23.931 -19.093 104 1HB ARG 13 1HB ARG 13 11.967 24.236 -17.573 105 2HB ARG 13 2HB ARG 13 12.885 24.272 -19.086 106 1HG ARG 13 1HG ARG 13 10.692 26.145 -18.093 107 2HG ARG 13 2HG ARG 13 12.397 26.509 -18.338 108 1HD ARG 13 1HD ARG 13 12.040 26.108 -20.824 109 2HD ARG 13 2HD ARG 13 10.301 26.044 -20.505 110 HE ARG 13 HE ARG 13 12.007 28.368 -20.601 111 1HH1 ARG 13 1HH1 ARG 13 9.076 27.140 -19.035 112 2HH1 ARG 13 2HH1 ARG 13 8.265 28.679 -19.045 113 1HH2 ARG 13 1HH2 ARG 13 10.971 30.383 -20.577 114 2HH2 ARG 13 2HH2 ARG 13 9.386 30.569 -19.881 115 H GLU 14 H GLU 14 12.627 22.037 -20.515 116 HA GLU 14 HA GLU 14 12.490 23.081 -23.110 117 1HB GLU 14 1HB GLU 14 14.234 21.538 -22.096 118 2HB GLU 14 2HB GLU 14 13.110 20.189 -22.340 119 1HG GLU 14 1HG GLU 14 13.053 20.742 -24.781 120 2HG GLU 14 2HG GLU 14 14.225 22.038 -24.475 121 H ALA 15 H ALA 15 10.821 20.201 -21.748 122 HA ALA 15 HA ALA 15 9.260 19.522 -23.994 123 1HB ALA 15 1HB ALA 15 9.503 18.093 -22.003 124 2HB ALA 15 2HB ALA 15 8.558 19.246 -21.038 125 3HB ALA 15 3HB ALA 15 7.792 18.379 -22.385 126 H PHE 16 H PHE 16 8.445 21.686 -21.241 127 HA PHE 16 HA PHE 16 5.918 22.515 -22.034 128 1HB PHE 16 1HB PHE 16 6.919 23.139 -19.891 129 2HB PHE 16 2HB PHE 16 8.099 24.156 -20.687 130 HD1 PHE 16 HD1 PHE 16 7.596 26.419 -21.375 131 HD2 PHE 16 HD2 PHE 16 4.455 23.771 -20.076 132 HE1 PHE 16 HE1 PHE 16 5.982 28.308 -21.390 133 HE2 PHE 16 HE2 PHE 16 2.870 25.673 -20.023 134 HZ PHE 16 HZ PHE 16 3.646 27.951 -20.659 135 H ASP 17 H ASP 17 9.058 24.057 -22.866 136 HA ASP 17 HA ASP 17 8.058 26.101 -24.516 137 1HB ASP 17 1HB ASP 17 10.361 26.048 -23.695 138 2HB ASP 17 2HB ASP 17 10.715 24.619 -24.678 139 H LEU 18 H LEU 18 9.211 22.807 -25.470 140 HA LEU 18 HA LEU 18 8.676 23.121 -28.232 141 1HB LEU 18 1HB LEU 18 10.012 21.315 -27.345 142 2HB LEU 18 2HB LEU 18 8.622 20.584 -26.537 143 HG LEU 18 HG LEU 18 8.351 21.101 -29.498 144 1HD1 LEU 18 1HD1 LEU 18 10.100 18.877 -28.408 145 2HD1 LEU 18 2HD1 LEU 18 9.561 19.076 -30.095 146 3HD1 LEU 18 3HD1 LEU 18 10.643 20.278 -29.369 147 1HD2 LEU 18 1HD2 LEU 18 7.275 18.852 -29.435 148 2HD2 LEU 18 2HD2 LEU 18 7.642 18.726 -27.703 149 3HD2 LEU 18 3HD2 LEU 18 6.508 19.955 -28.298 150 H PHE 19 H PHE 19 6.559 21.722 -25.668 151 HA PHE 19 HA PHE 19 4.387 21.235 -27.452 152 1HB PHE 19 1HB PHE 19 4.407 21.702 -24.451 153 2HB PHE 19 2HB PHE 19 3.036 21.051 -25.353 154 HD1 PHE 19 HD1 PHE 19 4.716 19.876 -22.949 155 HD2 PHE 19 HD2 PHE 19 4.524 19.082 -27.189 156 HE1 PHE 19 HE1 PHE 19 5.183 17.476 -22.545 157 HE2 PHE 19 HE2 PHE 19 5.166 16.754 -26.790 158 HZ PHE 19 HZ PHE 19 5.510 15.926 -24.464 159 H ASP 20 H ASP 20 5.329 24.123 -25.662 160 HA ASP 20 HA ASP 20 2.911 25.628 -26.293 161 1HB ASP 20 1HB ASP 20 4.411 26.024 -24.297 162 2HB ASP 20 2HB ASP 20 5.700 26.509 -25.407 163 H THR 21 H THR 21 3.626 24.415 -28.628 164 HA THR 21 HA THR 21 5.693 25.450 -30.124 165 HB THR 21 HB THR 21 3.173 24.451 -31.454 166 HG1 THR 21 HG1 THR 21 4.793 22.944 -29.678 167 1HG2 THR 21 1HG2 THR 21 6.092 23.549 -31.608 168 2HG2 THR 21 2HG2 THR 21 4.750 22.981 -32.619 169 3HG2 THR 21 3HG2 THR 21 5.302 24.668 -32.751 170 H ASP 22 H ASP 22 2.293 26.472 -29.996 171 HA ASP 22 HA ASP 22 2.958 28.942 -31.594 172 1HB ASP 22 1HB ASP 22 0.347 27.384 -31.417 173 2HB ASP 22 2HB ASP 22 0.586 28.912 -32.276 174 H GLY 23 H GLY 23 1.542 27.604 -28.649 175 1HA GLY 23 1HA GLY 23 -0.125 29.656 -27.828 176 2HA GLY 23 2HA GLY 23 0.760 28.573 -26.755 177 H SER 24 H SER 24 3.395 29.574 -27.736 178 HA SER 24 HA SER 24 4.986 31.081 -27.139 179 1HB SER 24 1HB SER 24 2.784 32.870 -28.191 180 2HB SER 24 2HB SER 24 4.514 33.283 -28.085 181 HG SER 24 HG SER 24 3.183 31.381 -29.722 182 H GLY 25 H GLY 25 4.113 30.401 -24.848 183 1HA GLY 25 1HA GLY 25 4.686 32.040 -22.866 184 2HA GLY 25 2HA GLY 25 3.082 32.693 -23.252 185 H THR 26 H THR 26 1.598 30.475 -23.906 186 HA THR 26 HA THR 26 1.663 28.708 -21.516 187 HB THR 26 HB THR 26 -0.608 29.250 -20.956 188 HG1 THR 26 HG1 THR 26 -1.719 30.795 -21.976 189 1HG2 THR 26 1HG2 THR 26 1.275 30.547 -19.862 190 2HG2 THR 26 2HG2 THR 26 0.951 31.857 -21.014 191 3HG2 THR 26 3HG2 THR 26 -0.306 31.354 -19.873 192 H ILE 27 H ILE 27 0.845 26.704 -21.866 193 HA ILE 27 HA ILE 27 0.594 25.888 -24.655 194 HB ILE 27 HB ILE 27 0.414 24.411 -22.018 195 1HG1 ILE 27 1HG1 ILE 27 2.521 24.468 -24.220 196 2HG1 ILE 27 2HG1 ILE 27 2.636 25.349 -22.692 197 1HG2 ILE 27 1HG2 ILE 27 -0.944 23.252 -23.828 198 2HG2 ILE 27 2HG2 ILE 27 0.545 23.176 -24.795 199 3HG2 ILE 27 3HG2 ILE 27 0.415 22.326 -23.252 200 1HD1 ILE 27 1HD1 ILE 27 2.579 22.329 -23.046 201 2HD1 ILE 27 2HD1 ILE 27 3.919 23.345 -22.526 202 3HD1 ILE 27 3HD1 ILE 27 2.495 23.159 -21.473 203 H ASP 28 H ASP 28 -1.354 26.269 -25.710 204 HA ASP 28 HA ASP 28 -3.891 26.561 -24.393 205 1HB ASP 28 1HB ASP 28 -3.395 27.414 -26.660 206 2HB ASP 28 2HB ASP 28 -3.295 25.750 -27.259 207 H ALA 29 H ALA 29 -5.534 25.048 -23.964 208 HA ALA 29 HA ALA 29 -5.200 22.458 -23.315 209 1HB ALA 29 1HB ALA 29 -7.313 23.669 -23.082 210 2HB ALA 29 2HB ALA 29 -7.572 23.623 -24.838 211 3HB ALA 29 3HB ALA 29 -7.602 22.119 -23.897 212 H LYS 30 H LYS 30 -5.826 23.511 -26.696 213 HA LYS 30 HA LYS 30 -5.888 20.926 -27.892 214 1HB LYS 30 1HB LYS 30 -5.048 23.622 -29.034 215 2HB LYS 30 2HB LYS 30 -5.371 22.166 -29.986 216 1HG LYS 30 1HG LYS 30 -7.701 22.116 -29.235 217 2HG LYS 30 2HG LYS 30 -7.434 23.510 -28.173 218 1HD LYS 30 1HD LYS 30 -6.832 24.907 -30.130 219 2HD LYS 30 2HD LYS 30 -7.131 23.526 -31.208 220 1HE LYS 30 1HE LYS 30 -9.501 23.451 -30.439 221 2HE LYS 30 2HE LYS 30 -9.193 24.825 -29.358 222 1HZ LYS 30 1HZ LYS 30 -10.193 25.510 -31.398 223 2HZ LYS 30 2HZ LYS 30 -8.677 26.142 -31.279 224 3HZ LYS 30 3HZ LYS 30 -8.963 24.867 -32.285 225 H GLU 31 H GLU 31 -3.159 23.147 -27.176 226 HA GLU 31 HA GLU 31 -1.166 21.582 -28.589 227 1HB GLU 31 1HB GLU 31 -0.956 23.722 -26.442 228 2HB GLU 31 2HB GLU 31 0.423 22.925 -27.204 229 1HG GLU 31 1HG GLU 31 -0.185 23.776 -29.390 230 2HG GLU 31 2HG GLU 31 -1.682 24.485 -28.757 231 H LEU 32 H LEU 32 -2.455 21.711 -25.225 232 HA LEU 32 HA LEU 32 -0.553 19.783 -24.264 233 1HB LEU 32 1HB LEU 32 -2.147 21.333 -22.867 234 2HB LEU 32 2HB LEU 32 -3.304 20.010 -23.069 235 HG LEU 32 HG LEU 32 -1.348 18.475 -22.203 236 1HD1 LEU 32 1HD1 LEU 32 -0.346 21.164 -21.195 237 2HD1 LEU 32 2HD1 LEU 32 0.224 19.568 -20.667 238 3HD1 LEU 32 3HD1 LEU 32 0.508 20.085 -22.325 239 1HD2 LEU 32 1HD2 LEU 32 -3.361 18.876 -20.913 240 2HD2 LEU 32 2HD2 LEU 32 -1.954 18.978 -19.842 241 3HD2 LEU 32 3HD2 LEU 32 -2.757 20.464 -20.387 242 H LYS 33 H LYS 33 -3.821 19.438 -25.707 243 HA LYS 33 HA LYS 33 -3.965 16.585 -25.571 244 1HB LYS 33 1HB LYS 33 -5.832 17.936 -26.034 245 2HB LYS 33 2HB LYS 33 -5.173 18.546 -27.542 246 1HG LYS 33 1HG LYS 33 -5.741 15.598 -26.985 247 2HG LYS 33 2HG LYS 33 -6.951 16.701 -27.631 248 1HD LYS 33 1HD LYS 33 -4.416 15.749 -29.028 249 2HD LYS 33 2HD LYS 33 -6.086 15.427 -29.443 250 1HE LYS 33 1HE LYS 33 -4.670 18.119 -29.664 251 2HE LYS 33 2HE LYS 33 -5.180 17.065 -30.980 252 1HZ LYS 33 1HZ LYS 33 -6.710 18.842 -30.647 253 2HZ LYS 33 2HZ LYS 33 -7.449 17.410 -30.302 254 3HZ LYS 33 3HZ LYS 33 -6.967 18.408 -29.079 255 H VAL 34 H VAL 34 -2.544 18.683 -28.148 256 HA VAL 34 HA VAL 34 -1.518 16.584 -29.756 257 HB VAL 34 HB VAL 34 -0.540 19.409 -29.231 258 1HG1 VAL 34 1HG1 VAL 34 1.475 18.192 -29.881 259 2HG1 VAL 34 2HG1 VAL 34 0.606 17.428 -31.233 260 3HG1 VAL 34 3HG1 VAL 34 0.911 19.179 -31.228 261 1HG2 VAL 34 1HG2 VAL 34 -1.440 19.806 -31.478 262 2HG2 VAL 34 2HG2 VAL 34 -1.863 18.088 -31.639 263 3HG2 VAL 34 3HG2 VAL 34 -2.697 19.102 -30.450 264 H ALA 35 H ALA 35 0.039 18.245 -26.977 265 HA ALA 35 HA ALA 35 2.437 16.828 -26.924 266 1HB ALA 35 1HB ALA 35 1.931 18.799 -25.511 267 2HB ALA 35 2HB ALA 35 0.840 17.822 -24.516 268 3HB ALA 35 3HB ALA 35 2.550 17.436 -24.550 269 H MET 36 H MET 36 -0.579 16.029 -25.134 270 HA MET 36 HA MET 36 0.306 13.542 -24.077 271 1HB MET 36 1HB MET 36 -2.400 14.750 -24.620 272 2HB MET 36 2HB MET 36 -2.236 13.122 -23.953 273 1HG MET 36 1HG MET 36 -0.827 13.914 -22.129 274 2HG MET 36 2HG MET 36 -0.935 15.576 -22.718 275 1HE MET 36 1HE MET 36 -3.954 15.937 -23.465 276 2HE MET 36 2HE MET 36 -4.564 16.574 -21.919 277 3HE MET 36 3HE MET 36 -2.961 17.052 -22.525 278 H ARG 37 H ARG 37 -1.264 14.295 -27.201 279 HA ARG 37 HA ARG 37 -1.514 11.639 -28.069 280 1HB ARG 37 1HB ARG 37 -2.191 13.990 -29.170 281 2HB ARG 37 2HB ARG 37 -0.726 13.720 -30.116 282 1HG ARG 37 1HG ARG 37 -3.049 11.773 -29.773 283 2HG ARG 37 2HG ARG 37 -2.893 12.888 -31.121 284 1HD ARG 37 1HD ARG 37 -1.387 11.623 -32.229 285 2HD ARG 37 2HD ARG 37 -0.498 11.130 -30.809 286 HE ARG 37 HE ARG 37 -2.761 9.779 -32.053 287 1HH1 ARG 37 1HH1 ARG 37 -0.648 9.872 -29.155 288 2HH1 ARG 37 2HH1 ARG 37 -1.672 8.748 -28.290 289 1HH2 ARG 37 1HH2 ARG 37 -3.743 7.979 -31.022 290 2HH2 ARG 37 2HH2 ARG 37 -3.155 7.425 -29.474 291 H ALA 38 H ALA 38 1.220 13.931 -28.538 292 HA ALA 38 HA ALA 38 2.991 12.129 -29.826 293 1HB ALA 38 1HB ALA 38 3.670 14.501 -28.037 294 2HB ALA 38 2HB ALA 38 4.746 13.718 -29.208 295 3HB ALA 38 3HB ALA 38 3.299 14.577 -29.772 296 H LEU 39 H LEU 39 2.468 12.789 -26.360 297 HA LEU 39 HA LEU 39 4.499 10.997 -25.381 298 1HB LEU 39 1HB LEU 39 1.978 12.113 -24.124 299 2HB LEU 39 2HB LEU 39 3.180 11.199 -23.227 300 HG LEU 39 HG LEU 39 3.949 13.745 -24.704 301 1HD1 LEU 39 1HD1 LEU 39 2.869 13.475 -21.862 302 2HD1 LEU 39 2HD1 LEU 39 3.670 14.919 -22.517 303 3HD1 LEU 39 3HD1 LEU 39 2.126 14.395 -23.182 304 1HD2 LEU 39 1HD2 LEU 39 5.761 13.770 -23.033 305 2HD2 LEU 39 2HD2 LEU 39 5.138 12.273 -22.314 306 3HD2 LEU 39 3HD2 LEU 39 5.789 12.268 -23.967 307 H GLY 40 H GLY 40 1.675 10.192 -27.105 308 1HA GLY 40 1HA GLY 40 0.985 8.086 -27.637 309 2HA GLY 40 2HA GLY 40 2.059 7.390 -26.418 310 H PHE 41 H PHE 41 -0.228 9.946 -25.541 311 HA PHE 41 HA PHE 41 -1.801 8.130 -23.822 312 1HB PHE 41 1HB PHE 41 -2.079 11.041 -24.640 313 2HB PHE 41 2HB PHE 41 -3.261 10.230 -23.663 314 HD1 PHE 41 HD1 PHE 41 0.537 10.187 -23.348 315 HD2 PHE 41 HD2 PHE 41 -3.266 11.275 -21.596 316 HE1 PHE 41 HE1 PHE 41 1.678 10.897 -21.288 317 HE2 PHE 41 HE2 PHE 41 -2.098 12.001 -19.548 318 HZ PHE 41 HZ PHE 41 0.377 11.821 -19.386 319 H GLU 42 H GLU 42 -4.274 8.261 -24.182 320 HA GLU 42 HA GLU 42 -5.049 8.337 -27.081 321 1HB GLU 42 1HB GLU 42 -6.105 6.576 -24.836 322 2HB GLU 42 2HB GLU 42 -6.832 6.742 -26.439 323 1HG GLU 42 1HG GLU 42 -4.008 5.709 -25.878 324 2HG GLU 42 2HG GLU 42 -5.413 4.722 -26.296 325 HA PRO 43 HA PRO 43 -6.751 11.956 -24.980 326 1HB PRO 43 1HB PRO 43 -7.602 12.401 -27.859 327 2HB PRO 43 2HB PRO 43 -7.119 13.622 -26.646 328 1HG PRO 43 1HG PRO 43 -5.296 12.719 -28.421 329 2HG PRO 43 2HG PRO 43 -4.838 12.813 -26.693 330 1HD PRO 43 1HD PRO 43 -5.739 10.377 -28.280 331 2HD PRO 43 2HD PRO 43 -4.397 10.545 -27.108 332 H LYS 44 H LYS 44 -8.255 10.229 -23.985 333 HA LYS 44 HA LYS 44 -11.007 10.153 -24.868 334 1HB LYS 44 1HB LYS 44 -9.731 9.783 -22.123 335 2HB LYS 44 2HB LYS 44 -11.455 9.576 -22.490 336 1HG LYS 44 1HG LYS 44 -10.884 7.814 -24.159 337 2HG LYS 44 2HG LYS 44 -9.172 8.022 -23.786 338 1HD LYS 44 1HD LYS 44 -10.083 6.072 -22.613 339 2HD LYS 44 2HD LYS 44 -9.509 7.294 -21.478 340 1HE LYS 44 1HE LYS 44 -11.655 6.237 -20.782 341 2HE LYS 44 2HE LYS 44 -11.796 7.984 -20.957 342 1HZ LYS 44 1HZ LYS 44 -12.799 7.652 -23.087 343 2HZ LYS 44 2HZ LYS 44 -12.642 6.013 -22.962 344 3HZ LYS 44 3HZ LYS 44 -13.633 6.834 -21.930 345 H LYS 45 H LYS 45 -11.380 12.254 -25.496 346 HA LYS 45 HA LYS 45 -11.120 14.677 -24.647 347 1HB LYS 45 1HB LYS 45 -13.961 13.734 -25.151 348 2HB LYS 45 2HB LYS 45 -13.270 15.325 -25.480 349 1HG LYS 45 1HG LYS 45 -12.694 12.702 -26.917 350 2HG LYS 45 2HG LYS 45 -13.542 14.107 -27.545 351 1HD LYS 45 1HD LYS 45 -11.499 15.476 -27.443 352 2HD LYS 45 2HD LYS 45 -10.577 14.121 -26.773 353 1HE LYS 45 1HE LYS 45 -11.896 14.142 -29.519 354 2HE LYS 45 2HE LYS 45 -10.174 14.375 -29.174 355 1HZ LYS 45 1HZ LYS 45 -10.527 12.147 -29.763 356 2HZ LYS 45 2HZ LYS 45 -10.193 12.174 -28.142 357 3HZ LYS 45 3HZ LYS 45 -11.737 11.950 -28.665 358 H GLU 46 H GLU 46 -13.530 12.645 -22.996 359 HA GLU 46 HA GLU 46 -14.445 14.503 -21.100 360 1HB GLU 46 1HB GLU 46 -14.086 11.634 -20.210 361 2HB GLU 46 2HB GLU 46 -15.409 12.760 -19.961 362 1HG GLU 46 1HG GLU 46 -16.323 11.201 -21.410 363 2HG GLU 46 2HG GLU 46 -15.841 12.466 -22.542 364 H GLU 47 H GLU 47 -11.765 12.156 -20.790 365 HA GLU 47 HA GLU 47 -11.091 12.933 -18.069 366 1HB GLU 47 1HB GLU 47 -9.579 11.248 -20.112 367 2HB GLU 47 2HB GLU 47 -9.182 11.417 -18.395 368 1HG GLU 47 1HG GLU 47 -11.427 10.485 -17.797 369 2HG GLU 47 2HG GLU 47 -11.765 10.223 -19.517 370 H ILE 48 H ILE 48 -9.832 13.520 -21.342 371 HA ILE 48 HA ILE 48 -7.554 15.090 -20.704 372 HB ILE 48 HB ILE 48 -9.519 15.136 -23.018 373 1HG1 ILE 48 1HG1 ILE 48 -8.081 13.070 -22.643 374 2HG1 ILE 48 2HG1 ILE 48 -7.998 13.841 -24.226 375 1HG2 ILE 48 1HG2 ILE 48 -7.752 16.362 -24.313 376 2HG2 ILE 48 2HG2 ILE 48 -8.578 17.319 -23.084 377 3HG2 ILE 48 3HG2 ILE 48 -6.941 16.705 -22.767 378 1HD1 ILE 48 1HD1 ILE 48 -5.766 13.104 -23.273 379 2HD1 ILE 48 2HD1 ILE 48 -5.854 14.799 -23.764 380 3HD1 ILE 48 3HD1 ILE 48 -5.933 14.357 -22.043 381 H LYS 49 H LYS 49 -10.939 16.227 -21.359 382 HA LYS 49 HA LYS 49 -10.449 18.913 -20.793 383 1HB LYS 49 1HB LYS 49 -12.455 17.937 -21.939 384 2HB LYS 49 2HB LYS 49 -13.042 17.361 -20.365 385 1HG LYS 49 1HG LYS 49 -12.975 19.738 -19.550 386 2HG LYS 49 2HG LYS 49 -12.454 20.236 -21.175 387 1HD LYS 49 1HD LYS 49 -14.574 19.264 -22.108 388 2HD LYS 49 2HD LYS 49 -15.100 18.873 -20.462 389 1HE LYS 49 1HE LYS 49 -14.508 21.672 -21.552 390 2HE LYS 49 2HE LYS 49 -16.114 20.984 -21.264 391 1HZ LYS 49 1HZ LYS 49 -14.084 21.521 -19.210 392 2HZ LYS 49 2HZ LYS 49 -15.456 22.387 -19.479 393 3HZ LYS 49 3HZ LYS 49 -15.558 20.835 -18.936 394 H LYS 50 H LYS 50 -11.690 16.313 -18.597 395 HA LYS 50 HA LYS 50 -11.986 17.917 -16.291 396 1HB LYS 50 1HB LYS 50 -11.259 14.986 -16.625 397 2HB LYS 50 2HB LYS 50 -11.575 15.728 -15.048 398 1HG LYS 50 1HG LYS 50 -13.829 16.310 -15.647 399 2HG LYS 50 2HG LYS 50 -13.577 15.867 -17.339 400 1HD LYS 50 1HD LYS 50 -13.178 13.501 -16.664 401 2HD LYS 50 2HD LYS 50 -13.482 13.944 -14.970 402 1HE LYS 50 1HE LYS 50 -15.785 14.683 -15.595 403 2HE LYS 50 2HE LYS 50 -15.466 14.232 -17.282 404 1HZ LYS 50 1HZ LYS 50 -15.455 12.397 -14.989 405 2HZ LYS 50 2HZ LYS 50 -16.648 12.532 -16.116 406 3HZ LYS 50 3HZ LYS 50 -15.161 11.978 -16.556 407 H MET 51 H MET 51 -9.103 15.919 -17.199 408 HA MET 51 HA MET 51 -7.479 16.719 -15.090 409 1HB MET 51 1HB MET 51 -7.161 14.816 -16.634 410 2HB MET 51 2HB MET 51 -6.688 15.914 -17.932 411 1HG MET 51 1HG MET 51 -5.315 15.796 -15.222 412 2HG MET 51 2HG MET 51 -4.862 14.724 -16.545 413 1HE MET 51 1HE MET 51 -3.166 17.028 -19.122 414 2HE MET 51 2HE MET 51 -3.609 15.370 -18.664 415 3HE MET 51 3HE MET 51 -4.872 16.532 -19.156 416 H ILE 52 H ILE 52 -7.628 18.115 -18.423 417 HA ILE 52 HA ILE 52 -5.790 20.210 -18.047 418 HB ILE 52 HB ILE 52 -8.262 19.918 -19.785 419 1HG1 ILE 52 1HG1 ILE 52 -5.272 20.063 -20.388 420 2HG1 ILE 52 2HG1 ILE 52 -6.161 18.551 -20.186 421 1HG2 ILE 52 1HG2 ILE 52 -8.016 22.361 -19.378 422 2HG2 ILE 52 2HG2 ILE 52 -6.314 22.256 -19.880 423 3HG2 ILE 52 3HG2 ILE 52 -7.625 21.932 -21.029 424 1HD1 ILE 52 1HD1 ILE 52 -6.501 20.594 -22.406 425 2HD1 ILE 52 2HD1 ILE 52 -5.947 18.925 -22.530 426 3HD1 ILE 52 3HD1 ILE 52 -7.645 19.264 -22.116 427 H SER 53 H SER 53 -9.318 20.199 -17.318 428 HA SER 53 HA SER 53 -9.394 22.900 -16.432 429 1HB SER 53 1HB SER 53 -11.156 20.582 -15.518 430 2HB SER 53 2HB SER 53 -11.512 22.313 -15.379 431 HG SER 53 HG SER 53 -11.156 20.823 -17.778 432 H GLU 54 H GLU 54 -8.850 19.860 -14.590 433 HA GLU 54 HA GLU 54 -8.642 21.054 -12.014 434 1HB GLU 54 1HB GLU 54 -7.369 18.551 -13.190 435 2HB GLU 54 2HB GLU 54 -7.273 18.995 -11.480 436 1HG GLU 54 1HG GLU 54 -9.666 18.860 -11.205 437 2HG GLU 54 2HG GLU 54 -9.935 18.670 -12.938 438 H ILE 55 H ILE 55 -6.125 20.475 -14.520 439 HA ILE 55 HA ILE 55 -4.002 21.605 -12.879 440 HB ILE 55 HB ILE 55 -4.186 21.064 -15.862 441 1HG1 ILE 55 1HG1 ILE 55 -4.368 18.982 -14.652 442 2HG1 ILE 55 2HG1 ILE 55 -2.771 19.108 -15.363 443 1HG2 ILE 55 1HG2 ILE 55 -2.452 22.706 -15.509 444 2HG2 ILE 55 2HG2 ILE 55 -1.755 21.777 -14.173 445 3HG2 ILE 55 3HG2 ILE 55 -1.702 21.154 -15.841 446 1HD1 ILE 55 1HD1 ILE 55 -3.538 19.439 -12.432 447 2HD1 ILE 55 2HD1 ILE 55 -2.574 18.157 -13.172 448 3HD1 ILE 55 3HD1 ILE 55 -1.910 19.795 -13.053 449 H ASP 56 H ASP 56 -6.292 22.956 -15.233 450 HA ASP 56 HA ASP 56 -4.930 25.479 -15.496 451 1HB ASP 56 1HB ASP 56 -6.423 24.538 -17.227 452 2HB ASP 56 2HB ASP 56 -7.798 24.688 -16.119 453 H LYS 57 H LYS 57 -4.634 25.659 -13.091 454 HA LYS 57 HA LYS 57 -6.744 26.460 -11.344 455 1HB LYS 57 1HB LYS 57 -3.861 27.456 -11.378 456 2HB LYS 57 2HB LYS 57 -4.984 27.525 -10.017 457 1HG LYS 57 1HG LYS 57 -3.783 25.014 -11.266 458 2HG LYS 57 2HG LYS 57 -3.391 25.735 -9.706 459 1HD LYS 57 1HD LYS 57 -5.797 25.352 -8.994 460 2HD LYS 57 2HD LYS 57 -6.043 24.436 -10.496 461 1HE LYS 57 1HE LYS 57 -3.977 23.766 -8.346 462 2HE LYS 57 2HE LYS 57 -5.543 22.965 -8.569 463 1HZ LYS 57 1HZ LYS 57 -3.383 23.017 -10.555 464 2HZ LYS 57 2HZ LYS 57 -3.798 21.737 -9.599 465 3HZ LYS 57 3HZ LYS 57 -4.857 22.297 -10.734 466 H ASP 58 H ASP 58 -4.754 28.333 -13.605 467 HA ASP 58 HA ASP 58 -6.604 30.678 -13.352 468 1HB ASP 58 1HB ASP 58 -4.758 30.945 -11.737 469 2HB ASP 58 2HB ASP 58 -3.576 30.744 -13.042 470 H GLY 59 H GLY 59 -4.293 28.868 -15.329 471 1HA GLY 59 1HA GLY 59 -3.673 30.755 -17.270 472 2HA GLY 59 2HA GLY 59 -3.664 29.014 -17.490 473 H SER 60 H SER 60 -6.777 29.271 -16.882 474 HA SER 60 HA SER 60 -8.738 29.498 -18.007 475 1HB SER 60 1HB SER 60 -7.407 32.074 -18.937 476 2HB SER 60 2HB SER 60 -9.145 31.731 -18.950 477 HG SER 60 HG SER 60 -7.454 31.810 -16.651 478 H GLY 61 H GLY 61 -7.963 27.597 -19.339 479 1HA GLY 61 1HA GLY 61 -8.439 26.648 -21.433 480 2HA GLY 61 2HA GLY 61 -8.343 28.227 -22.221 481 H THR 62 H THR 62 -5.712 28.787 -20.730 482 HA THR 62 HA THR 62 -3.949 26.941 -22.248 483 HB THR 62 HB THR 62 -2.295 28.606 -22.344 484 HG1 THR 62 HG1 THR 62 -4.000 30.173 -20.684 485 1HG2 THR 62 1HG2 THR 62 -4.915 30.015 -23.036 486 2HG2 THR 62 2HG2 THR 62 -3.308 30.348 -23.703 487 3HG2 THR 62 3HG2 THR 62 -4.107 28.810 -24.059 488 H ILE 63 H ILE 63 -1.946 26.402 -21.167 489 HA ILE 63 HA ILE 63 -2.161 26.203 -18.200 490 HB ILE 63 HB ILE 63 -0.895 24.298 -20.197 491 1HG1 ILE 63 1HG1 ILE 63 -3.321 24.172 -20.427 492 2HG1 ILE 63 2HG1 ILE 63 -2.651 22.719 -19.704 493 1HG2 ILE 63 1HG2 ILE 63 -1.272 24.062 -17.194 494 2HG2 ILE 63 2HG2 ILE 63 -0.676 22.775 -18.262 495 3HG2 ILE 63 3HG2 ILE 63 0.259 24.263 -18.057 496 1HD1 ILE 63 1HD1 ILE 63 -4.052 24.935 -18.139 497 2HD1 ILE 63 2HD1 ILE 63 -4.754 23.390 -18.629 498 3HD1 ILE 63 3HD1 ILE 63 -3.428 23.411 -17.471 499 H ASP 64 H ASP 64 -0.728 27.525 -17.296 500 HA ASP 64 HA ASP 64 1.554 28.656 -18.699 501 1HB ASP 64 1HB ASP 64 0.322 29.983 -17.052 502 2HB ASP 64 2HB ASP 64 0.604 28.762 -15.800 503 H PHE 65 H PHE 65 3.780 28.487 -17.910 504 HA PHE 65 HA PHE 65 4.793 25.916 -17.740 505 1HB PHE 65 1HB PHE 65 6.187 27.803 -18.294 506 2HB PHE 65 2HB PHE 65 5.959 28.506 -16.690 507 HD1 PHE 65 HD1 PHE 65 7.869 28.337 -15.318 508 HD2 PHE 65 HD2 PHE 65 6.974 25.100 -18.034 509 HE1 PHE 65 HE1 PHE 65 9.747 27.026 -14.392 510 HE2 PHE 65 HE2 PHE 65 8.804 23.778 -17.048 511 HZ PHE 65 HZ PHE 65 10.211 24.733 -15.239 512 H GLU 66 H GLU 66 3.898 28.029 -14.939 513 HA GLU 66 HA GLU 66 4.893 26.216 -12.963 514 1HB GLU 66 1HB GLU 66 2.644 28.272 -12.796 515 2HB GLU 66 2HB GLU 66 3.390 27.440 -11.422 516 1HG GLU 66 1HG GLU 66 5.605 28.389 -12.037 517 2HG GLU 66 2HG GLU 66 4.858 29.278 -13.373 518 H GLU 67 H GLU 67 1.680 26.519 -14.505 519 HA GLU 67 HA GLU 67 0.380 24.498 -12.930 520 1HB GLU 67 1HB GLU 67 -0.224 25.587 -15.704 521 2HB GLU 67 2HB GLU 67 -1.303 24.544 -14.765 522 1HG GLU 67 1HG GLU 67 -1.561 26.198 -13.025 523 2HG GLU 67 2HG GLU 67 -0.362 27.266 -13.769 524 H PHE 68 H PHE 68 2.038 24.445 -16.113 525 HA PHE 68 HA PHE 68 1.656 21.682 -16.677 526 1HB PHE 68 1HB PHE 68 2.405 23.335 -18.340 527 2HB PHE 68 2HB PHE 68 3.912 23.563 -17.465 528 HD1 PHE 68 HD1 PHE 68 5.791 22.156 -17.937 529 HD2 PHE 68 HD2 PHE 68 1.851 20.957 -19.224 530 HE1 PHE 68 HE1 PHE 68 6.784 20.391 -19.378 531 HE2 PHE 68 HE2 PHE 68 2.851 19.094 -20.527 532 HZ PHE 68 HZ PHE 68 5.324 18.800 -20.575 533 H LEU 69 H LEU 69 4.364 23.385 -15.044 534 HA LEU 69 HA LEU 69 5.953 21.147 -14.464 535 1HB LEU 69 1HB LEU 69 6.754 23.430 -14.245 536 2HB LEU 69 2HB LEU 69 5.564 23.773 -12.985 537 HG LEU 69 HG LEU 69 6.679 22.213 -11.442 538 1HD1 LEU 69 1HD1 LEU 69 7.655 20.578 -12.992 539 2HD1 LEU 69 2HD1 LEU 69 8.694 21.837 -13.706 540 3HD1 LEU 69 3HD1 LEU 69 8.935 21.317 -12.027 541 1HD2 LEU 69 1HD2 LEU 69 7.327 24.593 -11.514 542 2HD2 LEU 69 2HD2 LEU 69 8.705 23.563 -11.091 543 3HD2 LEU 69 3HD2 LEU 69 8.567 24.227 -12.733 544 H THR 70 H THR 70 3.258 22.615 -12.593 545 HA THR 70 HA THR 70 3.354 20.816 -10.406 546 HB THR 70 HB THR 70 0.865 22.129 -11.580 547 HG1 THR 70 HG1 THR 70 2.529 23.634 -11.111 548 1HG2 THR 70 1HG2 THR 70 0.358 20.405 -9.872 549 2HG2 THR 70 2HG2 THR 70 1.529 21.160 -8.768 550 3HG2 THR 70 3HG2 THR 70 0.066 22.039 -9.250 551 H MET 71 H MET 71 1.454 20.578 -13.480 552 HA MET 71 HA MET 71 0.279 18.071 -12.978 553 1HB MET 71 1HB MET 71 -0.343 19.573 -14.797 554 2HB MET 71 2HB MET 71 1.165 19.265 -15.644 555 1HG MET 71 1HG MET 71 -0.756 17.029 -14.905 556 2HG MET 71 2HG MET 71 -0.972 17.982 -16.372 557 1HE MET 71 1HE MET 71 0.412 17.864 -18.506 558 2HE MET 71 2HE MET 71 1.862 18.414 -17.630 559 3HE MET 71 3HE MET 71 1.939 16.968 -18.658 560 H MET 72 H MET 72 3.382 18.776 -14.637 561 HA MET 72 HA MET 72 4.111 16.070 -15.066 562 1HB MET 72 1HB MET 72 5.764 18.611 -14.809 563 2HB MET 72 2HB MET 72 6.454 17.063 -15.301 564 1HG MET 72 1HG MET 72 4.137 18.437 -16.729 565 2HG MET 72 2HG MET 72 5.813 18.571 -17.222 566 1HE MET 72 1HE MET 72 7.085 15.764 -17.135 567 2HE MET 72 2HE MET 72 6.624 15.105 -18.718 568 3HE MET 72 3HE MET 72 7.128 16.806 -18.577 569 H THR 73 H THR 73 4.758 18.210 -12.269 570 HA THR 73 HA THR 73 6.359 16.344 -10.804 571 HB THR 73 HB THR 73 4.443 18.444 -9.695 572 HG1 THR 73 HG1 THR 73 5.981 19.326 -11.120 573 1HG2 THR 73 1HG2 THR 73 6.925 17.126 -8.508 574 2HG2 THR 73 2HG2 THR 73 6.006 18.458 -7.780 575 3HG2 THR 73 3HG2 THR 73 5.252 16.864 -7.961 576 H ALA 74 H ALA 74 2.811 16.845 -11.008 577 HA ALA 74 HA ALA 74 2.190 14.551 -9.309 578 1HB ALA 74 1HB ALA 74 0.735 16.532 -9.409 579 2HB ALA 74 2HB ALA 74 0.429 16.233 -11.132 580 3HB ALA 74 3HB ALA 74 -0.122 15.063 -9.915 581 H LYS 75 H LYS 75 3.873 13.450 -10.884 582 HA LYS 75 HA LYS 75 4.218 11.552 -12.018 583 1HB LYS 75 1HB LYS 75 1.238 11.297 -12.533 584 2HB LYS 75 2HB LYS 75 2.484 10.071 -12.743 585 1HG LYS 75 1HG LYS 75 3.008 10.195 -10.305 586 2HG LYS 75 2HG LYS 75 1.682 11.361 -10.097 587 1HD LYS 75 1HD LYS 75 0.085 9.693 -11.045 588 2HD LYS 75 2HD LYS 75 1.390 8.502 -11.131 589 1HE LYS 75 1HE LYS 75 0.346 9.849 -8.588 590 2HE LYS 75 2HE LYS 75 -0.025 8.200 -9.114 591 1HZ LYS 75 1HZ LYS 75 1.702 8.212 -7.497 592 2HZ LYS 75 2HZ LYS 75 2.306 7.684 -8.938 593 3HZ LYS 75 3HZ LYS 75 2.639 9.210 -8.410 594 H MET 76 H MET 76 5.443 12.600 -13.536 595 HA MET 76 HA MET 76 4.738 13.899 -15.858 596 1HB MET 76 1HB MET 76 6.954 11.827 -15.541 597 2HB MET 76 2HB MET 76 6.848 13.057 -16.810 598 1HG MET 76 1HG MET 76 6.854 14.803 -14.969 599 2HG MET 76 2HG MET 76 7.296 13.524 -13.838 600 1HE MET 76 1HE MET 76 9.562 12.099 -14.082 601 2HE MET 76 2HE MET 76 9.302 11.790 -15.819 602 3HE MET 76 3HE MET 76 10.837 12.487 -15.265 Start of MODEL 16 1 H ARG 1 H ARG 1 14.842 14.342 -0.812 2 HA ARG 1 HA ARG 1 16.693 14.333 -3.053 3 1HB ARG 1 1HB ARG 1 15.826 12.116 -2.840 4 2HB ARG 1 2HB ARG 1 14.199 12.710 -2.480 5 1HG ARG 1 1HG ARG 1 14.300 11.772 -4.723 6 2HG ARG 1 2HG ARG 1 13.878 13.473 -4.747 7 1HD ARG 1 1HD ARG 1 16.439 13.875 -5.243 8 2HD ARG 1 2HD ARG 1 16.494 12.129 -5.536 9 HE ARG 1 HE ARG 1 14.348 13.098 -7.037 10 1HH1 ARG 1 1HH1 ARG 1 17.861 13.436 -6.981 11 2HH1 ARG 1 2HH1 ARG 1 17.966 14.024 -8.619 12 1HH2 ARG 1 1HH2 ARG 1 14.450 14.028 -9.114 13 2HH2 ARG 1 2HH2 ARG 1 15.964 14.342 -9.885 14 H VAL 2 H VAL 2 16.388 16.047 -4.368 15 HA VAL 2 HA VAL 2 14.370 17.996 -3.891 16 HB VAL 2 HB VAL 2 15.278 19.112 -5.876 17 1HG1 VAL 2 1HG1 VAL 2 16.411 19.323 -3.681 18 2HG1 VAL 2 2HG1 VAL 2 17.482 17.969 -4.103 19 3HG1 VAL 2 3HG1 VAL 2 17.535 19.471 -5.042 20 1HG2 VAL 2 1HG2 VAL 2 15.723 17.177 -7.346 21 2HG2 VAL 2 2HG2 VAL 2 17.164 18.175 -7.119 22 3HG2 VAL 2 3HG2 VAL 2 17.022 16.632 -6.265 23 H GLY 3 H GLY 3 14.331 15.150 -5.926 24 1HA GLY 3 1HA GLY 3 12.475 14.224 -6.979 25 2HA GLY 3 2HA GLY 3 11.528 15.678 -6.644 26 H LEU 4 H LEU 4 12.607 17.709 -7.789 27 HA LEU 4 HA LEU 4 13.171 17.071 -10.674 28 1HB LEU 4 1HB LEU 4 11.753 19.467 -9.490 29 2HB LEU 4 2HB LEU 4 12.166 19.212 -11.192 30 HG LEU 4 HG LEU 4 10.198 17.567 -9.538 31 1HD1 LEU 4 1HD1 LEU 4 9.411 19.798 -10.228 32 2HD1 LEU 4 2HD1 LEU 4 9.874 19.450 -11.910 33 3HD1 LEU 4 3HD1 LEU 4 8.567 18.528 -11.136 34 1HD2 LEU 4 1HD2 LEU 4 9.646 16.502 -11.763 35 2HD2 LEU 4 2HD2 LEU 4 11.128 17.222 -12.426 36 3HD2 LEU 4 3HD2 LEU 4 11.212 16.022 -11.113 37 H THR 5 H THR 5 15.448 17.098 -10.615 38 HA THR 5 HA THR 5 16.962 19.189 -9.316 39 HB THR 5 HB THR 5 18.772 18.456 -10.880 40 HG1 THR 5 HG1 THR 5 17.036 16.477 -11.835 41 1HG2 THR 5 1HG2 THR 5 17.282 16.191 -9.489 42 2HG2 THR 5 2HG2 THR 5 18.935 16.093 -10.133 43 3HG2 THR 5 3HG2 THR 5 18.561 17.217 -8.816 44 H GLU 6 H GLU 6 18.167 20.900 -10.468 45 HA GLU 6 HA GLU 6 16.722 22.554 -12.213 46 1HB GLU 6 1HB GLU 6 19.703 22.238 -11.693 47 2HB GLU 6 2HB GLU 6 19.048 23.446 -12.800 48 1HG GLU 6 1HG GLU 6 19.435 24.429 -10.594 49 2HG GLU 6 2HG GLU 6 17.732 24.490 -11.054 50 H GLU 7 H GLU 7 18.771 19.736 -12.996 51 HA GLU 7 HA GLU 7 18.827 20.246 -15.840 52 1HB GLU 7 1HB GLU 7 19.085 17.637 -14.256 53 2HB GLU 7 2HB GLU 7 19.447 17.835 -15.977 54 1HG GLU 7 1HG GLU 7 21.220 19.466 -15.457 55 2HG GLU 7 2HG GLU 7 20.868 19.347 -13.725 56 H GLN 8 H GLN 8 16.730 18.172 -13.758 57 HA GLN 8 HA GLN 8 14.963 17.367 -15.846 58 1HB GLN 8 1HB GLN 8 14.493 17.795 -12.885 59 2HB GLN 8 2HB GLN 8 13.296 17.082 -13.974 60 1HG GLN 8 1HG GLN 8 14.635 15.167 -14.425 61 2HG GLN 8 2HG GLN 8 16.105 15.928 -13.813 62 1HE2 GLN 8 1HE2 GLN 8 12.863 14.796 -12.750 63 2HE2 GLN 8 2HE2 GLN 8 13.319 14.580 -11.065 64 H LYS 9 H LYS 9 14.854 20.280 -13.709 65 HA LYS 9 HA LYS 9 12.460 21.303 -14.863 66 1HB LYS 9 1HB LYS 9 14.714 22.725 -13.435 67 2HB LYS 9 2HB LYS 9 13.185 23.490 -13.913 68 1HG LYS 9 1HG LYS 9 11.910 21.759 -12.657 69 2HG LYS 9 2HG LYS 9 13.420 21.047 -12.089 70 1HD LYS 9 1HD LYS 9 12.476 23.887 -11.479 71 2HD LYS 9 2HD LYS 9 12.317 22.479 -10.412 72 1HE LYS 9 1HE LYS 9 14.827 22.200 -10.502 73 2HE LYS 9 2HE LYS 9 14.907 23.765 -11.350 74 1HZ LYS 9 1HZ LYS 9 13.802 23.315 -8.673 75 2HZ LYS 9 2HZ LYS 9 15.274 23.970 -9.018 76 3HZ LYS 9 3HZ LYS 9 13.894 24.770 -9.448 77 H GLN 10 H GLN 10 15.883 21.757 -15.921 78 HA GLN 10 HA GLN 10 15.264 23.518 -18.089 79 1HB GLN 10 1HB GLN 10 17.480 21.479 -17.718 80 2HB GLN 10 2HB GLN 10 17.358 22.525 -19.136 81 1HG GLN 10 1HG GLN 10 17.593 24.520 -17.847 82 2HG GLN 10 2HG GLN 10 17.346 23.653 -16.324 83 1HE2 GLN 10 1HE2 GLN 10 18.927 22.351 -15.466 84 2HE2 GLN 10 2HE2 GLN 10 20.627 22.488 -15.953 85 H GLU 11 H GLU 11 15.353 19.917 -17.957 86 HA GLU 11 HA GLU 11 14.617 19.475 -20.671 87 1HB GLU 11 1HB GLU 11 14.016 17.810 -18.195 88 2HB GLU 11 2HB GLU 11 13.802 17.259 -19.855 89 1HG GLU 11 1HG GLU 11 16.138 17.311 -20.311 90 2HG GLU 11 2HG GLU 11 16.506 18.270 -18.881 91 H ILE 12 H ILE 12 12.562 19.851 -17.766 92 HA ILE 12 HA ILE 12 10.049 19.575 -19.068 93 HB ILE 12 HB ILE 12 10.865 20.968 -16.502 94 1HG1 ILE 12 1HG1 ILE 12 9.435 18.310 -16.999 95 2HG1 ILE 12 2HG1 ILE 12 11.162 18.423 -16.757 96 1HG2 ILE 12 1HG2 ILE 12 8.678 21.897 -17.341 97 2HG2 ILE 12 2HG2 ILE 12 8.042 20.241 -17.376 98 3HG2 ILE 12 3HG2 ILE 12 8.516 20.997 -15.845 99 1HD1 ILE 12 1HD1 ILE 12 10.790 19.444 -14.507 100 2HD1 ILE 12 2HD1 ILE 12 9.043 19.158 -14.704 101 3HD1 ILE 12 3HD1 ILE 12 10.165 17.793 -14.680 102 H ARG 13 H ARG 13 12.054 22.502 -18.435 103 HA ARG 13 HA ARG 13 10.306 24.391 -19.659 104 1HB ARG 13 1HB ARG 13 12.076 25.199 -18.349 105 2HB ARG 13 2HB ARG 13 13.288 24.279 -19.224 106 1HG ARG 13 1HG ARG 13 13.389 26.677 -19.701 107 2HG ARG 13 2HG ARG 13 13.194 25.684 -21.141 108 1HD ARG 13 1HD ARG 13 11.897 27.788 -21.157 109 2HD ARG 13 2HD ARG 13 10.874 26.371 -21.393 110 HE ARG 13 HE ARG 13 10.822 26.862 -18.646 111 1HH1 ARG 13 1HH1 ARG 13 9.928 28.543 -21.621 112 2HH1 ARG 13 2HH1 ARG 13 8.725 29.549 -20.863 113 1HH2 ARG 13 1HH2 ARG 13 9.190 28.100 -17.661 114 2HH2 ARG 13 2HH2 ARG 13 8.304 29.302 -18.561 115 H GLU 14 H GLU 14 13.000 22.463 -21.160 116 HA GLU 14 HA GLU 14 12.648 23.406 -23.756 117 1HB GLU 14 1HB GLU 14 14.496 21.945 -22.828 118 2HB GLU 14 2HB GLU 14 13.407 20.554 -22.967 119 1HG GLU 14 1HG GLU 14 13.193 21.000 -25.406 120 2HG GLU 14 2HG GLU 14 14.263 22.404 -25.223 121 H ALA 15 H ALA 15 11.129 20.510 -22.255 122 HA ALA 15 HA ALA 15 9.493 19.753 -24.427 123 1HB ALA 15 1HB ALA 15 9.866 18.350 -22.438 124 2HB ALA 15 2HB ALA 15 8.938 19.487 -21.438 125 3HB ALA 15 3HB ALA 15 8.131 18.584 -22.738 126 H PHE 16 H PHE 16 8.734 21.915 -21.670 127 HA PHE 16 HA PHE 16 6.109 22.570 -22.332 128 1HB PHE 16 1HB PHE 16 7.157 23.179 -20.201 129 2HB PHE 16 2HB PHE 16 8.243 24.294 -21.010 130 HD1 PHE 16 HD1 PHE 16 7.550 26.548 -21.562 131 HD2 PHE 16 HD2 PHE 16 4.677 23.656 -20.157 132 HE1 PHE 16 HE1 PHE 16 5.830 28.325 -21.408 133 HE2 PHE 16 HE2 PHE 16 2.969 25.436 -19.989 134 HZ PHE 16 HZ PHE 16 3.534 27.775 -20.624 135 H ASP 17 H ASP 17 9.119 24.245 -23.254 136 HA ASP 17 HA ASP 17 8.008 26.319 -24.800 137 1HB ASP 17 1HB ASP 17 10.335 26.271 -23.999 138 2HB ASP 17 2HB ASP 17 10.703 24.917 -25.075 139 H LEU 18 H LEU 18 9.251 23.087 -25.862 140 HA LEU 18 HA LEU 18 8.616 23.440 -28.602 141 1HB LEU 18 1HB LEU 18 10.045 21.666 -27.803 142 2HB LEU 18 2HB LEU 18 8.715 20.872 -26.956 143 HG LEU 18 HG LEU 18 8.329 21.429 -29.899 144 1HD1 LEU 18 1HD1 LEU 18 9.563 19.437 -30.559 145 2HD1 LEU 18 2HD1 LEU 18 10.641 20.652 -29.847 146 3HD1 LEU 18 3HD1 LEU 18 10.152 19.227 -28.890 147 1HD2 LEU 18 1HD2 LEU 18 6.543 20.221 -28.676 148 2HD2 LEU 18 2HD2 LEU 18 7.312 19.146 -29.835 149 3HD2 LEU 18 3HD2 LEU 18 7.720 19.017 -28.114 150 H PHE 19 H PHE 19 6.646 21.917 -25.985 151 HA PHE 19 HA PHE 19 4.421 21.387 -27.672 152 1HB PHE 19 1HB PHE 19 4.523 21.938 -24.683 153 2HB PHE 19 2HB PHE 19 3.117 21.289 -25.529 154 HD1 PHE 19 HD1 PHE 19 4.760 19.293 -27.375 155 HD2 PHE 19 HD2 PHE 19 4.571 20.080 -23.135 156 HE1 PHE 19 HE1 PHE 19 5.315 16.957 -26.927 157 HE2 PHE 19 HE2 PHE 19 5.005 17.675 -22.694 158 HZ PHE 19 HZ PHE 19 5.478 16.127 -24.582 159 H ASP 20 H ASP 20 5.274 24.312 -25.831 160 HA ASP 20 HA ASP 20 2.898 25.768 -26.715 161 1HB ASP 20 1HB ASP 20 4.025 26.359 -24.619 162 2HB ASP 20 2HB ASP 20 5.526 26.688 -25.502 163 H THR 21 H THR 21 3.600 24.621 -28.959 164 HA THR 21 HA THR 21 5.694 25.689 -30.476 165 HB THR 21 HB THR 21 3.131 24.758 -31.765 166 HG1 THR 21 HG1 THR 21 4.772 23.203 -30.047 167 1HG2 THR 21 1HG2 THR 21 5.230 25.031 -33.109 168 2HG2 THR 21 2HG2 THR 21 6.042 23.855 -32.043 169 3HG2 THR 21 3HG2 THR 21 4.674 23.339 -33.048 170 H ASP 22 H ASP 22 2.479 26.914 -29.751 171 HA ASP 22 HA ASP 22 2.536 29.061 -31.744 172 1HB ASP 22 1HB ASP 22 0.726 28.591 -29.336 173 2HB ASP 22 2HB ASP 22 0.469 29.796 -30.602 174 H GLY 23 H GLY 23 4.530 28.706 -29.155 175 1HA GLY 23 1HA GLY 23 5.722 30.130 -27.858 176 2HA GLY 23 2HA GLY 23 5.560 31.237 -29.231 177 H SER 24 H SER 24 2.979 30.087 -27.078 178 HA SER 24 HA SER 24 2.112 32.881 -26.646 179 1HB SER 24 1HB SER 24 0.781 30.187 -26.129 180 2HB SER 24 2HB SER 24 0.022 31.775 -25.972 181 HG SER 24 HG SER 24 1.318 31.234 -28.412 182 H GLY 25 H GLY 25 4.153 30.890 -24.976 183 1HA GLY 25 1HA GLY 25 4.948 30.875 -22.829 184 2HA GLY 25 2HA GLY 25 3.940 32.283 -22.450 185 H THR 26 H THR 26 2.276 29.574 -23.846 186 HA THR 26 HA THR 26 1.239 28.430 -21.334 187 HB THR 26 HB THR 26 -1.054 29.018 -22.348 188 HG1 THR 26 HG1 THR 26 0.391 31.238 -23.360 189 1HG2 THR 26 1HG2 THR 26 -1.250 31.079 -21.049 190 2HG2 THR 26 2HG2 THR 26 -0.265 29.902 -20.162 191 3HG2 THR 26 3HG2 THR 26 0.511 31.264 -20.998 192 H ILE 27 H ILE 27 0.704 26.288 -21.820 193 HA ILE 27 HA ILE 27 0.774 25.436 -24.681 194 HB ILE 27 HB ILE 27 0.439 23.827 -22.158 195 1HG1 ILE 27 1HG1 ILE 27 2.773 24.025 -24.124 196 2HG1 ILE 27 2HG1 ILE 27 2.720 24.862 -22.572 197 1HG2 ILE 27 1HG2 ILE 27 0.813 22.950 -25.058 198 2HG2 ILE 27 2HG2 ILE 27 0.623 21.881 -23.666 199 3HG2 ILE 27 3HG2 ILE 27 -0.728 22.869 -24.176 200 1HD1 ILE 27 1HD1 ILE 27 2.662 21.850 -22.967 201 2HD1 ILE 27 2HD1 ILE 27 3.960 22.835 -22.299 202 3HD1 ILE 27 3HD1 ILE 27 2.434 22.682 -21.407 203 H ASP 28 H ASP 28 -1.143 26.123 -25.666 204 HA ASP 28 HA ASP 28 -3.671 26.355 -24.307 205 1HB ASP 28 1HB ASP 28 -3.185 27.532 -26.411 206 2HB ASP 28 2HB ASP 28 -3.008 25.989 -27.260 207 H ALA 29 H ALA 29 -5.432 24.906 -24.257 208 HA ALA 29 HA ALA 29 -5.238 22.257 -23.828 209 1HB ALA 29 1HB ALA 29 -7.316 23.538 -23.608 210 2HB ALA 29 2HB ALA 29 -7.466 23.654 -25.375 211 3HB ALA 29 3HB ALA 29 -7.608 22.075 -24.573 212 H LYS 30 H LYS 30 -5.621 23.629 -27.141 213 HA LYS 30 HA LYS 30 -5.713 21.137 -28.536 214 1HB LYS 30 1HB LYS 30 -4.683 23.867 -29.400 215 2HB LYS 30 2HB LYS 30 -4.991 22.505 -30.490 216 1HG LYS 30 1HG LYS 30 -7.368 22.465 -29.804 217 2HG LYS 30 2HG LYS 30 -7.119 23.867 -28.759 218 1HD LYS 30 1HD LYS 30 -6.663 23.833 -31.781 219 2HD LYS 30 2HD LYS 30 -8.124 24.415 -30.971 220 1HE LYS 30 1HE LYS 30 -6.753 26.123 -29.748 221 2HE LYS 30 2HE LYS 30 -5.326 25.607 -30.667 222 1HZ LYS 30 1HZ LYS 30 -7.790 26.696 -31.820 223 2HZ LYS 30 2HZ LYS 30 -6.359 27.494 -31.646 224 3HZ LYS 30 3HZ LYS 30 -6.463 26.207 -32.668 225 H GLU 31 H GLU 31 -2.962 23.226 -27.575 226 HA GLU 31 HA GLU 31 -0.936 21.673 -28.931 227 1HB GLU 31 1HB GLU 31 -0.769 23.658 -26.630 228 2HB GLU 31 2HB GLU 31 0.600 22.941 -27.479 229 1HG GLU 31 1HG GLU 31 -0.077 23.990 -29.581 230 2HG GLU 31 2HG GLU 31 -1.536 24.655 -28.829 231 H LEU 32 H LEU 32 -2.378 21.704 -25.648 232 HA LEU 32 HA LEU 32 -0.611 19.726 -24.583 233 1HB LEU 32 1HB LEU 32 -2.382 21.284 -23.362 234 2HB LEU 32 2HB LEU 32 -3.475 19.927 -23.667 235 HG LEU 32 HG LEU 32 -1.661 18.438 -22.538 236 1HD1 LEU 32 1HD1 LEU 32 -0.645 21.168 -21.667 237 2HD1 LEU 32 2HD1 LEU 32 -0.244 19.635 -20.871 238 3HD1 LEU 32 3HD1 LEU 32 0.265 19.903 -22.532 239 1HD2 LEU 32 1HD2 LEU 32 -3.202 20.565 -21.006 240 2HD2 LEU 32 2HD2 LEU 32 -3.770 18.945 -21.458 241 3HD2 LEU 32 3HD2 LEU 32 -2.473 19.127 -20.263 242 H LYS 33 H LYS 33 -3.760 19.473 -26.296 243 HA LYS 33 HA LYS 33 -3.958 16.637 -26.184 244 1HB LYS 33 1HB LYS 33 -5.774 18.113 -26.780 245 2HB LYS 33 2HB LYS 33 -4.983 18.528 -28.318 246 1HG LYS 33 1HG LYS 33 -5.043 16.060 -28.916 247 2HG LYS 33 2HG LYS 33 -6.001 15.781 -27.462 248 1HD LYS 33 1HD LYS 33 -6.708 17.557 -29.854 249 2HD LYS 33 2HD LYS 33 -7.404 15.977 -29.497 250 1HE LYS 33 1HE LYS 33 -7.759 18.539 -27.864 251 2HE LYS 33 2HE LYS 33 -8.968 17.743 -28.872 252 1HZ LYS 33 1HZ LYS 33 -9.275 17.225 -26.581 253 2HZ LYS 33 2HZ LYS 33 -8.871 15.854 -27.402 254 3HZ LYS 33 3HZ LYS 33 -7.753 16.609 -26.455 255 H VAL 34 H VAL 34 -2.397 18.753 -28.666 256 HA VAL 34 HA VAL 34 -1.333 16.691 -30.292 257 HB VAL 34 HB VAL 34 -0.301 19.463 -29.596 258 1HG1 VAL 34 1HG1 VAL 34 1.247 19.271 -31.519 259 2HG1 VAL 34 2HG1 VAL 34 1.708 18.211 -30.189 260 3HG1 VAL 34 3HG1 VAL 34 0.891 17.532 -31.618 261 1HG2 VAL 34 1HG2 VAL 34 -1.510 18.305 -32.141 262 2HG2 VAL 34 2HG2 VAL 34 -2.398 19.271 -30.948 263 3HG2 VAL 34 3HG2 VAL 34 -1.063 19.999 -31.853 264 H ALA 35 H ALA 35 0.157 18.222 -27.395 265 HA ALA 35 HA ALA 35 2.476 16.667 -27.269 266 1HB ALA 35 1HB ALA 35 2.524 17.232 -24.881 267 2HB ALA 35 2HB ALA 35 2.056 18.642 -25.856 268 3HB ALA 35 3HB ALA 35 0.842 17.746 -24.928 269 H MET 36 H MET 36 -0.683 15.993 -25.679 270 HA MET 36 HA MET 36 0.066 13.480 -24.573 271 1HB MET 36 1HB MET 36 -2.586 14.767 -25.204 272 2HB MET 36 2HB MET 36 -2.466 13.170 -24.455 273 1HG MET 36 1HG MET 36 -1.019 14.064 -22.668 274 2HG MET 36 2HG MET 36 -1.166 15.685 -23.333 275 1HE MET 36 1HE MET 36 -4.791 16.669 -22.569 276 2HE MET 36 2HE MET 36 -3.222 17.100 -23.274 277 3HE MET 36 3HE MET 36 -4.242 15.907 -24.085 278 H ARG 37 H ARG 37 -1.330 14.263 -27.766 279 HA ARG 37 HA ARG 37 -1.602 11.574 -28.639 280 1HB ARG 37 1HB ARG 37 -2.289 13.871 -29.753 281 2HB ARG 37 2HB ARG 37 -0.709 13.764 -30.532 282 1HG ARG 37 1HG ARG 37 -3.027 11.782 -30.674 283 2HG ARG 37 2HG ARG 37 -2.457 12.861 -31.949 284 1HD ARG 37 1HD ARG 37 -0.209 11.548 -31.835 285 2HD ARG 37 2HD ARG 37 -1.074 10.398 -30.812 286 HE ARG 37 HE ARG 37 -2.204 9.564 -32.582 287 1HH1 ARG 37 1HH1 ARG 37 -0.744 12.624 -33.546 288 2HH1 ARG 37 2HH1 ARG 37 -1.058 12.415 -35.249 289 1HH2 ARG 37 1HH2 ARG 37 -2.661 9.276 -34.793 290 2HH2 ARG 37 2HH2 ARG 37 -2.195 10.476 -35.967 291 H ALA 38 H ALA 38 1.183 13.865 -28.909 292 HA ALA 38 HA ALA 38 3.002 12.036 -30.093 293 1HB ALA 38 1HB ALA 38 3.649 14.367 -28.243 294 2HB ALA 38 2HB ALA 38 4.748 13.568 -29.380 295 3HB ALA 38 3HB ALA 38 3.354 14.480 -29.992 296 H LEU 39 H LEU 39 2.218 12.614 -26.666 297 HA LEU 39 HA LEU 39 4.142 10.734 -25.601 298 1HB LEU 39 1HB LEU 39 1.597 11.913 -24.448 299 2HB LEU 39 2HB LEU 39 2.737 10.960 -23.523 300 HG LEU 39 HG LEU 39 3.646 13.505 -24.916 301 1HD1 LEU 39 1HD1 LEU 39 2.399 13.224 -22.146 302 2HD1 LEU 39 2HD1 LEU 39 3.310 14.642 -22.708 303 3HD1 LEU 39 3HD1 LEU 39 1.788 14.217 -23.481 304 1HD2 LEU 39 1HD2 LEU 39 5.379 13.452 -23.176 305 2HD2 LEU 39 2HD2 LEU 39 4.675 11.972 -22.493 306 3HD2 LEU 39 3HD2 LEU 39 5.398 11.954 -24.115 307 H GLY 40 H GLY 40 1.454 10.084 -27.537 308 1HA GLY 40 1HA GLY 40 0.542 8.095 -28.116 309 2HA GLY 40 2HA GLY 40 1.610 7.270 -26.969 310 H PHE 41 H PHE 41 -0.599 9.896 -26.026 311 HA PHE 41 HA PHE 41 -2.112 8.079 -24.238 312 1HB PHE 41 1HB PHE 41 -2.266 11.034 -24.880 313 2HB PHE 41 2HB PHE 41 -3.402 10.239 -23.825 314 HD1 PHE 41 HD1 PHE 41 0.129 9.116 -23.468 315 HD2 PHE 41 HD2 PHE 41 -2.870 11.934 -22.129 316 HE1 PHE 41 HE1 PHE 41 1.536 9.712 -21.559 317 HE2 PHE 41 HE2 PHE 41 -1.438 12.513 -20.197 318 HZ PHE 41 HZ PHE 41 0.778 11.418 -19.913 319 H GLU 42 H GLU 42 -4.518 8.225 -24.319 320 HA GLU 42 HA GLU 42 -5.657 8.431 -27.081 321 1HB GLU 42 1HB GLU 42 -6.683 6.927 -24.645 322 2HB GLU 42 2HB GLU 42 -7.462 7.062 -26.223 323 1HG GLU 42 1HG GLU 42 -6.400 4.948 -26.228 324 2HG GLU 42 2HG GLU 42 -5.417 5.985 -27.268 325 HA PRO 43 HA PRO 43 -7.132 12.232 -25.004 326 1HB PRO 43 1HB PRO 43 -8.075 12.567 -27.869 327 2HB PRO 43 2HB PRO 43 -7.514 13.826 -26.727 328 1HG PRO 43 1HG PRO 43 -5.798 12.815 -28.554 329 2HG PRO 43 2HG PRO 43 -5.254 12.971 -26.856 330 1HD PRO 43 1HD PRO 43 -6.235 10.480 -28.278 331 2HD PRO 43 2HD PRO 43 -4.854 10.710 -27.154 332 H LYS 44 H LYS 44 -8.618 10.534 -23.902 333 HA LYS 44 HA LYS 44 -11.376 10.344 -24.740 334 1HB LYS 44 1HB LYS 44 -9.933 10.067 -22.083 335 2HB LYS 44 2HB LYS 44 -11.695 10.136 -22.159 336 1HG LYS 44 1HG LYS 44 -11.085 7.879 -22.071 337 2HG LYS 44 2HG LYS 44 -11.786 8.206 -23.658 338 1HD LYS 44 1HD LYS 44 -9.524 8.256 -24.663 339 2HD LYS 44 2HD LYS 44 -8.791 7.992 -23.070 340 1HE LYS 44 1HE LYS 44 -10.711 6.062 -24.467 341 2HE LYS 44 2HE LYS 44 -8.949 5.909 -24.457 342 1HZ LYS 44 1HZ LYS 44 -10.673 5.830 -22.088 343 2HZ LYS 44 2HZ LYS 44 -9.912 4.551 -22.792 344 3HZ LYS 44 3HZ LYS 44 -9.028 5.741 -22.075 345 H LYS 45 H LYS 45 -11.645 12.445 -25.572 346 HA LYS 45 HA LYS 45 -11.364 14.875 -24.903 347 1HB LYS 45 1HB LYS 45 -14.219 13.995 -25.467 348 2HB LYS 45 2HB LYS 45 -13.488 15.558 -25.835 349 1HG LYS 45 1HG LYS 45 -12.834 12.875 -27.135 350 2HG LYS 45 2HG LYS 45 -13.706 14.228 -27.840 351 1HD LYS 45 1HD LYS 45 -11.672 15.647 -27.710 352 2HD LYS 45 2HD LYS 45 -10.765 14.281 -27.019 353 1HE LYS 45 1HE LYS 45 -11.207 12.929 -29.034 354 2HE LYS 45 2HE LYS 45 -12.113 14.276 -29.753 355 1HZ LYS 45 1HZ LYS 45 -10.106 15.573 -29.674 356 2HZ LYS 45 2HZ LYS 45 -9.271 14.308 -29.020 357 3HZ LYS 45 3HZ LYS 45 -9.883 14.193 -30.545 358 H GLU 46 H GLU 46 -14.112 13.261 -23.199 359 HA GLU 46 HA GLU 46 -14.725 15.485 -21.541 360 1HB GLU 46 1HB GLU 46 -15.139 12.506 -21.022 361 2HB GLU 46 2HB GLU 46 -15.894 13.829 -20.121 362 1HG GLU 46 1HG GLU 46 -16.983 14.640 -22.202 363 2HG GLU 46 2HG GLU 46 -16.277 13.293 -23.107 364 H GLU 47 H GLU 47 -12.515 12.727 -21.004 365 HA GLU 47 HA GLU 47 -11.885 13.381 -18.249 366 1HB GLU 47 1HB GLU 47 -10.375 11.688 -20.288 367 2HB GLU 47 2HB GLU 47 -10.070 11.755 -18.551 368 1HG GLU 47 1HG GLU 47 -12.281 10.814 -18.066 369 2HG GLU 47 2HG GLU 47 -12.718 10.844 -19.781 370 H ILE 48 H ILE 48 -10.438 13.963 -21.452 371 HA ILE 48 HA ILE 48 -8.107 15.367 -20.622 372 HB ILE 48 HB ILE 48 -9.819 15.565 -23.125 373 1HG1 ILE 48 1HG1 ILE 48 -8.649 13.364 -22.613 374 2HG1 ILE 48 2HG1 ILE 48 -8.328 14.118 -24.173 375 1HG2 ILE 48 1HG2 ILE 48 -7.161 16.886 -22.546 376 2HG2 ILE 48 2HG2 ILE 48 -7.782 16.604 -24.189 377 3HG2 ILE 48 3HG2 ILE 48 -8.679 17.639 -23.075 378 1HD1 ILE 48 1HD1 ILE 48 -6.299 13.155 -23.022 379 2HD1 ILE 48 2HD1 ILE 48 -6.161 14.855 -23.482 380 3HD1 ILE 48 3HD1 ILE 48 -6.449 14.409 -21.785 381 H LYS 49 H LYS 49 -11.359 16.683 -21.494 382 HA LYS 49 HA LYS 49 -10.770 19.385 -20.887 383 1HB LYS 49 1HB LYS 49 -13.364 17.801 -20.781 384 2HB LYS 49 2HB LYS 49 -13.279 19.544 -20.478 385 1HG LYS 49 1HG LYS 49 -12.352 19.963 -22.687 386 2HG LYS 49 2HG LYS 49 -12.277 18.228 -23.033 387 1HD LYS 49 1HD LYS 49 -14.751 18.069 -22.842 388 2HD LYS 49 2HD LYS 49 -14.834 19.783 -22.406 389 1HE LYS 49 1HE LYS 49 -15.428 19.523 -24.749 390 2HE LYS 49 2HE LYS 49 -13.898 20.404 -24.627 391 1HZ LYS 49 1HZ LYS 49 -13.844 18.713 -26.311 392 2HZ LYS 49 2HZ LYS 49 -12.762 18.356 -25.120 393 3HZ LYS 49 3HZ LYS 49 -14.191 17.539 -25.208 394 H LYS 50 H LYS 50 -12.175 16.839 -18.738 395 HA LYS 50 HA LYS 50 -12.380 18.451 -16.425 396 1HB LYS 50 1HB LYS 50 -11.817 15.481 -16.756 397 2HB LYS 50 2HB LYS 50 -12.107 16.225 -15.184 398 1HG LYS 50 1HG LYS 50 -14.103 16.479 -17.472 399 2HG LYS 50 2HG LYS 50 -14.080 15.100 -16.367 400 1HD LYS 50 1HD LYS 50 -14.397 16.612 -14.425 401 2HD LYS 50 2HD LYS 50 -14.376 18.018 -15.499 402 1HE LYS 50 1HE LYS 50 -16.672 17.479 -14.946 403 2HE LYS 50 2HE LYS 50 -16.399 17.183 -16.669 404 1HZ LYS 50 1HZ LYS 50 -17.635 15.430 -15.622 405 2HZ LYS 50 2HZ LYS 50 -16.192 14.856 -16.169 406 3HZ LYS 50 3HZ LYS 50 -16.411 15.134 -14.559 407 H MET 51 H MET 51 -9.612 16.320 -17.370 408 HA MET 51 HA MET 51 -7.938 16.984 -15.261 409 1HB MET 51 1HB MET 51 -7.702 15.133 -16.878 410 2HB MET 51 2HB MET 51 -7.199 16.261 -18.138 411 1HG MET 51 1HG MET 51 -5.811 15.978 -15.452 412 2HG MET 51 2HG MET 51 -5.399 14.963 -16.833 413 1HE MET 51 1HE MET 51 -3.657 17.364 -19.293 414 2HE MET 51 2HE MET 51 -4.112 15.688 -18.924 415 3HE MET 51 3HE MET 51 -5.365 16.885 -19.347 416 H ILE 52 H ILE 52 -8.041 18.513 -18.532 417 HA ILE 52 HA ILE 52 -6.100 20.502 -18.075 418 HB ILE 52 HB ILE 52 -8.576 20.444 -19.835 419 1HG1 ILE 52 1HG1 ILE 52 -5.586 20.329 -20.459 420 2HG1 ILE 52 2HG1 ILE 52 -6.602 18.900 -20.269 421 1HG2 ILE 52 1HG2 ILE 52 -7.679 22.445 -21.008 422 2HG2 ILE 52 2HG2 ILE 52 -8.131 22.829 -19.361 423 3HG2 ILE 52 3HG2 ILE 52 -6.418 22.603 -19.770 424 1HD1 ILE 52 1HD1 ILE 52 -6.388 19.305 -22.610 425 2HD1 ILE 52 2HD1 ILE 52 -8.051 19.741 -22.155 426 3HD1 ILE 52 3HD1 ILE 52 -6.834 21.004 -22.445 427 H SER 53 H SER 53 -9.629 20.594 -17.347 428 HA SER 53 HA SER 53 -9.596 23.254 -16.329 429 1HB SER 53 1HB SER 53 -11.426 20.967 -15.457 430 2HB SER 53 2HB SER 53 -11.722 22.704 -15.292 431 HG SER 53 HG SER 53 -11.471 21.230 -17.717 432 H GLU 54 H GLU 54 -9.144 20.115 -14.630 433 HA GLU 54 HA GLU 54 -8.868 21.181 -12.013 434 1HB GLU 54 1HB GLU 54 -7.670 18.700 -13.305 435 2HB GLU 54 2HB GLU 54 -7.546 19.071 -11.581 436 1HG GLU 54 1HG GLU 54 -9.936 18.983 -11.281 437 2HG GLU 54 2HG GLU 54 -10.230 18.873 -13.017 438 H ILE 55 H ILE 55 -6.398 20.717 -14.590 439 HA ILE 55 HA ILE 55 -4.261 21.706 -12.859 440 HB ILE 55 HB ILE 55 -4.346 21.260 -15.856 441 1HG1 ILE 55 1HG1 ILE 55 -4.751 19.153 -14.695 442 2HG1 ILE 55 2HG1 ILE 55 -3.157 19.180 -15.425 443 1HG2 ILE 55 1HG2 ILE 55 -2.521 22.741 -15.352 444 2HG2 ILE 55 2HG2 ILE 55 -1.993 21.751 -13.984 445 3HG2 ILE 55 3HG2 ILE 55 -1.846 21.137 -15.646 446 1HD1 ILE 55 1HD1 ILE 55 -2.161 19.618 -13.167 447 2HD1 ILE 55 2HD1 ILE 55 -3.795 19.534 -12.464 448 3HD1 ILE 55 3HD1 ILE 55 -3.093 18.116 -13.251 449 H ASP 56 H ASP 56 -6.439 23.219 -15.257 450 HA ASP 56 HA ASP 56 -4.758 25.587 -15.444 451 1HB ASP 56 1HB ASP 56 -5.948 24.667 -17.376 452 2HB ASP 56 2HB ASP 56 -7.501 25.031 -16.605 453 H LYS 57 H LYS 57 -4.696 26.543 -13.443 454 HA LYS 57 HA LYS 57 -6.876 27.106 -11.700 455 1HB LYS 57 1HB LYS 57 -4.275 28.626 -12.088 456 2HB LYS 57 2HB LYS 57 -5.325 28.717 -10.676 457 1HG LYS 57 1HG LYS 57 -3.760 26.237 -11.575 458 2HG LYS 57 2HG LYS 57 -3.342 27.357 -10.291 459 1HD LYS 57 1HD LYS 57 -4.333 25.811 -8.970 460 2HD LYS 57 2HD LYS 57 -5.770 26.753 -9.356 461 1HE LYS 57 1HE LYS 57 -6.254 24.378 -9.551 462 2HE LYS 57 2HE LYS 57 -6.303 25.046 -11.182 463 1HZ LYS 57 1HZ LYS 57 -5.139 22.990 -11.019 464 2HZ LYS 57 2HZ LYS 57 -4.157 24.180 -11.586 465 3HZ LYS 57 3HZ LYS 57 -3.998 23.652 -10.022 466 H ASP 58 H ASP 58 -6.151 28.617 -14.763 467 HA ASP 58 HA ASP 58 -7.802 31.007 -14.010 468 1HB ASP 58 1HB ASP 58 -6.807 32.175 -15.845 469 2HB ASP 58 2HB ASP 58 -5.534 31.582 -14.773 470 H GLY 59 H GLY 59 -8.114 27.983 -15.232 471 1HA GLY 59 1HA GLY 59 -9.524 26.897 -16.477 472 2HA GLY 59 2HA GLY 59 -10.646 28.239 -16.202 473 H SER 60 H SER 60 -8.082 29.526 -18.028 474 HA SER 60 HA SER 60 -9.911 29.697 -20.305 475 1HB SER 60 1HB SER 60 -7.232 31.057 -19.849 476 2HB SER 60 2HB SER 60 -8.486 31.501 -21.007 477 HG SER 60 HG SER 60 -8.915 31.426 -18.173 478 H GLY 61 H GLY 61 -9.150 27.177 -20.144 479 1HA GLY 61 1HA GLY 61 -8.054 25.380 -21.085 480 2HA GLY 61 2HA GLY 61 -8.471 26.246 -22.569 481 H THR 62 H THR 62 -5.962 27.002 -20.061 482 HA THR 62 HA THR 62 -3.811 26.420 -22.009 483 HB THR 62 HB THR 62 -2.812 28.684 -21.125 484 HG1 THR 62 HG1 THR 62 -5.596 29.251 -21.105 485 1HG2 THR 62 1HG2 THR 62 -3.173 28.354 -23.492 486 2HG2 THR 62 2HG2 THR 62 -4.927 28.608 -23.318 487 3HG2 THR 62 3HG2 THR 62 -3.792 29.941 -23.036 488 H ILE 63 H ILE 63 -2.049 25.556 -21.071 489 HA ILE 63 HA ILE 63 -1.944 25.426 -18.089 490 HB ILE 63 HB ILE 63 -0.360 23.810 -20.096 491 1HG1 ILE 63 1HG1 ILE 63 -2.625 23.218 -20.581 492 2HG1 ILE 63 2HG1 ILE 63 -1.875 21.934 -19.635 493 1HG2 ILE 63 1HG2 ILE 63 -0.023 22.299 -18.178 494 2HG2 ILE 63 2HG2 ILE 63 0.607 23.923 -17.875 495 3HG2 ILE 63 3HG2 ILE 63 -0.915 23.422 -17.132 496 1HD1 ILE 63 1HD1 ILE 63 -3.829 24.013 -18.563 497 2HD1 ILE 63 2HD1 ILE 63 -4.155 22.305 -18.885 498 3HD1 ILE 63 3HD1 ILE 63 -3.031 22.756 -17.595 499 H ASP 64 H ASP 64 -0.759 27.066 -17.269 500 HA ASP 64 HA ASP 64 1.457 28.356 -18.673 501 1HB ASP 64 1HB ASP 64 0.167 29.629 -17.050 502 2HB ASP 64 2HB ASP 64 0.484 28.432 -15.786 503 H PHE 65 H PHE 65 3.693 28.247 -17.930 504 HA PHE 65 HA PHE 65 4.819 25.725 -17.737 505 1HB PHE 65 1HB PHE 65 6.113 27.681 -18.321 506 2HB PHE 65 2HB PHE 65 5.865 28.386 -16.720 507 HD1 PHE 65 HD1 PHE 65 7.615 28.115 -15.135 508 HD2 PHE 65 HD2 PHE 65 7.121 25.171 -18.243 509 HE1 PHE 65 HE1 PHE 65 9.755 27.057 -14.473 510 HE2 PHE 65 HE2 PHE 65 9.280 24.128 -17.588 511 HZ PHE 65 HZ PHE 65 10.610 25.079 -15.722 512 H GLU 66 H GLU 66 4.007 27.893 -14.961 513 HA GLU 66 HA GLU 66 5.133 26.184 -12.972 514 1HB GLU 66 1HB GLU 66 2.829 28.177 -12.767 515 2HB GLU 66 2HB GLU 66 3.669 27.421 -11.406 516 1HG GLU 66 1HG GLU 66 5.822 28.408 -12.175 517 2HG GLU 66 2HG GLU 66 4.970 29.245 -13.483 518 H GLU 67 H GLU 67 1.914 26.284 -14.502 519 HA GLU 67 HA GLU 67 0.705 24.319 -12.774 520 1HB GLU 67 1HB GLU 67 -0.049 25.191 -15.589 521 2HB GLU 67 2HB GLU 67 -1.046 24.239 -14.482 522 1HG GLU 67 1HG GLU 67 -1.136 26.065 -12.871 523 2HG GLU 67 2HG GLU 67 -0.081 27.071 -13.873 524 H PHE 68 H PHE 68 2.277 24.188 -15.996 525 HA PHE 68 HA PHE 68 2.000 21.423 -16.516 526 1HB PHE 68 1HB PHE 68 2.773 23.166 -18.110 527 2HB PHE 68 2HB PHE 68 4.265 23.337 -17.215 528 HD1 PHE 68 HD1 PHE 68 6.153 22.062 -17.825 529 HD2 PHE 68 HD2 PHE 68 2.231 20.867 -19.173 530 HE1 PHE 68 HE1 PHE 68 7.180 20.629 -19.569 531 HE2 PHE 68 HE2 PHE 68 3.269 19.394 -20.872 532 HZ PHE 68 HZ PHE 68 5.759 19.295 -21.082 533 H LEU 69 H LEU 69 4.690 23.175 -14.900 534 HA LEU 69 HA LEU 69 6.207 20.905 -14.185 535 1HB LEU 69 1HB LEU 69 7.018 23.196 -14.202 536 2HB LEU 69 2HB LEU 69 6.008 23.630 -12.824 537 HG LEU 69 HG LEU 69 7.936 21.310 -12.544 538 1HD1 LEU 69 1HD1 LEU 69 9.752 22.882 -11.906 539 2HD1 LEU 69 2HD1 LEU 69 9.312 23.032 -13.615 540 3HD1 LEU 69 3HD1 LEU 69 8.749 24.246 -12.447 541 1HD2 LEU 69 1HD2 LEU 69 8.102 22.155 -10.233 542 2HD2 LEU 69 2HD2 LEU 69 7.097 23.559 -10.647 543 3HD2 LEU 69 3HD2 LEU 69 6.401 21.931 -10.648 544 H THR 70 H THR 70 3.631 22.641 -12.343 545 HA THR 70 HA THR 70 3.751 21.036 -10.026 546 HB THR 70 HB THR 70 1.329 22.445 -11.217 547 HG1 THR 70 HG1 THR 70 3.052 23.837 -10.792 548 1HG2 THR 70 1HG2 THR 70 1.899 21.465 -8.384 549 2HG2 THR 70 2HG2 THR 70 0.550 22.516 -8.858 550 3HG2 THR 70 3HG2 THR 70 0.624 20.855 -9.464 551 H MET 71 H MET 71 1.794 20.581 -13.014 552 HA MET 71 HA MET 71 0.369 18.290 -12.266 553 1HB MET 71 1HB MET 71 0.015 19.649 -14.324 554 2HB MET 71 2HB MET 71 1.517 19.003 -14.992 555 1HG MET 71 1HG MET 71 0.574 16.726 -14.965 556 2HG MET 71 2HG MET 71 -0.906 17.342 -14.225 557 1HE MET 71 1HE MET 71 1.360 17.279 -17.429 558 2HE MET 71 2HE MET 71 0.377 18.202 -18.590 559 3HE MET 71 3HE MET 71 1.154 19.039 -17.232 560 H MET 72 H MET 72 3.713 18.586 -13.565 561 HA MET 72 HA MET 72 4.134 15.704 -13.649 562 1HB MET 72 1HB MET 72 6.077 18.047 -13.698 563 2HB MET 72 2HB MET 72 6.532 16.342 -13.881 564 1HG MET 72 1HG MET 72 5.025 16.123 -15.816 565 2HG MET 72 2HG MET 72 4.556 17.823 -15.672 566 1HE MET 72 1HE MET 72 6.596 17.637 -18.991 567 2HE MET 72 2HE MET 72 5.584 16.339 -18.315 568 3HE MET 72 3HE MET 72 5.028 18.031 -18.237 569 H THR 73 H THR 73 5.154 18.274 -11.397 570 HA THR 73 HA THR 73 6.495 16.762 -9.499 571 HB THR 73 HB THR 73 4.662 19.117 -8.877 572 HG1 THR 73 HG1 THR 73 6.068 19.647 -10.571 573 1HG2 THR 73 1HG2 THR 73 6.361 19.605 -7.145 574 2HG2 THR 73 2HG2 THR 73 5.600 18.030 -6.859 575 3HG2 THR 73 3HG2 THR 73 7.229 18.115 -7.566 576 H ALA 74 H ALA 74 2.968 17.332 -9.713 577 HA ALA 74 HA ALA 74 2.157 16.073 -7.342 578 1HB ALA 74 1HB ALA 74 -0.027 15.851 -8.459 579 2HB ALA 74 2HB ALA 74 0.690 17.445 -8.771 580 3HB ALA 74 3HB ALA 74 0.726 16.190 -10.031 581 H LYS 75 H LYS 75 3.085 14.618 -10.466 582 HA LYS 75 HA LYS 75 2.245 11.912 -9.597 583 1HB LYS 75 1HB LYS 75 3.708 12.895 -12.075 584 2HB LYS 75 2HB LYS 75 3.200 11.228 -11.759 585 1HG LYS 75 1HG LYS 75 0.831 12.028 -11.552 586 2HG LYS 75 2HG LYS 75 1.342 13.640 -12.054 587 1HD LYS 75 1HD LYS 75 1.697 11.066 -13.675 588 2HD LYS 75 2HD LYS 75 0.383 12.222 -13.907 589 1HE LYS 75 1HE LYS 75 3.353 12.848 -14.303 590 2HE LYS 75 2HE LYS 75 2.183 12.505 -15.580 591 1HZ LYS 75 1HZ LYS 75 2.015 14.772 -13.716 592 2HZ LYS 75 2HZ LYS 75 2.491 14.834 -15.290 593 3HZ LYS 75 3HZ LYS 75 0.942 14.416 -14.914 594 H MET 76 H MET 76 5.159 13.887 -10.071 595 HA MET 76 HA MET 76 6.948 11.725 -9.141 596 1HB MET 76 1HB MET 76 7.531 14.565 -10.078 597 2HB MET 76 2HB MET 76 8.723 13.304 -9.714 598 1HG MET 76 1HG MET 76 7.744 11.892 -11.527 599 2HG MET 76 2HG MET 76 6.591 13.178 -11.889 600 1HE MET 76 1HE MET 76 10.306 12.032 -12.037 601 2HE MET 76 2HE MET 76 11.101 13.431 -12.791 602 3HE MET 76 3HE MET 76 10.520 13.543 -11.116 Start of MODEL 17 1 H ARG 1 H ARG 1 9.920 10.375 -4.757 2 HA ARG 1 HA ARG 1 10.013 10.745 -7.089 3 1HB ARG 1 1HB ARG 1 7.642 12.169 -5.786 4 2HB ARG 1 2HB ARG 1 7.747 11.621 -7.461 5 1HG ARG 1 1HG ARG 1 8.084 9.263 -6.562 6 2HG ARG 1 2HG ARG 1 7.673 9.902 -4.954 7 1HD ARG 1 1HD ARG 1 5.958 9.984 -7.474 8 2HD ARG 1 2HD ARG 1 5.685 8.974 -6.064 9 HE ARG 1 HE ARG 1 5.179 10.917 -4.728 10 1HH1 ARG 1 1HH1 ARG 1 5.298 11.686 -8.228 11 2HH1 ARG 1 2HH1 ARG 1 3.900 12.702 -8.167 12 1HH2 ARG 1 1HH2 ARG 1 3.540 12.490 -4.642 13 2HH2 ARG 1 2HH2 ARG 1 3.047 13.324 -6.094 14 H VAL 2 H VAL 2 9.097 13.760 -5.433 15 HA VAL 2 HA VAL 2 9.403 15.341 -7.799 16 HB VAL 2 HB VAL 2 8.644 17.168 -6.339 17 1HG1 VAL 2 1HG1 VAL 2 7.068 15.567 -7.411 18 2HG1 VAL 2 2HG1 VAL 2 7.062 14.572 -5.950 19 3HG1 VAL 2 3HG1 VAL 2 6.433 16.225 -5.892 20 1HG2 VAL 2 1HG2 VAL 2 8.013 16.789 -4.021 21 2HG2 VAL 2 2HG2 VAL 2 8.619 15.129 -4.055 22 3HG2 VAL 2 3HG2 VAL 2 9.746 16.493 -4.177 23 H GLY 3 H GLY 3 11.824 14.347 -7.695 24 1HA GLY 3 1HA GLY 3 13.769 16.034 -6.308 25 2HA GLY 3 2HA GLY 3 14.080 14.811 -7.550 26 H LEU 4 H LEU 4 12.421 17.995 -7.265 27 HA LEU 4 HA LEU 4 12.873 18.651 -10.058 28 1HB LEU 4 1HB LEU 4 12.106 20.486 -7.769 29 2HB LEU 4 2HB LEU 4 11.995 20.819 -9.504 30 HG LEU 4 HG LEU 4 10.350 18.837 -7.878 31 1HD1 LEU 4 1HD1 LEU 4 9.618 21.252 -9.583 32 2HD1 LEU 4 2HD1 LEU 4 8.516 20.299 -8.568 33 3HD1 LEU 4 3HD1 LEU 4 9.783 21.275 -7.812 34 1HD2 LEU 4 1HD2 LEU 4 10.776 17.731 -10.019 35 2HD2 LEU 4 2HD2 LEU 4 9.134 18.380 -10.025 36 3HD2 LEU 4 3HD2 LEU 4 10.416 19.234 -10.907 37 H THR 5 H THR 5 15.220 18.134 -9.964 38 HA THR 5 HA THR 5 17.049 20.107 -8.890 39 HB THR 5 HB THR 5 18.678 19.201 -10.438 40 HG1 THR 5 HG1 THR 5 17.132 17.364 -11.675 41 1HG2 THR 5 1HG2 THR 5 18.669 16.846 -9.856 42 2HG2 THR 5 2HG2 THR 5 18.105 17.791 -8.465 43 3HG2 THR 5 3HG2 THR 5 16.943 16.886 -9.459 44 H GLU 6 H GLU 6 18.290 21.655 -10.289 45 HA GLU 6 HA GLU 6 16.665 23.384 -11.857 46 1HB GLU 6 1HB GLU 6 19.706 22.958 -11.915 47 2HB GLU 6 2HB GLU 6 18.829 24.288 -12.663 48 1HG GLU 6 1HG GLU 6 19.678 25.166 -10.651 49 2HG GLU 6 2HG GLU 6 17.946 24.950 -10.390 50 H GLU 7 H GLU 7 18.554 20.479 -12.698 51 HA GLU 7 HA GLU 7 18.341 20.888 -15.548 52 1HB GLU 7 1HB GLU 7 19.038 18.490 -13.803 53 2HB GLU 7 2HB GLU 7 18.914 18.379 -15.561 54 1HG GLU 7 1HG GLU 7 21.253 18.763 -14.804 55 2HG GLU 7 2HG GLU 7 20.653 20.004 -15.910 56 H GLN 8 H GLN 8 16.403 18.949 -13.186 57 HA GLN 8 HA GLN 8 14.472 18.067 -15.111 58 1HB GLN 8 1HB GLN 8 14.473 18.489 -12.128 59 2HB GLN 8 2HB GLN 8 12.923 18.321 -12.947 60 1HG GLN 8 1HG GLN 8 13.743 16.162 -12.133 61 2HG GLN 8 2HG GLN 8 13.529 16.173 -13.887 62 1HE2 GLN 8 1HE2 GLN 8 15.471 16.062 -15.284 63 2HE2 GLN 8 2HE2 GLN 8 16.993 15.585 -14.569 64 H LYS 9 H LYS 9 14.584 21.117 -13.160 65 HA LYS 9 HA LYS 9 12.141 22.106 -14.214 66 1HB LYS 9 1HB LYS 9 14.589 23.549 -13.136 67 2HB LYS 9 2HB LYS 9 13.059 24.354 -13.535 68 1HG LYS 9 1HG LYS 9 11.836 23.070 -11.893 69 2HG LYS 9 2HG LYS 9 13.186 21.976 -11.627 70 1HD LYS 9 1HD LYS 9 13.001 23.519 -9.764 71 2HD LYS 9 2HD LYS 9 14.537 23.701 -10.603 72 1HE LYS 9 1HE LYS 9 13.580 25.885 -9.979 73 2HE LYS 9 2HE LYS 9 13.725 25.745 -11.733 74 1HZ LYS 9 1HZ LYS 9 11.392 25.212 -11.814 75 2HZ LYS 9 2HZ LYS 9 11.268 25.317 -10.173 76 3HZ LYS 9 3HZ LYS 9 11.623 26.659 -11.061 77 H GLN 10 H GLN 10 15.496 22.589 -15.432 78 HA GLN 10 HA GLN 10 14.884 24.139 -17.719 79 1HB GLN 10 1HB GLN 10 17.043 22.072 -17.171 80 2HB GLN 10 2HB GLN 10 16.966 22.969 -18.687 81 1HG GLN 10 1HG GLN 10 17.265 25.079 -17.611 82 2HG GLN 10 2HG GLN 10 17.015 24.372 -16.007 83 1HE2 GLN 10 1HE2 GLN 10 18.543 23.003 -15.122 84 2HE2 GLN 10 2HE2 GLN 10 20.249 23.043 -15.568 85 H GLU 11 H GLU 11 15.212 20.549 -17.552 86 HA GLU 11 HA GLU 11 14.449 19.908 -20.153 87 1HB GLU 11 1HB GLU 11 13.920 18.495 -17.521 88 2HB GLU 11 2HB GLU 11 13.620 17.737 -19.086 89 1HG GLU 11 1HG GLU 11 15.895 17.638 -19.657 90 2HG GLU 11 2HG GLU 11 16.360 18.909 -18.530 91 H ILE 12 H ILE 12 12.285 20.303 -17.309 92 HA ILE 12 HA ILE 12 9.857 19.836 -18.728 93 HB ILE 12 HB ILE 12 10.432 21.339 -16.154 94 1HG1 ILE 12 1HG1 ILE 12 9.284 18.549 -16.706 95 2HG1 ILE 12 2HG1 ILE 12 10.958 18.856 -16.264 96 1HG2 ILE 12 1HG2 ILE 12 7.738 20.359 -17.191 97 2HG2 ILE 12 2HG2 ILE 12 8.047 21.189 -15.657 98 3HG2 ILE 12 3HG2 ILE 12 8.231 22.061 -17.165 99 1HD1 ILE 12 1HD1 ILE 12 8.530 19.331 -14.516 100 2HD1 ILE 12 2HD1 ILE 12 9.836 18.161 -14.305 101 3HD1 ILE 12 3HD1 ILE 12 10.177 19.893 -14.116 102 H ARG 13 H ARG 13 11.650 22.919 -18.082 103 HA ARG 13 HA ARG 13 9.710 24.559 -19.345 104 1HB ARG 13 1HB ARG 13 12.136 25.021 -18.075 105 2HB ARG 13 2HB ARG 13 12.468 25.523 -19.737 106 1HG ARG 13 1HG ARG 13 10.299 26.485 -17.854 107 2HG ARG 13 2HG ARG 13 11.714 27.384 -18.365 108 1HD ARG 13 1HD ARG 13 10.857 27.715 -20.573 109 2HD ARG 13 2HD ARG 13 9.543 26.549 -20.343 110 HE ARG 13 HE ARG 13 9.180 28.347 -18.299 111 1HH1 ARG 13 1HH1 ARG 13 9.116 28.491 -21.846 112 2HH1 ARG 13 2HH1 ARG 13 8.128 29.923 -21.893 113 1HH2 ARG 13 1HH2 ARG 13 7.854 30.157 -18.361 114 2HH2 ARG 13 2HH2 ARG 13 7.348 30.862 -19.872 115 H GLU 14 H GLU 14 12.595 22.893 -20.710 116 HA GLU 14 HA GLU 14 12.271 23.860 -23.371 117 1HB GLU 14 1HB GLU 14 13.615 21.407 -22.193 118 2HB GLU 14 2HB GLU 14 13.433 21.593 -23.940 119 1HG GLU 14 1HG GLU 14 15.586 22.431 -23.367 120 2HG GLU 14 2HG GLU 14 14.581 23.791 -23.866 121 H ALA 15 H ALA 15 11.004 20.844 -21.863 122 HA ALA 15 HA ALA 15 9.569 19.898 -24.114 123 1HB ALA 15 1HB ALA 15 8.844 19.667 -21.158 124 2HB ALA 15 2HB ALA 15 8.194 18.671 -22.478 125 3HB ALA 15 3HB ALA 15 9.919 18.579 -22.062 126 H PHE 16 H PHE 16 8.546 22.101 -21.494 127 HA PHE 16 HA PHE 16 5.935 22.610 -22.330 128 1HB PHE 16 1HB PHE 16 6.793 23.328 -20.175 129 2HB PHE 16 2HB PHE 16 7.929 24.418 -20.924 130 HD1 PHE 16 HD1 PHE 16 7.336 26.631 -21.615 131 HD2 PHE 16 HD2 PHE 16 4.328 23.842 -20.305 132 HE1 PHE 16 HE1 PHE 16 5.700 28.482 -21.431 133 HE2 PHE 16 HE2 PHE 16 2.689 25.692 -20.123 134 HZ PHE 16 HZ PHE 16 3.396 28.023 -20.623 135 H ASP 17 H ASP 17 8.915 24.403 -23.148 136 HA ASP 17 HA ASP 17 7.827 26.329 -24.887 137 1HB ASP 17 1HB ASP 17 10.571 24.993 -25.068 138 2HB ASP 17 2HB ASP 17 10.091 26.498 -25.848 139 H LEU 18 H LEU 18 9.181 23.081 -25.662 140 HA LEU 18 HA LEU 18 8.737 23.213 -28.449 141 1HB LEU 18 1HB LEU 18 10.121 21.523 -27.433 142 2HB LEU 18 2HB LEU 18 8.752 20.786 -26.599 143 HG LEU 18 HG LEU 18 8.493 21.082 -29.586 144 1HD1 LEU 18 1HD1 LEU 18 10.351 19.035 -28.337 145 2HD1 LEU 18 2HD1 LEU 18 9.815 19.087 -30.035 146 3HD1 LEU 18 3HD1 LEU 18 10.825 20.393 -29.390 147 1HD2 LEU 18 1HD2 LEU 18 7.898 18.796 -27.640 148 2HD2 LEU 18 2HD2 LEU 18 6.705 19.925 -28.306 149 3HD2 LEU 18 3HD2 LEU 18 7.529 18.795 -29.374 150 H PHE 19 H PHE 19 6.585 21.827 -25.882 151 HA PHE 19 HA PHE 19 4.502 21.220 -27.733 152 1HB PHE 19 1HB PHE 19 4.354 21.862 -24.770 153 2HB PHE 19 2HB PHE 19 3.027 21.171 -25.709 154 HD1 PHE 19 HD1 PHE 19 4.515 19.092 -27.367 155 HD2 PHE 19 HD2 PHE 19 4.630 20.115 -23.177 156 HE1 PHE 19 HE1 PHE 19 5.146 16.789 -26.833 157 HE2 PHE 19 HE2 PHE 19 5.078 17.734 -22.634 158 HZ PHE 19 HZ PHE 19 5.460 16.088 -24.460 159 H ASP 20 H ASP 20 5.212 24.214 -25.954 160 HA ASP 20 HA ASP 20 2.870 25.607 -26.996 161 1HB ASP 20 1HB ASP 20 3.937 26.233 -24.863 162 2HB ASP 20 2HB ASP 20 5.420 26.656 -25.730 163 H THR 21 H THR 21 3.644 24.470 -29.160 164 HA THR 21 HA THR 21 5.602 25.619 -30.828 165 HB THR 21 HB THR 21 4.151 24.844 -32.687 166 HG1 THR 21 HG1 THR 21 2.271 24.590 -30.589 167 1HG2 THR 21 1HG2 THR 21 5.637 23.235 -31.456 168 2HG2 THR 21 2HG2 THR 21 4.259 22.798 -30.424 169 3HG2 THR 21 3HG2 THR 21 4.197 22.480 -32.162 170 H ASP 22 H ASP 22 2.389 26.791 -29.911 171 HA ASP 22 HA ASP 22 2.374 29.024 -31.768 172 1HB ASP 22 1HB ASP 22 0.718 28.417 -29.280 173 2HB ASP 22 2HB ASP 22 0.413 29.759 -30.385 174 H GLY 23 H GLY 23 4.479 28.594 -29.244 175 1HA GLY 23 1HA GLY 23 5.762 29.986 -28.006 176 2HA GLY 23 2HA GLY 23 5.597 31.082 -29.387 177 H SER 24 H SER 24 2.977 30.083 -27.207 178 HA SER 24 HA SER 24 2.303 32.928 -26.787 179 1HB SER 24 1HB SER 24 0.832 30.328 -26.190 180 2HB SER 24 2HB SER 24 0.175 31.961 -26.031 181 HG SER 24 HG SER 24 1.369 31.288 -28.495 182 H GLY 25 H GLY 25 4.339 31.016 -25.177 183 1HA GLY 25 1HA GLY 25 5.175 30.863 -23.054 184 2HA GLY 25 2HA GLY 25 4.267 32.323 -22.614 185 H THR 26 H THR 26 2.532 29.623 -24.017 186 HA THR 26 HA THR 26 1.433 28.530 -21.541 187 HB THR 26 HB THR 26 -0.824 29.294 -22.195 188 HG1 THR 26 HG1 THR 26 0.490 31.356 -23.613 189 1HG2 THR 26 1HG2 THR 26 0.358 30.375 -20.291 190 2HG2 THR 26 2HG2 THR 26 0.888 31.663 -21.396 191 3HG2 THR 26 3HG2 THR 26 -0.835 31.403 -21.098 192 H ILE 27 H ILE 27 0.646 26.492 -22.060 193 HA ILE 27 HA ILE 27 0.798 25.605 -24.911 194 HB ILE 27 HB ILE 27 0.392 24.150 -22.294 195 1HG1 ILE 27 1HG1 ILE 27 2.653 24.079 -24.351 196 2HG1 ILE 27 2HG1 ILE 27 2.699 24.987 -22.837 197 1HG2 ILE 27 1HG2 ILE 27 0.384 22.063 -23.543 198 2HG2 ILE 27 2HG2 ILE 27 -0.905 23.056 -24.164 199 3HG2 ILE 27 3HG2 ILE 27 0.620 22.925 -25.071 200 1HD1 ILE 27 1HD1 ILE 27 2.305 22.843 -21.588 201 2HD1 ILE 27 2HD1 ILE 27 2.507 21.965 -23.126 202 3HD1 ILE 27 3HD1 ILE 27 3.835 22.925 -22.484 203 H ASP 28 H ASP 28 -1.130 26.017 -26.081 204 HA ASP 28 HA ASP 28 -3.670 26.461 -24.773 205 1HB ASP 28 1HB ASP 28 -3.166 27.292 -27.039 206 2HB ASP 28 2HB ASP 28 -3.092 25.626 -27.636 207 H ALA 29 H ALA 29 -5.416 24.970 -24.352 208 HA ALA 29 HA ALA 29 -5.055 22.376 -23.683 209 1HB ALA 29 1HB ALA 29 -7.457 22.017 -24.216 210 2HB ALA 29 2HB ALA 29 -7.165 23.553 -23.381 211 3HB ALA 29 3HB ALA 29 -7.467 23.538 -25.134 212 H LYS 30 H LYS 30 -5.674 23.431 -27.074 213 HA LYS 30 HA LYS 30 -5.788 20.817 -28.222 214 1HB LYS 30 1HB LYS 30 -4.914 23.476 -29.425 215 2HB LYS 30 2HB LYS 30 -5.258 22.000 -30.340 216 1HG LYS 30 1HG LYS 30 -7.585 21.991 -29.545 217 2HG LYS 30 2HG LYS 30 -7.288 23.436 -28.561 218 1HD LYS 30 1HD LYS 30 -6.707 24.724 -30.598 219 2HD LYS 30 2HD LYS 30 -7.032 23.289 -31.597 220 1HE LYS 30 1HE LYS 30 -9.390 23.271 -30.783 221 2HE LYS 30 2HE LYS 30 -9.055 24.702 -29.787 222 1HZ LYS 30 1HZ LYS 30 -10.087 25.280 -31.844 223 2HZ LYS 30 2HZ LYS 30 -8.563 25.902 -31.791 224 3HZ LYS 30 3HZ LYS 30 -8.879 24.575 -32.715 225 H GLU 31 H GLU 31 -3.034 23.030 -27.596 226 HA GLU 31 HA GLU 31 -1.043 21.379 -28.895 227 1HB GLU 31 1HB GLU 31 -0.803 23.536 -26.764 228 2HB GLU 31 2HB GLU 31 0.554 22.720 -27.548 229 1HG GLU 31 1HG GLU 31 -0.148 23.574 -29.742 230 2HG GLU 31 2HG GLU 31 -1.543 24.383 -29.013 231 H LEU 32 H LEU 32 -2.413 21.611 -25.572 232 HA LEU 32 HA LEU 32 -0.618 19.674 -24.469 233 1HB LEU 32 1HB LEU 32 -2.341 21.217 -23.207 234 2HB LEU 32 2HB LEU 32 -3.471 19.887 -23.516 235 HG LEU 32 HG LEU 32 -1.634 18.345 -22.476 236 1HD1 LEU 32 1HD1 LEU 32 0.263 19.879 -22.423 237 2HD1 LEU 32 2HD1 LEU 32 -0.666 21.039 -21.446 238 3HD1 LEU 32 3HD1 LEU 32 -0.210 19.459 -20.781 239 1HD2 LEU 32 1HD2 LEU 32 -3.159 20.349 -20.772 240 2HD2 LEU 32 2HD2 LEU 32 -3.777 18.806 -21.393 241 3HD2 LEU 32 3HD2 LEU 32 -2.475 18.813 -20.196 242 H LYS 33 H LYS 33 -3.813 19.316 -26.093 243 HA LYS 33 HA LYS 33 -3.968 16.494 -25.848 244 1HB LYS 33 1HB LYS 33 -5.810 17.943 -26.494 245 2HB LYS 33 2HB LYS 33 -5.058 18.232 -28.079 246 1HG LYS 33 1HG LYS 33 -5.186 15.776 -28.546 247 2HG LYS 33 2HG LYS 33 -5.984 15.541 -26.976 248 1HD LYS 33 1HD LYS 33 -7.794 17.133 -27.706 249 2HD LYS 33 2HD LYS 33 -7.025 17.243 -29.297 250 1HE LYS 33 1HE LYS 33 -8.174 14.718 -28.009 251 2HE LYS 33 2HE LYS 33 -8.916 15.658 -29.308 252 1HZ LYS 33 1HZ LYS 33 -6.358 14.232 -29.486 253 2HZ LYS 33 2HZ LYS 33 -7.784 13.762 -30.159 254 3HZ LYS 33 3HZ LYS 33 -7.036 15.132 -30.688 255 H VAL 34 H VAL 34 -2.439 18.483 -28.432 256 HA VAL 34 HA VAL 34 -1.403 16.280 -29.934 257 HB VAL 34 HB VAL 34 -0.388 19.127 -29.544 258 1HG1 VAL 34 1HG1 VAL 34 0.994 18.730 -31.583 259 2HG1 VAL 34 2HG1 VAL 34 1.565 17.812 -30.188 260 3HG1 VAL 34 3HG1 VAL 34 0.631 16.995 -31.465 261 1HG2 VAL 34 1HG2 VAL 34 -2.582 18.854 -30.719 262 2HG2 VAL 34 2HG2 VAL 34 -1.315 19.463 -31.793 263 3HG2 VAL 34 3HG2 VAL 34 -1.804 17.757 -31.875 264 H ALA 35 H ALA 35 0.018 18.050 -27.131 265 HA ALA 35 HA ALA 35 2.453 16.663 -27.008 266 1HB ALA 35 1HB ALA 35 2.515 17.315 -24.649 267 2HB ALA 35 2HB ALA 35 1.920 18.661 -25.645 268 3HB ALA 35 3HB ALA 35 0.806 17.702 -24.655 269 H MET 36 H MET 36 -0.641 15.883 -25.369 270 HA MET 36 HA MET 36 0.206 13.418 -24.212 271 1HB MET 36 1HB MET 36 -2.494 14.579 -24.892 272 2HB MET 36 2HB MET 36 -2.308 13.013 -24.092 273 1HG MET 36 1HG MET 36 -0.914 14.028 -22.326 274 2HG MET 36 2HG MET 36 -1.123 15.618 -23.051 275 1HE MET 36 1HE MET 36 -4.776 16.498 -22.363 276 2HE MET 36 2HE MET 36 -3.219 16.932 -23.100 277 3HE MET 36 3HE MET 36 -4.208 15.659 -23.830 278 H ARG 37 H ARG 37 -1.300 14.077 -27.403 279 HA ARG 37 HA ARG 37 -1.386 11.380 -28.228 280 1HB ARG 37 1HB ARG 37 -2.468 13.066 -29.562 281 2HB ARG 37 2HB ARG 37 -0.955 13.935 -29.816 282 1HG ARG 37 1HG ARG 37 -1.542 12.735 -31.827 283 2HG ARG 37 2HG ARG 37 -0.043 12.100 -31.161 284 1HD ARG 37 1HD ARG 37 -1.496 10.229 -30.071 285 2HD ARG 37 2HD ARG 37 -2.828 10.894 -31.012 286 HE ARG 37 HE ARG 37 -1.941 9.951 -32.919 287 1HH1 ARG 37 1HH1 ARG 37 0.574 9.873 -30.364 288 2HH1 ARG 37 2HH1 ARG 37 1.613 8.833 -31.283 289 1HH2 ARG 37 1HH2 ARG 37 -0.550 8.585 -34.073 290 2HH2 ARG 37 2HH2 ARG 37 0.983 8.092 -33.407 291 H ALA 38 H ALA 38 1.305 13.766 -28.507 292 HA ALA 38 HA ALA 38 3.162 11.997 -29.740 293 1HB ALA 38 1HB ALA 38 4.860 13.612 -29.071 294 2HB ALA 38 2HB ALA 38 3.419 14.453 -29.680 295 3HB ALA 38 3HB ALA 38 3.741 14.383 -27.934 296 H LEU 39 H LEU 39 2.433 12.626 -26.308 297 HA LEU 39 HA LEU 39 4.417 10.830 -25.227 298 1HB LEU 39 1HB LEU 39 1.816 11.902 -24.087 299 2HB LEU 39 2HB LEU 39 3.003 11.012 -23.153 300 HG LEU 39 HG LEU 39 3.804 13.576 -24.573 301 1HD1 LEU 39 1HD1 LEU 39 3.396 14.733 -22.383 302 2HD1 LEU 39 2HD1 LEU 39 1.904 14.247 -23.177 303 3HD1 LEU 39 3HD1 LEU 39 2.524 13.292 -21.818 304 1HD2 LEU 39 1HD2 LEU 39 4.863 12.138 -22.106 305 2HD2 LEU 39 2HD2 LEU 39 5.605 12.109 -23.720 306 3HD2 LEU 39 3HD2 LEU 39 5.515 13.627 -22.817 307 H GLY 40 H GLY 40 1.737 10.065 -27.157 308 1HA GLY 40 1HA GLY 40 0.943 8.025 -27.746 309 2HA GLY 40 2HA GLY 40 2.029 7.255 -26.578 310 H PHE 41 H PHE 41 -0.225 9.803 -25.588 311 HA PHE 41 HA PHE 41 -1.684 7.927 -23.822 312 1HB PHE 41 1HB PHE 41 -1.908 10.886 -24.431 313 2HB PHE 41 2HB PHE 41 -3.015 10.061 -23.371 314 HD1 PHE 41 HD1 PHE 41 0.523 8.976 -23.034 315 HD2 PHE 41 HD2 PHE 41 -2.467 11.812 -21.717 316 HE1 PHE 41 HE1 PHE 41 1.961 9.628 -21.164 317 HE2 PHE 41 HE2 PHE 41 -1.004 12.452 -19.828 318 HZ PHE 41 HZ PHE 41 1.226 11.377 -19.556 319 H GLU 42 H GLU 42 -4.067 7.914 -23.898 320 HA GLU 42 HA GLU 42 -5.261 8.250 -26.609 321 1HB GLU 42 1HB GLU 42 -7.049 6.790 -25.651 322 2HB GLU 42 2HB GLU 42 -5.488 6.037 -26.006 323 1HG GLU 42 1HG GLU 42 -4.890 5.912 -23.671 324 2HG GLU 42 2HG GLU 42 -6.327 6.825 -23.186 325 HA PRO 43 HA PRO 43 -6.823 11.877 -24.355 326 1HB PRO 43 1HB PRO 43 -7.927 12.277 -27.153 327 2HB PRO 43 2HB PRO 43 -7.357 13.515 -25.992 328 1HG PRO 43 1HG PRO 43 -5.696 12.643 -27.944 329 2HG PRO 43 2HG PRO 43 -5.077 12.771 -26.270 330 1HD PRO 43 1HD PRO 43 -6.002 10.281 -27.728 331 2HD PRO 43 2HD PRO 43 -4.590 10.548 -26.651 332 H LYS 44 H LYS 44 -8.145 10.091 -23.245 333 HA LYS 44 HA LYS 44 -10.871 9.666 -24.048 334 1HB LYS 44 1HB LYS 44 -9.733 9.559 -21.236 335 2HB LYS 44 2HB LYS 44 -11.245 8.855 -21.838 336 1HG LYS 44 1HG LYS 44 -9.775 7.467 -23.452 337 2HG LYS 44 2HG LYS 44 -8.399 8.067 -22.532 338 1HD LYS 44 1HD LYS 44 -8.826 5.999 -21.539 339 2HD LYS 44 2HD LYS 44 -9.492 7.183 -20.416 340 1HE LYS 44 1HE LYS 44 -11.008 5.294 -20.643 341 2HE LYS 44 2HE LYS 44 -11.792 6.711 -21.343 342 1HZ LYS 44 1HZ LYS 44 -10.349 4.651 -22.869 343 2HZ LYS 44 2HZ LYS 44 -11.988 4.734 -22.701 344 3HZ LYS 44 3HZ LYS 44 -11.180 5.923 -23.501 345 H LYS 45 H LYS 45 -11.770 11.557 -24.632 346 HA LYS 45 HA LYS 45 -11.708 14.034 -24.077 347 1HB LYS 45 1HB LYS 45 -13.354 12.978 -25.541 348 2HB LYS 45 2HB LYS 45 -14.352 12.527 -24.152 349 1HG LYS 45 1HG LYS 45 -14.747 14.918 -23.649 350 2HG LYS 45 2HG LYS 45 -13.683 15.382 -24.997 351 1HD LYS 45 1HD LYS 45 -15.169 14.243 -26.600 352 2HD LYS 45 2HD LYS 45 -16.223 13.697 -25.290 353 1HE LYS 45 1HE LYS 45 -15.697 16.625 -26.002 354 2HE LYS 45 2HE LYS 45 -17.100 15.682 -26.527 355 1HZ LYS 45 1HZ LYS 45 -16.413 16.268 -23.736 356 2HZ LYS 45 2HZ LYS 45 -17.615 16.970 -24.616 357 3HZ LYS 45 3HZ LYS 45 -17.697 15.369 -24.244 358 H GLU 46 H GLU 46 -13.889 12.141 -21.896 359 HA GLU 46 HA GLU 46 -14.519 14.348 -20.241 360 1HB GLU 46 1HB GLU 46 -15.777 12.205 -20.395 361 2HB GLU 46 2HB GLU 46 -14.516 11.391 -19.466 362 1HG GLU 46 1HG GLU 46 -16.159 13.781 -18.493 363 2HG GLU 46 2HG GLU 46 -16.543 12.092 -18.154 364 H GLU 47 H GLU 47 -12.122 11.722 -19.721 365 HA GLU 47 HA GLU 47 -11.096 12.712 -17.274 366 1HB GLU 47 1HB GLU 47 -9.721 10.967 -19.371 367 2HB GLU 47 2HB GLU 47 -9.198 11.240 -17.710 368 1HG GLU 47 1HG GLU 47 -10.307 9.300 -17.349 369 2HG GLU 47 2HG GLU 47 -11.670 10.392 -17.110 370 H ILE 48 H ILE 48 -10.111 13.292 -20.654 371 HA ILE 48 HA ILE 48 -7.822 14.921 -20.129 372 HB ILE 48 HB ILE 48 -9.834 14.806 -22.401 373 1HG1 ILE 48 1HG1 ILE 48 -8.209 12.881 -21.962 374 2HG1 ILE 48 2HG1 ILE 48 -8.260 13.583 -23.581 375 1HG2 ILE 48 1HG2 ILE 48 -9.066 17.062 -22.527 376 2HG2 ILE 48 2HG2 ILE 48 -7.383 16.583 -22.228 377 3HG2 ILE 48 3HG2 ILE 48 -8.193 16.139 -23.750 378 1HD1 ILE 48 1HD1 ILE 48 -6.206 14.742 -23.269 379 2HD1 ILE 48 2HD1 ILE 48 -6.168 14.415 -21.522 380 3HD1 ILE 48 3HD1 ILE 48 -5.930 13.100 -22.674 381 H LYS 49 H LYS 49 -11.256 15.915 -20.673 382 HA LYS 49 HA LYS 49 -10.779 18.675 -20.179 383 1HB LYS 49 1HB LYS 49 -13.281 16.969 -19.885 384 2HB LYS 49 2HB LYS 49 -13.254 18.724 -19.637 385 1HG LYS 49 1HG LYS 49 -12.362 19.064 -21.908 386 2HG LYS 49 2HG LYS 49 -12.419 17.318 -22.212 387 1HD LYS 49 1HD LYS 49 -14.870 17.323 -21.816 388 2HD LYS 49 2HD LYS 49 -14.832 19.066 -21.507 389 1HE LYS 49 1HE LYS 49 -14.060 17.717 -24.141 390 2HE LYS 49 2HE LYS 49 -15.593 18.549 -23.809 391 1HZ LYS 49 1HZ LYS 49 -12.938 19.790 -23.815 392 2HZ LYS 49 2HZ LYS 49 -14.106 19.966 -24.960 393 3HZ LYS 49 3HZ LYS 49 -14.347 20.557 -23.442 394 H LYS 50 H LYS 50 -11.753 16.059 -17.922 395 HA LYS 50 HA LYS 50 -11.983 17.639 -15.618 396 1HB LYS 50 1HB LYS 50 -12.679 15.260 -15.788 397 2HB LYS 50 2HB LYS 50 -10.988 14.770 -15.883 398 1HG LYS 50 1HG LYS 50 -11.691 14.344 -13.682 399 2HG LYS 50 2HG LYS 50 -10.626 15.747 -13.577 400 1HD LYS 50 1HD LYS 50 -12.727 17.217 -13.570 401 2HD LYS 50 2HD LYS 50 -13.686 15.732 -13.509 402 1HE LYS 50 1HE LYS 50 -11.653 16.712 -11.443 403 2HE LYS 50 2HE LYS 50 -13.413 16.709 -11.270 404 1HZ LYS 50 1HZ LYS 50 -13.346 14.313 -11.403 405 2HZ LYS 50 2HZ LYS 50 -11.700 14.337 -11.513 406 3HZ LYS 50 3HZ LYS 50 -12.440 14.875 -10.145 407 H MET 51 H MET 51 -9.072 15.792 -16.737 408 HA MET 51 HA MET 51 -7.322 16.654 -14.753 409 1HB MET 51 1HB MET 51 -6.986 14.827 -16.497 410 2HB MET 51 2HB MET 51 -6.577 16.101 -17.656 411 1HG MET 51 1HG MET 51 -4.795 16.856 -15.948 412 2HG MET 51 2HG MET 51 -5.224 15.411 -15.026 413 1HE MET 51 1HE MET 51 -2.949 15.506 -19.032 414 2HE MET 51 2HE MET 51 -4.674 15.939 -18.987 415 3HE MET 51 3HE MET 51 -3.479 16.931 -18.111 416 H ILE 52 H ILE 52 -7.841 18.066 -18.031 417 HA ILE 52 HA ILE 52 -6.059 20.231 -17.766 418 HB ILE 52 HB ILE 52 -8.629 19.877 -19.353 419 1HG1 ILE 52 1HG1 ILE 52 -5.682 20.053 -20.158 420 2HG1 ILE 52 2HG1 ILE 52 -6.555 18.540 -19.907 421 1HG2 ILE 52 1HG2 ILE 52 -6.732 22.263 -19.477 422 2HG2 ILE 52 2HG2 ILE 52 -8.051 21.933 -20.618 423 3HG2 ILE 52 3HG2 ILE 52 -8.426 22.304 -18.949 424 1HD1 ILE 52 1HD1 ILE 52 -7.077 20.593 -22.086 425 2HD1 ILE 52 2HD1 ILE 52 -6.492 18.938 -22.256 426 3HD1 ILE 52 3HD1 ILE 52 -8.163 19.229 -21.726 427 H SER 53 H SER 53 -9.557 20.089 -16.834 428 HA SER 53 HA SER 53 -9.636 22.748 -15.846 429 1HB SER 53 1HB SER 53 -11.234 20.343 -14.851 430 2HB SER 53 2HB SER 53 -11.639 22.057 -14.639 431 HG SER 53 HG SER 53 -11.484 20.600 -17.079 432 H GLU 54 H GLU 54 -8.741 19.703 -14.158 433 HA GLU 54 HA GLU 54 -8.428 20.868 -11.573 434 1HB GLU 54 1HB GLU 54 -7.128 18.441 -12.857 435 2HB GLU 54 2HB GLU 54 -6.912 18.892 -11.160 436 1HG GLU 54 1HG GLU 54 -9.298 18.723 -10.719 437 2HG GLU 54 2HG GLU 54 -9.649 18.395 -12.417 438 H ILE 55 H ILE 55 -6.136 20.603 -14.315 439 HA ILE 55 HA ILE 55 -3.960 21.822 -12.758 440 HB ILE 55 HB ILE 55 -4.239 21.188 -15.717 441 1HG1 ILE 55 1HG1 ILE 55 -4.337 19.124 -14.472 442 2HG1 ILE 55 2HG1 ILE 55 -2.777 19.263 -15.253 443 1HG2 ILE 55 1HG2 ILE 55 -1.731 21.303 -15.730 444 2HG2 ILE 55 2HG2 ILE 55 -2.543 22.848 -15.495 445 3HG2 ILE 55 3HG2 ILE 55 -1.799 22.028 -14.108 446 1HD1 ILE 55 1HD1 ILE 55 -1.803 19.995 -13.022 447 2HD1 ILE 55 2HD1 ILE 55 -3.397 19.693 -12.293 448 3HD1 ILE 55 3HD1 ILE 55 -2.494 18.364 -13.022 449 H ASP 56 H ASP 56 -6.417 22.987 -15.033 450 HA ASP 56 HA ASP 56 -4.993 25.464 -15.561 451 1HB ASP 56 1HB ASP 56 -6.225 24.281 -17.317 452 2HB ASP 56 2HB ASP 56 -7.740 24.492 -16.419 453 H LYS 57 H LYS 57 -4.885 26.456 -13.519 454 HA LYS 57 HA LYS 57 -7.416 27.410 -12.245 455 1HB LYS 57 1HB LYS 57 -4.563 27.931 -11.399 456 2HB LYS 57 2HB LYS 57 -6.032 28.153 -10.448 457 1HG LYS 57 1HG LYS 57 -4.829 25.475 -11.338 458 2HG LYS 57 2HG LYS 57 -4.705 26.222 -9.759 459 1HD LYS 57 1HD LYS 57 -6.292 24.579 -9.482 460 2HD LYS 57 2HD LYS 57 -7.248 26.065 -9.545 461 1HE LYS 57 1HE LYS 57 -8.110 25.480 -11.734 462 2HE LYS 57 2HE LYS 57 -6.790 24.328 -12.013 463 1HZ LYS 57 1HZ LYS 57 -7.720 22.930 -10.392 464 2HZ LYS 57 2HZ LYS 57 -8.955 23.995 -10.078 465 3HZ LYS 57 3HZ LYS 57 -8.815 23.283 -11.569 466 H ASP 58 H ASP 58 -4.471 28.668 -13.804 467 HA ASP 58 HA ASP 58 -5.774 31.359 -14.056 468 1HB ASP 58 1HB ASP 58 -3.552 32.287 -14.206 469 2HB ASP 58 2HB ASP 58 -3.730 31.370 -12.707 470 H GLY 59 H GLY 59 -4.323 28.664 -15.785 471 1HA GLY 59 1HA GLY 59 -3.436 29.853 -18.100 472 2HA GLY 59 2HA GLY 59 -4.018 28.198 -17.925 473 H SER 60 H SER 60 -6.802 29.045 -17.307 474 HA SER 60 HA SER 60 -8.781 29.515 -18.342 475 1HB SER 60 1HB SER 60 -7.208 31.860 -19.492 476 2HB SER 60 2HB SER 60 -8.963 31.758 -19.272 477 HG SER 60 HG SER 60 -6.948 31.775 -17.255 478 H GLY 61 H GLY 61 -7.899 27.449 -19.674 479 1HA GLY 61 1HA GLY 61 -8.631 26.488 -21.723 480 2HA GLY 61 2HA GLY 61 -8.461 28.033 -22.561 481 H THR 62 H THR 62 -5.749 28.351 -21.017 482 HA THR 62 HA THR 62 -4.152 26.404 -22.612 483 HB THR 62 HB THR 62 -2.400 27.958 -22.697 484 HG1 THR 62 HG1 THR 62 -3.887 29.651 -20.962 485 1HG2 THR 62 1HG2 THR 62 -3.259 29.905 -23.836 486 2HG2 THR 62 2HG2 THR 62 -4.296 28.536 -24.277 487 3HG2 THR 62 3HG2 THR 62 -4.856 29.727 -23.092 488 H ILE 63 H ILE 63 -1.942 26.118 -21.413 489 HA ILE 63 HA ILE 63 -2.302 25.866 -18.459 490 HB ILE 63 HB ILE 63 -0.649 24.105 -20.305 491 1HG1 ILE 63 1HG1 ILE 63 -3.023 23.616 -20.689 492 2HG1 ILE 63 2HG1 ILE 63 -2.160 22.293 -19.917 493 1HG2 ILE 63 1HG2 ILE 63 0.338 24.287 -18.104 494 2HG2 ILE 63 2HG2 ILE 63 -1.205 23.917 -17.325 495 3HG2 ILE 63 3HG2 ILE 63 -0.374 22.680 -18.291 496 1HD1 ILE 63 1HD1 ILE 63 -4.416 22.633 -18.975 497 2HD1 ILE 63 2HD1 ILE 63 -3.153 22.803 -17.753 498 3HD1 ILE 63 3HD1 ILE 63 -3.951 24.246 -18.413 499 H ASP 64 H ASP 64 -0.995 27.322 -17.494 500 HA ASP 64 HA ASP 64 1.172 28.696 -18.890 501 1HB ASP 64 1HB ASP 64 -0.232 29.883 -17.276 502 2HB ASP 64 2HB ASP 64 0.192 28.732 -16.001 503 H PHE 65 H PHE 65 3.416 28.696 -18.107 504 HA PHE 65 HA PHE 65 4.586 26.178 -17.903 505 1HB PHE 65 1HB PHE 65 5.916 28.087 -18.513 506 2HB PHE 65 2HB PHE 65 5.624 28.863 -16.953 507 HD1 PHE 65 HD1 PHE 65 6.996 25.647 -18.388 508 HD2 PHE 65 HD2 PHE 65 7.194 28.546 -15.198 509 HE1 PHE 65 HE1 PHE 65 8.659 24.257 -17.221 510 HE2 PHE 65 HE2 PHE 65 8.918 27.179 -14.072 511 HZ PHE 65 HZ PHE 65 9.637 25.008 -15.065 512 H GLU 66 H GLU 66 3.671 28.348 -15.162 513 HA GLU 66 HA GLU 66 4.814 26.708 -13.131 514 1HB GLU 66 1HB GLU 66 2.403 28.581 -13.009 515 2HB GLU 66 2HB GLU 66 3.252 27.893 -11.616 516 1HG GLU 66 1HG GLU 66 5.357 29.002 -12.338 517 2HG GLU 66 2HG GLU 66 4.508 29.740 -13.705 518 H GLU 67 H GLU 67 1.593 26.688 -14.656 519 HA GLU 67 HA GLU 67 0.442 24.664 -12.973 520 1HB GLU 67 1HB GLU 67 -0.256 25.526 -15.807 521 2HB GLU 67 2HB GLU 67 -1.250 24.508 -14.757 522 1HG GLU 67 1HG GLU 67 -1.521 26.301 -13.136 523 2HG GLU 67 2HG GLU 67 -0.467 27.373 -14.068 524 H PHE 68 H PHE 68 2.099 24.587 -16.165 525 HA PHE 68 HA PHE 68 1.862 21.794 -16.636 526 1HB PHE 68 1HB PHE 68 2.533 23.490 -18.312 527 2HB PHE 68 2HB PHE 68 4.047 23.744 -17.465 528 HD1 PHE 68 HD1 PHE 68 2.040 21.236 -19.382 529 HD2 PHE 68 HD2 PHE 68 5.925 22.297 -17.838 530 HE1 PHE 68 HE1 PHE 68 3.104 19.635 -20.950 531 HE2 PHE 68 HE2 PHE 68 6.981 20.698 -19.419 532 HZ PHE 68 HZ PHE 68 5.588 19.383 -20.970 533 H LEU 69 H LEU 69 4.464 23.685 -15.049 534 HA LEU 69 HA LEU 69 6.155 21.546 -14.366 535 1HB LEU 69 1HB LEU 69 6.844 23.885 -14.231 536 2HB LEU 69 2HB LEU 69 5.639 24.207 -12.983 537 HG LEU 69 HG LEU 69 6.820 22.710 -11.406 538 1HD1 LEU 69 1HD1 LEU 69 7.896 21.122 -12.937 539 2HD1 LEU 69 2HD1 LEU 69 8.864 22.431 -13.659 540 3HD1 LEU 69 3HD1 LEU 69 9.129 21.939 -11.975 541 1HD2 LEU 69 1HD2 LEU 69 8.750 24.166 -11.029 542 2HD2 LEU 69 2HD2 LEU 69 8.622 24.806 -12.680 543 3HD2 LEU 69 3HD2 LEU 69 7.335 25.125 -11.497 544 H THR 70 H THR 70 3.440 23.031 -12.512 545 HA THR 70 HA THR 70 3.618 21.345 -10.258 546 HB THR 70 HB THR 70 1.083 22.539 -11.463 547 HG1 THR 70 HG1 THR 70 2.679 24.111 -11.076 548 1HG2 THR 70 1HG2 THR 70 0.607 20.887 -9.677 549 2HG2 THR 70 2HG2 THR 70 1.785 21.696 -8.616 550 3HG2 THR 70 3HG2 THR 70 0.308 22.541 -9.116 551 H MET 71 H MET 71 1.709 20.883 -13.285 552 HA MET 71 HA MET 71 0.541 18.409 -12.643 553 1HB MET 71 1HB MET 71 -0.017 19.832 -14.623 554 2HB MET 71 2HB MET 71 1.520 19.378 -15.360 555 1HG MET 71 1HG MET 71 0.800 16.962 -15.246 556 2HG MET 71 2HG MET 71 -0.756 17.513 -14.614 557 1HE MET 71 1HE MET 71 1.463 19.070 -17.593 558 2HE MET 71 2HE MET 71 1.671 17.301 -17.645 559 3HE MET 71 3HE MET 71 0.771 18.133 -18.931 560 H MET 72 H MET 72 3.642 19.042 -14.376 561 HA MET 72 HA MET 72 4.387 16.312 -14.631 562 1HB MET 72 1HB MET 72 6.030 18.875 -14.516 563 2HB MET 72 2HB MET 72 6.749 17.282 -14.813 564 1HG MET 72 1HG MET 72 4.559 18.516 -16.530 565 2HG MET 72 2HG MET 72 6.284 18.518 -16.899 566 1HE MET 72 1HE MET 72 4.136 17.558 -18.941 567 2HE MET 72 2HE MET 72 5.890 17.501 -19.268 568 3HE MET 72 3HE MET 72 4.880 16.066 -19.573 569 H THR 73 H THR 73 5.157 18.658 -12.053 570 HA THR 73 HA THR 73 6.765 16.987 -10.443 571 HB THR 73 HB THR 73 4.822 19.166 -9.558 572 HG1 THR 73 HG1 THR 73 6.311 19.909 -11.073 573 1HG2 THR 73 1HG2 THR 73 7.300 18.025 -8.210 574 2HG2 THR 73 2HG2 THR 73 6.377 19.438 -7.660 575 3HG2 THR 73 3HG2 THR 73 5.624 17.837 -7.642 576 H ALA 74 H ALA 74 3.179 17.399 -10.464 577 HA ALA 74 HA ALA 74 2.663 15.526 -8.387 578 1HB ALA 74 1HB ALA 74 0.385 15.463 -9.268 579 2HB ALA 74 2HB ALA 74 0.993 17.130 -9.225 580 3HB ALA 74 3HB ALA 74 0.903 16.254 -10.766 581 H LYS 75 H LYS 75 2.816 15.071 -11.957 582 HA LYS 75 HA LYS 75 2.119 12.309 -11.885 583 1HB LYS 75 1HB LYS 75 3.506 14.027 -13.976 584 2HB LYS 75 2HB LYS 75 3.159 12.308 -14.210 585 1HG LYS 75 1HG LYS 75 0.759 12.703 -13.787 586 2HG LYS 75 2HG LYS 75 1.069 14.446 -13.637 587 1HD LYS 75 1HD LYS 75 1.800 14.582 -15.955 588 2HD LYS 75 2HD LYS 75 1.871 12.821 -16.098 589 1HE LYS 75 1HE LYS 75 -0.119 13.638 -17.241 590 2HE LYS 75 2HE LYS 75 -0.569 12.636 -15.853 591 1HZ LYS 75 1HZ LYS 75 -1.898 14.580 -15.947 592 2HZ LYS 75 2HZ LYS 75 -0.924 14.686 -14.620 593 3HZ LYS 75 3HZ LYS 75 -0.587 15.567 -15.978 594 H MET 76 H MET 76 5.391 13.806 -12.128 595 HA MET 76 HA MET 76 6.792 11.502 -12.801 596 1HB MET 76 1HB MET 76 7.627 13.928 -11.177 597 2HB MET 76 2HB MET 76 8.768 12.647 -11.615 598 1HG MET 76 1HG MET 76 8.252 12.962 -14.007 599 2HG MET 76 2HG MET 76 7.204 14.319 -13.614 600 1HE MET 76 1HE MET 76 8.132 16.607 -12.522 601 2HE MET 76 2HE MET 76 9.018 15.736 -11.241 602 3HE MET 76 3HE MET 76 9.862 16.922 -12.253 Start of MODEL 18 1 H ARG 1 H ARG 1 12.677 13.372 -2.134 2 HA ARG 1 HA ARG 1 10.504 14.154 -1.805 3 1HB ARG 1 1HB ARG 1 10.102 16.261 -0.577 4 2HB ARG 1 2HB ARG 1 10.697 14.963 0.466 5 1HG ARG 1 1HG ARG 1 12.956 15.931 0.468 6 2HG ARG 1 2HG ARG 1 12.456 17.183 -0.678 7 1HD ARG 1 1HD ARG 1 10.796 18.026 1.030 8 2HD ARG 1 2HD ARG 1 11.356 16.771 2.135 9 HE ARG 1 HE ARG 1 13.210 17.987 2.640 10 1HH1 ARG 1 1HH1 ARG 1 11.830 19.308 -0.332 11 2HH1 ARG 1 2HH1 ARG 1 12.890 20.692 -0.380 12 1HH2 ARG 1 1HH2 ARG 1 14.617 19.770 2.577 13 2HH2 ARG 1 2HH2 ARG 1 14.513 20.945 1.295 14 H VAL 2 H VAL 2 9.585 15.862 -3.101 15 HA VAL 2 HA VAL 2 9.434 17.237 -4.836 16 HB VAL 2 HB VAL 2 12.227 18.254 -4.150 17 1HG1 VAL 2 1HG1 VAL 2 11.502 18.915 -6.403 18 2HG1 VAL 2 2HG1 VAL 2 9.948 19.480 -5.757 19 3HG1 VAL 2 3HG1 VAL 2 11.457 20.296 -5.303 20 1HG2 VAL 2 1HG2 VAL 2 10.711 18.460 -2.204 21 2HG2 VAL 2 2HG2 VAL 2 11.006 20.038 -2.943 22 3HG2 VAL 2 3HG2 VAL 2 9.471 19.198 -3.241 23 H GLY 3 H GLY 3 12.869 16.181 -4.980 24 1HA GLY 3 1HA GLY 3 14.056 15.111 -6.636 25 2HA GLY 3 2HA GLY 3 12.545 14.244 -6.955 26 H LEU 4 H LEU 4 13.405 17.688 -7.401 27 HA LEU 4 HA LEU 4 13.046 17.465 -10.374 28 1HB LEU 4 1HB LEU 4 12.289 19.749 -8.547 29 2HB LEU 4 2HB LEU 4 12.277 19.785 -10.314 30 HG LEU 4 HG LEU 4 10.555 17.947 -8.585 31 1HD1 LEU 4 1HD1 LEU 4 9.984 20.347 -8.442 32 2HD1 LEU 4 2HD1 LEU 4 9.900 20.421 -10.218 33 3HD1 LEU 4 3HD1 LEU 4 8.736 19.432 -9.306 34 1HD2 LEU 4 1HD2 LEU 4 10.634 18.388 -11.609 35 2HD2 LEU 4 2HD2 LEU 4 10.941 16.861 -10.747 36 3HD2 LEU 4 3HD2 LEU 4 9.326 17.561 -10.743 37 H THR 5 H THR 5 15.335 17.079 -10.611 38 HA THR 5 HA THR 5 17.300 18.920 -9.575 39 HB THR 5 HB THR 5 18.742 17.964 -11.365 40 HG1 THR 5 HG1 THR 5 16.598 16.281 -12.030 41 1HG2 THR 5 1HG2 THR 5 17.155 15.856 -9.829 42 2HG2 THR 5 2HG2 THR 5 18.746 15.639 -10.585 43 3HG2 THR 5 3HG2 THR 5 18.555 16.766 -9.230 44 H GLU 6 H GLU 6 18.524 20.489 -10.886 45 HA GLU 6 HA GLU 6 16.966 22.352 -12.334 46 1HB GLU 6 1HB GLU 6 19.976 21.802 -12.474 47 2HB GLU 6 2HB GLU 6 19.154 23.239 -13.104 48 1HG GLU 6 1HG GLU 6 18.344 23.791 -10.817 49 2HG GLU 6 2HG GLU 6 19.210 22.392 -10.164 50 H GLU 7 H GLU 7 18.937 19.578 -13.412 51 HA GLU 7 HA GLU 7 18.692 19.843 -16.202 52 1HB GLU 7 1HB GLU 7 18.815 17.358 -14.423 53 2HB GLU 7 2HB GLU 7 18.877 17.326 -16.185 54 1HG GLU 7 1HG GLU 7 21.128 17.198 -15.334 55 2HG GLU 7 2HG GLU 7 20.905 18.723 -16.194 56 H GLN 8 H GLN 8 16.515 18.029 -13.926 57 HA GLN 8 HA GLN 8 14.545 17.384 -15.866 58 1HB GLN 8 1HB GLN 8 14.329 17.901 -12.888 59 2HB GLN 8 2HB GLN 8 12.955 17.393 -13.871 60 1HG GLN 8 1HG GLN 8 13.925 15.289 -14.404 61 2HG GLN 8 2HG GLN 8 15.534 15.796 -13.884 62 1HE2 GLN 8 1HE2 GLN 8 12.228 15.037 -12.670 63 2HE2 GLN 8 2HE2 GLN 8 12.736 14.837 -10.997 64 H LYS 9 H LYS 9 14.758 20.329 -13.744 65 HA LYS 9 HA LYS 9 12.356 21.492 -14.688 66 1HB LYS 9 1HB LYS 9 14.911 22.890 -13.787 67 2HB LYS 9 2HB LYS 9 13.342 23.675 -14.012 68 1HG LYS 9 1HG LYS 9 12.335 22.211 -12.281 69 2HG LYS 9 2HG LYS 9 13.900 21.427 -12.031 70 1HD LYS 9 1HD LYS 9 14.865 23.745 -11.524 71 2HD LYS 9 2HD LYS 9 13.192 24.343 -11.518 72 1HE LYS 9 1HE LYS 9 12.668 22.609 -9.738 73 2HE LYS 9 2HE LYS 9 14.389 22.167 -9.740 74 1HZ LYS 9 1HZ LYS 9 14.904 24.398 -9.082 75 2HZ LYS 9 2HZ LYS 9 13.309 24.813 -9.071 76 3HZ LYS 9 3HZ LYS 9 13.878 23.696 -8.002 77 H GLN 10 H GLN 10 15.680 21.842 -16.003 78 HA GLN 10 HA GLN 10 15.007 23.607 -18.127 79 1HB GLN 10 1HB GLN 10 17.225 21.537 -17.816 80 2HB GLN 10 2HB GLN 10 17.108 22.619 -19.203 81 1HG GLN 10 1HG GLN 10 17.324 23.542 -16.297 82 2HG GLN 10 2HG GLN 10 18.663 23.464 -17.445 83 1HE2 GLN 10 1HE2 GLN 10 17.984 24.627 -19.701 84 2HE2 GLN 10 2HE2 GLN 10 17.293 26.221 -19.451 85 H GLU 11 H GLU 11 15.177 19.996 -18.116 86 HA GLU 11 HA GLU 11 14.371 19.723 -20.839 87 1HB GLU 11 1HB GLU 11 13.965 17.854 -18.462 88 2HB GLU 11 2HB GLU 11 13.658 17.414 -20.148 89 1HG GLU 11 1HG GLU 11 16.377 18.299 -19.065 90 2HG GLU 11 2HG GLU 11 15.878 16.634 -19.366 91 H ILE 12 H ILE 12 12.377 19.835 -17.861 92 HA ILE 12 HA ILE 12 9.873 19.487 -19.182 93 HB ILE 12 HB ILE 12 10.559 20.847 -16.553 94 1HG1 ILE 12 1HG1 ILE 12 9.365 18.082 -17.114 95 2HG1 ILE 12 2HG1 ILE 12 11.081 18.346 -16.847 96 1HG2 ILE 12 1HG2 ILE 12 7.847 19.896 -17.579 97 2HG2 ILE 12 2HG2 ILE 12 8.167 20.582 -15.982 98 3HG2 ILE 12 3HG2 ILE 12 8.318 21.598 -17.403 99 1HD1 ILE 12 1HD1 ILE 12 10.177 17.619 -14.784 100 2HD1 ILE 12 2HD1 ILE 12 10.554 19.343 -14.598 101 3HD1 ILE 12 3HD1 ILE 12 8.870 18.805 -14.826 102 H ARG 13 H ARG 13 11.797 22.450 -18.462 103 HA ARG 13 HA ARG 13 9.867 24.239 -19.532 104 1HB ARG 13 1HB ARG 13 11.765 24.964 -18.092 105 2HB ARG 13 2HB ARG 13 12.891 24.549 -19.388 106 1HG ARG 13 1HG ARG 13 12.576 26.913 -19.481 107 2HG ARG 13 2HG ARG 13 11.750 26.223 -20.867 108 1HD ARG 13 1HD ARG 13 9.641 26.312 -19.120 109 2HD ARG 13 2HD ARG 13 10.662 27.564 -18.410 110 HE ARG 13 HE ARG 13 10.316 27.793 -21.303 111 1HH1 ARG 13 1HH1 ARG 13 8.754 28.453 -18.204 112 2HH1 ARG 13 2HH1 ARG 13 7.786 29.773 -18.809 113 1HH2 ARG 13 1HH2 ARG 13 8.873 29.322 -22.156 114 2HH2 ARG 13 2HH2 ARG 13 7.905 30.329 -21.105 115 H GLU 14 H GLU 14 12.668 22.614 -21.114 116 HA GLU 14 HA GLU 14 12.343 23.704 -23.667 117 1HB GLU 14 1HB GLU 14 14.191 22.211 -22.723 118 2HB GLU 14 2HB GLU 14 13.162 20.818 -23.069 119 1HG GLU 14 1HG GLU 14 14.105 22.906 -25.083 120 2HG GLU 14 2HG GLU 14 14.868 21.332 -24.818 121 H ALA 15 H ALA 15 10.920 20.691 -22.320 122 HA ALA 15 HA ALA 15 9.277 19.998 -24.492 123 1HB ALA 15 1HB ALA 15 7.956 18.730 -22.857 124 2HB ALA 15 2HB ALA 15 9.694 18.539 -22.548 125 3HB ALA 15 3HB ALA 15 8.720 19.610 -21.519 126 H PHE 16 H PHE 16 8.509 22.098 -21.674 127 HA PHE 16 HA PHE 16 5.875 22.712 -22.311 128 1HB PHE 16 1HB PHE 16 6.879 23.346 -20.198 129 2HB PHE 16 2HB PHE 16 8.002 24.432 -20.985 130 HD1 PHE 16 HD1 PHE 16 4.390 23.926 -20.260 131 HD2 PHE 16 HD2 PHE 16 7.442 26.693 -21.532 132 HE1 PHE 16 HE1 PHE 16 2.794 25.802 -20.006 133 HE2 PHE 16 HE2 PHE 16 5.828 28.562 -21.309 134 HZ PHE 16 HZ PHE 16 3.545 28.135 -20.464 135 H ASP 17 H ASP 17 8.799 24.590 -23.195 136 HA ASP 17 HA ASP 17 7.477 26.541 -24.782 137 1HB ASP 17 1HB ASP 17 10.335 25.479 -24.871 138 2HB ASP 17 2HB ASP 17 9.760 26.836 -25.849 139 H LEU 18 H LEU 18 8.996 23.419 -25.756 140 HA LEU 18 HA LEU 18 8.471 23.643 -28.520 141 1HB LEU 18 1HB LEU 18 9.901 21.952 -27.556 142 2HB LEU 18 2HB LEU 18 8.551 21.150 -26.757 143 HG LEU 18 HG LEU 18 8.436 21.544 -29.761 144 1HD1 LEU 18 1HD1 LEU 18 10.700 20.698 -29.361 145 2HD1 LEU 18 2HD1 LEU 18 10.042 19.373 -28.367 146 3HD1 LEU 18 3HD1 LEU 18 9.675 19.459 -30.107 147 1HD2 LEU 18 1HD2 LEU 18 7.356 19.276 -29.650 148 2HD2 LEU 18 2HD2 LEU 18 7.516 19.304 -27.885 149 3HD2 LEU 18 3HD2 LEU 18 6.462 20.465 -28.716 150 H PHE 19 H PHE 19 6.433 22.129 -25.956 151 HA PHE 19 HA PHE 19 4.299 21.484 -27.706 152 1HB PHE 19 1HB PHE 19 4.277 22.075 -24.727 153 2HB PHE 19 2HB PHE 19 2.934 21.345 -25.608 154 HD1 PHE 19 HD1 PHE 19 4.621 20.297 -23.160 155 HD2 PHE 19 HD2 PHE 19 4.523 19.374 -27.381 156 HE1 PHE 19 HE1 PHE 19 5.184 17.931 -22.686 157 HE2 PHE 19 HE2 PHE 19 5.231 17.084 -26.906 158 HZ PHE 19 HZ PHE 19 5.629 16.351 -24.556 159 H ASP 20 H ASP 20 4.932 24.504 -25.892 160 HA ASP 20 HA ASP 20 2.491 25.749 -26.938 161 1HB ASP 20 1HB ASP 20 3.522 26.525 -24.835 162 2HB ASP 20 2HB ASP 20 4.976 26.996 -25.726 163 H THR 21 H THR 21 3.262 24.630 -29.094 164 HA THR 21 HA THR 21 5.286 25.632 -30.720 165 HB THR 21 HB THR 21 3.852 24.877 -32.622 166 HG1 THR 21 HG1 THR 21 1.913 24.773 -30.571 167 1HG2 THR 21 1HG2 THR 21 3.869 22.912 -30.288 168 2HG2 THR 21 2HG2 THR 21 3.750 22.523 -32.010 169 3HG2 THR 21 3HG2 THR 21 5.239 23.239 -31.369 170 H ASP 22 H ASP 22 2.047 26.995 -30.137 171 HA ASP 22 HA ASP 22 2.194 29.043 -32.134 172 1HB ASP 22 1HB ASP 22 0.104 28.269 -31.052 173 2HB ASP 22 2HB ASP 22 0.633 28.978 -29.519 174 H GLY 23 H GLY 23 3.781 28.756 -29.021 175 1HA GLY 23 1HA GLY 23 5.136 30.157 -27.864 176 2HA GLY 23 2HA GLY 23 5.211 31.211 -29.286 177 H SER 24 H SER 24 2.206 30.288 -27.533 178 HA SER 24 HA SER 24 1.359 33.005 -27.311 179 1HB SER 24 1HB SER 24 0.302 30.702 -25.641 180 2HB SER 24 2HB SER 24 -0.565 32.110 -26.268 181 HG SER 24 HG SER 24 -0.041 31.177 -28.420 182 H GLY 25 H GLY 25 3.296 30.945 -25.253 183 1HA GLY 25 1HA GLY 25 4.612 31.880 -23.423 184 2HA GLY 25 2HA GLY 25 3.227 32.888 -22.968 185 H THR 26 H THR 26 1.338 30.652 -23.711 186 HA THR 26 HA THR 26 1.658 28.732 -21.468 187 HB THR 26 HB THR 26 -0.684 29.098 -20.999 188 HG1 THR 26 HG1 THR 26 -1.796 30.671 -22.031 189 1HG2 THR 26 1HG2 THR 26 -0.516 31.183 -19.829 190 2HG2 THR 26 2HG2 THR 26 1.116 30.484 -19.818 191 3HG2 THR 26 3HG2 THR 26 0.723 31.797 -20.935 192 H ILE 27 H ILE 27 0.745 26.688 -21.889 193 HA ILE 27 HA ILE 27 0.691 25.933 -24.736 194 HB ILE 27 HB ILE 27 0.342 24.402 -22.146 195 1HG1 ILE 27 1HG1 ILE 27 2.559 24.403 -24.247 196 2HG1 ILE 27 2HG1 ILE 27 2.631 25.282 -22.715 197 1HG2 ILE 27 1HG2 ILE 27 0.360 22.344 -23.466 198 2HG2 ILE 27 2HG2 ILE 27 -0.971 23.327 -24.001 199 3HG2 ILE 27 3HG2 ILE 27 0.520 23.269 -24.969 200 1HD1 ILE 27 1HD1 ILE 27 2.470 22.264 -23.066 201 2HD1 ILE 27 2HD1 ILE 27 3.808 23.230 -22.463 202 3HD1 ILE 27 3HD1 ILE 27 2.318 23.108 -21.502 203 H ASP 28 H ASP 28 -1.260 26.151 -25.915 204 HA ASP 28 HA ASP 28 -3.802 26.598 -24.609 205 1HB ASP 28 1HB ASP 28 -3.331 27.360 -26.901 206 2HB ASP 28 2HB ASP 28 -3.205 25.675 -27.438 207 H ALA 29 H ALA 29 -5.475 25.122 -24.086 208 HA ALA 29 HA ALA 29 -5.126 22.574 -23.310 209 1HB ALA 29 1HB ALA 29 -7.534 23.664 -24.825 210 2HB ALA 29 2HB ALA 29 -7.534 22.194 -23.829 211 3HB ALA 29 3HB ALA 29 -7.234 23.771 -23.077 212 H LYS 30 H LYS 30 -5.832 23.404 -26.765 213 HA LYS 30 HA LYS 30 -5.891 20.672 -27.659 214 1HB LYS 30 1HB LYS 30 -5.465 23.318 -29.107 215 2HB LYS 30 2HB LYS 30 -5.386 21.754 -29.914 216 1HG LYS 30 1HG LYS 30 -7.551 22.582 -30.279 217 2HG LYS 30 2HG LYS 30 -7.689 21.207 -29.179 218 1HD LYS 30 1HD LYS 30 -8.023 22.749 -27.272 219 2HD LYS 30 2HD LYS 30 -7.742 24.146 -28.340 220 1HE LYS 30 1HE LYS 30 -9.741 23.514 -29.673 221 2HE LYS 30 2HE LYS 30 -10.016 22.126 -28.603 222 1HZ LYS 30 1HZ LYS 30 -11.361 23.992 -28.005 223 2HZ LYS 30 2HZ LYS 30 -10.289 23.669 -26.794 224 3HZ LYS 30 3HZ LYS 30 -10.037 24.950 -27.798 225 H GLU 31 H GLU 31 -3.240 23.056 -27.330 226 HA GLU 31 HA GLU 31 -1.242 21.452 -28.683 227 1HB GLU 31 1HB GLU 31 -1.007 23.698 -26.646 228 2HB GLU 31 2HB GLU 31 0.356 22.894 -27.423 229 1HG GLU 31 1HG GLU 31 -0.391 23.629 -29.631 230 2HG GLU 31 2HG GLU 31 -1.821 24.398 -28.929 231 H LEU 32 H LEU 32 -2.418 21.759 -25.290 232 HA LEU 32 HA LEU 32 -0.485 19.927 -24.236 233 1HB LEU 32 1HB LEU 32 -2.095 21.480 -22.898 234 2HB LEU 32 2HB LEU 32 -3.276 20.182 -23.112 235 HG LEU 32 HG LEU 32 -1.315 18.633 -22.186 236 1HD1 LEU 32 1HD1 LEU 32 -0.462 21.345 -21.117 237 2HD1 LEU 32 2HD1 LEU 32 0.113 19.771 -20.538 238 3HD1 LEU 32 3HD1 LEU 32 0.483 20.277 -22.184 239 1HD2 LEU 32 1HD2 LEU 32 -2.125 18.980 -19.895 240 2HD2 LEU 32 2HD2 LEU 32 -2.870 20.516 -20.379 241 3HD2 LEU 32 3HD2 LEU 32 -3.466 18.985 -21.046 242 H LYS 33 H LYS 33 -3.788 19.422 -25.571 243 HA LYS 33 HA LYS 33 -3.902 16.609 -25.175 244 1HB LYS 33 1HB LYS 33 -5.746 18.123 -25.762 245 2HB LYS 33 2HB LYS 33 -5.141 18.201 -27.437 246 1HG LYS 33 1HG LYS 33 -5.399 15.663 -27.516 247 2HG LYS 33 2HG LYS 33 -6.128 15.777 -25.897 248 1HD LYS 33 1HD LYS 33 -7.893 17.312 -26.849 249 2HD LYS 33 2HD LYS 33 -7.145 17.124 -28.443 250 1HE LYS 33 1HE LYS 33 -9.011 15.619 -28.383 251 2HE LYS 33 2HE LYS 33 -7.552 14.626 -28.270 252 1HZ LYS 33 1HZ LYS 33 -9.109 13.880 -26.688 253 2HZ LYS 33 2HZ LYS 33 -7.927 14.641 -25.845 254 3HZ LYS 33 3HZ LYS 33 -9.365 15.400 -26.090 255 H VAL 34 H VAL 34 -2.648 18.441 -28.008 256 HA VAL 34 HA VAL 34 -1.661 16.220 -29.481 257 HB VAL 34 HB VAL 34 -0.718 19.101 -29.240 258 1HG1 VAL 34 1HG1 VAL 34 1.276 17.857 -29.905 259 2HG1 VAL 34 2HG1 VAL 34 0.340 16.945 -31.112 260 3HG1 VAL 34 3HG1 VAL 34 0.611 18.688 -31.311 261 1HG2 VAL 34 1HG2 VAL 34 -2.139 17.585 -31.472 262 2HG2 VAL 34 2HG2 VAL 34 -2.938 18.668 -30.318 263 3HG2 VAL 34 3HG2 VAL 34 -1.744 19.316 -31.452 264 H ALA 35 H ALA 35 -0.021 18.188 -26.952 265 HA ALA 35 HA ALA 35 2.425 16.863 -26.914 266 1HB ALA 35 1HB ALA 35 2.646 17.665 -24.610 267 2HB ALA 35 2HB ALA 35 1.948 18.928 -25.651 268 3HB ALA 35 3HB ALA 35 0.937 18.023 -24.512 269 H MET 36 H MET 36 -0.484 16.090 -24.948 270 HA MET 36 HA MET 36 0.613 13.786 -23.670 271 1HB MET 36 1HB MET 36 -2.205 14.709 -24.171 272 2HB MET 36 2HB MET 36 -1.823 13.258 -23.229 273 1HG MET 36 1HG MET 36 -0.388 14.513 -21.709 274 2HG MET 36 2HG MET 36 -0.697 16.013 -22.588 275 1HE MET 36 1HE MET 36 -4.418 16.736 -21.765 276 2HE MET 36 2HE MET 36 -2.951 17.243 -22.632 277 3HE MET 36 3HE MET 36 -3.808 15.798 -23.145 278 H ARG 37 H ARG 37 -1.265 14.094 -26.716 279 HA ARG 37 HA ARG 37 -1.379 11.354 -27.349 280 1HB ARG 37 1HB ARG 37 -2.283 13.497 -28.604 281 2HB ARG 37 2HB ARG 37 -0.744 13.465 -29.453 282 1HG ARG 37 1HG ARG 37 -2.959 11.388 -29.490 283 2HG ARG 37 2HG ARG 37 -2.390 12.428 -30.796 284 1HD ARG 37 1HD ARG 37 -1.394 10.423 -31.391 285 2HD ARG 37 2HD ARG 37 -0.097 11.166 -30.488 286 HE ARG 37 HE ARG 37 -0.410 9.683 -28.709 287 1HH1 ARG 37 1HH1 ARG 37 -2.802 9.036 -31.264 288 2HH1 ARG 37 2HH1 ARG 37 -3.427 7.613 -30.478 289 1HH2 ARG 37 1HH2 ARG 37 -1.566 8.052 -27.537 290 2HH2 ARG 37 2HH2 ARG 37 -2.611 6.964 -28.395 291 H ALA 38 H ALA 38 1.182 13.733 -28.236 292 HA ALA 38 HA ALA 38 2.974 11.898 -29.422 293 1HB ALA 38 1HB ALA 38 3.094 14.344 -29.703 294 2HB ALA 38 2HB ALA 38 3.598 14.526 -28.009 295 3HB ALA 38 3HB ALA 38 4.645 13.673 -29.161 296 H LEU 39 H LEU 39 2.725 12.966 -26.036 297 HA LEU 39 HA LEU 39 5.000 11.578 -25.005 298 1HB LEU 39 1HB LEU 39 2.402 12.538 -23.789 299 2HB LEU 39 2HB LEU 39 3.651 11.780 -22.814 300 HG LEU 39 HG LEU 39 4.257 14.237 -24.497 301 1HD1 LEU 39 1HD1 LEU 39 2.380 14.909 -23.046 302 2HD1 LEU 39 2HD1 LEU 39 3.151 14.141 -21.650 303 3HD1 LEU 39 3HD1 LEU 39 3.876 15.573 -22.404 304 1HD2 LEU 39 1HD2 LEU 39 6.186 12.963 -23.610 305 2HD2 LEU 39 2HD2 LEU 39 6.043 14.537 -22.816 306 3HD2 LEU 39 3HD2 LEU 39 5.510 13.072 -21.972 307 H GLY 40 H GLY 40 1.966 10.336 -26.183 308 1HA GLY 40 1HA GLY 40 1.650 8.088 -26.597 309 2HA GLY 40 2HA GLY 40 2.786 7.625 -25.328 310 H PHE 41 H PHE 41 0.226 10.020 -24.754 311 HA PHE 41 HA PHE 41 -1.174 8.179 -22.873 312 1HB PHE 41 1HB PHE 41 -1.581 11.073 -23.696 313 2HB PHE 41 2HB PHE 41 -2.706 10.226 -22.680 314 HD1 PHE 41 HD1 PHE 41 -2.496 10.377 -20.339 315 HD2 PHE 41 HD2 PHE 41 0.979 11.032 -22.809 316 HE1 PHE 41 HE1 PHE 41 -1.188 11.000 -18.342 317 HE2 PHE 41 HE2 PHE 41 2.274 11.690 -20.806 318 HZ PHE 41 HZ PHE 41 1.207 11.666 -18.570 319 H GLU 42 H GLU 42 -3.684 8.305 -23.226 320 HA GLU 42 HA GLU 42 -4.445 8.132 -26.128 321 1HB GLU 42 1HB GLU 42 -5.399 6.602 -23.683 322 2HB GLU 42 2HB GLU 42 -6.360 6.732 -25.158 323 1HG GLU 42 1HG GLU 42 -3.499 5.665 -25.143 324 2HG GLU 42 2HG GLU 42 -4.934 4.644 -24.987 325 HA PRO 43 HA PRO 43 -6.215 11.909 -24.317 326 1HB PRO 43 1HB PRO 43 -6.652 12.383 -27.281 327 2HB PRO 43 2HB PRO 43 -6.200 13.556 -26.006 328 1HG PRO 43 1HG PRO 43 -4.307 12.530 -27.611 329 2HG PRO 43 2HG PRO 43 -4.008 12.637 -25.851 330 1HD PRO 43 1HD PRO 43 -4.901 10.218 -27.474 331 2HD PRO 43 2HD PRO 43 -3.656 10.350 -26.198 332 H LYS 44 H LYS 44 -7.907 10.116 -23.639 333 HA LYS 44 HA LYS 44 -10.448 10.094 -24.978 334 1HB LYS 44 1HB LYS 44 -9.746 9.632 -22.054 335 2HB LYS 44 2HB LYS 44 -11.308 9.287 -22.826 336 1HG LYS 44 1HG LYS 44 -10.183 7.718 -24.389 337 2HG LYS 44 2HG LYS 44 -8.642 7.995 -23.555 338 1HD LYS 44 1HD LYS 44 -9.702 7.235 -21.410 339 2HD LYS 44 2HD LYS 44 -11.176 6.833 -22.305 340 1HE LYS 44 1HE LYS 44 -8.402 5.623 -22.768 341 2HE LYS 44 2HE LYS 44 -9.745 4.845 -21.915 342 1HZ LYS 44 1HZ LYS 44 -11.007 4.936 -23.947 343 2HZ LYS 44 2HZ LYS 44 -9.737 5.623 -24.746 344 3HZ LYS 44 3HZ LYS 44 -9.606 4.093 -24.152 345 H LYS 45 H LYS 45 -11.301 11.995 -25.485 346 HA LYS 45 HA LYS 45 -10.860 14.441 -24.642 347 1HB LYS 45 1HB LYS 45 -13.010 15.150 -25.568 348 2HB LYS 45 2HB LYS 45 -12.165 13.967 -26.571 349 1HG LYS 45 1HG LYS 45 -13.670 12.162 -25.624 350 2HG LYS 45 2HG LYS 45 -14.574 13.438 -24.778 351 1HD LYS 45 1HD LYS 45 -15.073 14.534 -26.936 352 2HD LYS 45 2HD LYS 45 -14.174 13.264 -27.795 353 1HE LYS 45 1HE LYS 45 -15.743 11.550 -26.903 354 2HE LYS 45 2HE LYS 45 -16.641 12.815 -26.042 355 1HZ LYS 45 1HZ LYS 45 -17.137 13.810 -28.155 356 2HZ LYS 45 2HZ LYS 45 -16.308 12.630 -28.954 357 3HZ LYS 45 3HZ LYS 45 -17.666 12.251 -28.104 358 H GLU 46 H GLU 46 -13.376 12.472 -22.990 359 HA GLU 46 HA GLU 46 -14.305 14.575 -21.301 360 1HB GLU 46 1HB GLU 46 -14.284 11.550 -20.858 361 2HB GLU 46 2HB GLU 46 -15.135 12.728 -19.851 362 1HG GLU 46 1HG GLU 46 -16.454 13.468 -21.829 363 2HG GLU 46 2HG GLU 46 -15.631 12.256 -22.827 364 H GLU 47 H GLU 47 -11.951 11.951 -20.619 365 HA GLU 47 HA GLU 47 -11.232 12.828 -18.007 366 1HB GLU 47 1HB GLU 47 -9.771 11.129 -20.073 367 2HB GLU 47 2HB GLU 47 -9.167 11.431 -18.442 368 1HG GLU 47 1HG GLU 47 -10.322 9.283 -18.513 369 2HG GLU 47 2HG GLU 47 -11.144 10.413 -17.432 370 H ILE 48 H ILE 48 -9.816 13.475 -21.214 371 HA ILE 48 HA ILE 48 -7.636 15.120 -20.418 372 HB ILE 48 HB ILE 48 -9.409 15.040 -22.876 373 1HG1 ILE 48 1HG1 ILE 48 -7.854 13.083 -22.260 374 2HG1 ILE 48 2HG1 ILE 48 -7.755 13.757 -23.885 375 1HG2 ILE 48 1HG2 ILE 48 -8.585 17.283 -22.895 376 2HG2 ILE 48 2HG2 ILE 48 -6.946 16.757 -22.462 377 3HG2 ILE 48 3HG2 ILE 48 -7.635 16.353 -24.051 378 1HD1 ILE 48 1HD1 ILE 48 -5.728 14.863 -23.441 379 2HD1 ILE 48 2HD1 ILE 48 -5.855 14.644 -21.677 380 3HD1 ILE 48 3HD1 ILE 48 -5.523 13.261 -22.717 381 H LYS 49 H LYS 49 -10.978 16.183 -21.351 382 HA LYS 49 HA LYS 49 -10.505 18.912 -20.747 383 1HB LYS 49 1HB LYS 49 -13.042 17.241 -20.804 384 2HB LYS 49 2HB LYS 49 -13.064 18.984 -20.534 385 1HG LYS 49 1HG LYS 49 -11.766 17.729 -22.992 386 2HG LYS 49 2HG LYS 49 -13.470 18.197 -22.913 387 1HD LYS 49 1HD LYS 49 -12.802 20.540 -22.364 388 2HD LYS 49 2HD LYS 49 -11.096 20.086 -22.541 389 1HE LYS 49 1HE LYS 49 -11.512 19.411 -24.894 390 2HE LYS 49 2HE LYS 49 -13.216 19.877 -24.725 391 1HZ LYS 49 1HZ LYS 49 -10.920 21.681 -24.437 392 2HZ LYS 49 2HZ LYS 49 -11.924 21.593 -25.741 393 3HZ LYS 49 3HZ LYS 49 -12.504 22.108 -24.287 394 H LYS 50 H LYS 50 -11.849 16.309 -18.669 395 HA LYS 50 HA LYS 50 -12.365 17.906 -16.385 396 1HB LYS 50 1HB LYS 50 -11.542 14.996 -16.672 397 2HB LYS 50 2HB LYS 50 -12.030 15.718 -15.132 398 1HG LYS 50 1HG LYS 50 -14.243 16.180 -15.904 399 2HG LYS 50 2HG LYS 50 -13.816 15.864 -17.590 400 1HD LYS 50 1HD LYS 50 -13.352 13.479 -17.028 401 2HD LYS 50 2HD LYS 50 -13.875 13.781 -15.357 402 1HE LYS 50 1HE LYS 50 -16.130 14.401 -16.170 403 2HE LYS 50 2HE LYS 50 -15.598 14.212 -17.850 404 1HZ LYS 50 1HZ LYS 50 -16.763 12.296 -17.097 405 2HZ LYS 50 2HZ LYS 50 -15.194 11.899 -17.400 406 3HZ LYS 50 3HZ LYS 50 -15.715 12.072 -15.845 407 H MET 51 H MET 51 -9.386 15.952 -17.101 408 HA MET 51 HA MET 51 -7.948 16.793 -14.861 409 1HB MET 51 1HB MET 51 -7.422 14.883 -16.431 410 2HB MET 51 2HB MET 51 -6.831 16.073 -17.604 411 1HG MET 51 1HG MET 51 -5.207 16.873 -15.821 412 2HG MET 51 2HG MET 51 -5.844 15.606 -14.765 413 1HE MET 51 1HE MET 51 -3.708 16.493 -17.889 414 2HE MET 51 2HE MET 51 -3.246 14.884 -18.497 415 3HE MET 51 3HE MET 51 -4.923 15.438 -18.658 416 H ILE 52 H ILE 52 -7.898 18.136 -18.208 417 HA ILE 52 HA ILE 52 -6.076 20.235 -17.775 418 HB ILE 52 HB ILE 52 -8.443 19.903 -19.648 419 1HG1 ILE 52 1HG1 ILE 52 -5.413 20.047 -20.046 420 2HG1 ILE 52 2HG1 ILE 52 -6.347 18.552 -19.953 421 1HG2 ILE 52 1HG2 ILE 52 -8.274 22.346 -19.247 422 2HG2 ILE 52 2HG2 ILE 52 -6.543 22.279 -19.640 423 3HG2 ILE 52 3HG2 ILE 52 -7.771 21.921 -20.867 424 1HD1 ILE 52 1HD1 ILE 52 -7.654 19.345 -21.984 425 2HD1 ILE 52 2HD1 ILE 52 -6.461 20.657 -22.143 426 3HD1 ILE 52 3HD1 ILE 52 -5.936 18.979 -22.264 427 H SER 53 H SER 53 -9.660 20.259 -17.286 428 HA SER 53 HA SER 53 -9.753 22.940 -16.379 429 1HB SER 53 1HB SER 53 -11.568 20.630 -15.542 430 2HB SER 53 2HB SER 53 -11.915 22.363 -15.404 431 HG SER 53 HG SER 53 -11.521 20.858 -17.787 432 H GLU 54 H GLU 54 -9.364 19.910 -14.453 433 HA GLU 54 HA GLU 54 -9.249 21.211 -11.924 434 1HB GLU 54 1HB GLU 54 -7.912 18.636 -12.868 435 2HB GLU 54 2HB GLU 54 -7.995 19.168 -11.184 436 1HG GLU 54 1HG GLU 54 -10.420 18.561 -12.941 437 2HG GLU 54 2HG GLU 54 -9.746 17.506 -11.698 438 H ILE 55 H ILE 55 -6.620 20.530 -14.266 439 HA ILE 55 HA ILE 55 -4.552 21.623 -12.539 440 HB ILE 55 HB ILE 55 -4.678 21.027 -15.516 441 1HG1 ILE 55 1HG1 ILE 55 -4.886 19.020 -14.058 442 2HG1 ILE 55 2HG1 ILE 55 -3.453 19.026 -15.075 443 1HG2 ILE 55 1HG2 ILE 55 -2.265 21.823 -13.849 444 2HG2 ILE 55 2HG2 ILE 55 -2.180 21.060 -15.457 445 3HG2 ILE 55 3HG2 ILE 55 -2.936 22.644 -15.268 446 1HD1 ILE 55 1HD1 ILE 55 -2.968 18.173 -12.837 447 2HD1 ILE 55 2HD1 ILE 55 -2.067 19.669 -13.104 448 3HD1 ILE 55 3HD1 ILE 55 -3.529 19.674 -12.090 449 H ASP 56 H ASP 56 -6.715 22.995 -15.012 450 HA ASP 56 HA ASP 56 -5.106 25.336 -15.397 451 1HB ASP 56 1HB ASP 56 -6.483 24.323 -17.165 452 2HB ASP 56 2HB ASP 56 -7.955 24.720 -16.257 453 H LYS 57 H LYS 57 -5.038 25.797 -13.014 454 HA LYS 57 HA LYS 57 -7.266 27.016 -11.668 455 1HB LYS 57 1HB LYS 57 -4.293 27.577 -11.290 456 2HB LYS 57 2HB LYS 57 -5.587 27.926 -10.142 457 1HG LYS 57 1HG LYS 57 -4.590 25.173 -11.000 458 2HG LYS 57 2HG LYS 57 -4.357 25.979 -9.447 459 1HD LYS 57 1HD LYS 57 -6.926 26.000 -9.217 460 2HD LYS 57 2HD LYS 57 -6.958 24.884 -10.599 461 1HE LYS 57 1HE LYS 57 -5.539 24.427 -7.929 462 2HE LYS 57 2HE LYS 57 -7.037 23.654 -8.476 463 1HZ LYS 57 1HZ LYS 57 -5.158 22.243 -8.806 464 2HZ LYS 57 2HZ LYS 57 -5.824 22.657 -10.255 465 3HZ LYS 57 3HZ LYS 57 -4.415 23.361 -9.764 466 H ASP 58 H ASP 58 -4.656 28.379 -13.660 467 HA ASP 58 HA ASP 58 -5.862 31.127 -13.489 468 1HB ASP 58 1HB ASP 58 -3.771 30.982 -12.262 469 2HB ASP 58 2HB ASP 58 -2.971 30.175 -13.622 470 H GLY 59 H GLY 59 -4.182 28.744 -15.540 471 1HA GLY 59 1HA GLY 59 -3.523 30.313 -17.691 472 2HA GLY 59 2HA GLY 59 -3.820 28.579 -17.722 473 H SER 60 H SER 60 -6.764 29.137 -16.996 474 HA SER 60 HA SER 60 -8.775 29.464 -18.031 475 1HB SER 60 1HB SER 60 -7.382 32.019 -18.935 476 2HB SER 60 2HB SER 60 -9.131 31.752 -18.840 477 HG SER 60 HG SER 60 -7.262 31.733 -16.692 478 H GLY 61 H GLY 61 -7.909 27.591 -19.493 479 1HA GLY 61 1HA GLY 61 -8.599 26.770 -21.621 480 2HA GLY 61 2HA GLY 61 -8.393 28.367 -22.350 481 H THR 62 H THR 62 -5.758 28.760 -20.890 482 HA THR 62 HA THR 62 -4.089 26.843 -22.441 483 HB THR 62 HB THR 62 -2.315 28.444 -22.421 484 HG1 THR 62 HG1 THR 62 -4.057 30.046 -20.834 485 1HG2 THR 62 1HG2 THR 62 -3.232 30.251 -23.781 486 2HG2 THR 62 2HG2 THR 62 -4.073 28.758 -24.205 487 3HG2 THR 62 3HG2 THR 62 -4.868 29.959 -23.173 488 H ILE 63 H ILE 63 -1.946 26.478 -21.241 489 HA ILE 63 HA ILE 63 -2.328 26.188 -18.300 490 HB ILE 63 HB ILE 63 -1.008 24.289 -20.274 491 1HG1 ILE 63 1HG1 ILE 63 -3.471 24.148 -20.403 492 2HG1 ILE 63 2HG1 ILE 63 -2.713 22.690 -19.787 493 1HG2 ILE 63 1HG2 ILE 63 0.201 24.268 -18.170 494 2HG2 ILE 63 2HG2 ILE 63 -1.303 24.078 -17.258 495 3HG2 ILE 63 3HG2 ILE 63 -0.734 22.776 -18.324 496 1HD1 ILE 63 1HD1 ILE 63 -4.777 23.254 -18.570 497 2HD1 ILE 63 2HD1 ILE 63 -3.383 23.213 -17.497 498 3HD1 ILE 63 3HD1 ILE 63 -4.064 24.772 -18.012 499 H ASP 64 H ASP 64 -0.832 27.457 -17.292 500 HA ASP 64 HA ASP 64 1.442 28.535 -18.812 501 1HB ASP 64 1HB ASP 64 1.961 29.835 -16.814 502 2HB ASP 64 2HB ASP 64 0.280 30.016 -17.254 503 H PHE 65 H PHE 65 3.617 28.578 -17.731 504 HA PHE 65 HA PHE 65 4.641 25.977 -17.732 505 1HB PHE 65 1HB PHE 65 5.992 27.932 -18.256 506 2HB PHE 65 2HB PHE 65 5.843 28.519 -16.594 507 HD1 PHE 65 HD1 PHE 65 7.867 28.290 -15.392 508 HD2 PHE 65 HD2 PHE 65 6.738 25.208 -18.199 509 HE1 PHE 65 HE1 PHE 65 9.875 26.980 -14.778 510 HE2 PHE 65 HE2 PHE 65 8.706 23.875 -17.513 511 HZ PHE 65 HZ PHE 65 10.304 24.773 -15.839 512 H GLU 66 H GLU 66 3.390 27.862 -14.978 513 HA GLU 66 HA GLU 66 4.786 26.192 -13.010 514 1HB GLU 66 1HB GLU 66 2.435 28.088 -12.579 515 2HB GLU 66 2HB GLU 66 3.452 27.336 -11.348 516 1HG GLU 66 1HG GLU 66 5.449 28.498 -12.278 517 2HG GLU 66 2HG GLU 66 4.424 29.301 -13.478 518 H GLU 67 H GLU 67 1.451 26.485 -14.235 519 HA GLU 67 HA GLU 67 0.262 24.280 -12.901 520 1HB GLU 67 1HB GLU 67 -0.226 25.477 -15.651 521 2HB GLU 67 2HB GLU 67 -1.293 24.289 -14.885 522 1HG GLU 67 1HG GLU 67 -1.871 25.774 -13.097 523 2HG GLU 67 2HG GLU 67 -0.663 26.967 -13.581 524 H PHE 68 H PHE 68 1.915 24.454 -16.093 525 HA PHE 68 HA PHE 68 1.681 21.730 -16.784 526 1HB PHE 68 1HB PHE 68 2.390 23.490 -18.350 527 2HB PHE 68 2HB PHE 68 3.880 23.724 -17.450 528 HD1 PHE 68 HD1 PHE 68 5.814 22.434 -17.993 529 HD2 PHE 68 HD2 PHE 68 1.930 21.139 -19.350 530 HE1 PHE 68 HE1 PHE 68 6.881 20.787 -19.515 531 HE2 PHE 68 HE2 PHE 68 3.007 19.402 -20.762 532 HZ PHE 68 HZ PHE 68 5.495 19.216 -20.814 533 H LEU 69 H LEU 69 4.446 23.397 -15.169 534 HA LEU 69 HA LEU 69 6.053 21.153 -14.744 535 1HB LEU 69 1HB LEU 69 6.827 23.440 -14.432 536 2HB LEU 69 2HB LEU 69 5.690 23.689 -13.103 537 HG LEU 69 HG LEU 69 6.907 22.057 -11.707 538 1HD1 LEU 69 1HD1 LEU 69 8.830 21.880 -14.072 539 2HD1 LEU 69 2HD1 LEU 69 9.140 21.237 -12.448 540 3HD1 LEU 69 3HD1 LEU 69 7.836 20.552 -13.420 541 1HD2 LEU 69 1HD2 LEU 69 8.922 23.426 -11.367 542 2HD2 LEU 69 2HD2 LEU 69 8.693 24.188 -12.957 543 3HD2 LEU 69 3HD2 LEU 69 7.506 24.451 -11.661 544 H THR 70 H THR 70 3.472 22.520 -12.654 545 HA THR 70 HA THR 70 3.693 20.660 -10.540 546 HB THR 70 HB THR 70 1.153 22.021 -11.543 547 HG1 THR 70 HG1 THR 70 2.789 23.513 -11.113 548 1HG2 THR 70 1HG2 THR 70 0.466 21.859 -9.175 549 2HG2 THR 70 2HG2 THR 70 0.696 20.245 -9.872 550 3HG2 THR 70 3HG2 THR 70 1.936 20.938 -8.800 551 H MET 71 H MET 71 1.600 20.505 -13.499 552 HA MET 71 HA MET 71 0.447 17.989 -12.948 553 1HB MET 71 1HB MET 71 -0.261 19.560 -14.779 554 2HB MET 71 2HB MET 71 1.186 19.107 -15.680 555 1HG MET 71 1HG MET 71 0.356 16.659 -15.495 556 2HG MET 71 2HG MET 71 -1.139 17.335 -14.853 557 1HE MET 71 1HE MET 71 1.168 18.652 -17.896 558 2HE MET 71 2HE MET 71 1.228 16.871 -17.898 559 3HE MET 71 3HE MET 71 0.381 17.736 -19.198 560 H MET 72 H MET 72 3.354 18.735 -14.940 561 HA MET 72 HA MET 72 4.021 16.065 -15.562 562 1HB MET 72 1HB MET 72 5.800 18.520 -15.243 563 2HB MET 72 2HB MET 72 6.350 16.985 -15.917 564 1HG MET 72 1HG MET 72 4.143 18.752 -17.059 565 2HG MET 72 2HG MET 72 5.772 18.573 -17.688 566 1HE MET 72 1HE MET 72 6.157 15.326 -17.531 567 2HE MET 72 2HE MET 72 5.669 14.958 -19.198 568 3HE MET 72 3HE MET 72 6.673 16.389 -18.867 569 H THR 73 H THR 73 5.036 18.054 -12.760 570 HA THR 73 HA THR 73 6.664 16.083 -11.520 571 HB THR 73 HB THR 73 4.971 18.233 -10.189 572 HG1 THR 73 HG1 THR 73 6.385 19.086 -11.708 573 1HG2 THR 73 1HG2 THR 73 7.446 16.714 -9.245 574 2HG2 THR 73 2HG2 THR 73 6.704 18.100 -8.420 575 3HG2 THR 73 3HG2 THR 73 5.814 16.575 -8.557 576 H ALA 74 H ALA 74 3.139 16.771 -11.115 577 HA ALA 74 HA ALA 74 2.626 14.738 -9.227 578 1HB ALA 74 1HB ALA 74 0.734 15.878 -11.325 579 2HB ALA 74 2HB ALA 74 0.280 15.016 -9.844 580 3HB ALA 74 3HB ALA 74 1.081 16.596 -9.737 581 H LYS 75 H LYS 75 2.788 14.559 -12.790 582 HA LYS 75 HA LYS 75 1.773 11.883 -12.992 583 1HB LYS 75 1HB LYS 75 3.691 13.396 -14.792 584 2HB LYS 75 2HB LYS 75 2.945 11.858 -15.208 585 1HG LYS 75 1HG LYS 75 1.302 14.334 -14.548 586 2HG LYS 75 2HG LYS 75 1.895 13.956 -16.169 587 1HD LYS 75 1HD LYS 75 0.631 11.818 -16.139 588 2HD LYS 75 2HD LYS 75 0.093 12.149 -14.488 589 1HE LYS 75 1HE LYS 75 -1.684 12.725 -16.059 590 2HE LYS 75 2HE LYS 75 -1.104 14.171 -15.223 591 1HZ LYS 75 1HZ LYS 75 -1.393 14.572 -17.534 592 2HZ LYS 75 2HZ LYS 75 0.203 14.682 -17.169 593 3HZ LYS 75 3HZ LYS 75 -0.373 13.349 -17.950 594 H MET 76 H MET 76 4.863 13.014 -11.763 595 HA MET 76 HA MET 76 5.644 10.195 -11.403 596 1HB MET 76 1HB MET 76 8.020 10.723 -12.059 597 2HB MET 76 2HB MET 76 6.837 10.555 -13.347 598 1HG MET 76 1HG MET 76 8.316 12.316 -13.897 599 2HG MET 76 2HG MET 76 6.712 12.985 -13.640 600 1HE MET 76 1HE MET 76 9.472 14.627 -13.957 601 2HE MET 76 2HE MET 76 7.867 15.375 -13.784 602 3HE MET 76 3HE MET 76 9.204 15.887 -12.730 Start of MODEL 19 1 H ARG 1 H ARG 1 16.431 18.831 -1.625 2 HA ARG 1 HA ARG 1 15.550 19.895 -3.572 3 1HB ARG 1 1HB ARG 1 16.934 18.015 -3.969 4 2HB ARG 1 2HB ARG 1 15.668 16.857 -3.524 5 1HG ARG 1 1HG ARG 1 14.420 17.243 -5.490 6 2HG ARG 1 2HG ARG 1 15.275 18.743 -5.867 7 1HD ARG 1 1HD ARG 1 16.487 15.947 -5.906 8 2HD ARG 1 2HD ARG 1 15.897 16.796 -7.327 9 HE ARG 1 HE ARG 1 18.431 17.130 -6.046 10 1HH1 ARG 1 1HH1 ARG 1 15.969 18.986 -7.851 11 2HH1 ARG 1 2HH1 ARG 1 17.051 20.326 -8.148 12 1HH2 ARG 1 1HH2 ARG 1 19.848 18.803 -6.604 13 2HH2 ARG 1 2HH2 ARG 1 19.322 20.113 -7.630 14 H VAL 2 H VAL 2 13.844 20.309 -4.926 15 HA VAL 2 HA VAL 2 11.145 19.802 -3.996 16 HB VAL 2 HB VAL 2 10.538 21.128 -6.013 17 1HG1 VAL 2 1HG1 VAL 2 11.037 22.224 -3.866 18 2HG1 VAL 2 2HG1 VAL 2 12.746 22.377 -4.327 19 3HG1 VAL 2 3HG1 VAL 2 11.496 23.235 -5.247 20 1HG2 VAL 2 1HG2 VAL 2 13.542 21.429 -6.524 21 2HG2 VAL 2 2HG2 VAL 2 12.473 20.417 -7.507 22 3HG2 VAL 2 3HG2 VAL 2 12.208 22.162 -7.419 23 H GLY 3 H GLY 3 12.182 17.306 -4.341 24 1HA GLY 3 1HA GLY 3 11.829 15.284 -5.345 25 2HA GLY 3 2HA GLY 3 10.534 16.013 -6.305 26 H LEU 4 H LEU 4 11.455 17.589 -8.063 27 HA LEU 4 HA LEU 4 12.890 15.867 -9.889 28 1HB LEU 4 1HB LEU 4 11.939 18.727 -10.192 29 2HB LEU 4 2HB LEU 4 12.468 17.659 -11.497 30 HG LEU 4 HG LEU 4 9.999 17.289 -9.729 31 1HD1 LEU 4 1HD1 LEU 4 10.439 17.949 -12.652 32 2HD1 LEU 4 2HD1 LEU 4 8.851 17.629 -11.929 33 3HD1 LEU 4 3HD1 LEU 4 9.793 19.043 -11.409 34 1HD2 LEU 4 1HD2 LEU 4 11.055 15.535 -11.994 35 2HD2 LEU 4 2HD2 LEU 4 10.857 15.047 -10.292 36 3HD2 LEU 4 3HD2 LEU 4 9.440 15.408 -11.274 37 H THR 5 H THR 5 14.899 16.046 -10.750 38 HA THR 5 HA THR 5 16.961 17.652 -9.513 39 HB THR 5 HB THR 5 18.343 16.794 -11.380 40 HG1 THR 5 HG1 THR 5 16.128 15.229 -12.105 41 1HG2 THR 5 1HG2 THR 5 18.263 14.429 -10.728 42 2HG2 THR 5 2HG2 THR 5 18.131 15.488 -9.312 43 3HG2 THR 5 3HG2 THR 5 16.690 14.667 -9.941 44 H GLU 6 H GLU 6 18.276 19.265 -10.766 45 HA GLU 6 HA GLU 6 16.726 21.247 -12.158 46 1HB GLU 6 1HB GLU 6 19.720 20.691 -11.961 47 2HB GLU 6 2HB GLU 6 19.067 21.936 -13.028 48 1HG GLU 6 1HG GLU 6 19.723 22.950 -10.928 49 2HG GLU 6 2HG GLU 6 17.978 23.085 -11.163 50 H GLU 7 H GLU 7 18.666 18.468 -13.273 51 HA GLU 7 HA GLU 7 18.448 18.892 -16.062 52 1HB GLU 7 1HB GLU 7 18.560 16.307 -14.424 53 2HB GLU 7 2HB GLU 7 18.661 16.386 -16.181 54 1HG GLU 7 1HG GLU 7 20.895 16.217 -15.312 55 2HG GLU 7 2HG GLU 7 20.682 17.809 -16.044 56 H GLN 8 H GLN 8 16.240 16.981 -13.876 57 HA GLN 8 HA GLN 8 14.309 16.442 -15.883 58 1HB GLN 8 1HB GLN 8 14.116 16.765 -12.887 59 2HB GLN 8 2HB GLN 8 12.688 16.402 -13.870 60 1HG GLN 8 1HG GLN 8 13.577 14.330 -14.646 61 2HG GLN 8 2HG GLN 8 15.199 14.706 -14.063 62 1HE2 GLN 8 1HE2 GLN 8 12.187 13.209 -13.200 63 2HE2 GLN 8 2HE2 GLN 8 12.566 12.973 -11.506 64 H LYS 9 H LYS 9 14.454 19.301 -13.623 65 HA LYS 9 HA LYS 9 12.062 20.458 -14.675 66 1HB LYS 9 1HB LYS 9 14.446 21.732 -13.295 67 2HB LYS 9 2HB LYS 9 12.947 22.592 -13.703 68 1HG LYS 9 1HG LYS 9 11.636 20.881 -12.435 69 2HG LYS 9 2HG LYS 9 13.132 20.130 -11.903 70 1HD LYS 9 1HD LYS 9 12.256 23.011 -11.342 71 2HD LYS 9 2HD LYS 9 12.100 21.660 -10.217 72 1HE LYS 9 1HE LYS 9 14.725 22.825 -11.254 73 2HE LYS 9 2HE LYS 9 14.044 23.023 -9.635 74 1HZ LYS 9 1HZ LYS 9 14.242 20.644 -9.329 75 2HZ LYS 9 2HZ LYS 9 14.887 20.482 -10.835 76 3HZ LYS 9 3HZ LYS 9 15.700 21.334 -9.683 77 H GLN 10 H GLN 10 15.454 20.834 -15.724 78 HA GLN 10 HA GLN 10 15.090 22.791 -17.713 79 1HB GLN 10 1HB GLN 10 17.241 22.136 -16.774 80 2HB GLN 10 2HB GLN 10 17.048 20.485 -17.349 81 1HG GLN 10 1HG GLN 10 18.605 21.601 -18.714 82 2HG GLN 10 2HG GLN 10 17.165 21.213 -19.661 83 1HE2 GLN 10 1HE2 GLN 10 17.376 22.879 -21.241 84 2HE2 GLN 10 2HE2 GLN 10 17.296 24.588 -20.814 85 H GLU 11 H GLU 11 15.104 19.188 -17.970 86 HA GLU 11 HA GLU 11 14.439 18.979 -20.710 87 1HB GLU 11 1HB GLU 11 13.787 17.188 -18.335 88 2HB GLU 11 2HB GLU 11 13.468 16.737 -20.014 89 1HG GLU 11 1HG GLU 11 15.794 16.765 -20.587 90 2HG GLU 11 2HG GLU 11 16.255 17.532 -19.069 91 H ILE 12 H ILE 12 12.267 19.144 -17.847 92 HA ILE 12 HA ILE 12 9.832 19.005 -19.316 93 HB ILE 12 HB ILE 12 10.482 20.173 -16.597 94 1HG1 ILE 12 1HG1 ILE 12 9.082 17.566 -17.395 95 2HG1 ILE 12 2HG1 ILE 12 10.803 17.647 -17.092 96 1HG2 ILE 12 1HG2 ILE 12 8.355 21.177 -17.459 97 2HG2 ILE 12 2HG2 ILE 12 7.733 19.535 -17.740 98 3HG2 ILE 12 3HG2 ILE 12 8.078 20.101 -16.101 99 1HD1 ILE 12 1HD1 ILE 12 9.792 16.879 -15.080 100 2HD1 ILE 12 2HD1 ILE 12 10.368 18.537 -14.810 101 3HD1 ILE 12 3HD1 ILE 12 8.633 18.218 -15.043 102 H ARG 13 H ARG 13 11.828 21.861 -18.358 103 HA ARG 13 HA ARG 13 10.027 23.752 -19.465 104 1HB ARG 13 1HB ARG 13 11.796 24.455 -17.957 105 2HB ARG 13 2HB ARG 13 13.036 23.925 -19.098 106 1HG ARG 13 1HG ARG 13 12.803 26.338 -19.194 107 2HG ARG 13 2HG ARG 13 12.311 25.635 -20.732 108 1HD ARG 13 1HD ARG 13 9.888 25.850 -19.962 109 2HD ARG 13 2HD ARG 13 10.502 26.680 -18.514 110 HE ARG 13 HE ARG 13 11.508 27.880 -20.924 111 1HH1 ARG 13 1HH1 ARG 13 8.584 27.605 -18.971 112 2HH1 ARG 13 2HH1 ARG 13 7.843 29.050 -19.604 113 1HH2 ARG 13 1HH2 ARG 13 10.562 29.775 -21.774 114 2HH2 ARG 13 2HH2 ARG 13 8.993 30.309 -21.237 115 H GLU 14 H GLU 14 12.794 22.003 -20.971 116 HA GLU 14 HA GLU 14 12.576 23.232 -23.532 117 1HB GLU 14 1HB GLU 14 13.522 20.452 -22.728 118 2HB GLU 14 2HB GLU 14 13.641 21.105 -24.367 119 1HG GLU 14 1HG GLU 14 15.050 22.942 -23.624 120 2HG GLU 14 2HG GLU 14 14.848 22.487 -21.929 121 H ALA 15 H ALA 15 11.038 20.218 -22.308 122 HA ALA 15 HA ALA 15 9.515 19.601 -24.601 123 1HB ALA 15 1HB ALA 15 8.782 19.165 -21.671 124 2HB ALA 15 2HB ALA 15 8.068 18.336 -23.069 125 3HB ALA 15 3HB ALA 15 9.780 18.089 -22.672 126 H PHE 16 H PHE 16 8.569 21.551 -21.738 127 HA PHE 16 HA PHE 16 6.043 22.399 -22.524 128 1HB PHE 16 1HB PHE 16 6.982 22.922 -20.332 129 2HB PHE 16 2HB PHE 16 8.201 23.956 -21.041 130 HD1 PHE 16 HD1 PHE 16 7.696 26.231 -21.821 131 HD2 PHE 16 HD2 PHE 16 4.599 23.647 -20.296 132 HE1 PHE 16 HE1 PHE 16 6.066 28.087 -21.962 133 HE2 PHE 16 HE2 PHE 16 3.010 25.547 -20.307 134 HZ PHE 16 HZ PHE 16 3.708 27.732 -21.235 135 H ASP 17 H ASP 17 9.136 24.113 -23.116 136 HA ASP 17 HA ASP 17 8.177 26.227 -24.649 137 1HB ASP 17 1HB ASP 17 10.449 26.092 -23.724 138 2HB ASP 17 2HB ASP 17 10.858 24.791 -24.853 139 H LEU 18 H LEU 18 9.367 23.021 -25.808 140 HA LEU 18 HA LEU 18 8.926 23.516 -28.559 141 1HB LEU 18 1HB LEU 18 10.223 21.645 -27.776 142 2HB LEU 18 2HB LEU 18 8.818 20.881 -27.030 143 HG LEU 18 HG LEU 18 8.526 21.583 -29.939 144 1HD1 LEU 18 1HD1 LEU 18 9.774 19.649 -30.710 145 2HD1 LEU 18 2HD1 LEU 18 10.837 20.825 -29.919 146 3HD1 LEU 18 3HD1 LEU 18 10.360 19.339 -29.056 147 1HD2 LEU 18 1HD2 LEU 18 7.490 19.326 -30.021 148 2HD2 LEU 18 2HD2 LEU 18 7.921 19.059 -28.321 149 3HD2 LEU 18 3HD2 LEU 18 6.746 20.312 -28.764 150 H PHE 19 H PHE 19 6.691 21.984 -26.143 151 HA PHE 19 HA PHE 19 4.585 21.618 -28.028 152 1HB PHE 19 1HB PHE 19 4.408 22.108 -25.038 153 2HB PHE 19 2HB PHE 19 3.128 21.407 -26.031 154 HD1 PHE 19 HD1 PHE 19 4.654 20.335 -23.466 155 HD2 PHE 19 HD2 PHE 19 4.771 19.430 -27.686 156 HE1 PHE 19 HE1 PHE 19 5.243 17.989 -22.967 157 HE2 PHE 19 HE2 PHE 19 5.519 17.145 -27.179 158 HZ PHE 19 HZ PHE 19 5.804 16.415 -24.814 159 H ASP 20 H ASP 20 5.458 24.366 -26.035 160 HA ASP 20 HA ASP 20 3.052 25.890 -26.279 161 1HB ASP 20 1HB ASP 20 4.869 25.909 -24.470 162 2HB ASP 20 2HB ASP 20 5.885 26.774 -25.646 163 H THR 21 H THR 21 4.025 25.106 -28.895 164 HA THR 21 HA THR 21 5.618 26.706 -30.399 165 HB THR 21 HB THR 21 4.100 26.044 -32.313 166 HG1 THR 21 HG1 THR 21 2.555 24.953 -30.170 167 1HG2 THR 21 1HG2 THR 21 5.877 24.474 -31.373 168 2HG2 THR 21 2HG2 THR 21 4.577 23.695 -30.443 169 3HG2 THR 21 3HG2 THR 21 4.520 23.693 -32.205 170 H ASP 22 H ASP 22 2.136 27.131 -30.123 171 HA ASP 22 HA ASP 22 2.290 30.010 -30.994 172 1HB ASP 22 1HB ASP 22 0.699 28.671 -32.233 173 2HB ASP 22 2HB ASP 22 0.021 27.991 -30.746 174 H GLY 23 H GLY 23 1.641 27.859 -28.304 175 1HA GLY 23 1HA GLY 23 0.012 29.306 -26.649 176 2HA GLY 23 2HA GLY 23 1.259 28.168 -26.118 177 H SER 24 H SER 24 3.483 29.795 -27.150 178 HA SER 24 HA SER 24 4.980 31.303 -26.274 179 1HB SER 24 1HB SER 24 2.591 33.024 -26.984 180 2HB SER 24 2HB SER 24 4.304 33.517 -26.969 181 HG SER 24 HG SER 24 2.908 31.768 -28.701 182 H GLY 25 H GLY 25 4.258 30.304 -24.028 183 1HA GLY 25 1HA GLY 25 4.696 31.444 -21.800 184 2HA GLY 25 2HA GLY 25 3.302 32.472 -22.162 185 H THR 26 H THR 26 1.577 30.507 -23.366 186 HA THR 26 HA THR 26 1.022 28.650 -21.070 187 HB THR 26 HB THR 26 -1.285 29.354 -21.189 188 HG1 THR 26 HG1 THR 26 -0.886 30.211 -23.477 189 1HG2 THR 26 1HG2 THR 26 0.456 31.807 -20.796 190 2HG2 THR 26 2HG2 THR 26 -1.166 31.507 -20.149 191 3HG2 THR 26 3HG2 THR 26 0.199 30.526 -19.588 192 H ILE 27 H ILE 27 0.782 26.597 -21.802 193 HA ILE 27 HA ILE 27 0.610 26.033 -24.661 194 HB ILE 27 HB ILE 27 0.564 24.346 -22.147 195 1HG1 ILE 27 1HG1 ILE 27 2.533 24.587 -24.471 196 2HG1 ILE 27 2HG1 ILE 27 2.702 25.423 -22.928 197 1HG2 ILE 27 1HG2 ILE 27 -0.839 23.219 -23.963 198 2HG2 ILE 27 2HG2 ILE 27 0.622 23.241 -24.975 199 3HG2 ILE 27 3HG2 ILE 27 0.576 22.331 -23.463 200 1HD1 ILE 27 1HD1 ILE 27 2.757 22.411 -23.401 201 2HD1 ILE 27 2HD1 ILE 27 4.082 23.465 -22.911 202 3HD1 ILE 27 3HD1 ILE 27 2.728 23.166 -21.792 203 H ASP 28 H ASP 28 -1.312 26.305 -25.742 204 HA ASP 28 HA ASP 28 -3.878 26.408 -24.451 205 1HB ASP 28 1HB ASP 28 -3.430 27.496 -26.614 206 2HB ASP 28 2HB ASP 28 -3.134 25.920 -27.365 207 H ALA 29 H ALA 29 -5.503 24.848 -24.271 208 HA ALA 29 HA ALA 29 -5.125 22.239 -23.764 209 1HB ALA 29 1HB ALA 29 -7.453 23.408 -25.350 210 2HB ALA 29 2HB ALA 29 -7.474 21.858 -24.482 211 3HB ALA 29 3HB ALA 29 -7.289 23.377 -23.581 212 H LYS 30 H LYS 30 -5.597 23.450 -27.134 213 HA LYS 30 HA LYS 30 -5.551 20.916 -28.400 214 1HB LYS 30 1HB LYS 30 -6.291 23.085 -29.404 215 2HB LYS 30 2HB LYS 30 -4.594 23.590 -29.510 216 1HG LYS 30 1HG LYS 30 -4.131 21.611 -30.971 217 2HG LYS 30 2HG LYS 30 -5.843 21.150 -30.859 218 1HD LYS 30 1HD LYS 30 -6.469 23.377 -31.842 219 2HD LYS 30 2HD LYS 30 -4.749 23.752 -32.040 220 1HE LYS 30 1HE LYS 30 -6.253 21.424 -33.341 221 2HE LYS 30 2HE LYS 30 -5.764 22.925 -34.141 222 1HZ LYS 30 1HZ LYS 30 -3.947 20.924 -32.995 223 2HZ LYS 30 2HZ LYS 30 -4.235 21.180 -34.595 224 3HZ LYS 30 3HZ LYS 30 -3.482 22.340 -33.700 225 H GLU 31 H GLU 31 -2.883 23.185 -27.605 226 HA GLU 31 HA GLU 31 -0.782 21.664 -28.879 227 1HB GLU 31 1HB GLU 31 -0.770 23.740 -26.659 228 2HB GLU 31 2HB GLU 31 0.693 23.008 -27.334 229 1HG GLU 31 1HG GLU 31 0.297 23.954 -29.500 230 2HG GLU 31 2HG GLU 31 -1.322 24.521 -29.039 231 H LEU 32 H LEU 32 -2.205 21.751 -25.568 232 HA LEU 32 HA LEU 32 -0.381 19.839 -24.499 233 1HB LEU 32 1HB LEU 32 -2.133 21.361 -23.247 234 2HB LEU 32 2HB LEU 32 -3.227 20.002 -23.530 235 HG LEU 32 HG LEU 32 -1.308 18.538 -22.475 236 1HD1 LEU 32 1HD1 LEU 32 0.062 19.709 -20.803 237 2HD1 LEU 32 2HD1 LEU 32 0.505 20.160 -22.445 238 3HD1 LEU 32 3HD1 LEU 32 -0.473 21.271 -21.455 239 1HD2 LEU 32 1HD2 LEU 32 -3.479 18.910 -21.401 240 2HD2 LEU 32 2HD2 LEU 32 -2.188 19.025 -20.197 241 3HD2 LEU 32 3HD2 LEU 32 -2.950 20.500 -20.831 242 H LYS 33 H LYS 33 -3.556 19.405 -26.134 243 HA LYS 33 HA LYS 33 -3.687 16.562 -25.879 244 1HB LYS 33 1HB LYS 33 -5.547 17.987 -26.469 245 2HB LYS 33 2HB LYS 33 -4.817 18.350 -28.051 246 1HG LYS 33 1HG LYS 33 -4.943 15.936 -28.648 247 2HG LYS 33 2HG LYS 33 -5.618 15.583 -27.044 248 1HD LYS 33 1HD LYS 33 -7.567 17.050 -27.543 249 2HD LYS 33 2HD LYS 33 -6.886 17.395 -29.146 250 1HE LYS 33 1HE LYS 33 -7.017 14.960 -29.704 251 2HE LYS 33 2HE LYS 33 -7.744 14.649 -28.114 252 1HZ LYS 33 1HZ LYS 33 -9.555 16.065 -28.726 253 2HZ LYS 33 2HZ LYS 33 -8.888 16.358 -30.204 254 3HZ LYS 33 3HZ LYS 33 -9.387 14.838 -29.813 255 H VAL 34 H VAL 34 -2.255 18.602 -28.488 256 HA VAL 34 HA VAL 34 -1.221 16.454 -30.045 257 HB VAL 34 HB VAL 34 -0.236 19.301 -29.619 258 1HG1 VAL 34 1HG1 VAL 34 0.770 17.215 -31.599 259 2HG1 VAL 34 2HG1 VAL 34 1.109 18.955 -31.696 260 3HG1 VAL 34 3HG1 VAL 34 1.722 18.020 -30.330 261 1HG2 VAL 34 1HG2 VAL 34 -2.454 18.984 -30.765 262 2HG2 VAL 34 2HG2 VAL 34 -1.221 19.667 -31.832 263 3HG2 VAL 34 3HG2 VAL 34 -1.655 17.951 -31.961 264 H ALA 35 H ALA 35 0.276 18.227 -27.294 265 HA ALA 35 HA ALA 35 2.697 16.824 -27.182 266 1HB ALA 35 1HB ALA 35 1.080 17.909 -24.828 267 2HB ALA 35 2HB ALA 35 2.782 17.492 -24.828 268 3HB ALA 35 3HB ALA 35 2.199 18.835 -25.839 269 H MET 36 H MET 36 -0.375 16.056 -25.466 270 HA MET 36 HA MET 36 0.542 13.661 -24.259 271 1HB MET 36 1HB MET 36 -2.170 14.797 -24.878 272 2HB MET 36 2HB MET 36 -2.017 13.173 -24.203 273 1HG MET 36 1HG MET 36 -0.673 13.965 -22.338 274 2HG MET 36 2HG MET 36 -0.736 15.623 -22.948 275 1HE MET 36 1HE MET 36 -2.761 17.052 -23.005 276 2HE MET 36 2HE MET 36 -3.849 15.908 -23.794 277 3HE MET 36 3HE MET 36 -4.347 16.711 -22.285 278 H ARG 37 H ARG 37 -1.016 14.145 -27.464 279 HA ARG 37 HA ARG 37 -1.046 11.375 -28.163 280 1HB ARG 37 1HB ARG 37 -0.682 13.845 -29.903 281 2HB ARG 37 2HB ARG 37 -0.924 12.226 -30.546 282 1HG ARG 37 1HG ARG 37 -2.952 13.272 -28.568 283 2HG ARG 37 2HG ARG 37 -2.925 13.966 -30.189 284 1HD ARG 37 1HD ARG 37 -4.526 12.146 -30.144 285 2HD ARG 37 2HD ARG 37 -3.163 11.756 -31.209 286 HE ARG 37 HE ARG 37 -2.870 10.770 -28.466 287 1HH1 ARG 37 1HH1 ARG 37 -4.337 10.009 -31.592 288 2HH1 ARG 37 2HH1 ARG 37 -4.251 8.284 -31.355 289 1HH2 ARG 37 1HH2 ARG 37 -2.753 8.591 -28.143 290 2HH2 ARG 37 2HH2 ARG 37 -3.294 7.441 -29.352 291 H ALA 38 H ALA 38 1.513 13.857 -28.715 292 HA ALA 38 HA ALA 38 3.402 12.091 -29.875 293 1HB ALA 38 1HB ALA 38 3.603 14.553 -29.895 294 2HB ALA 38 2HB ALA 38 3.947 14.547 -28.153 295 3HB ALA 38 3HB ALA 38 5.072 13.770 -29.280 296 H LEU 39 H LEU 39 2.757 12.837 -26.459 297 HA LEU 39 HA LEU 39 4.842 11.152 -25.369 298 1HB LEU 39 1HB LEU 39 2.322 12.358 -24.208 299 2HB LEU 39 2HB LEU 39 3.519 11.518 -23.232 300 HG LEU 39 HG LEU 39 4.271 13.950 -24.901 301 1HD1 LEU 39 1HD1 LEU 39 3.209 13.892 -22.040 302 2HD1 LEU 39 2HD1 LEU 39 3.936 15.300 -22.844 303 3HD1 LEU 39 3HD1 LEU 39 2.404 14.645 -23.426 304 1HD2 LEU 39 1HD2 LEU 39 6.075 14.133 -23.240 305 2HD2 LEU 39 2HD2 LEU 39 5.473 12.688 -22.404 306 3HD2 LEU 39 3HD2 LEU 39 6.127 12.561 -24.051 307 H GLY 40 H GLY 40 2.039 10.217 -27.038 308 1HA GLY 40 1HA GLY 40 1.375 8.087 -27.451 309 2HA GLY 40 2HA GLY 40 2.426 7.474 -26.170 310 H PHE 41 H PHE 41 0.115 10.021 -25.404 311 HA PHE 41 HA PHE 41 -1.500 8.153 -23.745 312 1HB PHE 41 1HB PHE 41 -1.461 11.136 -24.168 313 2HB PHE 41 2HB PHE 41 -2.778 10.366 -23.317 314 HD1 PHE 41 HD1 PHE 41 -2.590 9.874 -20.977 315 HD2 PHE 41 HD2 PHE 41 0.919 10.845 -23.268 316 HE1 PHE 41 HE1 PHE 41 -1.236 9.854 -18.903 317 HE2 PHE 41 HE2 PHE 41 2.293 10.786 -21.191 318 HZ PHE 41 HZ PHE 41 1.214 10.263 -19.010 319 H GLU 42 H GLU 42 -3.803 8.092 -23.993 320 HA GLU 42 HA GLU 42 -4.865 8.579 -26.746 321 1HB GLU 42 1HB GLU 42 -5.862 6.787 -24.507 322 2HB GLU 42 2HB GLU 42 -6.661 7.056 -26.064 323 1HG GLU 42 1HG GLU 42 -4.635 6.179 -27.236 324 2HG GLU 42 2HG GLU 42 -3.885 5.837 -25.668 325 HA PRO 43 HA PRO 43 -6.348 11.926 -24.035 326 1HB PRO 43 1HB PRO 43 -6.953 13.857 -25.893 327 2HB PRO 43 2HB PRO 43 -5.310 13.479 -25.308 328 1HG PRO 43 1HG PRO 43 -6.648 12.450 -27.818 329 2HG PRO 43 2HG PRO 43 -5.021 13.182 -27.624 330 1HD PRO 43 1HD PRO 43 -5.400 10.485 -27.701 331 2HD PRO 43 2HD PRO 43 -4.184 11.205 -26.593 332 H LYS 44 H LYS 44 -8.019 10.361 -23.553 333 HA LYS 44 HA LYS 44 -10.615 10.315 -24.699 334 1HB LYS 44 1HB LYS 44 -9.618 9.999 -21.852 335 2HB LYS 44 2HB LYS 44 -11.281 9.648 -22.350 336 1HG LYS 44 1HG LYS 44 -10.616 7.915 -23.837 337 2HG LYS 44 2HG LYS 44 -8.909 8.309 -23.735 338 1HD LYS 44 1HD LYS 44 -10.591 7.315 -21.387 339 2HD LYS 44 2HD LYS 44 -9.618 6.273 -22.428 340 1HE LYS 44 1HE LYS 44 -8.517 8.498 -20.640 341 2HE LYS 44 2HE LYS 44 -8.437 6.761 -20.345 342 1HZ LYS 44 1HZ LYS 44 -7.136 6.534 -22.339 343 2HZ LYS 44 2HZ LYS 44 -7.154 8.164 -22.591 344 3HZ LYS 44 3HZ LYS 44 -6.415 7.544 -21.258 345 H LYS 45 H LYS 45 -11.010 12.400 -25.379 346 HA LYS 45 HA LYS 45 -10.801 14.771 -24.572 347 1HB LYS 45 1HB LYS 45 -12.912 15.479 -25.592 348 2HB LYS 45 2HB LYS 45 -12.005 14.291 -26.532 349 1HG LYS 45 1HG LYS 45 -13.548 12.488 -25.689 350 2HG LYS 45 2HG LYS 45 -14.505 13.750 -24.877 351 1HD LYS 45 1HD LYS 45 -14.903 14.862 -27.057 352 2HD LYS 45 2HD LYS 45 -13.912 13.639 -27.867 353 1HE LYS 45 1HE LYS 45 -16.254 13.096 -28.179 354 2HE LYS 45 2HE LYS 45 -15.507 11.862 -27.155 355 1HZ LYS 45 1HZ LYS 45 -17.639 12.566 -26.343 356 2HZ LYS 45 2HZ LYS 45 -16.468 12.956 -25.255 357 3HZ LYS 45 3HZ LYS 45 -17.130 14.126 -26.209 358 H GLU 46 H GLU 46 -13.533 12.994 -23.002 359 HA GLU 46 HA GLU 46 -14.347 15.205 -21.394 360 1HB GLU 46 1HB GLU 46 -15.719 13.178 -21.795 361 2HB GLU 46 2HB GLU 46 -14.599 12.220 -20.805 362 1HG GLU 46 1HG GLU 46 -15.109 13.699 -18.846 363 2HG GLU 46 2HG GLU 46 -16.256 14.602 -19.852 364 H GLU 47 H GLU 47 -12.073 12.520 -20.772 365 HA GLU 47 HA GLU 47 -11.560 13.228 -18.014 366 1HB GLU 47 1HB GLU 47 -9.793 11.594 -19.885 367 2HB GLU 47 2HB GLU 47 -9.837 11.561 -18.118 368 1HG GLU 47 1HG GLU 47 -11.987 10.543 -20.036 369 2HG GLU 47 2HG GLU 47 -10.971 9.595 -18.955 370 H ILE 48 H ILE 48 -10.055 13.859 -21.165 371 HA ILE 48 HA ILE 48 -7.814 15.360 -20.221 372 HB ILE 48 HB ILE 48 -9.364 15.438 -22.823 373 1HG1 ILE 48 1HG1 ILE 48 -8.129 13.297 -22.133 374 2HG1 ILE 48 2HG1 ILE 48 -7.757 14.009 -23.699 375 1HG2 ILE 48 1HG2 ILE 48 -7.296 16.532 -23.772 376 2HG2 ILE 48 2HG2 ILE 48 -8.287 17.555 -22.731 377 3HG2 ILE 48 3HG2 ILE 48 -6.783 16.857 -22.097 378 1HD1 ILE 48 1HD1 ILE 48 -6.025 14.587 -21.259 379 2HD1 ILE 48 2HD1 ILE 48 -5.756 13.195 -22.308 380 3HD1 ILE 48 3HD1 ILE 48 -5.670 14.825 -22.985 381 H LYS 49 H LYS 49 -11.137 16.481 -21.141 382 HA LYS 49 HA LYS 49 -10.611 19.224 -20.593 383 1HB LYS 49 1HB LYS 49 -13.162 17.578 -20.505 384 2HB LYS 49 2HB LYS 49 -13.151 19.316 -20.211 385 1HG LYS 49 1HG LYS 49 -11.981 18.122 -22.755 386 2HG LYS 49 2HG LYS 49 -13.698 18.504 -22.575 387 1HD LYS 49 1HD LYS 49 -13.152 20.876 -22.093 388 2HD LYS 49 2HD LYS 49 -11.425 20.520 -22.214 389 1HE LYS 49 1HE LYS 49 -12.176 21.528 -24.283 390 2HE LYS 49 2HE LYS 49 -11.706 19.847 -24.586 391 1HZ LYS 49 1HZ LYS 49 -13.758 20.441 -25.662 392 2HZ LYS 49 2HZ LYS 49 -14.022 19.262 -24.543 393 3HZ LYS 49 3HZ LYS 49 -14.459 20.818 -24.220 394 H LYS 50 H LYS 50 -11.873 16.630 -18.438 395 HA LYS 50 HA LYS 50 -12.133 18.237 -16.110 396 1HB LYS 50 1HB LYS 50 -11.386 15.301 -16.403 397 2HB LYS 50 2HB LYS 50 -11.772 16.063 -14.864 398 1HG LYS 50 1HG LYS 50 -13.705 16.026 -17.226 399 2HG LYS 50 2HG LYS 50 -13.629 14.762 -15.995 400 1HD LYS 50 1HD LYS 50 -14.080 16.471 -14.225 401 2HD LYS 50 2HD LYS 50 -14.254 17.709 -15.488 402 1HE LYS 50 1HE LYS 50 -16.111 16.412 -16.511 403 2HE LYS 50 2HE LYS 50 -15.943 15.174 -15.253 404 1HZ LYS 50 1HZ LYS 50 -16.651 17.987 -14.802 405 2HZ LYS 50 2HZ LYS 50 -17.682 16.703 -14.750 406 3HZ LYS 50 3HZ LYS 50 -16.483 16.840 -13.629 407 H MET 51 H MET 51 -9.322 16.192 -17.061 408 HA MET 51 HA MET 51 -7.513 16.877 -15.103 409 1HB MET 51 1HB MET 51 -7.293 15.102 -16.723 410 2HB MET 51 2HB MET 51 -7.172 16.234 -18.069 411 1HG MET 51 1HG MET 51 -5.138 16.177 -15.836 412 2HG MET 51 2HG MET 51 -5.096 15.089 -17.229 413 1HE MET 51 1HE MET 51 -2.817 15.622 -18.210 414 2HE MET 51 2HE MET 51 -2.148 17.267 -18.281 415 3HE MET 51 3HE MET 51 -2.559 16.541 -16.705 416 H ILE 52 H ILE 52 -7.782 18.448 -18.333 417 HA ILE 52 HA ILE 52 -5.927 20.504 -17.894 418 HB ILE 52 HB ILE 52 -8.392 20.283 -19.660 419 1HG1 ILE 52 1HG1 ILE 52 -5.386 20.353 -20.234 420 2HG1 ILE 52 2HG1 ILE 52 -6.352 18.882 -20.107 421 1HG2 ILE 52 1HG2 ILE 52 -8.151 22.701 -19.210 422 2HG2 ILE 52 2HG2 ILE 52 -6.439 22.620 -19.671 423 3HG2 ILE 52 3HG2 ILE 52 -7.718 22.321 -20.861 424 1HD1 ILE 52 1HD1 ILE 52 -7.776 19.745 -22.024 425 2HD1 ILE 52 2HD1 ILE 52 -6.564 21.029 -22.242 426 3HD1 ILE 52 3HD1 ILE 52 -6.092 19.338 -22.431 427 H SER 53 H SER 53 -9.479 20.528 -17.194 428 HA SER 53 HA SER 53 -9.478 23.218 -16.267 429 1HB SER 53 1HB SER 53 -11.304 20.927 -15.403 430 2HB SER 53 2HB SER 53 -11.617 22.663 -15.214 431 HG SER 53 HG SER 53 -11.345 21.201 -17.638 432 H GLU 54 H GLU 54 -9.007 20.151 -14.455 433 HA GLU 54 HA GLU 54 -8.808 21.337 -11.871 434 1HB GLU 54 1HB GLU 54 -7.607 18.795 -13.037 435 2HB GLU 54 2HB GLU 54 -7.495 19.241 -11.327 436 1HG GLU 54 1HG GLU 54 -9.910 19.233 -11.076 437 2HG GLU 54 2HG GLU 54 -10.154 18.966 -12.804 438 H ILE 55 H ILE 55 -6.271 20.680 -14.343 439 HA ILE 55 HA ILE 55 -4.153 21.765 -12.664 440 HB ILE 55 HB ILE 55 -4.302 21.249 -15.658 441 1HG1 ILE 55 1HG1 ILE 55 -4.589 19.158 -14.486 442 2HG1 ILE 55 2HG1 ILE 55 -2.990 19.225 -15.185 443 1HG2 ILE 55 1HG2 ILE 55 -1.886 21.867 -13.913 444 2HG2 ILE 55 2HG2 ILE 55 -1.809 21.232 -15.574 445 3HG2 ILE 55 3HG2 ILE 55 -2.520 22.811 -15.270 446 1HD1 ILE 55 1HD1 ILE 55 -2.102 19.836 -12.866 447 2HD1 ILE 55 2HD1 ILE 55 -3.748 19.582 -12.249 448 3HD1 ILE 55 3HD1 ILE 55 -2.864 18.242 -12.981 449 H ASP 56 H ASP 56 -6.355 23.176 -15.090 450 HA ASP 56 HA ASP 56 -4.721 25.550 -15.377 451 1HB ASP 56 1HB ASP 56 -5.992 24.592 -17.251 452 2HB ASP 56 2HB ASP 56 -7.508 24.948 -16.409 453 H LYS 57 H LYS 57 -4.722 25.998 -13.053 454 HA LYS 57 HA LYS 57 -6.947 27.045 -11.613 455 1HB LYS 57 1HB LYS 57 -4.081 28.030 -11.417 456 2HB LYS 57 2HB LYS 57 -5.327 28.063 -10.167 457 1HG LYS 57 1HG LYS 57 -3.850 25.624 -11.255 458 2HG LYS 57 2HG LYS 57 -3.733 26.356 -9.659 459 1HD LYS 57 1HD LYS 57 -6.120 25.727 -9.201 460 2HD LYS 57 2HD LYS 57 -6.213 24.979 -10.806 461 1HE LYS 57 1HE LYS 57 -5.835 23.254 -9.163 462 2HE LYS 57 2HE LYS 57 -4.431 23.389 -10.228 463 1HZ LYS 57 1HZ LYS 57 -3.826 23.179 -7.922 464 2HZ LYS 57 2HZ LYS 57 -3.323 24.630 -8.514 465 3HZ LYS 57 3HZ LYS 57 -4.648 24.554 -7.534 466 H ASP 58 H ASP 58 -5.539 28.324 -14.465 467 HA ASP 58 HA ASP 58 -6.206 31.153 -13.856 468 1HB ASP 58 1HB ASP 58 -4.016 30.692 -14.854 469 2HB ASP 58 2HB ASP 58 -4.770 29.815 -16.189 470 H GLY 59 H GLY 59 -7.521 28.274 -15.157 471 1HA GLY 59 1HA GLY 59 -9.284 27.718 -16.301 472 2HA GLY 59 2HA GLY 59 -10.040 29.136 -15.549 473 H SER 60 H SER 60 -7.430 29.157 -18.014 474 HA SER 60 HA SER 60 -9.094 30.812 -19.825 475 1HB SER 60 1HB SER 60 -6.751 31.184 -20.801 476 2HB SER 60 2HB SER 60 -7.037 31.770 -19.150 477 HG SER 60 HG SER 60 -5.355 30.594 -18.702 478 H GLY 61 H GLY 61 -8.168 27.537 -19.509 479 1HA GLY 61 1HA GLY 61 -8.407 25.764 -20.988 480 2HA GLY 61 2HA GLY 61 -8.747 26.875 -22.328 481 H THR 62 H THR 62 -6.003 27.499 -20.183 482 HA THR 62 HA THR 62 -4.100 26.325 -22.089 483 HB THR 62 HB THR 62 -2.816 28.310 -22.286 484 HG1 THR 62 HG1 THR 62 -4.641 29.481 -20.438 485 1HG2 THR 62 1HG2 THR 62 -5.687 29.296 -22.615 486 2HG2 THR 62 2HG2 THR 62 -4.231 29.903 -23.418 487 3HG2 THR 62 3HG2 THR 62 -4.842 28.286 -23.802 488 H ILE 63 H ILE 63 -2.097 25.812 -21.120 489 HA ILE 63 HA ILE 63 -2.091 25.740 -18.135 490 HB ILE 63 HB ILE 63 -0.552 24.004 -20.090 491 1HG1 ILE 63 1HG1 ILE 63 -2.849 23.463 -20.513 492 2HG1 ILE 63 2HG1 ILE 63 -2.093 22.189 -19.561 493 1HG2 ILE 63 1HG2 ILE 63 -0.221 22.563 -18.124 494 2HG2 ILE 63 2HG2 ILE 63 0.423 24.191 -17.864 495 3HG2 ILE 63 3HG2 ILE 63 -1.101 23.722 -17.107 496 1HD1 ILE 63 1HD1 ILE 63 -4.344 22.598 -18.764 497 2HD1 ILE 63 2HD1 ILE 63 -3.204 23.060 -17.502 498 3HD1 ILE 63 3HD1 ILE 63 -3.993 24.311 -18.486 499 H ASP 64 H ASP 64 -0.884 27.409 -17.375 500 HA ASP 64 HA ASP 64 1.352 28.613 -18.796 501 1HB ASP 64 1HB ASP 64 0.066 29.855 -17.102 502 2HB ASP 64 2HB ASP 64 0.533 28.683 -15.861 503 H PHE 65 H PHE 65 3.595 28.352 -18.317 504 HA PHE 65 HA PHE 65 4.610 25.812 -18.039 505 1HB PHE 65 1HB PHE 65 5.989 27.631 -18.783 506 2HB PHE 65 2HB PHE 65 5.869 28.437 -17.216 507 HD1 PHE 65 HD1 PHE 65 7.861 28.334 -15.956 508 HD2 PHE 65 HD2 PHE 65 6.773 24.948 -18.404 509 HE1 PHE 65 HE1 PHE 65 9.812 27.077 -15.106 510 HE2 PHE 65 HE2 PHE 65 8.693 23.680 -17.496 511 HZ PHE 65 HZ PHE 65 10.229 24.746 -15.862 512 H GLU 66 H GLU 66 3.956 28.040 -15.279 513 HA GLU 66 HA GLU 66 5.116 26.343 -13.294 514 1HB GLU 66 1HB GLU 66 2.828 28.351 -13.080 515 2HB GLU 66 2HB GLU 66 3.687 27.617 -11.716 516 1HG GLU 66 1HG GLU 66 5.823 28.597 -12.514 517 2HG GLU 66 2HG GLU 66 4.979 29.370 -13.863 518 H GLU 67 H GLU 67 1.823 26.485 -14.669 519 HA GLU 67 HA GLU 67 0.654 24.538 -12.884 520 1HB GLU 67 1HB GLU 67 -0.189 25.455 -15.663 521 2HB GLU 67 2HB GLU 67 -1.168 24.498 -14.547 522 1HG GLU 67 1HG GLU 67 -1.232 26.303 -12.923 523 2HG GLU 67 2HG GLU 67 -0.155 27.303 -13.908 524 H PHE 68 H PHE 68 2.065 24.430 -16.163 525 HA PHE 68 HA PHE 68 1.716 21.670 -16.703 526 1HB PHE 68 1HB PHE 68 2.438 23.327 -18.398 527 2HB PHE 68 2HB PHE 68 3.960 23.543 -17.554 528 HD1 PHE 68 HD1 PHE 68 5.827 22.154 -18.087 529 HD2 PHE 68 HD2 PHE 68 1.855 20.964 -19.284 530 HE1 PHE 68 HE1 PHE 68 6.787 20.453 -19.624 531 HE2 PHE 68 HE2 PHE 68 2.825 19.170 -20.698 532 HZ PHE 68 HZ PHE 68 5.299 18.902 -20.838 533 H LEU 69 H LEU 69 4.496 23.375 -15.205 534 HA LEU 69 HA LEU 69 6.087 21.109 -14.730 535 1HB LEU 69 1HB LEU 69 6.922 23.405 -14.626 536 2HB LEU 69 2HB LEU 69 5.884 23.757 -13.240 537 HG LEU 69 HG LEU 69 7.148 22.160 -11.845 538 1HD1 LEU 69 1HD1 LEU 69 7.915 20.527 -13.518 539 2HD1 LEU 69 2HD1 LEU 69 8.883 21.782 -14.331 540 3HD1 LEU 69 3HD1 LEU 69 9.301 21.238 -12.694 541 1HD2 LEU 69 1HD2 LEU 69 7.823 24.532 -11.966 542 2HD2 LEU 69 2HD2 LEU 69 9.223 23.474 -11.713 543 3HD2 LEU 69 3HD2 LEU 69 8.910 24.160 -13.322 544 H THR 70 H THR 70 3.630 22.712 -12.634 545 HA THR 70 HA THR 70 3.887 20.978 -10.416 546 HB THR 70 HB THR 70 1.342 22.338 -11.413 547 HG1 THR 70 HG1 THR 70 3.024 23.823 -11.144 548 1HG2 THR 70 1HG2 THR 70 2.207 21.416 -8.636 549 2HG2 THR 70 2HG2 THR 70 0.748 22.351 -9.012 550 3HG2 THR 70 3HG2 THR 70 0.907 20.691 -9.611 551 H MET 71 H MET 71 1.644 20.733 -13.223 552 HA MET 71 HA MET 71 0.394 18.303 -12.602 553 1HB MET 71 1HB MET 71 -0.284 19.848 -14.358 554 2HB MET 71 2HB MET 71 1.150 19.513 -15.304 555 1HG MET 71 1HG MET 71 -0.959 17.445 -14.588 556 2HG MET 71 2HG MET 71 -0.956 18.400 -16.071 557 1HE MET 71 1HE MET 71 2.200 18.345 -16.930 558 2HE MET 71 2HE MET 71 2.100 16.971 -18.044 559 3HE MET 71 3HE MET 71 0.803 18.187 -18.025 560 H MET 72 H MET 72 3.341 18.846 -14.578 561 HA MET 72 HA MET 72 3.822 16.132 -15.095 562 1HB MET 72 1HB MET 72 4.791 18.179 -16.272 563 2HB MET 72 2HB MET 72 5.945 18.312 -14.934 564 1HG MET 72 1HG MET 72 6.953 17.128 -16.777 565 2HG MET 72 2HG MET 72 6.715 15.972 -15.462 566 1HE MET 72 1HE MET 72 6.364 13.757 -18.659 567 2HE MET 72 2HE MET 72 7.479 15.119 -18.397 568 3HE MET 72 3HE MET 72 7.163 13.957 -17.082 569 H THR 73 H THR 73 5.048 18.224 -12.453 570 HA THR 73 HA THR 73 6.744 16.302 -11.220 571 HB THR 73 HB THR 73 5.120 18.513 -9.877 572 HG1 THR 73 HG1 THR 73 6.461 19.314 -11.502 573 1HG2 THR 73 1HG2 THR 73 7.647 17.032 -9.018 574 2HG2 THR 73 2HG2 THR 73 6.967 18.458 -8.211 575 3HG2 THR 73 3HG2 THR 73 6.061 16.937 -8.225 576 H ALA 74 H ALA 74 3.255 17.039 -10.676 577 HA ALA 74 HA ALA 74 2.827 15.070 -8.676 578 1HB ALA 74 1HB ALA 74 0.448 15.356 -9.201 579 2HB ALA 74 2HB ALA 74 1.273 16.927 -9.142 580 3HB ALA 74 3HB ALA 74 0.854 16.201 -10.708 581 H LYS 75 H LYS 75 2.547 14.883 -12.236 582 HA LYS 75 HA LYS 75 1.619 12.195 -12.393 583 1HB LYS 75 1HB LYS 75 1.524 13.823 -14.221 584 2HB LYS 75 2HB LYS 75 3.287 13.839 -14.342 585 1HG LYS 75 1HG LYS 75 3.320 11.476 -14.982 586 2HG LYS 75 2HG LYS 75 1.563 11.364 -14.819 587 1HD LYS 75 1HD LYS 75 2.939 13.341 -16.700 588 2HD LYS 75 2HD LYS 75 2.550 11.683 -17.187 589 1HE LYS 75 1HE LYS 75 0.157 12.058 -16.764 590 2HE LYS 75 2HE LYS 75 0.481 13.706 -16.208 591 1HZ LYS 75 1HZ LYS 75 -0.235 13.674 -18.460 592 2HZ LYS 75 2HZ LYS 75 1.316 14.220 -18.377 593 3HZ LYS 75 3HZ LYS 75 1.006 12.688 -18.907 594 H MET 76 H MET 76 4.921 13.579 -12.341 595 HA MET 76 HA MET 76 6.149 10.876 -12.305 596 1HB MET 76 1HB MET 76 7.390 13.655 -12.406 597 2HB MET 76 2HB MET 76 8.252 12.122 -12.574 598 1HG MET 76 1HG MET 76 6.158 13.260 -14.474 599 2HG MET 76 2HG MET 76 7.891 13.152 -14.750 600 1HE MET 76 1HE MET 76 9.180 10.870 -15.164 601 2HE MET 76 2HE MET 76 8.484 10.099 -13.714 602 3HE MET 76 3HE MET 76 8.371 9.291 -15.290 Start of MODEL 20 1 H ARG 1 H ARG 1 17.030 16.013 -4.614 2 HA ARG 1 HA ARG 1 18.293 15.144 -6.418 3 1HB ARG 1 1HB ARG 1 19.194 12.900 -6.342 4 2HB ARG 1 2HB ARG 1 19.985 13.961 -5.173 5 1HG ARG 1 1HG ARG 1 18.576 12.974 -3.345 6 2HG ARG 1 2HG ARG 1 17.870 11.850 -4.523 7 1HD ARG 1 1HD ARG 1 20.825 12.072 -3.819 8 2HD ARG 1 2HD ARG 1 19.704 10.833 -3.214 9 HE ARG 1 HE ARG 1 19.541 10.755 -6.014 10 1HH1 ARG 1 1HH1 ARG 1 21.951 10.143 -3.509 11 2HH1 ARG 1 2HH1 ARG 1 22.841 8.971 -4.443 12 1HH2 ARG 1 1HH2 ARG 1 20.692 9.231 -7.257 13 2HH2 ARG 1 2HH2 ARG 1 22.105 8.440 -6.615 14 H VAL 2 H VAL 2 15.945 13.723 -4.206 15 HA VAL 2 HA VAL 2 14.418 12.445 -6.365 16 HB VAL 2 HB VAL 2 12.735 12.053 -4.629 17 1HG1 VAL 2 1HG1 VAL 2 14.002 10.485 -3.273 18 2HG1 VAL 2 2HG1 VAL 2 14.613 10.463 -4.936 19 3HG1 VAL 2 3HG1 VAL 2 15.526 11.301 -3.664 20 1HG2 VAL 2 1HG2 VAL 2 13.047 14.094 -3.242 21 2HG2 VAL 2 2HG2 VAL 2 13.116 12.610 -2.284 22 3HG2 VAL 2 3HG2 VAL 2 14.611 13.470 -2.678 23 H GLY 3 H GLY 3 12.117 13.174 -6.726 24 1HA GLY 3 1HA GLY 3 10.569 14.786 -7.278 25 2HA GLY 3 2HA GLY 3 11.376 15.921 -6.181 26 H LEU 4 H LEU 4 10.871 17.462 -8.008 27 HA LEU 4 HA LEU 4 12.243 17.111 -10.543 28 1HB LEU 4 1HB LEU 4 10.867 19.565 -9.401 29 2HB LEU 4 2HB LEU 4 11.408 19.322 -11.066 30 HG LEU 4 HG LEU 4 9.168 17.867 -9.607 31 1HD1 LEU 4 1HD1 LEU 4 7.823 18.892 -11.430 32 2HD1 LEU 4 2HD1 LEU 4 8.683 20.112 -10.471 33 3HD1 LEU 4 3HD1 LEU 4 9.289 19.650 -12.073 34 1HD2 LEU 4 1HD2 LEU 4 10.215 16.144 -10.963 35 2HD2 LEU 4 2HD2 LEU 4 8.779 16.706 -11.822 36 3HD2 LEU 4 3HD2 LEU 4 10.388 17.259 -12.337 37 H THR 5 H THR 5 14.420 16.946 -10.196 38 HA THR 5 HA THR 5 16.026 18.919 -8.848 39 HB THR 5 HB THR 5 17.851 17.883 -10.241 40 HG1 THR 5 HG1 THR 5 17.283 16.151 -11.566 41 1HG2 THR 5 1HG2 THR 5 17.175 16.878 -8.073 42 2HG2 THR 5 2HG2 THR 5 15.984 15.861 -8.904 43 3HG2 THR 5 3HG2 THR 5 17.713 15.643 -9.225 44 H GLU 6 H GLU 6 17.473 20.533 -10.007 45 HA GLU 6 HA GLU 6 16.062 22.221 -11.673 46 1HB GLU 6 1HB GLU 6 18.091 22.671 -10.207 47 2HB GLU 6 2HB GLU 6 19.091 21.893 -11.446 48 1HG GLU 6 1HG GLU 6 19.164 24.281 -11.663 49 2HG GLU 6 2HG GLU 6 18.368 23.575 -13.078 50 H GLU 7 H GLU 7 18.258 19.543 -12.484 51 HA GLU 7 HA GLU 7 18.431 19.921 -15.289 52 1HB GLU 7 1HB GLU 7 18.325 17.266 -13.782 53 2HB GLU 7 2HB GLU 7 19.001 17.562 -15.389 54 1HG GLU 7 1HG GLU 7 20.094 18.621 -12.735 55 2HG GLU 7 2HG GLU 7 20.801 17.387 -13.772 56 H GLN 8 H GLN 8 16.030 18.002 -13.379 57 HA GLN 8 HA GLN 8 14.402 17.293 -15.626 58 1HB GLN 8 1HB GLN 8 13.803 17.618 -12.667 59 2HB GLN 8 2HB GLN 8 12.573 17.143 -13.843 60 1HG GLN 8 1HG GLN 8 13.748 15.146 -14.453 61 2HG GLN 8 2HG GLN 8 15.191 15.623 -13.545 62 1HE2 GLN 8 1HE2 GLN 8 15.191 15.510 -11.257 63 2HE2 GLN 8 2HE2 GLN 8 13.882 14.748 -10.346 64 H LYS 9 H LYS 9 14.335 20.142 -13.410 65 HA LYS 9 HA LYS 9 12.117 21.418 -14.504 66 1HB LYS 9 1HB LYS 9 13.567 21.989 -12.465 67 2HB LYS 9 2HB LYS 9 14.564 22.942 -13.583 68 1HG LYS 9 1HG LYS 9 12.447 24.131 -14.298 69 2HG LYS 9 2HG LYS 9 11.607 23.301 -12.975 70 1HD LYS 9 1HD LYS 9 14.039 25.139 -12.688 71 2HD LYS 9 2HD LYS 9 12.365 25.617 -12.385 72 1HE LYS 9 1HE LYS 9 12.191 23.987 -10.538 73 2HE LYS 9 2HE LYS 9 13.853 23.439 -10.829 74 1HZ LYS 9 1HZ LYS 9 14.661 25.554 -10.301 75 2HZ LYS 9 2HZ LYS 9 13.141 26.171 -10.081 76 3HZ LYS 9 3HZ LYS 9 13.723 25.008 -9.064 77 H GLN 10 H GLN 10 15.536 21.520 -15.676 78 HA GLN 10 HA GLN 10 15.060 23.374 -17.803 79 1HB GLN 10 1HB GLN 10 17.041 21.054 -17.916 80 2HB GLN 10 2HB GLN 10 17.015 22.520 -18.889 81 1HG GLN 10 1HG GLN 10 17.918 22.139 -16.059 82 2HG GLN 10 2HG GLN 10 18.719 22.928 -17.400 83 1HE2 GLN 10 1HE2 GLN 10 16.547 23.318 -14.729 84 2HE2 GLN 10 2HE2 GLN 10 16.428 25.069 -14.804 85 H GLU 11 H GLU 11 14.988 19.776 -17.781 86 HA GLU 11 HA GLU 11 14.182 19.474 -20.484 87 1HB GLU 11 1HB GLU 11 13.485 17.692 -18.102 88 2HB GLU 11 2HB GLU 11 13.337 17.249 -19.806 89 1HG GLU 11 1HG GLU 11 15.954 17.928 -18.381 90 2HG GLU 11 2HG GLU 11 15.390 16.320 -18.831 91 H ILE 12 H ILE 12 12.176 19.908 -17.574 92 HA ILE 12 HA ILE 12 9.638 19.678 -18.849 93 HB ILE 12 HB ILE 12 10.550 21.087 -16.321 94 1HG1 ILE 12 1HG1 ILE 12 8.964 18.507 -16.763 95 2HG1 ILE 12 2HG1 ILE 12 10.700 18.512 -16.583 96 1HG2 ILE 12 1HG2 ILE 12 8.417 22.130 -17.131 97 2HG2 ILE 12 2HG2 ILE 12 7.679 20.512 -17.145 98 3HG2 ILE 12 3HG2 ILE 12 8.217 21.249 -15.628 99 1HD1 ILE 12 1HD1 ILE 12 10.516 19.520 -14.334 100 2HD1 ILE 12 2HD1 ILE 12 8.742 19.447 -14.458 101 3HD1 ILE 12 3HD1 ILE 12 9.691 17.955 -14.477 102 H ARG 13 H ARG 13 11.739 22.554 -18.249 103 HA ARG 13 HA ARG 13 9.999 24.437 -19.509 104 1HB ARG 13 1HB ARG 13 11.683 25.279 -18.166 105 2HB ARG 13 2HB ARG 13 12.959 24.351 -18.952 106 1HG ARG 13 1HG ARG 13 13.090 26.733 -19.495 107 2HG ARG 13 2HG ARG 13 12.900 25.721 -20.925 108 1HD ARG 13 1HD ARG 13 11.563 27.748 -21.087 109 2HD ARG 13 2HD ARG 13 10.512 26.329 -21.071 110 HE ARG 13 HE ARG 13 10.712 27.221 -18.413 111 1HH1 ARG 13 1HH1 ARG 13 9.396 28.207 -21.558 112 2HH1 ARG 13 2HH1 ARG 13 8.253 29.330 -20.874 113 1HH2 ARG 13 1HH2 ARG 13 9.055 28.529 -17.522 114 2HH2 ARG 13 2HH2 ARG 13 8.059 29.526 -18.544 115 H GLU 14 H GLU 14 12.718 22.513 -20.950 116 HA GLU 14 HA GLU 14 12.336 23.454 -23.592 117 1HB GLU 14 1HB GLU 14 13.246 20.686 -22.672 118 2HB GLU 14 2HB GLU 14 13.395 21.315 -24.316 119 1HG GLU 14 1HG GLU 14 14.752 22.485 -21.843 120 2HG GLU 14 2HG GLU 14 15.517 21.526 -23.107 121 H ALA 15 H ALA 15 10.839 20.584 -22.043 122 HA ALA 15 HA ALA 15 9.242 19.764 -24.219 123 1HB ALA 15 1HB ALA 15 7.868 18.626 -22.523 124 2HB ALA 15 2HB ALA 15 9.599 18.413 -22.191 125 3HB ALA 15 3HB ALA 15 8.646 19.567 -21.234 126 H PHE 16 H PHE 16 8.465 22.019 -21.540 127 HA PHE 16 HA PHE 16 5.843 22.675 -22.268 128 1HB PHE 16 1HB PHE 16 6.857 23.343 -20.144 129 2HB PHE 16 2HB PHE 16 7.992 24.392 -20.964 130 HD1 PHE 16 HD1 PHE 16 7.367 26.596 -21.771 131 HD2 PHE 16 HD2 PHE 16 4.430 23.958 -20.042 132 HE1 PHE 16 HE1 PHE 16 5.793 28.499 -21.530 133 HE2 PHE 16 HE2 PHE 16 2.856 25.857 -19.823 134 HZ PHE 16 HZ PHE 16 3.574 28.149 -20.490 135 H ASP 17 H ASP 17 8.897 24.297 -23.203 136 HA ASP 17 HA ASP 17 7.764 26.274 -24.885 137 1HB ASP 17 1HB ASP 17 10.481 24.898 -25.143 138 2HB ASP 17 2HB ASP 17 10.004 26.405 -25.930 139 H LEU 18 H LEU 18 9.039 23.003 -25.730 140 HA LEU 18 HA LEU 18 8.500 23.185 -28.502 141 1HB LEU 18 1HB LEU 18 9.893 21.468 -27.523 142 2HB LEU 18 2HB LEU 18 8.525 20.723 -26.694 143 HG LEU 18 HG LEU 18 8.341 21.087 -29.695 144 1HD1 LEU 18 1HD1 LEU 18 10.613 20.238 -29.388 145 2HD1 LEU 18 2HD1 LEU 18 9.991 18.915 -28.368 146 3HD1 LEU 18 3HD1 LEU 18 9.552 19.005 -30.092 147 1HD2 LEU 18 1HD2 LEU 18 7.255 18.832 -29.539 148 2HD2 LEU 18 2HD2 LEU 18 7.494 18.850 -27.783 149 3HD2 LEU 18 3HD2 LEU 18 6.413 20.023 -28.560 150 H PHE 19 H PHE 19 6.447 21.814 -25.875 151 HA PHE 19 HA PHE 19 4.274 21.179 -27.590 152 1HB PHE 19 1HB PHE 19 4.294 21.883 -24.630 153 2HB PHE 19 2HB PHE 19 2.925 21.159 -25.478 154 HD1 PHE 19 HD1 PHE 19 4.390 20.113 -22.983 155 HD2 PHE 19 HD2 PHE 19 4.624 19.108 -27.177 156 HE1 PHE 19 HE1 PHE 19 4.861 17.747 -22.416 157 HE2 PHE 19 HE2 PHE 19 5.227 16.815 -26.604 158 HZ PHE 19 HZ PHE 19 5.399 16.113 -24.216 159 H ASP 20 H ASP 20 5.046 24.192 -25.837 160 HA ASP 20 HA ASP 20 2.696 25.580 -26.889 161 1HB ASP 20 1HB ASP 20 3.754 26.287 -24.778 162 2HB ASP 20 2HB ASP 20 5.274 26.585 -25.633 163 H THR 21 H THR 21 3.499 24.350 -29.068 164 HA THR 21 HA THR 21 5.726 25.268 -30.447 165 HB THR 21 HB THR 21 3.238 24.392 -31.916 166 HG1 THR 21 HG1 THR 21 4.678 22.852 -30.018 167 1HG2 THR 21 1HG2 THR 21 4.822 22.856 -33.004 168 2HG2 THR 21 2HG2 THR 21 5.446 24.522 -33.095 169 3HG2 THR 21 3HG2 THR 21 6.123 23.371 -31.915 170 H ASP 22 H ASP 22 2.478 26.645 -30.188 171 HA ASP 22 HA ASP 22 2.721 28.573 -32.318 172 1HB ASP 22 1HB ASP 22 0.567 27.855 -31.366 173 2HB ASP 22 2HB ASP 22 1.006 28.557 -29.802 174 H GLY 23 H GLY 23 4.132 28.445 -29.102 175 1HA GLY 23 1HA GLY 23 5.472 29.927 -28.006 176 2HA GLY 23 2HA GLY 23 5.453 30.990 -29.421 177 H SER 24 H SER 24 2.587 29.830 -27.611 178 HA SER 24 HA SER 24 1.591 32.518 -27.196 179 1HB SER 24 1HB SER 24 0.543 29.960 -25.948 180 2HB SER 24 2HB SER 24 -0.324 31.424 -26.395 181 HG SER 24 HG SER 24 0.357 30.790 -28.659 182 H GLY 25 H GLY 25 3.932 30.842 -25.566 183 1HA GLY 25 1HA GLY 25 4.983 31.061 -23.546 184 2HA GLY 25 2HA GLY 25 3.929 32.427 -23.143 185 H THR 26 H THR 26 2.234 29.587 -24.143 186 HA THR 26 HA THR 26 1.607 28.468 -21.510 187 HB THR 26 HB THR 26 -0.715 29.157 -21.742 188 HG1 THR 26 HG1 THR 26 0.252 31.132 -23.566 189 1HG2 THR 26 1HG2 THR 26 -0.628 31.317 -20.793 190 2HG2 THR 26 2HG2 THR 26 0.801 30.445 -20.217 191 3HG2 THR 26 3HG2 THR 26 0.955 31.671 -21.493 192 H ILE 27 H ILE 27 0.628 26.397 -21.900 193 HA ILE 27 HA ILE 27 0.790 25.505 -24.743 194 HB ILE 27 HB ILE 27 0.203 23.916 -22.258 195 1HG1 ILE 27 1HG1 ILE 27 2.758 24.125 -23.927 196 2HG1 ILE 27 2HG1 ILE 27 2.519 24.900 -22.355 197 1HG2 ILE 27 1HG2 ILE 27 -0.751 22.967 -24.366 198 2HG2 ILE 27 2HG2 ILE 27 0.860 23.061 -25.112 199 3HG2 ILE 27 3HG2 ILE 27 0.546 21.971 -23.755 200 1HD1 ILE 27 1HD1 ILE 27 2.522 21.917 -22.902 201 2HD1 ILE 27 2HD1 ILE 27 3.684 22.855 -21.969 202 3HD1 ILE 27 3HD1 ILE 27 2.032 22.657 -21.357 203 H ASP 28 H ASP 28 -1.107 26.027 -25.935 204 HA ASP 28 HA ASP 28 -3.678 26.440 -24.717 205 1HB ASP 28 1HB ASP 28 -3.091 27.312 -26.942 206 2HB ASP 28 2HB ASP 28 -2.982 25.660 -27.572 207 H ALA 29 H ALA 29 -5.475 25.002 -24.423 208 HA ALA 29 HA ALA 29 -5.254 22.395 -23.784 209 1HB ALA 29 1HB ALA 29 -7.336 23.655 -23.613 210 2HB ALA 29 2HB ALA 29 -7.527 23.647 -25.380 211 3HB ALA 29 3HB ALA 29 -7.630 22.127 -24.465 212 H LYS 30 H LYS 30 -5.707 23.480 -27.196 213 HA LYS 30 HA LYS 30 -5.808 20.869 -28.358 214 1HB LYS 30 1HB LYS 30 -4.859 23.515 -29.535 215 2HB LYS 30 2HB LYS 30 -5.214 22.045 -30.453 216 1HG LYS 30 1HG LYS 30 -7.563 22.102 -29.715 217 2HG LYS 30 2HG LYS 30 -7.245 23.549 -28.740 218 1HD LYS 30 1HD LYS 30 -6.594 24.803 -30.783 219 2HD LYS 30 2HD LYS 30 -6.870 23.354 -31.763 220 1HE LYS 30 1HE LYS 30 -8.787 24.838 -31.957 221 2HE LYS 30 2HE LYS 30 -9.275 23.362 -31.109 222 1HZ LYS 30 1HZ LYS 30 -9.106 24.562 -29.054 223 2HZ LYS 30 2HZ LYS 30 -8.598 25.924 -29.831 224 3HZ LYS 30 3HZ LYS 30 -10.123 25.351 -30.081 225 H GLU 31 H GLU 31 -3.079 23.070 -27.625 226 HA GLU 31 HA GLU 31 -1.045 21.434 -28.871 227 1HB GLU 31 1HB GLU 31 -0.894 23.610 -26.755 228 2HB GLU 31 2HB GLU 31 0.487 22.789 -27.473 229 1HG GLU 31 1HG GLU 31 -0.078 23.608 -29.697 230 2HG GLU 31 2HG GLU 31 -1.552 24.379 -29.086 231 H LEU 32 H LEU 32 -2.540 21.619 -25.613 232 HA LEU 32 HA LEU 32 -0.713 19.757 -24.429 233 1HB LEU 32 1HB LEU 32 -2.509 21.353 -23.303 234 2HB LEU 32 2HB LEU 32 -3.571 19.952 -23.512 235 HG LEU 32 HG LEU 32 -1.682 18.590 -22.323 236 1HD1 LEU 32 1HD1 LEU 32 -0.329 19.949 -20.718 237 2HD1 LEU 32 2HD1 LEU 32 0.178 20.102 -22.393 238 3HD1 LEU 32 3HD1 LEU 32 -0.772 21.402 -21.636 239 1HD2 LEU 32 1HD2 LEU 32 -3.354 20.700 -20.910 240 2HD2 LEU 32 2HD2 LEU 32 -3.815 19.029 -21.272 241 3HD2 LEU 32 3HD2 LEU 32 -2.540 19.353 -20.082 242 H LYS 33 H LYS 33 -3.865 19.346 -26.095 243 HA LYS 33 HA LYS 33 -4.016 16.507 -25.874 244 1HB LYS 33 1HB LYS 33 -5.855 17.843 -26.478 245 2HB LYS 33 2HB LYS 33 -5.101 18.413 -27.968 246 1HG LYS 33 1HG LYS 33 -5.822 15.495 -27.418 247 2HG LYS 33 2HG LYS 33 -6.881 16.674 -28.203 248 1HD LYS 33 1HD LYS 33 -4.925 17.046 -29.892 249 2HD LYS 33 2HD LYS 33 -4.305 15.495 -29.283 250 1HE LYS 33 1HE LYS 33 -6.528 14.449 -29.818 251 2HE LYS 33 2HE LYS 33 -7.037 15.988 -30.534 252 1HZ LYS 33 1HZ LYS 33 -6.200 14.479 -32.167 253 2HZ LYS 33 2HZ LYS 33 -5.231 15.807 -32.075 254 3HZ LYS 33 3HZ LYS 33 -4.740 14.382 -31.410 255 H VAL 34 H VAL 34 -2.498 18.534 -28.445 256 HA VAL 34 HA VAL 34 -1.353 16.427 -29.950 257 HB VAL 34 HB VAL 34 -0.426 19.263 -29.398 258 1HG1 VAL 34 1HG1 VAL 34 1.636 18.058 -29.902 259 2HG1 VAL 34 2HG1 VAL 34 0.861 17.266 -31.293 260 3HG1 VAL 34 3HG1 VAL 34 1.151 19.019 -31.298 261 1HG2 VAL 34 1HG2 VAL 34 -1.183 19.648 -31.689 262 2HG2 VAL 34 2HG2 VAL 34 -1.561 17.925 -31.889 263 3HG2 VAL 34 3HG2 VAL 34 -2.501 18.918 -30.760 264 H ALA 35 H ALA 35 0.048 18.159 -27.130 265 HA ALA 35 HA ALA 35 2.448 16.762 -26.928 266 1HB ALA 35 1HB ALA 35 0.740 17.845 -24.639 267 2HB ALA 35 2HB ALA 35 2.446 17.443 -24.567 268 3HB ALA 35 3HB ALA 35 1.895 18.773 -25.610 269 H MET 36 H MET 36 -0.624 15.999 -25.217 270 HA MET 36 HA MET 36 0.230 13.574 -24.020 271 1HB MET 36 1HB MET 36 -2.448 14.739 -24.752 272 2HB MET 36 2HB MET 36 -2.334 13.117 -24.066 273 1HG MET 36 1HG MET 36 -1.070 13.903 -22.151 274 2HG MET 36 2HG MET 36 -1.092 15.559 -22.763 275 1HE MET 36 1HE MET 36 -4.706 16.697 -22.245 276 2HE MET 36 2HE MET 36 -3.062 17.042 -22.824 277 3HE MET 36 3HE MET 36 -4.099 15.949 -23.744 278 H ARG 37 H ARG 37 -1.293 14.109 -27.240 279 HA ARG 37 HA ARG 37 -1.350 11.356 -27.887 280 1HB ARG 37 1HB ARG 37 -2.455 13.328 -29.150 281 2HB ARG 37 2HB ARG 37 -0.879 13.578 -29.910 282 1HG ARG 37 1HG ARG 37 -2.080 12.229 -31.435 283 2HG ARG 37 2HG ARG 37 -1.005 11.088 -30.618 284 1HD ARG 37 1HD ARG 37 -2.961 10.550 -29.053 285 2HD ARG 37 2HD ARG 37 -3.965 11.575 -30.068 286 HE ARG 37 HE ARG 37 -3.526 10.109 -31.956 287 1HH1 ARG 37 1HH1 ARG 37 -2.863 8.637 -28.718 288 2HH1 ARG 37 2HH1 ARG 37 -3.033 7.035 -29.354 289 1HH2 ARG 37 1HH2 ARG 37 -3.748 8.001 -32.663 290 2HH2 ARG 37 2HH2 ARG 37 -3.554 6.657 -31.576 291 H ALA 38 H ALA 38 1.226 13.794 -28.465 292 HA ALA 38 HA ALA 38 3.092 12.036 -29.697 293 1HB ALA 38 1HB ALA 38 4.771 13.703 -29.096 294 2HB ALA 38 2HB ALA 38 3.302 14.497 -29.698 295 3HB ALA 38 3HB ALA 38 3.653 14.475 -27.957 296 H LEU 39 H LEU 39 2.437 12.732 -26.263 297 HA LEU 39 HA LEU 39 4.494 11.002 -25.198 298 1HB LEU 39 1HB LEU 39 1.940 12.132 -24.012 299 2HB LEU 39 2HB LEU 39 3.131 11.248 -23.080 300 HG LEU 39 HG LEU 39 3.920 13.757 -24.605 301 1HD1 LEU 39 1HD1 LEU 39 3.568 14.994 -22.458 302 2HD1 LEU 39 2HD1 LEU 39 2.049 14.452 -23.167 303 3HD1 LEU 39 3HD1 LEU 39 2.741 13.568 -21.797 304 1HD2 LEU 39 1HD2 LEU 39 5.741 12.310 -23.766 305 2HD2 LEU 39 2HD2 LEU 39 5.684 13.848 -22.893 306 3HD2 LEU 39 3HD2 LEU 39 5.046 12.377 -22.132 307 H GLY 40 H GLY 40 1.798 10.117 -27.016 308 1HA GLY 40 1HA GLY 40 1.230 7.980 -27.563 309 2HA GLY 40 2HA GLY 40 2.113 7.341 -26.172 310 H PHE 41 H PHE 41 -0.163 9.932 -25.526 311 HA PHE 41 HA PHE 41 -1.907 8.130 -23.991 312 1HB PHE 41 1HB PHE 41 -2.056 11.065 -24.726 313 2HB PHE 41 2HB PHE 41 -3.305 10.262 -23.834 314 HD1 PHE 41 HD1 PHE 41 0.474 10.083 -23.339 315 HD2 PHE 41 HD2 PHE 41 -3.366 11.280 -21.746 316 HE1 PHE 41 HE1 PHE 41 1.541 10.716 -21.222 317 HE2 PHE 41 HE2 PHE 41 -2.267 11.943 -19.638 318 HZ PHE 41 HZ PHE 41 0.190 11.666 -19.366 319 H GLU 42 H GLU 42 -4.211 8.016 -24.396 320 HA GLU 42 HA GLU 42 -5.110 8.352 -27.217 321 1HB GLU 42 1HB GLU 42 -6.928 6.796 -26.465 322 2HB GLU 42 2HB GLU 42 -5.305 6.129 -26.699 323 1HG GLU 42 1HG GLU 42 -4.912 5.994 -24.304 324 2HG GLU 42 2HG GLU 42 -6.467 6.774 -23.961 325 HA PRO 43 HA PRO 43 -6.807 11.957 -25.026 326 1HB PRO 43 1HB PRO 43 -7.853 12.335 -27.850 327 2HB PRO 43 2HB PRO 43 -7.318 13.583 -26.683 328 1HG PRO 43 1HG PRO 43 -5.592 12.702 -28.569 329 2HG PRO 43 2HG PRO 43 -5.026 12.821 -26.876 330 1HD PRO 43 1HD PRO 43 -5.929 10.345 -28.374 331 2HD PRO 43 2HD PRO 43 -4.545 10.597 -27.259 332 H LYS 44 H LYS 44 -8.154 10.276 -23.882 333 HA LYS 44 HA LYS 44 -10.910 9.879 -24.571 334 1HB LYS 44 1HB LYS 44 -9.546 10.016 -21.851 335 2HB LYS 44 2HB LYS 44 -11.202 9.453 -22.150 336 1HG LYS 44 1HG LYS 44 -10.275 7.662 -23.653 337 2HG LYS 44 2HG LYS 44 -8.641 8.182 -23.206 338 1HD LYS 44 1HD LYS 44 -9.238 7.791 -20.780 339 2HD LYS 44 2HD LYS 44 -10.791 7.118 -21.322 340 1HE LYS 44 1HE LYS 44 -9.520 5.416 -22.685 341 2HE LYS 44 2HE LYS 44 -8.007 6.082 -22.037 342 1HZ LYS 44 1HZ LYS 44 -8.710 4.171 -20.837 343 2HZ LYS 44 2HZ LYS 44 -8.746 5.491 -19.853 344 3HZ LYS 44 3HZ LYS 44 -10.153 4.868 -20.449 345 H LYS 45 H LYS 45 -11.289 11.954 -25.476 346 HA LYS 45 HA LYS 45 -11.152 14.416 -24.865 347 1HB LYS 45 1HB LYS 45 -13.863 13.211 -25.547 348 2HB LYS 45 2HB LYS 45 -13.415 14.916 -25.727 349 1HG LYS 45 1HG LYS 45 -11.571 14.241 -27.279 350 2HG LYS 45 2HG LYS 45 -12.139 12.562 -27.198 351 1HD LYS 45 1HD LYS 45 -14.392 13.300 -27.995 352 2HD LYS 45 2HD LYS 45 -13.770 14.946 -28.191 353 1HE LYS 45 1HE LYS 45 -12.728 12.453 -29.629 354 2HE LYS 45 2HE LYS 45 -13.800 13.677 -30.326 355 1HZ LYS 45 1HZ LYS 45 -12.072 15.295 -29.998 356 2HZ LYS 45 2HZ LYS 45 -11.063 14.146 -29.379 357 3HZ LYS 45 3HZ LYS 45 -11.551 14.053 -30.949 358 H GLU 46 H GLU 46 -13.866 12.698 -23.204 359 HA GLU 46 HA GLU 46 -14.664 14.865 -21.596 360 1HB GLU 46 1HB GLU 46 -15.941 12.750 -21.892 361 2HB GLU 46 2HB GLU 46 -14.743 11.893 -20.900 362 1HG GLU 46 1HG GLU 46 -15.293 13.408 -18.976 363 2HG GLU 46 2HG GLU 46 -16.506 14.213 -19.986 364 H GLU 47 H GLU 47 -12.213 12.336 -20.942 365 HA GLU 47 HA GLU 47 -11.760 13.194 -18.205 366 1HB GLU 47 1HB GLU 47 -10.008 11.415 -19.948 367 2HB GLU 47 2HB GLU 47 -10.023 11.532 -18.184 368 1HG GLU 47 1HG GLU 47 -12.228 10.393 -19.966 369 2HG GLU 47 2HG GLU 47 -11.201 9.516 -18.832 370 H ILE 48 H ILE 48 -10.201 13.657 -21.364 371 HA ILE 48 HA ILE 48 -7.966 15.230 -20.532 372 HB ILE 48 HB ILE 48 -9.671 15.307 -23.050 373 1HG1 ILE 48 1HG1 ILE 48 -8.426 13.153 -22.546 374 2HG1 ILE 48 2HG1 ILE 48 -8.106 13.927 -24.095 375 1HG2 ILE 48 1HG2 ILE 48 -7.696 16.435 -24.114 376 2HG2 ILE 48 2HG2 ILE 48 -8.614 17.432 -22.983 377 3HG2 ILE 48 3HG2 ILE 48 -7.066 16.734 -22.475 378 1HD1 ILE 48 1HD1 ILE 48 -6.061 13.042 -22.965 379 2HD1 ILE 48 2HD1 ILE 48 -5.983 14.768 -23.328 380 3HD1 ILE 48 3HD1 ILE 48 -6.287 14.220 -21.663 381 H LYS 49 H LYS 49 -11.269 16.283 -21.517 382 HA LYS 49 HA LYS 49 -10.922 19.013 -21.021 383 1HB LYS 49 1HB LYS 49 -12.839 17.675 -22.169 384 2HB LYS 49 2HB LYS 49 -13.561 17.572 -20.565 385 1HG LYS 49 1HG LYS 49 -12.891 20.073 -22.185 386 2HG LYS 49 2HG LYS 49 -14.494 19.392 -21.874 387 1HD LYS 49 1HD LYS 49 -14.055 19.798 -19.375 388 2HD LYS 49 2HD LYS 49 -12.627 20.733 -19.893 389 1HE LYS 49 1HE LYS 49 -14.003 22.271 -21.161 390 2HE LYS 49 2HE LYS 49 -15.471 21.360 -20.749 391 1HZ LYS 49 1HZ LYS 49 -13.687 22.580 -18.761 392 2HZ LYS 49 2HZ LYS 49 -15.065 23.293 -19.337 393 3HZ LYS 49 3HZ LYS 49 -15.145 21.884 -18.486 394 H LYS 50 H LYS 50 -12.263 16.482 -18.822 395 HA LYS 50 HA LYS 50 -12.675 18.102 -16.555 396 1HB LYS 50 1HB LYS 50 -11.875 15.182 -16.814 397 2HB LYS 50 2HB LYS 50 -12.283 15.921 -15.267 398 1HG LYS 50 1HG LYS 50 -14.206 15.987 -17.631 399 2HG LYS 50 2HG LYS 50 -14.122 14.630 -16.500 400 1HD LYS 50 1HD LYS 50 -14.582 16.179 -14.603 401 2HD LYS 50 2HD LYS 50 -14.739 17.528 -15.747 402 1HE LYS 50 1HE LYS 50 -16.608 16.348 -16.886 403 2HE LYS 50 2HE LYS 50 -16.449 14.995 -15.751 404 1HZ LYS 50 1HZ LYS 50 -16.975 16.505 -13.976 405 2HZ LYS 50 2HZ LYS 50 -17.137 17.758 -15.035 406 3HZ LYS 50 3HZ LYS 50 -18.176 16.482 -15.103 407 H MET 51 H MET 51 -9.718 16.131 -17.298 408 HA MET 51 HA MET 51 -8.203 16.933 -15.129 409 1HB MET 51 1HB MET 51 -7.745 15.096 -16.708 410 2HB MET 51 2HB MET 51 -7.280 16.246 -17.962 411 1HG MET 51 1HG MET 51 -5.981 16.086 -15.222 412 2HG MET 51 2HG MET 51 -5.444 15.100 -16.580 413 1HE MET 51 1HE MET 51 -3.804 17.641 -18.993 414 2HE MET 51 2HE MET 51 -4.138 15.930 -18.647 415 3HE MET 51 3HE MET 51 -5.468 17.028 -19.097 416 H ILE 52 H ILE 52 -8.244 18.427 -18.419 417 HA ILE 52 HA ILE 52 -6.492 20.567 -17.858 418 HB ILE 52 HB ILE 52 -8.835 20.325 -19.773 419 1HG1 ILE 52 1HG1 ILE 52 -5.806 20.373 -20.202 420 2HG1 ILE 52 2HG1 ILE 52 -6.761 18.897 -20.075 421 1HG2 ILE 52 1HG2 ILE 52 -6.818 22.607 -19.569 422 2HG2 ILE 52 2HG2 ILE 52 -7.971 22.375 -20.898 423 3HG2 ILE 52 3HG2 ILE 52 -8.566 22.732 -19.290 424 1HD1 ILE 52 1HD1 ILE 52 -8.121 19.656 -22.056 425 2HD1 ILE 52 2HD1 ILE 52 -6.949 20.979 -22.276 426 3HD1 ILE 52 3HD1 ILE 52 -6.413 19.300 -22.394 427 H SER 53 H SER 53 -10.062 20.404 -17.391 428 HA SER 53 HA SER 53 -10.341 23.061 -16.440 429 1HB SER 53 1HB SER 53 -12.016 20.652 -15.613 430 2HB SER 53 2HB SER 53 -12.465 22.361 -15.513 431 HG SER 53 HG SER 53 -11.891 20.878 -17.872 432 H GLU 54 H GLU 54 -9.718 20.026 -14.594 433 HA GLU 54 HA GLU 54 -9.688 21.279 -12.024 434 1HB GLU 54 1HB GLU 54 -8.179 18.805 -12.986 435 2HB GLU 54 2HB GLU 54 -8.377 19.302 -11.302 436 1HG GLU 54 1HG GLU 54 -10.625 18.465 -13.185 437 2HG GLU 54 2HG GLU 54 -9.970 17.538 -11.840 438 H ILE 55 H ILE 55 -7.066 20.783 -14.427 439 HA ILE 55 HA ILE 55 -5.056 21.962 -12.683 440 HB ILE 55 HB ILE 55 -5.099 21.477 -15.682 441 1HG1 ILE 55 1HG1 ILE 55 -5.189 19.372 -14.454 442 2HG1 ILE 55 2HG1 ILE 55 -3.613 19.591 -15.203 443 1HG2 ILE 55 1HG2 ILE 55 -2.814 22.372 -13.886 444 2HG2 ILE 55 2HG2 ILE 55 -2.603 21.706 -15.518 445 3HG2 ILE 55 3HG2 ILE 55 -3.486 23.210 -15.299 446 1HD1 ILE 55 1HD1 ILE 55 -2.709 20.283 -12.947 447 2HD1 ILE 55 2HD1 ILE 55 -4.303 19.903 -12.251 448 3HD1 ILE 55 3HD1 ILE 55 -3.348 18.632 -13.018 449 H ASP 56 H ASP 56 -7.361 23.306 -15.011 450 HA ASP 56 HA ASP 56 -5.982 25.754 -15.421 451 1HB ASP 56 1HB ASP 56 -7.678 24.740 -16.932 452 2HB ASP 56 2HB ASP 56 -8.948 25.217 -15.791 453 H LYS 57 H LYS 57 -5.436 26.135 -13.136 454 HA LYS 57 HA LYS 57 -7.389 27.477 -11.434 455 1HB LYS 57 1HB LYS 57 -5.515 26.154 -10.537 456 2HB LYS 57 2HB LYS 57 -4.358 27.132 -11.431 457 1HG LYS 57 1HG LYS 57 -4.363 27.740 -9.094 458 2HG LYS 57 2HG LYS 57 -4.836 29.086 -10.118 459 1HD LYS 57 1HD LYS 57 -6.201 28.960 -8.047 460 2HD LYS 57 2HD LYS 57 -7.186 28.847 -9.501 461 1HE LYS 57 1HE LYS 57 -7.912 27.254 -7.751 462 2HE LYS 57 2HE LYS 57 -7.414 26.407 -9.217 463 1HZ LYS 57 1HZ LYS 57 -6.544 25.385 -7.256 464 2HZ LYS 57 2HZ LYS 57 -5.310 25.969 -8.176 465 3HZ LYS 57 3HZ LYS 57 -5.769 26.769 -6.809 466 H ASP 58 H ASP 58 -4.917 28.277 -13.830 467 HA ASP 58 HA ASP 58 -5.724 31.110 -13.995 468 1HB ASP 58 1HB ASP 58 -3.375 31.865 -13.632 469 2HB ASP 58 2HB ASP 58 -4.089 31.158 -12.181 470 H GLY 59 H GLY 59 -5.957 28.775 -15.687 471 1HA GLY 59 1HA GLY 59 -3.787 28.957 -17.708 472 2HA GLY 59 2HA GLY 59 -5.003 27.696 -17.445 473 H SER 60 H SER 60 -7.308 29.247 -17.317 474 HA SER 60 HA SER 60 -9.011 29.789 -18.747 475 1HB SER 60 1HB SER 60 -8.594 31.960 -20.036 476 2HB SER 60 2HB SER 60 -8.380 32.007 -18.280 477 HG SER 60 HG SER 60 -6.154 31.437 -19.884 478 H GLY 61 H GLY 61 -8.131 27.561 -19.705 479 1HA GLY 61 1HA GLY 61 -8.495 26.376 -21.676 480 2HA GLY 61 2HA GLY 61 -8.443 27.862 -22.627 481 H THR 62 H THR 62 -5.699 28.221 -20.870 482 HA THR 62 HA THR 62 -4.048 26.387 -22.530 483 HB THR 62 HB THR 62 -2.307 27.999 -22.570 484 HG1 THR 62 HG1 THR 62 -3.906 29.542 -20.791 485 1HG2 THR 62 1HG2 THR 62 -3.220 29.931 -23.711 486 2HG2 THR 62 2HG2 THR 62 -4.182 28.527 -24.201 487 3HG2 THR 62 3HG2 THR 62 -4.827 29.676 -23.016 488 H ILE 63 H ILE 63 -1.934 25.900 -21.347 489 HA ILE 63 HA ILE 63 -2.307 25.721 -18.381 490 HB ILE 63 HB ILE 63 -0.532 24.029 -20.164 491 1HG1 ILE 63 1HG1 ILE 63 -2.816 23.421 -20.698 492 2HG1 ILE 63 2HG1 ILE 63 -2.027 22.164 -19.746 493 1HG2 ILE 63 1HG2 ILE 63 -1.240 23.780 -17.218 494 2HG2 ILE 63 2HG2 ILE 63 -0.286 22.616 -18.158 495 3HG2 ILE 63 3HG2 ILE 63 0.321 24.255 -17.903 496 1HD1 ILE 63 1HD1 ILE 63 -4.348 22.486 -19.047 497 2HD1 ILE 63 2HD1 ILE 63 -3.238 22.865 -17.725 498 3HD1 ILE 63 3HD1 ILE 63 -4.029 24.175 -18.632 499 H ASP 64 H ASP 64 -1.174 27.295 -17.418 500 HA ASP 64 HA ASP 64 1.005 28.730 -18.694 501 1HB ASP 64 1HB ASP 64 -0.526 29.792 -17.057 502 2HB ASP 64 2HB ASP 64 0.025 28.674 -15.803 503 H PHE 65 H PHE 65 3.247 28.747 -17.897 504 HA PHE 65 HA PHE 65 4.423 26.220 -17.620 505 1HB PHE 65 1HB PHE 65 5.705 28.172 -18.285 506 2HB PHE 65 2HB PHE 65 5.473 28.911 -16.696 507 HD1 PHE 65 HD1 PHE 65 7.198 28.624 -15.087 508 HD2 PHE 65 HD2 PHE 65 6.760 25.697 -18.229 509 HE1 PHE 65 HE1 PHE 65 9.303 27.534 -14.373 510 HE2 PHE 65 HE2 PHE 65 8.832 24.573 -17.460 511 HZ PHE 65 HZ PHE 65 10.134 25.517 -15.574 512 H GLU 66 H GLU 66 3.367 28.452 -14.993 513 HA GLU 66 HA GLU 66 4.451 26.930 -12.844 514 1HB GLU 66 1HB GLU 66 1.963 28.698 -12.947 515 2HB GLU 66 2HB GLU 66 2.727 28.079 -11.476 516 1HG GLU 66 1HG GLU 66 4.836 29.250 -12.053 517 2HG GLU 66 2HG GLU 66 4.084 29.916 -13.510 518 H GLU 67 H GLU 67 1.308 26.705 -14.550 519 HA GLU 67 HA GLU 67 0.200 24.664 -12.854 520 1HB GLU 67 1HB GLU 67 -0.439 25.483 -15.711 521 2HB GLU 67 2HB GLU 67 -1.399 24.361 -14.738 522 1HG GLU 67 1HG GLU 67 -1.890 26.088 -13.088 523 2HG GLU 67 2HG GLU 67 -0.848 27.251 -13.915 524 H PHE 68 H PHE 68 1.950 24.581 -15.992 525 HA PHE 68 HA PHE 68 1.877 21.769 -16.383 526 1HB PHE 68 1HB PHE 68 2.557 23.533 -18.037 527 2HB PHE 68 2HB PHE 68 4.065 23.740 -17.168 528 HD1 PHE 68 HD1 PHE 68 5.937 22.390 -17.764 529 HD2 PHE 68 HD2 PHE 68 1.973 21.184 -18.969 530 HE1 PHE 68 HE1 PHE 68 6.907 20.775 -19.381 531 HE2 PHE 68 HE2 PHE 68 2.955 19.579 -20.582 532 HZ PHE 68 HZ PHE 68 5.437 19.380 -20.783 533 H LEU 69 H LEU 69 4.378 23.810 -14.834 534 HA LEU 69 HA LEU 69 6.102 21.803 -13.939 535 1HB LEU 69 1HB LEU 69 6.640 24.192 -13.911 536 2HB LEU 69 2HB LEU 69 5.388 24.491 -12.702 537 HG LEU 69 HG LEU 69 6.627 23.140 -11.042 538 1HD1 LEU 69 1HD1 LEU 69 8.726 22.889 -13.247 539 2HD1 LEU 69 2HD1 LEU 69 8.977 22.472 -11.537 540 3HD1 LEU 69 3HD1 LEU 69 7.813 21.558 -12.500 541 1HD2 LEU 69 1HD2 LEU 69 7.002 25.571 -11.221 542 2HD2 LEU 69 2HD2 LEU 69 8.477 24.724 -10.718 543 3HD2 LEU 69 3HD2 LEU 69 8.308 25.291 -12.394 544 H THR 70 H THR 70 3.179 23.193 -12.331 545 HA THR 70 HA THR 70 3.355 21.626 -9.984 546 HB THR 70 HB THR 70 0.823 22.669 -11.315 547 HG1 THR 70 HG1 THR 70 2.353 24.296 -10.863 548 1HG2 THR 70 1HG2 THR 70 1.430 21.861 -8.437 549 2HG2 THR 70 2HG2 THR 70 -0.048 22.667 -8.997 550 3HG2 THR 70 3HG2 THR 70 0.316 21.022 -9.542 551 H MET 71 H MET 71 1.673 20.864 -13.108 552 HA MET 71 HA MET 71 0.625 18.332 -12.346 553 1HB MET 71 1HB MET 71 1.755 19.208 -15.046 554 2HB MET 71 2HB MET 71 0.860 17.721 -14.747 555 1HG MET 71 1HG MET 71 -1.146 18.876 -14.278 556 2HG MET 71 2HG MET 71 -0.336 20.440 -14.165 557 1HE MET 71 1HE MET 71 -0.860 18.188 -18.174 558 2HE MET 71 2HE MET 71 0.403 17.747 -17.007 559 3HE MET 71 3HE MET 71 -1.318 17.506 -16.595 560 H MET 72 H MET 72 3.805 19.166 -13.798 561 HA MET 72 HA MET 72 4.818 16.499 -13.745 562 1HB MET 72 1HB MET 72 6.076 19.233 -13.980 563 2HB MET 72 2HB MET 72 7.089 17.802 -13.727 564 1HG MET 72 1HG MET 72 6.841 18.278 -16.109 565 2HG MET 72 2HG MET 72 6.203 16.696 -15.666 566 1HE MET 72 1HE MET 72 4.998 16.292 -17.882 567 2HE MET 72 2HE MET 72 4.003 17.515 -18.707 568 3HE MET 72 3HE MET 72 5.748 17.794 -18.477 569 H THR 73 H THR 73 4.963 19.073 -11.285 570 HA THR 73 HA THR 73 6.635 17.687 -9.450 571 HB THR 73 HB THR 73 4.450 19.702 -8.788 572 HG1 THR 73 HG1 THR 73 5.964 20.474 -10.342 573 1HG2 THR 73 1HG2 THR 73 5.385 18.567 -6.788 574 2HG2 THR 73 2HG2 THR 73 7.032 18.927 -7.359 575 3HG2 THR 73 3HG2 THR 73 5.943 20.248 -6.891 576 H ALA 74 H ALA 74 3.066 17.742 -9.861 577 HA ALA 74 HA ALA 74 2.440 16.035 -7.677 578 1HB ALA 74 1HB ALA 74 0.769 17.393 -8.887 579 2HB ALA 74 2HB ALA 74 0.955 16.361 -10.320 580 3HB ALA 74 3HB ALA 74 0.307 15.681 -8.816 581 H LYS 75 H LYS 75 3.217 15.288 -11.114 582 HA LYS 75 HA LYS 75 2.955 12.437 -10.773 583 1HB LYS 75 1HB LYS 75 4.444 14.102 -12.827 584 2HB LYS 75 2HB LYS 75 4.322 12.334 -12.878 585 1HG LYS 75 1HG LYS 75 1.831 12.516 -12.817 586 2HG LYS 75 2HG LYS 75 1.957 14.266 -12.949 587 1HD LYS 75 1HD LYS 75 3.000 12.201 -14.963 588 2HD LYS 75 2HD LYS 75 1.499 13.117 -15.127 589 1HE LYS 75 1HE LYS 75 4.316 14.299 -15.116 590 2HE LYS 75 2HE LYS 75 3.265 14.091 -16.521 591 1HZ LYS 75 1HZ LYS 75 1.706 15.592 -15.526 592 2HZ LYS 75 2HZ LYS 75 2.672 15.784 -14.203 593 3HZ LYS 75 3HZ LYS 75 3.181 16.314 -15.677 594 H MET 76 H MET 76 5.783 14.625 -10.433 595 HA MET 76 HA MET 76 7.239 12.440 -9.015 596 1HB MET 76 1HB MET 76 8.358 14.186 -11.246 597 2HB MET 76 2HB MET 76 9.300 13.095 -10.212 598 1HG MET 76 1HG MET 76 7.834 11.199 -11.037 599 2HG MET 76 2HG MET 76 7.161 12.319 -12.228 600 1HE MET 76 1HE MET 76 10.357 13.107 -14.413 601 2HE MET 76 2HE MET 76 8.640 13.490 -14.135 602 3HE MET 76 3HE MET 76 9.880 14.020 -12.970
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