NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
557446 | 2m20 | 18888 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 LYS 1 1H LYS 1 -1.188 0.982 -34.006 2 H2 LYS 1 2H LYS 1 -1.236 1.098 -32.320 3 H3 LYS 1 3H LYS 1 -2.491 0.324 -33.149 4 HA LYS 1 HA LYS 1 -1.011 -1.414 -33.872 5 HB2 LYS 1 1HB LYS 1 1.013 0.228 -32.356 6 HB3 LYS 1 2HB LYS 1 1.273 -1.470 -32.727 7 HG2 LYS 1 1HG LYS 1 1.092 -0.979 -35.114 8 HG3 LYS 1 2HG LYS 1 0.831 0.726 -34.741 9 HD2 LYS 1 1HD LYS 1 3.038 0.831 -33.686 10 HD3 LYS 1 2HD LYS 1 3.298 -0.874 -34.056 11 HE2 LYS 1 1HE LYS 1 4.434 0.318 -35.740 12 HE3 LYS 1 2HE LYS 1 2.944 -0.254 -36.488 13 HZ1 LYS 1 3HZ LYS 1 3.405 2.482 -35.426 14 HZ2 LYS 1 1HZ LYS 1 1.974 1.934 -36.143 15 HZ3 LYS 1 2HZ LYS 1 3.391 2.047 -37.061 16 H ILE 2 H ILE 2 -1.096 0.166 -30.706 17 HA ILE 2 HA ILE 2 -2.057 -2.352 -29.550 18 HB ILE 2 HB ILE 2 -0.744 -1.708 -27.428 19 HG12 ILE 2 1HG1 ILE 2 1.572 -0.707 -28.389 20 HG13 ILE 2 2HG1 ILE 2 0.436 0.129 -29.442 21 HG21 ILE 2 1HG2 ILE 2 0.692 -2.767 -29.855 22 HG22 ILE 2 2HG2 ILE 2 -0.297 -3.699 -28.731 23 HG23 ILE 2 3HG2 ILE 2 1.215 -2.974 -28.184 24 HD11 ILE 2 3HD1 ILE 2 0.421 0.181 -26.433 25 HD12 ILE 2 1HD1 ILE 2 -0.719 1.021 -27.486 26 HD13 ILE 2 2HD1 ILE 2 0.987 1.469 -27.498 27 HA PRO 3 HA PRO 3 -5.187 0.228 -27.771 28 HB2 PRO 3 1HB PRO 3 -5.891 -1.284 -25.610 29 HB3 PRO 3 2HB PRO 3 -6.352 -1.696 -27.272 30 HG2 PRO 3 1HG PRO 3 -4.158 -2.806 -25.595 31 HG3 PRO 3 2HG PRO 3 -5.267 -3.638 -26.704 32 HD2 PRO 3 1HD PRO 3 -2.717 -3.023 -27.380 33 HD3 PRO 3 2HD PRO 3 -4.039 -3.092 -28.563 34 H SER 4 H SER 4 -5.296 1.909 -26.393 35 HA SER 4 HA SER 4 -3.077 2.406 -24.620 36 HB2 SER 4 1HB SER 4 -5.545 4.059 -25.206 37 HB3 SER 4 2HB SER 4 -4.151 4.607 -24.275 38 HG SER 4 HG SER 4 -4.240 3.897 -27.017 39 H ILE 5 H ILE 5 -5.970 0.792 -24.272 40 HA ILE 5 HA ILE 5 -6.576 1.615 -21.566 41 HB ILE 5 HB ILE 5 -7.705 -0.823 -22.933 42 HG12 ILE 5 1HG1 ILE 5 -9.611 1.075 -23.339 43 HG13 ILE 5 2HG1 ILE 5 -8.150 2.033 -23.554 44 HG21 ILE 5 1HG2 ILE 5 -8.200 -0.588 -20.565 45 HG22 ILE 5 2HG2 ILE 5 -9.658 -0.344 -21.526 46 HG23 ILE 5 3HG2 ILE 5 -8.814 1.043 -20.838 47 HD11 ILE 5 3HD1 ILE 5 -8.974 1.155 -25.667 48 HD12 ILE 5 1HD1 ILE 5 -8.829 -0.490 -25.047 49 HD13 ILE 5 2HD1 ILE 5 -7.385 0.496 -25.276 50 H ALA 6 H ALA 6 -4.875 -1.000 -23.168 51 HA ALA 6 HA ALA 6 -4.571 -2.558 -20.747 52 HB1 ALA 6 3HB ALA 6 -4.803 -3.643 -22.946 53 HB2 ALA 6 1HB ALA 6 -3.316 -4.106 -22.118 54 HB3 ALA 6 2HB ALA 6 -3.264 -2.936 -23.438 55 H THR 7 H THR 7 -2.756 -0.184 -22.535 56 HA THR 7 HA THR 7 -0.179 -0.698 -21.513 57 HB THR 7 HB THR 7 -1.034 2.093 -22.178 58 HG1 THR 7 HG1 THR 7 -0.512 0.133 -24.169 59 HG21 THR 7 3HG2 THR 7 1.163 2.106 -23.318 60 HG22 THR 7 1HG2 THR 7 1.412 0.435 -22.812 61 HG23 THR 7 2HG2 THR 7 1.297 1.714 -21.603 62 H GLY 8 H GLY 8 -2.907 1.098 -20.226 63 HA2 GLY 8 1HA GLY 8 -1.382 2.309 -18.086 64 HA3 GLY 8 2HA GLY 8 -3.123 2.386 -18.301 65 H LEU 9 H LEU 9 -3.696 -0.341 -18.418 66 HA LEU 9 HA LEU 9 -3.933 -0.994 -15.698 67 HB2 LEU 9 1HB LEU 9 -4.235 -2.709 -18.165 68 HB3 LEU 9 2HB LEU 9 -4.658 -3.243 -16.549 69 HG LEU 9 HG LEU 9 -5.913 -0.772 -17.704 70 HD11 LEU 9 1HD1 LEU 9 -7.815 -2.291 -18.369 71 HD12 LEU 9 2HD1 LEU 9 -6.683 -3.634 -18.211 72 HD13 LEU 9 3HD1 LEU 9 -6.381 -2.358 -19.390 73 HD21 LEU 9 3HD2 LEU 9 -6.785 -2.803 -15.648 74 HD22 LEU 9 1HD2 LEU 9 -7.744 -1.424 -16.187 75 HD23 LEU 9 2HD2 LEU 9 -6.225 -1.161 -15.332 76 H VAL 10 H VAL 10 -1.700 -2.179 -18.195 77 HA VAL 10 HA VAL 10 -0.468 -4.162 -16.644 78 HB VAL 10 HB VAL 10 1.443 -4.002 -18.229 79 HG11 VAL 10 1HG1 VAL 10 -1.374 -4.168 -19.259 80 HG12 VAL 10 2HG1 VAL 10 -0.259 -5.480 -18.866 81 HG13 VAL 10 3HG1 VAL 10 0.020 -4.486 -20.295 82 HG21 VAL 10 3HG2 VAL 10 1.445 -1.612 -18.662 83 HG22 VAL 10 1HG2 VAL 10 -0.148 -1.722 -19.413 84 HG23 VAL 10 2HG2 VAL 10 1.242 -2.497 -20.174 85 H GLY 11 H GLY 11 0.225 -0.741 -16.968 86 HA2 GLY 11 1HA GLY 11 2.663 -0.738 -15.505 87 HA3 GLY 11 2HA GLY 11 1.659 0.666 -15.834 88 H ALA 12 H ALA 12 -0.676 0.067 -14.547 89 HA ALA 12 HA ALA 12 0.063 0.579 -11.832 90 HB1 ALA 12 3HB ALA 12 -1.914 1.567 -13.082 91 HB2 ALA 12 1HB ALA 12 -2.208 1.025 -11.429 92 HB3 ALA 12 2HB ALA 12 -2.730 0.030 -12.789 93 H LEU 13 H LEU 13 -1.486 -2.166 -13.461 94 HA LEU 13 HA LEU 13 -1.987 -3.638 -11.105 95 HB2 LEU 13 1HB LEU 13 -1.864 -4.293 -14.015 96 HB3 LEU 13 2HB LEU 13 -1.903 -5.607 -12.856 97 HG LEU 13 HG LEU 13 -4.019 -4.632 -11.922 98 HD11 LEU 13 1HD1 LEU 13 -3.747 -2.333 -12.705 99 HD12 LEU 13 2HD1 LEU 13 -5.261 -3.028 -13.286 100 HD13 LEU 13 3HD1 LEU 13 -3.882 -2.879 -14.375 101 HD21 LEU 13 3HD2 LEU 13 -4.049 -6.509 -13.474 102 HD22 LEU 13 1HD2 LEU 13 -4.049 -5.392 -14.839 103 HD23 LEU 13 2HD2 LEU 13 -5.430 -5.446 -13.744 104 H LEU 14 H LEU 14 0.781 -3.565 -13.331 105 HA LEU 14 HA LEU 14 2.180 -5.668 -12.013 106 HB2 LEU 14 1HB LEU 14 2.735 -3.770 -14.188 107 HB3 LEU 14 2HB LEU 14 4.145 -4.275 -13.277 108 HG LEU 14 HG LEU 14 3.321 -6.683 -13.719 109 HD11 LEU 14 1HD1 LEU 14 1.086 -5.776 -14.591 110 HD12 LEU 14 2HD1 LEU 14 1.865 -7.075 -15.497 111 HD13 LEU 14 3HD1 LEU 14 1.970 -5.412 -16.074 112 HD21 LEU 14 3HD2 LEU 14 4.356 -4.969 -15.973 113 HD22 LEU 14 1HD2 LEU 14 4.468 -6.726 -15.878 114 HD23 LEU 14 2HD2 LEU 14 5.327 -5.724 -14.710 115 H LEU 15 H LEU 15 2.230 -2.148 -11.766 116 HA LEU 15 HA LEU 15 4.439 -2.048 -9.961 117 HB2 LEU 15 1HB LEU 15 2.612 -0.164 -11.187 118 HB3 LEU 15 2HB LEU 15 2.886 0.230 -9.501 119 HG LEU 15 HG LEU 15 5.436 -0.158 -10.290 120 HD11 LEU 15 1HD1 LEU 15 4.014 0.943 -12.708 121 HD12 LEU 15 2HD1 LEU 15 4.822 -0.621 -12.602 122 HD13 LEU 15 3HD1 LEU 15 5.761 0.867 -12.479 123 HD21 LEU 15 3HD2 LEU 15 3.890 2.406 -10.645 124 HD22 LEU 15 1HD2 LEU 15 5.630 2.255 -10.409 125 HD23 LEU 15 2HD2 LEU 15 4.522 1.796 -9.115 126 H LEU 16 H LEU 16 0.937 -2.163 -9.572 127 HA LEU 16 HA LEU 16 0.925 -1.822 -6.748 128 HB2 LEU 16 1HB LEU 16 -0.991 -1.695 -8.604 129 HB3 LEU 16 2HB LEU 16 -1.244 -3.351 -8.092 130 HG LEU 16 HG LEU 16 -1.095 -1.274 -5.968 131 HD11 LEU 16 1HD1 LEU 16 -3.465 -0.732 -6.253 132 HD12 LEU 16 2HD1 LEU 16 -3.491 -1.654 -7.757 133 HD13 LEU 16 3HD1 LEU 16 -2.502 -0.200 -7.633 134 HD21 LEU 16 3HD2 LEU 16 -1.362 -3.639 -5.408 135 HD22 LEU 16 1HD2 LEU 16 -2.822 -3.713 -6.395 136 HD23 LEU 16 2HD2 LEU 16 -2.786 -2.709 -4.944 137 H LEU 17 H LEU 17 1.132 -4.600 -8.895 138 HA LEU 17 HA LEU 17 0.754 -6.596 -6.916 139 HB2 LEU 17 1HB LEU 17 0.649 -6.741 -9.515 140 HB3 LEU 17 2HB LEU 17 2.373 -7.034 -9.399 141 HG LEU 17 HG LEU 17 1.588 -8.893 -7.676 142 HD11 LEU 17 1HD1 LEU 17 -0.782 -8.609 -9.519 143 HD12 LEU 17 2HD1 LEU 17 -0.776 -8.316 -7.779 144 HD13 LEU 17 3HD1 LEU 17 -0.496 -9.942 -8.400 145 HD21 LEU 17 3HD2 LEU 17 2.897 -9.300 -9.683 146 HD22 LEU 17 1HD2 LEU 17 1.445 -9.172 -10.676 147 HD23 LEU 17 2HD2 LEU 17 1.614 -10.501 -9.529 148 H VAL 18 H VAL 18 3.648 -5.067 -8.301 149 HA VAL 18 HA VAL 18 5.524 -6.668 -6.884 150 HB VAL 18 HB VAL 18 5.896 -3.918 -8.095 151 HG11 VAL 18 1HG1 VAL 18 8.294 -4.437 -8.077 152 HG12 VAL 18 2HG1 VAL 18 7.959 -5.940 -7.217 153 HG13 VAL 18 3HG1 VAL 18 7.627 -4.389 -6.445 154 HG21 VAL 18 3HG2 VAL 18 5.218 -5.579 -9.742 155 HG22 VAL 18 1HG2 VAL 18 6.503 -6.659 -9.202 156 HG23 VAL 18 2HG2 VAL 18 6.907 -5.127 -9.975 157 H VAL 19 H VAL 19 4.092 -3.474 -6.238 158 HA VAL 19 HA VAL 19 5.604 -2.966 -3.883 159 HB VAL 19 HB VAL 19 2.956 -1.790 -4.761 160 HG11 VAL 19 1HG1 VAL 19 3.435 0.029 -3.188 161 HG12 VAL 19 2HG1 VAL 19 4.861 -0.840 -2.622 162 HG13 VAL 19 3HG1 VAL 19 3.255 -1.517 -2.358 163 HG21 VAL 19 3HG2 VAL 19 5.775 -0.744 -5.016 164 HG22 VAL 19 1HG2 VAL 19 4.311 0.127 -5.473 165 HG23 VAL 19 2HG2 VAL 19 4.764 -1.347 -6.330 166 H ALA 20 H ALA 20 2.432 -4.433 -4.463 167 HA ALA 20 HA ALA 20 1.713 -4.664 -1.717 168 HB1 ALA 20 3HB ALA 20 0.048 -4.684 -3.512 169 HB2 ALA 20 1HB ALA 20 -0.075 -6.120 -2.496 170 HB3 ALA 20 2HB ALA 20 0.686 -6.225 -4.084 171 H LEU 21 H LEU 21 3.374 -6.770 -4.003 172 HA LEU 21 HA LEU 21 3.397 -9.083 -2.345 173 HB2 LEU 21 1HB LEU 21 3.851 -8.758 -4.926 174 HB3 LEU 21 2HB LEU 21 5.512 -8.598 -4.395 175 HG LEU 21 HG LEU 21 4.929 -10.870 -3.128 176 HD11 LEU 21 1HD1 LEU 21 3.128 -10.905 -5.545 177 HD12 LEU 21 2HD1 LEU 21 2.607 -10.928 -3.860 178 HD13 LEU 21 3HD1 LEU 21 3.512 -12.289 -4.521 179 HD21 LEU 21 3HD2 LEU 21 6.759 -10.559 -4.693 180 HD22 LEU 21 1HD2 LEU 21 5.636 -10.646 -6.051 181 HD23 LEU 21 2HD2 LEU 21 5.905 -12.064 -5.036 182 H GLY 22 H GLY 22 5.770 -6.506 -2.971 183 HA2 GLY 22 1HA GLY 22 7.792 -7.579 -1.276 184 HA3 GLY 22 2HA GLY 22 7.722 -5.935 -1.889 185 H ILE 23 H ILE 23 5.626 -4.780 -0.812 186 HA ILE 23 HA ILE 23 6.343 -4.338 1.884 187 HB ILE 23 HB ILE 23 3.759 -3.568 0.510 188 HG12 ILE 23 1HG1 ILE 23 5.642 -2.695 -0.754 189 HG13 ILE 23 2HG1 ILE 23 4.854 -1.378 0.103 190 HG21 ILE 23 1HG2 ILE 23 3.402 -3.258 2.799 191 HG22 ILE 23 2HG2 ILE 23 3.864 -1.663 2.206 192 HG23 ILE 23 3HG2 ILE 23 5.039 -2.658 3.067 193 HD11 ILE 23 3HD1 ILE 23 6.654 -1.599 1.854 194 HD12 ILE 23 1HD1 ILE 23 7.180 -1.019 0.274 195 HD13 ILE 23 2HD1 ILE 23 7.480 -2.692 0.743 196 H GLY 24 H GLY 24 3.805 -6.274 0.370 197 HA2 GLY 24 1HA GLY 24 2.365 -6.926 2.714 198 HA3 GLY 24 2HA GLY 24 2.351 -7.840 1.213 199 H LEU 25 H LEU 25 4.961 -8.665 1.004 200 HA LEU 25 HA LEU 25 5.040 -10.812 2.888 201 HB2 LEU 25 1HB LEU 25 6.904 -9.926 0.698 202 HB3 LEU 25 2HB LEU 25 7.272 -11.289 1.737 203 HG LEU 25 HG LEU 25 4.700 -11.201 0.190 204 HD11 LEU 25 1HD1 LEU 25 5.791 -12.420 -1.615 205 HD12 LEU 25 2HD1 LEU 25 7.350 -12.233 -0.812 206 HD13 LEU 25 3HD1 LEU 25 6.497 -10.816 -1.423 207 HD21 LEU 25 3HD2 LEU 25 6.424 -13.424 1.279 208 HD22 LEU 25 1HD2 LEU 25 4.962 -13.656 0.321 209 HD23 LEU 25 2HD2 LEU 25 4.865 -12.893 1.907 210 H PHE 26 H PHE 26 6.476 -7.670 2.713 211 HA PHE 26 HA PHE 26 8.652 -8.159 4.498 212 HB2 PHE 26 1HB PHE 26 7.578 -5.910 3.011 213 HB3 PHE 26 2HB PHE 26 8.064 -5.435 4.635 214 HD1 PHE 26 HD2 PHE 26 9.202 -6.688 1.397 215 HD2 PHE 26 HD1 PHE 26 10.379 -5.530 5.320 216 HE1 PHE 26 HE2 PHE 26 11.549 -6.599 0.662 217 HE2 PHE 26 HE1 PHE 26 12.728 -5.437 4.592 218 HZ PHE 26 HZ PHE 26 13.315 -5.973 2.261 219 H ILE 27 H ILE 27 5.352 -6.916 4.884 220 HA ILE 27 HA ILE 27 5.714 -6.460 7.722 221 HB ILE 27 HB ILE 27 3.121 -6.416 6.166 222 HG12 ILE 27 1HG1 ILE 27 4.694 -3.968 6.923 223 HG13 ILE 27 2HG1 ILE 27 5.058 -4.827 5.430 224 HG21 ILE 27 1HG2 ILE 27 3.883 -5.206 8.825 225 HG22 ILE 27 2HG2 ILE 27 2.820 -6.590 8.575 226 HG23 ILE 27 3HG2 ILE 27 2.334 -4.994 8.009 227 HD11 ILE 27 3HD1 ILE 27 2.786 -4.473 4.653 228 HD12 ILE 27 1HD1 ILE 27 3.557 -2.940 5.062 229 HD13 ILE 27 2HD1 ILE 27 2.383 -3.659 6.164 230 H ARG 28 H ARG 28 4.306 -8.929 5.648 231 HA ARG 28 HA ARG 28 2.896 -10.346 7.654 232 HB2 ARG 28 1HB ARG 28 3.878 -11.022 4.907 233 HB3 ARG 28 2HB ARG 28 3.223 -12.287 5.936 234 HG2 ARG 28 1HG ARG 28 1.128 -11.046 6.133 235 HG3 ARG 28 2HG ARG 28 1.787 -9.774 5.102 236 HD2 ARG 28 1HD ARG 28 2.031 -11.387 3.276 237 HD3 ARG 28 2HD ARG 28 1.374 -12.656 4.309 238 HE ARG 28 HE ARG 28 -0.466 -10.550 4.215 239 HH11 ARG 28 1HH1 ARG 28 0.875 -12.980 2.092 240 HH12 ARG 28 2HH1 ARG 28 -0.536 -13.063 1.093 241 HH21 ARG 28 1HH2 ARG 28 -2.319 -10.660 2.900 242 HH22 ARG 28 2HH2 ARG 28 -2.347 -11.746 1.550 243 H ARG 29 H ARG 29 6.242 -10.282 6.739 244 HA ARG 29 HA ARG 29 6.919 -12.757 8.063 245 HB2 ARG 29 1HB ARG 29 8.501 -10.598 6.702 246 HB3 ARG 29 2HB ARG 29 9.308 -11.831 7.661 247 HG2 ARG 29 1HG ARG 29 8.343 -13.571 6.244 248 HG3 ARG 29 2HG ARG 29 7.529 -12.334 5.283 249 HD2 ARG 29 1HD ARG 29 9.701 -11.389 4.669 250 HD3 ARG 29 2HD ARG 29 10.512 -12.625 5.629 251 HE ARG 29 HE ARG 29 8.848 -13.896 3.773 252 HH11 ARG 29 1HH1 ARG 29 11.759 -11.962 3.821 253 HH12 ARG 29 2HH1 ARG 29 12.399 -12.667 2.375 254 HH21 ARG 29 1HH2 ARG 29 9.692 -14.820 1.873 255 HH22 ARG 29 2HH2 ARG 29 11.226 -14.289 1.269 256 H ARG 30 H ARG 30 6.497 -9.498 8.989 257 HA ARG 30 HA ARG 30 8.276 -9.562 11.261 258 HB2 ARG 30 1HB ARG 30 6.229 -7.585 10.276 259 HB3 ARG 30 2HB ARG 30 7.052 -7.380 11.817 260 HG2 ARG 30 1HG ARG 30 9.207 -7.352 10.664 261 HG3 ARG 30 2HG ARG 30 8.381 -7.559 9.119 262 HD2 ARG 30 1HD ARG 30 7.204 -5.441 9.466 263 HD3 ARG 30 2HD ARG 30 8.029 -5.236 11.010 264 HE ARG 30 HE ARG 30 9.963 -5.570 9.017 265 HH11 ARG 30 1HH1 ARG 30 7.549 -3.235 9.986 266 HH12 ARG 30 2HH1 ARG 30 8.418 -1.884 9.338 267 HH21 ARG 30 1HH2 ARG 30 11.101 -3.793 8.168 268 HH22 ARG 30 2HH2 ARG 30 10.433 -2.201 8.307 269 H HIS 31 H HIS 31 5.011 -10.456 10.621 270 HA HIS 31 HA HIS 31 3.974 -10.185 13.259 271 HB2 HIS 31 1HB HIS 31 3.081 -11.669 10.803 272 HB3 HIS 31 2HB HIS 31 2.242 -11.877 12.336 273 HD1 HIS 31 HD1 HIS 31 0.733 -9.979 13.122 274 HD2 HIS 31 HD2 HIS 31 2.813 -9.097 9.635 275 HE1 HIS 31 HE1 HIS 31 -0.304 -7.867 12.238 276 HE2 HIS 31 HE2 HIS 31 1.028 -7.305 10.174 277 H ILE 32 H ILE 32 5.800 -12.667 11.625 278 HA ILE 32 HA ILE 32 5.259 -14.690 13.623 279 HB ILE 32 HB ILE 32 7.453 -14.849 11.563 280 HG12 ILE 32 1HG1 ILE 32 4.769 -15.983 10.945 281 HG13 ILE 32 2HG1 ILE 32 4.962 -14.242 10.768 282 HG21 ILE 32 1HG2 ILE 32 6.986 -17.257 11.697 283 HG22 ILE 32 2HG2 ILE 32 5.734 -16.941 12.899 284 HG23 ILE 32 3HG2 ILE 32 7.422 -16.584 13.269 285 HD11 ILE 32 3HD1 ILE 32 6.926 -14.706 9.288 286 HD12 ILE 32 1HD1 ILE 32 5.367 -15.233 8.653 287 HD13 ILE 32 2HD1 ILE 32 6.480 -16.411 9.347 288 H VAL 33 H VAL 33 7.599 -12.202 13.074 289 HA VAL 33 HA VAL 33 9.461 -13.319 15.036 290 HB VAL 33 HB VAL 33 9.859 -10.678 13.655 291 HG11 VAL 33 1HG1 VAL 33 12.229 -11.267 13.887 292 HG12 VAL 33 2HG1 VAL 33 11.770 -12.792 14.647 293 HG13 VAL 33 3HG1 VAL 33 11.401 -11.263 15.445 294 HG21 VAL 33 3HG2 VAL 33 9.308 -12.249 11.875 295 HG22 VAL 33 1HG2 VAL 33 10.508 -13.386 12.488 296 HG23 VAL 33 2HG2 VAL 33 11.021 -11.833 11.829 297 H ARG 34 H ARG 34 6.759 -11.365 15.008 298 HA ARG 34 HA ARG 34 7.625 -9.613 17.174 299 HB2 ARG 34 1HB ARG 34 6.018 -9.086 15.107 300 HB3 ARG 34 2HB ARG 34 4.800 -9.660 16.236 301 HG2 ARG 34 1HG ARG 34 5.572 -7.981 17.872 302 HG3 ARG 34 2HG ARG 34 6.712 -7.375 16.670 303 HD2 ARG 34 1HD ARG 34 4.804 -6.915 15.158 304 HD3 ARG 34 2HD ARG 34 3.706 -7.416 16.444 305 HE ARG 34 HE ARG 34 5.331 -5.445 17.512 306 HH11 ARG 34 1HH1 ARG 34 2.976 -5.706 14.943 307 HH12 ARG 34 2HH1 ARG 34 2.481 -4.049 15.061 308 HH21 ARG 34 1HH2 ARG 34 4.679 -3.271 17.664 309 HH22 ARG 34 2HH2 ARG 34 3.449 -2.669 16.605 310 H LYS 35 H LYS 35 6.307 -9.425 19.133 311 HA LYS 35 HA LYS 35 5.609 -12.060 20.154 312 HB2 LYS 35 1HB LYS 35 6.044 -9.378 21.456 313 HB3 LYS 35 2HB LYS 35 5.394 -10.749 22.345 314 HG2 LYS 35 1HG LYS 35 7.413 -12.032 21.848 315 HG3 LYS 35 2HG LYS 35 8.065 -10.658 20.954 316 HD2 LYS 35 1HD LYS 35 8.007 -9.305 22.994 317 HD3 LYS 35 2HD LYS 35 7.355 -10.681 23.887 318 HE2 LYS 35 1HE LYS 35 9.385 -11.957 23.396 319 HE3 LYS 35 2HE LYS 35 10.034 -10.583 22.504 320 HZ1 LYS 35 3HZ LYS 35 9.369 -10.606 25.398 321 HZ2 LYS 35 1HZ LYS 35 9.993 -9.287 24.543 322 HZ3 LYS 35 2HZ LYS 35 10.927 -10.681 24.744 323 H ARG 36 H ARG 36 3.648 -12.495 21.272 324 HA ARG 36 HA ARG 36 1.361 -11.156 20.093 325 HB2 ARG 36 1HB ARG 36 1.689 -13.695 21.679 326 HB3 ARG 36 2HB ARG 36 0.105 -13.039 21.294 327 HG2 ARG 36 1HG ARG 36 0.614 -13.199 18.910 328 HG3 ARG 36 2HG ARG 36 2.206 -13.855 19.296 329 HD2 ARG 36 1HD ARG 36 1.148 -15.764 20.404 330 HD3 ARG 36 2HD ARG 36 -0.442 -15.107 20.017 331 HE ARG 36 HE ARG 36 1.009 -15.366 17.639 332 HH11 ARG 36 1HH1 ARG 36 -0.431 -17.401 20.088 333 HH12 ARG 36 2HH1 ARG 36 -0.711 -18.721 19.002 334 HH21 ARG 36 1HH2 ARG 36 0.639 -17.100 16.214 335 HH22 ARG 36 2HH2 ARG 36 -0.103 -18.550 16.805 336 H THR 37 H THR 37 3.095 -10.091 22.396 337 HA THR 37 HA THR 37 1.254 -9.939 24.619 338 HB THR 37 HB THR 37 2.979 -8.300 25.530 339 HG1 THR 37 HG1 THR 37 5.016 -9.118 24.030 340 HG21 THR 37 3HG2 THR 37 2.919 -10.648 26.205 341 HG22 THR 37 1HG2 THR 37 4.583 -10.076 26.075 342 HG23 THR 37 2HG2 THR 37 3.896 -11.085 24.803 343 H LEU 38 H LEU 38 1.755 -8.204 21.743 344 HA LEU 38 HA LEU 38 0.693 -5.695 22.757 345 HB2 LEU 38 1HB LEU 38 2.567 -6.045 20.939 346 HB3 LEU 38 2HB LEU 38 1.198 -6.207 19.857 347 HG LEU 38 HG LEU 38 0.427 -3.937 20.819 348 HD11 LEU 38 1HD1 LEU 38 3.292 -4.023 21.727 349 HD12 LEU 38 2HD1 LEU 38 1.853 -3.667 22.684 350 HD13 LEU 38 3HD1 LEU 38 2.414 -2.516 21.472 351 HD21 LEU 38 3HD2 LEU 38 2.888 -4.092 19.085 352 HD22 LEU 38 1HD2 LEU 38 1.763 -2.737 19.178 353 HD23 LEU 38 2HD2 LEU 38 1.225 -4.287 18.533 354 H ARG 39 H ARG 39 -0.387 -8.565 21.520 355 HA ARG 39 HA ARG 39 -2.878 -7.547 20.403 356 HB2 ARG 39 1HB ARG 39 -1.479 -10.212 20.267 357 HB3 ARG 39 2HB ARG 39 -3.186 -10.062 19.874 358 HG2 ARG 39 1HG ARG 39 -2.726 -8.616 18.048 359 HG3 ARG 39 2HG ARG 39 -1.039 -8.443 18.532 360 HD2 ARG 39 1HD ARG 39 -2.186 -11.129 17.860 361 HD3 ARG 39 2HD ARG 39 -1.621 -10.043 16.591 362 HE ARG 39 HE ARG 39 0.249 -10.586 18.748 363 HH11 ARG 39 1HH1 ARG 39 -0.803 -11.366 15.506 364 HH12 ARG 39 2HH1 ARG 39 0.702 -12.101 15.063 365 HH21 ARG 39 1HH2 ARG 39 2.224 -11.552 18.161 366 HH22 ARG 39 2HH2 ARG 39 2.418 -12.206 16.570 367 H ARG 40 H ARG 40 -1.399 -9.422 22.929 368 HA ARG 40 HA ARG 40 -3.862 -10.240 24.183 369 HB2 ARG 40 1HB ARG 40 -0.965 -10.282 25.021 370 HB3 ARG 40 2HB ARG 40 -2.245 -10.701 26.150 371 HG2 ARG 40 1HG ARG 40 -2.972 -12.498 24.665 372 HG3 ARG 40 2HG ARG 40 -1.690 -12.078 23.529 373 HD2 ARG 40 1HD ARG 40 -0.849 -13.891 24.767 374 HD3 ARG 40 2HD ARG 40 -0.071 -12.463 25.448 375 HE ARG 40 HE ARG 40 -2.395 -12.989 26.917 376 HH11 ARG 40 1HH1 ARG 40 0.743 -14.416 26.338 377 HH12 ARG 40 2HH1 ARG 40 0.813 -15.191 27.885 378 HH21 ARG 40 1HH2 ARG 40 -2.300 -14.009 28.948 379 HH22 ARG 40 2HH2 ARG 40 -0.915 -14.961 29.365 380 H LEU 41 H LEU 41 -1.833 -7.514 24.102 381 HA LEU 41 HA LEU 41 -3.168 -6.256 26.374 382 HB2 LEU 41 1HB LEU 41 -0.595 -5.688 24.935 383 HB3 LEU 41 2HB LEU 41 -1.372 -4.443 25.891 384 HG LEU 41 HG LEU 41 -0.678 -7.121 27.078 385 HD11 LEU 41 1HD1 LEU 41 1.079 -4.675 26.919 386 HD12 LEU 41 2HD1 LEU 41 1.380 -6.235 26.152 387 HD13 LEU 41 3HD1 LEU 41 1.396 -6.099 27.910 388 HD21 LEU 41 3HD2 LEU 41 -2.199 -5.816 28.397 389 HD22 LEU 41 1HD2 LEU 41 -1.194 -4.378 28.219 390 HD23 LEU 41 2HD2 LEU 41 -0.610 -5.750 29.159 391 H LEU 42 H LEU 42 -2.962 -6.357 22.940 392 HA LEU 42 HA LEU 42 -3.780 -3.722 22.305 393 HB2 LEU 42 1HB LEU 42 -2.938 -5.582 20.742 394 HB3 LEU 42 2HB LEU 42 -4.600 -6.139 20.715 395 HG LEU 42 HG LEU 42 -4.159 -3.279 20.064 396 HD11 LEU 42 1HD1 LEU 42 -2.298 -4.336 18.891 397 HD12 LEU 42 2HD1 LEU 42 -3.534 -3.786 17.761 398 HD13 LEU 42 3HD1 LEU 42 -3.408 -5.498 18.164 399 HD21 LEU 42 3HD2 LEU 42 -5.915 -3.750 18.433 400 HD22 LEU 42 1HD2 LEU 42 -6.389 -4.279 20.048 401 HD23 LEU 42 2HD2 LEU 42 -5.856 -5.462 18.853 402 H GLN 43 H GLN 43 -5.658 -6.662 22.909 403 HA GLN 43 HA GLN 43 -8.155 -5.166 22.765 404 HB2 GLN 43 1HB GLN 43 -7.620 -7.628 21.905 405 HB3 GLN 43 2HB GLN 43 -8.068 -8.041 23.554 406 HG2 GLN 43 1HG GLN 43 -10.229 -6.945 23.243 407 HG3 GLN 43 2HG GLN 43 -9.780 -6.532 21.589 408 HE21 GLN 43 2HE2 GLN 43 -9.684 -8.153 20.034 409 HE22 GLN 43 1HE2 GLN 43 -10.419 -9.700 20.271 410 H GLU 44 H GLU 44 -5.840 -6.043 25.071 411 HA GLU 44 HA GLU 44 -7.681 -6.268 27.305 412 HB2 GLU 44 1HB GLU 44 -5.195 -7.250 26.905 413 HB3 GLU 44 2HB GLU 44 -4.811 -5.812 27.841 414 HG2 GLU 44 1HG GLU 44 -5.033 -7.433 29.465 415 HG3 GLU 44 2HG GLU 44 -6.619 -6.665 29.469 416 H ARG 45 H ARG 45 -5.346 -3.887 26.103 417 HA ARG 45 HA ARG 45 -6.060 -1.999 28.192 418 HB2 ARG 45 1HB ARG 45 -4.037 -1.983 25.967 419 HB3 ARG 45 2HB ARG 45 -4.398 -0.526 26.881 420 HG2 ARG 45 1HG ARG 45 -3.716 -3.003 28.378 421 HG3 ARG 45 2HG ARG 45 -2.424 -2.120 27.564 422 HD2 ARG 45 1HD ARG 45 -3.064 -0.084 28.764 423 HD3 ARG 45 2HD ARG 45 -4.354 -0.968 29.576 424 HE ARG 45 HE ARG 45 -1.940 -2.297 30.054 425 HH11 ARG 45 1HH1 ARG 45 -3.493 0.727 30.867 426 HH12 ARG 45 2HH1 ARG 45 -2.657 0.893 32.374 427 HH21 ARG 45 1HH2 ARG 45 -0.842 -2.075 32.035 428 HH22 ARG 45 2HH2 ARG 45 -1.152 -0.696 33.036 429 H GLU 46 H GLU 46 -7.225 -2.812 25.143 430 HA GLU 46 HA GLU 46 -7.893 -0.302 24.060 431 HB2 GLU 46 1HB GLU 46 -8.061 -2.851 23.171 432 HB3 GLU 46 2HB GLU 46 -9.751 -2.543 23.542 433 HG2 GLU 46 1HG GLU 46 -9.652 -0.525 22.115 434 HG3 GLU 46 2HG GLU 46 -7.998 -0.955 21.682 435 H LEU 47 H LEU 47 -10.043 -2.607 25.776 436 HA LEU 47 HA LEU 47 -11.412 -0.365 27.029 437 HB2 LEU 47 1HB LEU 47 -12.758 -2.333 25.190 438 HB3 LEU 47 2HB LEU 47 -13.650 -1.432 26.401 439 HG LEU 47 HG LEU 47 -12.313 0.572 25.105 440 HD11 LEU 47 1HD1 LEU 47 -11.467 -1.013 23.430 441 HD12 LEU 47 2HD1 LEU 47 -12.540 0.196 22.726 442 HD13 LEU 47 3HD1 LEU 47 -13.126 -1.442 23.015 443 HD21 LEU 47 3HD2 LEU 47 -14.473 1.050 24.049 444 HD22 LEU 47 1HD2 LEU 47 -14.663 0.577 25.738 445 HD23 LEU 47 2HD2 LEU 47 -15.026 -0.575 24.453 446 H VAL 48 H VAL 48 -9.706 -2.600 27.876 447 HA VAL 48 HA VAL 48 -11.545 -3.801 29.839 448 HB VAL 48 HB VAL 48 -9.100 -5.271 28.871 449 HG11 VAL 48 1HG1 VAL 48 -11.657 -6.185 30.189 450 HG12 VAL 48 2HG1 VAL 48 -10.084 -6.015 30.969 451 HG13 VAL 48 3HG1 VAL 48 -10.318 -7.228 29.710 452 HG21 VAL 48 3HG2 VAL 48 -10.440 -6.521 27.303 453 HG22 VAL 48 1HG2 VAL 48 -10.550 -4.804 26.917 454 HG23 VAL 48 2HG2 VAL 48 -11.881 -5.608 27.750 455 H GLU 49 H GLU 49 -10.569 -1.573 30.661 456 HA GLU 49 HA GLU 49 -8.000 -1.984 31.993 457 HB2 GLU 49 1HB GLU 49 -9.758 0.438 31.617 458 HB3 GLU 49 2HB GLU 49 -8.371 0.444 32.697 459 HG2 GLU 49 1HG GLU 49 -7.511 1.344 30.756 460 HG3 GLU 49 2HG GLU 49 -7.044 -0.352 30.632 461 HA PRO 50 HA PRO 50 -9.935 -3.038 35.847 462 HB2 PRO 50 1HB PRO 50 -7.893 -2.439 37.552 463 HB3 PRO 50 2HB PRO 50 -7.885 -3.869 36.502 464 HG2 PRO 50 1HG PRO 50 -6.508 -1.256 36.136 465 HG3 PRO 50 2HG PRO 50 -5.921 -2.901 35.812 466 HD2 PRO 50 1HD PRO 50 -6.827 -1.251 33.857 467 HD3 PRO 50 2HD PRO 50 -6.961 -3.019 33.775 468 H LEU 51 H LEU 51 -11.298 -2.003 37.169 469 HA LEU 51 HA LEU 51 -10.692 0.672 38.117 470 HB2 LEU 51 1HB LEU 51 -13.180 -0.041 36.564 471 HB3 LEU 51 2HB LEU 51 -13.041 1.402 37.548 472 HG LEU 51 HG LEU 51 -10.988 0.945 35.435 473 HD11 LEU 51 1HD1 LEU 51 -12.427 2.017 33.766 474 HD12 LEU 51 2HD1 LEU 51 -13.781 1.943 34.894 475 HD13 LEU 51 3HD1 LEU 51 -13.065 0.454 34.276 476 HD21 LEU 51 3HD2 LEU 51 -12.397 3.396 36.490 477 HD22 LEU 51 1HD2 LEU 51 -11.088 3.385 35.308 478 HD23 LEU 51 2HD2 LEU 51 -10.789 2.841 36.958 479 H THR 52 H THR 52 -10.434 -0.318 40.114 480 HA THR 52 HA THR 52 -12.958 -0.922 41.484 481 HB THR 52 HB THR 52 -11.690 -2.676 42.831 482 HG1 THR 52 HG1 THR 52 -9.911 -3.620 41.642 483 HG21 THR 52 3HG2 THR 52 -13.404 -3.274 41.195 484 HG22 THR 52 1HG2 THR 52 -12.082 -4.441 41.172 485 HG23 THR 52 2HG2 THR 52 -12.203 -3.222 39.904 486 HA PRO 53 HA PRO 53 -11.388 1.893 44.529 487 HB2 PRO 53 1HB PRO 53 -12.776 1.053 46.723 488 HB3 PRO 53 2HB PRO 53 -13.521 1.970 45.400 489 HG2 PRO 53 1HG PRO 53 -13.601 -0.955 45.940 490 HG3 PRO 53 2HG PRO 53 -14.892 0.128 45.382 491 HD2 PRO 53 1HD PRO 53 -13.529 -1.508 43.705 492 HD3 PRO 53 2HD PRO 53 -14.196 0.057 43.198 493 H SER 54 H SER 54 -9.393 1.788 45.295 494 HA SER 54 HA SER 54 -8.486 -0.630 46.686 495 HB2 SER 54 1HB SER 54 -7.162 0.262 44.743 496 HB3 SER 54 2HB SER 54 -6.813 1.695 45.709 497 HG SER 54 HG SER 54 -6.232 -0.924 46.610 498 H GLY 55 H GLY 55 -9.635 2.458 47.330 499 HA2 GLY 55 1HA GLY 55 -9.312 2.246 50.115 500 HA3 GLY 55 2HA GLY 55 -8.051 3.300 49.493 501 H GLU 56 H GLU 56 -11.564 2.821 49.518 502 HA GLU 56 HA GLU 56 -11.875 5.749 49.473 503 HB2 GLU 56 1HB GLU 56 -13.452 3.669 47.966 504 HB3 GLU 56 2HB GLU 56 -14.092 5.277 48.278 505 HG2 GLU 56 1HG GLU 56 -12.206 6.262 47.079 506 HG3 GLU 56 2HG GLU 56 -11.563 4.650 46.769 507 H LYS 57 H LYS 57 -13.289 2.644 50.428 508 HA LYS 57 HA LYS 57 -15.185 3.909 52.203 509 HB2 LYS 57 1HB LYS 57 -14.571 1.042 51.526 510 HB3 LYS 57 2HB LYS 57 -15.682 1.472 52.819 511 HG2 LYS 57 1HG LYS 57 -17.084 2.673 51.217 512 HG3 LYS 57 2HG LYS 57 -15.968 2.241 49.920 513 HD2 LYS 57 1HD LYS 57 -16.420 -0.131 50.324 514 HD3 LYS 57 2HD LYS 57 -17.531 0.300 51.625 515 HE2 LYS 57 1HE LYS 57 -18.888 -0.123 49.747 516 HE3 LYS 57 2HE LYS 57 -18.817 1.632 49.893 517 HZ1 LYS 57 3HZ LYS 57 -17.195 -0.017 48.028 518 HZ2 LYS 57 1HZ LYS 57 -17.124 1.669 48.167 519 HZ3 LYS 57 2HZ LYS 57 -18.535 0.925 47.603 520 H LEU 58 H LEU 58 -12.256 1.937 52.487 521 HA LEU 58 HA LEU 58 -12.284 2.168 55.378 522 HB2 LEU 58 1HB LEU 58 -10.436 0.747 53.471 523 HB3 LEU 58 2HB LEU 58 -10.176 0.792 55.204 524 HG LEU 58 HG LEU 58 -12.802 -0.207 54.210 525 HD11 LEU 58 1HD1 LEU 58 -11.220 -1.345 52.762 526 HD12 LEU 58 2HD1 LEU 58 -11.882 -2.463 53.955 527 HD13 LEU 58 3HD1 LEU 58 -10.254 -1.816 54.161 528 HD21 LEU 58 3HD2 LEU 58 -12.591 -1.658 56.166 529 HD22 LEU 58 1HD2 LEU 58 -12.399 0.040 56.605 530 HD23 LEU 58 2HD2 LEU 58 -10.983 -1.004 56.480 531 H TRP 59 H TRP 59 -11.187 3.993 52.820 532 HA TRP 59 HA TRP 59 -9.231 5.366 54.539 533 HB2 TRP 59 1HB TRP 59 -8.977 4.702 51.605 534 HB3 TRP 59 2HB TRP 59 -7.994 5.935 52.388 535 HD1 TRP 59 HD1 TRP 59 -8.534 2.138 52.321 536 HE1 TRP 59 HE1 TRP 59 -6.462 0.997 53.337 537 HE3 TRP 59 HE3 TRP 59 -6.041 6.290 53.975 538 HZ2 TRP 59 HZ2 TRP 59 -4.089 1.753 54.661 539 HZ3 TRP 59 HZ3 TRP 59 -3.877 5.991 55.106 540 HH2 TRP 59 HH2 TRP 59 -2.922 3.769 55.442 541 H SER 60 H SER 60 -9.226 7.588 54.464 542 HA SER 60 HA SER 60 -11.538 8.801 53.122 543 HB2 SER 60 1HB SER 60 -11.300 9.037 55.615 544 HB3 SER 60 2HB SER 60 -9.842 9.986 55.331 545 HG SER 60 HG SER 60 -11.680 11.043 53.805 546 H1 LYS 61 1H LYS 61 0.046 7.945 -33.101 547 H2 LYS 61 2H LYS 61 0.149 7.394 -31.506 548 H3 LYS 61 3H LYS 61 1.379 8.362 -32.146 549 HA LYS 61 HA LYS 61 -0.115 10.222 -32.340 550 HB2 LYS 61 1HB LYS 61 -2.095 8.232 -31.238 551 HB3 LYS 61 2HB LYS 61 -2.360 9.968 -31.144 552 HG2 LYS 61 1HG LYS 61 -2.261 10.117 -33.580 553 HG3 LYS 61 2HG LYS 61 -1.994 8.376 -33.674 554 HD2 LYS 61 1HD LYS 61 -4.166 7.989 -32.610 555 HD3 LYS 61 2HD LYS 61 -4.429 9.731 -32.514 556 HE2 LYS 61 1HE LYS 61 -5.628 9.014 -34.412 557 HE3 LYS 61 2HE LYS 61 -4.161 9.769 -35.034 558 HZ1 LYS 61 3HZ LYS 61 -4.598 6.849 -34.708 559 HZ2 LYS 61 1HZ LYS 61 -3.189 7.571 -35.305 560 HZ3 LYS 61 2HZ LYS 61 -4.637 7.696 -36.172 561 H ILE 62 H ILE 62 0.067 7.870 -29.701 562 HA ILE 62 HA ILE 62 1.079 10.002 -27.959 563 HB ILE 62 HB ILE 62 -0.166 8.820 -26.037 564 HG12 ILE 62 1HG1 ILE 62 -2.517 8.096 -27.148 565 HG13 ILE 62 2HG1 ILE 62 -1.420 7.570 -28.421 566 HG21 ILE 62 1HG2 ILE 62 -1.677 10.470 -28.054 567 HG22 ILE 62 2HG2 ILE 62 -0.646 11.081 -26.759 568 HG23 ILE 62 3HG2 ILE 62 -2.143 10.232 -26.369 569 HD11 ILE 62 3HD1 ILE 62 -1.305 6.731 -25.533 570 HD12 ILE 62 1HD1 ILE 62 -0.205 6.202 -26.806 571 HD13 ILE 62 2HD1 ILE 62 -1.912 5.764 -26.877 572 HA PRO 63 HA PRO 63 4.254 7.061 -27.023 573 HB2 PRO 63 1HB PRO 63 5.038 7.959 -24.565 574 HB3 PRO 63 2HB PRO 63 5.443 8.793 -26.077 575 HG2 PRO 63 1HG PRO 63 3.312 9.417 -24.097 576 HG3 PRO 63 2HG PRO 63 4.387 10.515 -24.985 577 HD2 PRO 63 1HD PRO 63 1.814 10.086 -25.713 578 HD3 PRO 63 2HD PRO 63 3.096 10.468 -26.880 579 H SER 64 H SER 64 4.402 5.079 -26.136 580 HA SER 64 HA SER 64 2.242 4.127 -24.482 581 HB2 SER 64 1HB SER 64 4.682 2.694 -25.561 582 HB3 SER 64 2HB SER 64 3.317 1.917 -24.760 583 HG SER 64 HG SER 64 3.317 3.319 -27.223 584 H ILE 65 H ILE 65 5.152 5.606 -23.821 585 HA ILE 65 HA ILE 65 5.845 4.107 -21.445 586 HB ILE 65 HB ILE 65 6.938 6.822 -22.165 587 HG12 ILE 65 1HG1 ILE 65 8.821 5.105 -23.117 588 HG13 ILE 65 2HG1 ILE 65 7.349 4.230 -23.526 589 HG21 ILE 65 1HG2 ILE 65 7.510 5.978 -19.958 590 HG22 ILE 65 2HG2 ILE 65 8.935 6.001 -20.997 591 HG23 ILE 65 3HG2 ILE 65 8.108 4.479 -20.668 592 HD11 ILE 65 3HD1 ILE 65 8.106 5.634 -25.362 593 HD12 ILE 65 1HD1 ILE 65 7.989 7.058 -24.329 594 HD13 ILE 65 2HD1 ILE 65 6.534 6.160 -24.760 595 H ALA 66 H ALA 66 4.103 7.043 -22.250 596 HA ALA 66 HA ALA 66 3.886 7.911 -19.499 597 HB1 ALA 66 3HB ALA 66 4.050 9.535 -21.342 598 HB2 ALA 66 1HB ALA 66 2.593 9.758 -20.374 599 HB3 ALA 66 2HB ALA 66 2.492 8.974 -21.951 600 H THR 67 H THR 67 2.002 6.080 -21.783 601 HA THR 67 HA THR 67 -0.537 6.297 -20.576 602 HB THR 67 HB THR 67 0.283 3.781 -21.975 603 HG1 THR 67 HG1 THR 67 -0.297 6.191 -23.367 604 HG21 THR 67 3HG2 THR 67 -1.952 4.057 -23.005 605 HG22 THR 67 1HG2 THR 67 -2.175 5.536 -22.072 606 HG23 THR 67 2HG2 THR 67 -2.025 3.987 -21.244 607 H GLY 68 H GLY 68 2.225 4.239 -19.896 608 HA2 GLY 68 1HA GLY 68 0.766 2.504 -18.097 609 HA3 GLY 68 2HA GLY 68 2.498 2.494 -18.383 610 H LEU 69 H LEU 69 3.080 5.160 -17.802 611 HA LEU 69 HA LEU 69 3.410 5.080 -15.016 612 HB2 LEU 69 1HB LEU 69 3.638 7.381 -16.957 613 HB3 LEU 69 2HB LEU 69 4.116 7.476 -15.272 614 HG LEU 69 HG LEU 69 5.322 5.398 -17.073 615 HD11 LEU 69 1HD1 LEU 69 7.207 7.047 -17.381 616 HD12 LEU 69 2HD1 LEU 69 6.086 8.297 -16.841 617 HD13 LEU 69 3HD1 LEU 69 5.740 7.372 -18.302 618 HD21 LEU 69 3HD2 LEU 69 6.270 6.825 -14.589 619 HD22 LEU 69 1HD2 LEU 69 7.205 5.640 -15.502 620 HD23 LEU 69 2HD2 LEU 69 5.714 5.155 -14.695 621 H VAL 70 H VAL 70 1.100 6.866 -17.039 622 HA VAL 70 HA VAL 70 -0.070 8.370 -14.984 623 HB VAL 70 HB VAL 70 -2.033 8.621 -16.491 624 HG11 VAL 70 1HG1 VAL 70 0.747 9.063 -17.535 625 HG12 VAL 70 2HG1 VAL 70 -0.347 10.221 -16.775 626 HG13 VAL 70 3HG1 VAL 70 -0.678 9.634 -18.406 627 HG21 VAL 70 3HG2 VAL 70 -2.061 6.427 -17.533 628 HG22 VAL 70 1HG2 VAL 70 -0.494 6.737 -18.281 629 HG23 VAL 70 2HG2 VAL 70 -1.905 7.677 -18.767 630 H GLY 71 H GLY 71 -0.789 5.149 -16.168 631 HA2 GLY 71 1HA GLY 71 -3.176 4.753 -14.676 632 HA3 GLY 71 2HA GLY 71 -2.190 3.489 -15.394 633 H ALA 72 H ALA 72 0.188 3.741 -14.073 634 HA ALA 72 HA ALA 72 -0.462 2.533 -11.563 635 HB1 ALA 72 3HB ALA 72 1.470 1.915 -13.093 636 HB2 ALA 72 1HB ALA 72 1.820 2.008 -11.367 637 HB3 ALA 72 2HB ALA 72 2.299 3.325 -12.436 638 H LEU 73 H LEU 73 1.045 5.615 -12.469 639 HA LEU 73 HA LEU 73 1.631 6.423 -9.828 640 HB2 LEU 73 1HB LEU 73 1.414 7.815 -12.460 641 HB3 LEU 73 2HB LEU 73 1.497 8.780 -11.000 642 HG LEU 73 HG LEU 73 3.639 7.605 -10.424 643 HD11 LEU 73 1HD1 LEU 73 3.330 5.589 -11.770 644 HD12 LEU 73 2HD1 LEU 73 4.826 6.418 -12.200 645 HD13 LEU 73 3HD1 LEU 73 3.412 6.553 -13.244 646 HD21 LEU 73 3HD2 LEU 73 3.626 9.822 -11.432 647 HD22 LEU 73 1HD2 LEU 73 3.575 9.101 -13.041 648 HD23 LEU 73 2HD2 LEU 73 4.992 8.872 -12.015 649 H LEU 74 H LEU 74 -1.211 6.922 -11.902 650 HA LEU 74 HA LEU 74 -2.556 8.601 -10.035 651 HB2 LEU 74 1HB LEU 74 -3.191 7.335 -12.610 652 HB3 LEU 74 2HB LEU 74 -4.568 7.578 -11.552 653 HG LEU 74 HG LEU 74 -3.748 10.021 -11.377 654 HD11 LEU 74 1HD1 LEU 74 -1.547 9.384 -12.529 655 HD12 LEU 74 2HD1 LEU 74 -2.349 10.871 -13.037 656 HD13 LEU 74 3HD1 LEU 74 -2.481 9.417 -14.026 657 HD21 LEU 74 3HD2 LEU 74 -4.866 8.952 -13.965 658 HD22 LEU 74 1HD2 LEU 74 -4.967 10.623 -13.410 659 HD23 LEU 74 2HD2 LEU 74 -5.791 9.346 -12.516 660 H LEU 75 H LEU 75 -2.612 5.138 -10.714 661 HA LEU 75 HA LEU 75 -4.761 4.560 -8.925 662 HB2 LEU 75 1HB LEU 75 -2.984 3.070 -10.662 663 HB3 LEU 75 2HB LEU 75 -3.203 2.248 -9.130 664 HG LEU 75 HG LEU 75 -5.777 2.817 -9.703 665 HD11 LEU 75 1HD1 LEU 75 -4.441 2.393 -12.372 666 HD12 LEU 75 2HD1 LEU 75 -5.238 3.871 -11.834 667 HD13 LEU 75 3HD1 LEU 75 -6.178 2.399 -12.072 668 HD21 LEU 75 3HD2 LEU 75 -4.253 0.442 -10.767 669 HD22 LEU 75 1HD2 LEU 75 -5.985 0.519 -10.443 670 HD23 LEU 75 2HD2 LEU 75 -4.832 0.628 -9.112 671 H LEU 76 H LEU 76 -1.247 4.586 -8.637 672 HA LEU 76 HA LEU 76 -1.142 3.518 -6.003 673 HB2 LEU 76 1HB LEU 76 0.711 3.889 -7.891 674 HB3 LEU 76 2HB LEU 76 0.988 5.355 -6.972 675 HG LEU 76 HG LEU 76 0.900 2.794 -5.460 676 HD11 LEU 76 1HD1 LEU 76 3.257 2.356 -5.957 677 HD12 LEU 76 2HD1 LEU 76 3.238 3.640 -7.167 678 HD13 LEU 76 3HD1 LEU 76 2.246 2.198 -7.394 679 HD21 LEU 76 3HD2 LEU 76 1.196 4.931 -4.311 680 HD22 LEU 76 1HD2 LEU 76 2.622 5.266 -5.293 681 HD23 LEU 76 2HD2 LEU 76 2.632 3.919 -4.155 682 H LEU 77 H LEU 77 -1.409 6.760 -7.341 683 HA LEU 77 HA LEU 77 -0.956 8.170 -4.922 684 HB2 LEU 77 1HB LEU 77 -0.937 8.991 -7.396 685 HB3 LEU 77 2HB LEU 77 -2.655 9.234 -7.149 686 HG LEU 77 HG LEU 77 -1.804 10.583 -5.028 687 HD11 LEU 77 1HD1 LEU 77 0.501 10.801 -6.958 688 HD12 LEU 77 2HD1 LEU 77 0.552 10.063 -5.357 689 HD13 LEU 77 3HD1 LEU 77 0.259 11.794 -5.521 690 HD21 LEU 77 3HD2 LEU 77 -3.177 11.493 -6.813 691 HD22 LEU 77 1HD2 LEU 77 -1.760 11.637 -7.853 692 HD23 LEU 77 2HD2 LEU 77 -1.886 12.619 -6.394 693 H VAL 78 H VAL 78 -3.901 7.043 -6.561 694 HA VAL 78 HA VAL 78 -5.721 8.210 -4.713 695 HB VAL 78 HB VAL 78 -6.146 5.871 -6.588 696 HG11 VAL 78 1HG1 VAL 78 -8.539 6.356 -6.355 697 HG12 VAL 78 2HG1 VAL 78 -8.170 7.583 -5.144 698 HG13 VAL 78 3HG1 VAL 78 -7.819 5.887 -4.816 699 HG21 VAL 78 3HG2 VAL 78 -5.516 7.908 -7.766 700 HG22 VAL 78 1HG2 VAL 78 -6.777 8.804 -6.918 701 HG23 VAL 78 2HG2 VAL 78 -7.214 7.526 -8.052 702 H VAL 79 H VAL 79 -4.284 4.965 -4.973 703 HA VAL 79 HA VAL 79 -5.718 3.852 -2.783 704 HB VAL 79 HB VAL 79 -3.106 2.959 -4.026 705 HG11 VAL 79 1HG1 VAL 79 -3.540 0.790 -2.968 706 HG12 VAL 79 2HG1 VAL 79 -4.943 1.474 -2.148 707 HG13 VAL 79 3HG1 VAL 79 -3.325 2.065 -1.769 708 HG21 VAL 79 3HG2 VAL 79 -5.937 2.003 -4.451 709 HG22 VAL 79 1HG2 VAL 79 -4.493 1.288 -5.169 710 HG23 VAL 79 2HG2 VAL 79 -4.968 2.933 -5.595 711 H ALA 80 H ALA 80 -2.560 5.434 -3.065 712 HA ALA 80 HA ALA 80 -1.748 4.943 -0.380 713 HB1 ALA 80 3HB ALA 80 -0.145 5.438 -2.162 714 HB2 ALA 80 1HB ALA 80 0.018 6.559 -0.810 715 HB3 ALA 80 2HB ALA 80 -0.794 7.073 -2.289 716 H LEU 81 H LEU 81 -3.476 7.566 -1.979 717 HA LEU 81 HA LEU 81 -3.432 9.365 0.225 718 HB2 LEU 81 1HB LEU 81 -3.974 9.724 -2.335 719 HB3 LEU 81 2HB LEU 81 -5.619 9.423 -1.808 720 HG LEU 81 HG LEU 81 -4.983 11.287 -0.011 721 HD11 LEU 81 1HD1 LEU 81 -3.263 11.960 -2.393 722 HD12 LEU 81 2HD1 LEU 81 -2.686 11.545 -0.781 723 HD13 LEU 81 3HD1 LEU 81 -3.608 13.027 -1.033 724 HD21 LEU 81 3HD2 LEU 81 -6.865 11.388 -1.542 725 HD22 LEU 81 1HD2 LEU 81 -5.788 11.831 -2.865 726 HD23 LEU 81 2HD2 LEU 81 -6.016 12.933 -1.508 727 H GLY 82 H GLY 82 -5.837 7.030 -0.972 728 HA2 GLY 82 1HA GLY 82 -7.798 7.615 1.011 729 HA3 GLY 82 2HA GLY 82 -7.754 6.187 -0.013 730 H ILE 83 H ILE 83 -5.629 4.801 0.654 731 HA ILE 83 HA ILE 83 -6.257 3.665 3.164 732 HB ILE 83 HB ILE 83 -3.724 3.293 1.550 733 HG12 ILE 83 1HG1 ILE 83 -5.652 2.773 0.165 734 HG13 ILE 83 2HG1 ILE 83 -4.843 1.281 0.621 735 HG21 ILE 83 1HG2 ILE 83 -3.292 2.398 3.666 736 HG22 ILE 83 2HG2 ILE 83 -3.781 1.011 2.691 737 HG23 ILE 83 3HG2 ILE 83 -4.920 1.741 3.822 738 HD11 ILE 83 3HD1 ILE 83 -6.581 1.029 2.429 739 HD12 ILE 83 1HD1 ILE 83 -7.163 0.879 0.770 740 HD13 ILE 83 2HD1 ILE 83 -7.439 2.370 1.671 741 H GLY 84 H GLY 84 -3.764 5.942 2.124 742 HA2 GLY 84 1HA GLY 84 -2.242 5.965 4.507 743 HA3 GLY 84 2HA GLY 84 -2.274 7.239 3.298 744 H LEU 85 H LEU 85 -4.886 8.080 3.398 745 HA LEU 85 HA LEU 85 -4.893 9.658 5.780 746 HB2 LEU 85 1HB LEU 85 -6.833 9.367 3.498 747 HB3 LEU 85 2HB LEU 85 -7.159 10.409 4.869 748 HG LEU 85 HG LEU 85 -4.642 10.741 3.268 749 HD11 LEU 85 1HD1 LEU 85 -5.786 12.384 1.882 750 HD12 LEU 85 2HD1 LEU 85 -7.318 11.987 2.660 751 HD13 LEU 85 3HD1 LEU 85 -6.492 10.782 1.671 752 HD21 LEU 85 3HD2 LEU 85 -6.319 12.594 4.957 753 HD22 LEU 85 1HD2 LEU 85 -4.888 13.075 4.045 754 HD23 LEU 85 2HD2 LEU 85 -4.742 11.923 5.372 755 H PHE 86 H PHE 86 -6.347 6.665 4.838 756 HA PHE 86 HA PHE 86 -8.460 6.662 6.760 757 HB2 PHE 86 1HB PHE 86 -7.447 4.884 4.703 758 HB3 PHE 86 2HB PHE 86 -7.881 3.998 6.161 759 HD1 PHE 86 HD2 PHE 86 -9.121 6.049 3.404 760 HD2 PHE 86 HD1 PHE 86 -10.172 3.901 6.924 761 HE1 PHE 86 HE2 PHE 86 -11.492 6.144 2.750 762 HE2 PHE 86 HE1 PHE 86 -12.543 3.990 6.276 763 HZ PHE 86 HZ PHE 86 -13.206 5.114 4.187 764 H ILE 87 H ILE 87 -5.155 5.375 6.697 765 HA ILE 87 HA ILE 87 -5.424 4.191 9.328 766 HB ILE 87 HB ILE 87 -2.885 4.567 7.728 767 HG12 ILE 87 1HG1 ILE 87 -4.442 1.999 7.872 768 HG13 ILE 87 2HG1 ILE 87 -4.853 3.217 6.668 769 HG21 ILE 87 1HG2 ILE 87 -3.563 2.700 10.003 770 HG22 ILE 87 2HG2 ILE 87 -2.503 4.107 10.090 771 HG23 ILE 87 3HG2 ILE 87 -2.043 2.716 9.109 772 HD11 ILE 87 3HD1 ILE 87 -2.609 3.089 5.750 773 HD12 ILE 87 1HD1 ILE 87 -3.373 1.498 5.770 774 HD13 ILE 87 2HD1 ILE 87 -2.159 1.910 6.983 775 H ARG 88 H ARG 88 -4.075 7.123 7.926 776 HA ARG 88 HA ARG 88 -2.592 7.972 10.184 777 HB2 ARG 88 1HB ARG 88 -3.664 9.338 7.744 778 HB3 ARG 88 2HB ARG 88 -2.968 10.294 9.045 779 HG2 ARG 88 1HG ARG 88 -0.874 9.053 8.841 780 HG3 ARG 88 2HG ARG 88 -1.573 8.093 7.536 781 HD2 ARG 88 1HD ARG 88 -1.870 10.125 6.205 782 HD3 ARG 88 2HD ARG 88 -1.172 11.083 7.510 783 HE ARG 88 HE ARG 88 0.654 9.081 6.808 784 HH11 ARG 88 1HH1 ARG 88 -0.748 11.978 5.441 785 HH12 ARG 88 2HH1 ARG 88 0.630 12.325 4.450 786 HH21 ARG 88 1HH2 ARG 88 2.462 9.541 5.506 787 HH22 ARG 88 2HH2 ARG 88 2.451 10.942 4.488 788 H ARG 89 H ARG 89 -5.968 8.135 9.397 789 HA ARG 89 HA ARG 89 -6.589 10.175 11.344 790 HB2 ARG 89 1HB ARG 89 -8.225 8.440 9.519 791 HB3 ARG 89 2HB ARG 89 -8.994 9.376 10.793 792 HG2 ARG 89 1HG ARG 89 -8.069 11.430 9.850 793 HG3 ARG 89 2HG ARG 89 -7.294 10.491 8.572 794 HD2 ARG 89 1HD ARG 89 -9.489 9.729 7.804 795 HD3 ARG 89 2HD ARG 89 -10.262 10.668 9.081 796 HE ARG 89 HE ARG 89 -8.656 12.387 7.567 797 HH11 ARG 89 1HH1 ARG 89 -11.572 10.495 7.206 798 HH12 ARG 89 2HH1 ARG 89 -12.257 11.550 6.016 799 HH21 ARG 89 1HH2 ARG 89 -9.558 13.771 6.005 800 HH22 ARG 89 2HH2 ARG 89 -11.114 13.409 5.334 801 H ARG 90 H ARG 90 -6.151 6.790 11.371 802 HA ARG 90 HA ARG 90 -7.853 6.248 13.639 803 HB2 ARG 90 1HB ARG 90 -5.848 4.607 12.104 804 HB3 ARG 90 2HB ARG 90 -6.621 4.003 13.563 805 HG2 ARG 90 1HG ARG 90 -8.812 4.266 12.517 806 HG3 ARG 90 2HG ARG 90 -8.038 4.875 11.053 807 HD2 ARG 90 1HD ARG 90 -6.860 2.745 10.794 808 HD3 ARG 90 2HD ARG 90 -7.634 2.139 12.258 809 HE ARG 90 HE ARG 90 -9.632 2.974 10.488 810 HH11 ARG 90 1HH1 ARG 90 -7.196 0.478 10.731 811 HH12 ARG 90 2HH1 ARG 90 -8.092 -0.660 9.782 812 HH21 ARG 90 1HH2 ARG 90 -10.805 1.476 9.242 813 HH22 ARG 90 2HH2 ARG 90 -10.140 -0.094 8.938 814 H HIS 91 H HIS 91 -4.607 7.294 13.146 815 HA HIS 91 HA HIS 91 -3.483 6.347 15.585 816 HB2 HIS 91 1HB HIS 91 -2.667 8.425 13.574 817 HB3 HIS 91 2HB HIS 91 -1.776 8.229 15.079 818 HD1 HIS 91 HD1 HIS 91 -0.251 6.198 15.292 819 HD2 HIS 91 HD2 HIS 91 -2.449 6.250 11.767 820 HE1 HIS 91 HE1 HIS 91 0.747 4.395 13.851 821 HE2 HIS 91 HE2 HIS 91 -0.654 4.387 11.758 822 H ILE 92 H ILE 92 -5.352 9.161 14.718 823 HA ILE 92 HA ILE 92 -4.737 10.595 17.157 824 HB ILE 92 HB ILE 92 -6.997 11.276 15.284 825 HG12 ILE 92 1HG1 ILE 92 -4.330 12.545 14.895 826 HG13 ILE 92 2HG1 ILE 92 -4.536 10.910 14.276 827 HG21 ILE 92 1HG2 ILE 92 -6.515 13.568 16.028 828 HG22 ILE 92 2HG2 ILE 92 -5.225 12.955 17.062 829 HG23 ILE 92 3HG2 ILE 92 -6.900 12.506 17.382 830 HD11 ILE 92 3HD1 ILE 92 -6.546 11.735 13.035 831 HD12 ILE 92 1HD1 ILE 92 -5.007 12.417 12.508 832 HD13 ILE 92 2HD1 ILE 92 -6.091 13.367 13.523 833 H VAL 93 H VAL 93 -7.104 8.326 16.055 834 HA VAL 93 HA VAL 93 -8.894 8.883 18.302 835 HB VAL 93 HB VAL 93 -9.350 6.693 16.292 836 HG11 VAL 93 1HG1 VAL 93 -11.708 7.191 16.750 837 HG12 VAL 93 2HG1 VAL 93 -11.218 8.465 17.866 838 HG13 VAL 93 3HG1 VAL 93 -10.829 6.783 18.223 839 HG21 VAL 93 3HG2 VAL 93 -8.851 8.677 14.968 840 HG22 VAL 93 1HG2 VAL 93 -10.026 9.609 15.897 841 HG23 VAL 93 2HG2 VAL 93 -10.567 8.281 14.871 842 H ARG 94 H ARG 94 -6.204 7.017 17.674 843 HA ARG 94 HA ARG 94 -7.004 4.755 19.335 844 HB2 ARG 94 1HB ARG 94 -5.469 4.795 17.149 845 HB3 ARG 94 2HB ARG 94 -4.211 5.058 18.347 846 HG2 ARG 94 1HG ARG 94 -4.936 3.007 19.512 847 HG3 ARG 94 2HG ARG 94 -6.119 2.731 18.232 848 HD2 ARG 94 1HD ARG 94 -4.264 2.690 16.591 849 HD3 ARG 94 2HD ARG 94 -3.121 2.843 17.925 850 HE ARG 94 HE ARG 94 -4.718 0.654 18.494 851 HH11 ARG 94 1HH1 ARG 94 -2.449 1.588 16.005 852 HH12 ARG 94 2HH1 ARG 94 -1.959 -0.040 15.670 853 HH21 ARG 94 1HH2 ARG 94 -4.072 -1.482 18.051 854 HH22 ARG 94 2HH2 ARG 94 -2.880 -1.780 16.830 855 H LYS 95 H LYS 95 -5.622 4.068 21.131 856 HA LYS 95 HA LYS 95 -4.879 6.347 22.781 857 HB2 LYS 95 1HB LYS 95 -5.282 3.416 23.351 858 HB3 LYS 95 2HB LYS 95 -4.598 4.510 24.545 859 HG2 LYS 95 1HG LYS 95 -6.625 5.869 24.468 860 HG3 LYS 95 2HG LYS 95 -7.313 4.774 23.268 861 HD2 LYS 95 1HD LYS 95 -7.193 2.936 24.881 862 HD3 LYS 95 2HD LYS 95 -6.506 4.032 26.081 863 HE2 LYS 95 1HE LYS 95 -8.546 5.384 26.008 864 HE3 LYS 95 2HE LYS 95 -9.231 4.287 24.809 865 HZ1 LYS 95 3HZ LYS 95 -8.468 3.556 27.586 866 HZ2 LYS 95 1HZ LYS 95 -9.127 2.503 26.437 867 HZ3 LYS 95 2HZ LYS 95 -10.046 3.794 27.026 868 H ARG 96 H ARG 96 -2.880 6.483 23.908 869 HA ARG 96 HA ARG 96 -0.639 5.510 22.345 870 HB2 ARG 96 1HB ARG 96 -0.904 7.545 24.549 871 HB3 ARG 96 2HB ARG 96 0.665 7.019 23.953 872 HG2 ARG 96 1HG ARG 96 0.078 7.794 21.712 873 HG3 ARG 96 2HG ARG 96 -1.499 8.319 22.308 874 HD2 ARG 96 1HD ARG 96 -0.395 9.876 23.841 875 HD3 ARG 96 2HD ARG 96 1.177 9.351 23.243 876 HE ARG 96 HE ARG 96 -0.351 10.216 21.065 877 HH11 ARG 96 1HH1 ARG 96 1.179 11.547 23.911 878 HH12 ARG 96 2HH1 ARG 96 1.429 13.106 23.200 879 HH21 ARG 96 1HH2 ARG 96 -0.022 12.265 20.132 880 HH22 ARG 96 2HH2 ARG 96 0.747 13.513 21.055 881 H THR 97 H THR 97 -2.301 3.871 24.345 882 HA THR 97 HA THR 97 -0.387 3.151 26.389 883 HB THR 97 HB THR 97 -2.087 1.324 26.897 884 HG1 THR 97 HG1 THR 97 -4.170 2.496 25.731 885 HG21 THR 97 3HG2 THR 97 -1.995 3.415 28.159 886 HG22 THR 97 1HG2 THR 97 -3.664 2.889 27.941 887 HG23 THR 97 2HG2 THR 97 -3.016 4.199 26.954 888 H LEU 98 H LEU 98 -0.992 2.227 23.177 889 HA LEU 98 HA LEU 98 0.094 -0.455 23.464 890 HB2 LEU 98 1HB LEU 98 -1.840 0.349 21.865 891 HB3 LEU 98 2HB LEU 98 -0.507 0.795 20.818 892 HG LEU 98 HG LEU 98 0.287 -1.644 21.126 893 HD11 LEU 98 1HD1 LEU 98 -2.547 -1.812 22.120 894 HD12 LEU 98 2HD1 LEU 98 -1.078 -2.399 22.902 895 HD13 LEU 98 3HD1 LEU 98 -1.684 -3.196 21.450 896 HD21 LEU 98 3HD2 LEU 98 -2.231 -1.053 19.576 897 HD22 LEU 98 1HD2 LEU 98 -1.109 -2.380 19.274 898 HD23 LEU 98 2HD2 LEU 98 -0.586 -0.712 19.039 899 H ARG 99 H ARG 99 1.144 2.642 22.984 900 HA ARG 99 HA ARG 99 3.591 1.964 21.558 901 HB2 ARG 99 1HB ARG 99 2.200 4.566 22.170 902 HB3 ARG 99 2HB ARG 99 3.893 4.531 21.696 903 HG2 ARG 99 1HG ARG 99 3.366 3.610 19.571 904 HG3 ARG 99 2HG ARG 99 1.694 3.310 20.049 905 HD2 ARG 99 1HD ARG 99 2.830 6.083 20.065 906 HD3 ARG 99 2HD ARG 99 2.219 5.364 18.576 907 HE ARG 99 HE ARG 99 0.425 5.316 20.860 908 HH11 ARG 99 1HH1 ARG 99 1.371 6.920 17.902 909 HH12 ARG 99 2HH1 ARG 99 -0.145 7.739 17.717 910 HH21 ARG 99 1HH2 ARG 99 -1.564 6.392 20.612 911 HH22 ARG 99 2HH2 ARG 99 -1.809 7.439 19.255 912 H ARG 100 H ARG 100 2.206 3.106 24.534 913 HA ARG 100 HA ARG 100 4.713 3.579 25.875 914 HB2 ARG 100 1HB ARG 100 1.846 3.388 26.791 915 HB3 ARG 100 2HB ARG 100 3.164 3.503 27.948 916 HG2 ARG 100 1HG ARG 100 3.850 5.629 26.961 917 HG3 ARG 100 2HG ARG 100 2.528 5.515 25.798 918 HD2 ARG 100 1HD ARG 100 1.737 6.937 27.494 919 HD3 ARG 100 2HD ARG 100 0.977 5.377 27.804 920 HE ARG 100 HE ARG 100 3.351 5.512 29.280 921 HH11 ARG 100 1HH1 ARG 100 0.202 7.026 29.200 922 HH12 ARG 100 2HH1 ARG 100 0.187 7.370 30.897 923 HH21 ARG 100 1HH2 ARG 100 3.328 5.965 31.510 924 HH22 ARG 100 2HH2 ARG 100 1.961 6.769 32.208 925 H LEU 101 H LEU 101 2.670 0.960 25.152 926 HA LEU 101 HA LEU 101 4.075 -0.842 26.972 927 HB2 LEU 101 1HB LEU 101 1.453 -1.025 25.521 928 HB3 LEU 101 2HB LEU 101 2.255 -2.474 26.092 929 HG LEU 101 HG LEU 101 1.613 -0.202 27.959 930 HD11 LEU 101 1HD1 LEU 101 -0.158 -2.529 27.225 931 HD12 LEU 101 2HD1 LEU 101 -0.478 -0.824 26.902 932 HD13 LEU 101 3HD1 LEU 101 -0.435 -1.415 28.564 933 HD21 LEU 101 3HD2 LEU 101 3.172 -1.799 28.839 934 HD22 LEU 101 1HD2 LEU 101 2.155 -3.146 28.326 935 HD23 LEU 101 2HD2 LEU 101 1.609 -2.069 29.610 936 H LEU 102 H LEU 102 3.755 0.152 23.691 937 HA LEU 102 HA LEU 102 4.540 -2.221 22.363 938 HB2 LEU 102 1HB LEU 102 3.654 -0.021 21.370 939 HB3 LEU 102 2HB LEU 102 5.317 0.531 21.434 940 HG LEU 102 HG LEU 102 4.841 -2.060 20.073 941 HD11 LEU 102 1HD1 LEU 102 2.947 -0.743 19.280 942 HD12 LEU 102 2HD1 LEU 102 4.141 -0.973 18.003 943 HD13 LEU 102 3HD1 LEU 102 4.037 0.573 18.845 944 HD21 LEU 102 3HD2 LEU 102 6.544 -1.173 18.565 945 HD22 LEU 102 1HD2 LEU 102 7.074 -1.082 20.244 946 HD23 LEU 102 2HD2 LEU 102 6.506 0.369 19.419 947 H GLN 103 H GLN 103 6.450 0.467 23.651 948 HA GLN 103 HA GLN 103 8.934 -0.928 23.038 949 HB2 GLN 103 1HB GLN 103 8.382 1.671 22.870 950 HB3 GLN 103 2HB GLN 103 8.887 1.640 24.554 951 HG2 GLN 103 1HG GLN 103 11.031 0.673 23.895 952 HG3 GLN 103 2HG GLN 103 10.524 0.705 22.207 953 HE21 GLN 103 2HE2 GLN 103 10.384 2.676 21.133 954 HE22 GLN 103 1HE2 GLN 103 11.134 4.109 21.741 955 H GLU 104 H GLU 104 6.700 -0.694 25.570 956 HA GLU 104 HA GLU 104 8.617 -1.053 27.722 957 HB2 GLU 104 1HB GLU 104 6.122 -0.012 27.675 958 HB3 GLU 104 2HB GLU 104 5.764 -1.646 28.216 959 HG2 GLU 104 1HG GLU 104 6.047 -0.505 30.199 960 HG3 GLU 104 2HG GLU 104 7.630 -1.241 29.949 961 H ARG 105 H ARG 105 6.232 -3.048 26.017 962 HA ARG 105 HA ARG 105 7.007 -5.413 27.517 963 HB2 ARG 105 1HB ARG 105 4.911 -4.856 25.433 964 HB3 ARG 105 2HB ARG 105 5.295 -6.500 25.921 965 HG2 ARG 105 1HG ARG 105 4.675 -4.503 28.036 966 HG3 ARG 105 2HG ARG 105 3.353 -5.148 27.062 967 HD2 ARG 105 1HD ARG 105 4.023 -7.425 27.666 968 HD3 ARG 105 2HD ARG 105 5.344 -6.778 28.638 969 HE ARG 105 HE ARG 105 2.952 -5.631 29.527 970 HH11 ARG 105 1HH1 ARG 105 4.520 -8.755 29.469 971 HH12 ARG 105 2HH1 ARG 105 3.733 -9.313 30.907 972 HH21 ARG 105 1HH2 ARG 105 1.921 -6.367 31.417 973 HH22 ARG 105 2HH2 ARG 105 2.259 -7.958 32.011 974 H GLU 106 H GLU 106 8.073 -3.826 24.748 975 HA GLU 106 HA GLU 106 8.694 -5.963 23.024 976 HB2 GLU 106 1HB GLU 106 8.843 -3.269 22.828 977 HB3 GLU 106 2HB GLU 106 10.544 -3.656 23.049 978 HG2 GLU 106 1HG GLU 106 10.388 -5.231 21.148 979 HG3 GLU 106 2HG GLU 106 8.723 -4.710 20.897 980 H LEU 107 H LEU 107 10.911 -4.176 25.210 981 HA LEU 107 HA LEU 107 12.310 -6.663 25.788 982 HB2 LEU 107 1HB LEU 107 13.603 -4.276 24.483 983 HB3 LEU 107 2HB LEU 107 14.530 -5.459 25.386 984 HG LEU 107 HG LEU 107 13.142 -7.060 23.657 985 HD11 LEU 107 1HD1 LEU 107 12.248 -5.096 22.483 986 HD12 LEU 107 2HD1 LEU 107 13.292 -6.074 21.453 987 HD13 LEU 107 3HD1 LEU 107 13.894 -4.567 22.141 988 HD21 LEU 107 3HD2 LEU 107 15.263 -7.236 22.441 989 HD22 LEU 107 1HD2 LEU 107 15.511 -7.220 24.187 990 HD23 LEU 107 2HD2 LEU 107 15.837 -5.770 23.238 991 H VAL 108 H VAL 108 10.643 -4.734 27.245 992 HA VAL 108 HA VAL 108 12.553 -4.080 29.392 993 HB VAL 108 HB VAL 108 10.083 -2.419 28.925 994 HG11 VAL 108 1HG1 VAL 108 12.686 -1.870 30.349 995 HG12 VAL 108 2HG1 VAL 108 11.140 -2.245 31.109 996 HG13 VAL 108 3HG1 VAL 108 11.338 -0.743 30.205 997 HG21 VAL 108 3HG2 VAL 108 11.375 -0.796 27.694 998 HG22 VAL 108 1HG2 VAL 108 11.465 -2.353 26.869 999 HG23 VAL 108 2HG2 VAL 108 12.826 -1.788 27.838 1000 H GLU 109 H GLU 109 11.595 -6.449 29.635 1001 HA GLU 109 HA GLU 109 9.072 -6.413 31.114 1002 HB2 GLU 109 1HB GLU 109 10.806 -8.643 30.060 1003 HB3 GLU 109 2HB GLU 109 9.456 -8.939 31.145 1004 HG2 GLU 109 1HG GLU 109 8.528 -9.303 29.067 1005 HG3 GLU 109 2HG GLU 109 8.066 -7.637 29.405 1006 HA PRO 110 HA PRO 110 11.140 -6.394 35.043 1007 HB2 PRO 110 1HB PRO 110 9.155 -7.427 36.598 1008 HB3 PRO 110 2HB PRO 110 9.117 -5.772 35.960 1009 HG2 PRO 110 1HG PRO 110 7.717 -8.204 34.969 1010 HG3 PRO 110 2HG PRO 110 7.127 -6.535 35.107 1011 HD2 PRO 110 1HD PRO 110 7.959 -7.612 32.759 1012 HD3 PRO 110 2HD PRO 110 8.098 -5.883 33.137 1013 H LEU 111 H LEU 111 12.542 -7.732 36.002 1014 HA LEU 111 HA LEU 111 11.956 -10.565 36.237 1015 HB2 LEU 111 1HB LEU 111 14.395 -9.459 34.842 1016 HB3 LEU 111 2HB LEU 111 14.281 -11.110 35.419 1017 HG LEU 111 HG LEU 111 12.162 -10.126 33.568 1018 HD11 LEU 111 1HD1 LEU 111 13.540 -10.718 31.630 1019 HD12 LEU 111 2HD1 LEU 111 14.930 -10.935 32.692 1020 HD13 LEU 111 3HD1 LEU 111 14.201 -9.340 32.509 1021 HD21 LEU 111 3HD2 LEU 111 13.593 -12.762 33.898 1022 HD22 LEU 111 1HD2 LEU 111 12.246 -12.447 32.805 1023 HD23 LEU 111 2HD2 LEU 111 12.005 -12.355 34.549 1024 H THR 112 H THR 112 11.769 -10.132 38.431 1025 HA THR 112 HA THR 112 14.341 -9.896 39.826 1026 HB THR 112 HB THR 112 13.127 -8.561 41.627 1027 HG1 THR 112 HG1 THR 112 11.313 -7.346 40.786 1028 HG21 THR 112 3HG2 THR 112 14.787 -7.548 40.147 1029 HG22 THR 112 1HG2 THR 112 13.470 -6.422 40.475 1030 HG23 THR 112 2HG2 THR 112 13.543 -7.267 38.929 1031 HA PRO 113 HA PRO 113 12.861 -13.416 42.079 1032 HB2 PRO 113 1HB PRO 113 14.325 -13.172 44.370 1033 HB3 PRO 113 2HB PRO 113 15.021 -13.710 42.829 1034 HG2 PRO 113 1HG PRO 113 15.132 -11.026 44.112 1035 HG3 PRO 113 2HG PRO 113 16.398 -11.921 43.247 1036 HD2 PRO 113 1HD PRO 113 14.988 -9.909 42.103 1037 HD3 PRO 113 2HD PRO 113 15.631 -11.284 41.182 1038 H SER 114 H SER 114 10.893 -13.524 42.913 1039 HA SER 114 HA SER 114 10.044 -11.558 44.918 1040 HB2 SER 114 1HB SER 114 8.652 -11.917 42.853 1041 HB3 SER 114 2HB SER 114 8.328 -13.553 43.422 1042 HG SER 114 HG SER 114 7.791 -11.264 44.995 1043 H GLY 115 H GLY 115 11.200 -14.702 44.693 1044 HA2 GLY 115 1HA GLY 115 10.971 -15.226 47.446 1045 HA3 GLY 115 2HA GLY 115 9.686 -16.087 46.612 1046 H GLU 116 H GLU 116 13.199 -15.616 46.645 1047 HA GLU 116 HA GLU 116 13.496 -18.428 45.825 1048 HB2 GLU 116 1HB GLU 116 15.031 -16.020 44.863 1049 HB3 GLU 116 2HB GLU 116 15.673 -17.651 44.721 1050 HG2 GLU 116 1HG GLU 116 13.744 -18.296 43.370 1051 HG3 GLU 116 2HG GLU 116 13.098 -16.661 43.514 1052 H LYS 117 H LYS 117 14.955 -15.674 47.510 1053 HA LYS 117 HA LYS 117 16.903 -17.352 48.829 1054 HB2 LYS 117 1HB LYS 117 16.280 -14.410 48.946 1055 HB3 LYS 117 2HB LYS 117 17.432 -15.157 50.043 1056 HG2 LYS 117 1HG LYS 117 18.773 -15.893 48.137 1057 HG3 LYS 117 2HG LYS 117 17.616 -15.141 47.037 1058 HD2 LYS 117 1HD LYS 117 18.092 -12.954 48.031 1059 HD3 LYS 117 2HD LYS 117 19.244 -13.706 49.136 1060 HE2 LYS 117 1HE LYS 117 20.540 -12.801 47.390 1061 HE3 LYS 117 2HE LYS 117 20.465 -14.534 47.074 1062 HZ1 LYS 117 3HZ LYS 117 18.789 -12.462 45.760 1063 HZ2 LYS 117 1HZ LYS 117 18.716 -14.126 45.457 1064 HZ3 LYS 117 2HZ LYS 117 20.111 -13.254 45.060 1065 H LEU 118 H LEU 118 13.994 -15.535 49.717 1066 HA LEU 118 HA LEU 118 14.117 -16.513 52.445 1067 HB2 LEU 118 1HB LEU 118 12.213 -14.651 51.037 1068 HB3 LEU 118 2HB LEU 118 12.011 -15.149 52.705 1069 HG LEU 118 HG LEU 118 14.608 -13.914 51.920 1070 HD11 LEU 118 1HD1 LEU 118 12.983 -12.443 50.874 1071 HD12 LEU 118 2HD1 LEU 118 13.688 -11.673 52.295 1072 HD13 LEU 118 3HD1 LEU 118 12.066 -12.358 52.378 1073 HD21 LEU 118 3HD2 LEU 118 14.467 -13.026 54.194 1074 HD22 LEU 118 1HD2 LEU 118 14.283 -14.779 54.179 1075 HD23 LEU 118 2HD2 LEU 118 12.868 -13.746 54.380 1076 H TRP 119 H TRP 119 12.927 -17.610 49.537 1077 HA TRP 119 HA TRP 119 11.024 -19.394 50.900 1078 HB2 TRP 119 1HB TRP 119 10.675 -17.988 48.252 1079 HB3 TRP 119 2HB TRP 119 9.713 -19.386 48.718 1080 HD1 TRP 119 HD1 TRP 119 10.267 -15.702 49.629 1081 HE1 TRP 119 HE1 TRP 119 8.236 -14.876 50.975 1082 HE3 TRP 119 HE3 TRP 119 7.813 -20.153 50.222 1083 HZ2 TRP 119 HZ2 TRP 119 5.905 -15.962 52.134 1084 HZ3 TRP 119 HZ3 TRP 119 5.689 -20.169 51.463 1085 HH2 TRP 119 HH2 TRP 119 4.756 -18.116 52.399 1086 H SER 120 H SER 120 11.007 -21.520 50.248 1087 HA SER 120 HA SER 120 13.267 -22.330 48.558 1088 HB2 SER 120 1HB SER 120 13.112 -23.210 50.908 1089 HB3 SER 120 2HB SER 120 11.640 -24.058 50.437 1090 HG SER 120 HG SER 120 13.422 -24.671 48.627 Start of MODEL 2 1 H1 LYS 1 1H LYS 1 1.409 -1.873 -34.273 2 H2 LYS 1 2H LYS 1 0.800 -3.311 -33.624 3 H3 LYS 1 3H LYS 1 1.871 -2.364 -32.721 4 HA LYS 1 HA LYS 1 0.268 -0.589 -32.589 5 HB2 LYS 1 1HB LYS 1 -1.374 -2.495 -34.250 6 HB3 LYS 1 2HB LYS 1 -2.106 -1.194 -33.322 7 HG2 LYS 1 1HG LYS 1 -0.799 0.442 -34.580 8 HG3 LYS 1 2HG LYS 1 -0.061 -0.864 -35.509 9 HD2 LYS 1 1HD LYS 1 -2.266 -1.502 -36.361 10 HD3 LYS 1 2HD LYS 1 -3.004 -0.200 -35.426 11 HE2 LYS 1 1HE LYS 1 -1.698 1.440 -36.693 12 HE3 LYS 1 2HE LYS 1 -0.969 0.135 -37.629 13 HZ1 LYS 1 3HZ LYS 1 -2.796 1.179 -38.819 14 HZ2 LYS 1 1HZ LYS 1 -3.864 0.797 -37.563 15 HZ3 LYS 1 2HZ LYS 1 -3.154 -0.438 -38.474 16 H ILE 2 H ILE 2 -0.548 -0.488 -30.596 17 HA ILE 2 HA ILE 2 -1.640 -2.918 -29.368 18 HB ILE 2 HB ILE 2 -0.463 -2.203 -27.204 19 HG12 ILE 2 1HG1 ILE 2 1.769 -1.126 -28.810 20 HG13 ILE 2 2HG1 ILE 2 0.379 -0.056 -28.664 21 HG21 ILE 2 1HG2 ILE 2 1.141 -3.339 -29.489 22 HG22 ILE 2 2HG2 ILE 2 0.082 -4.236 -28.401 23 HG23 ILE 2 3HG2 ILE 2 1.552 -3.485 -27.780 24 HD11 ILE 2 3HD1 ILE 2 2.030 0.392 -26.942 25 HD12 ILE 2 1HD1 ILE 2 1.913 -1.275 -26.380 26 HD13 ILE 2 2HD1 ILE 2 0.526 -0.197 -26.234 27 HA PRO 3 HA PRO 3 -4.841 -0.202 -27.963 28 HB2 PRO 3 1HB PRO 3 -5.688 -1.558 -25.744 29 HB3 PRO 3 2HB PRO 3 -6.063 -2.071 -27.400 30 HG2 PRO 3 1HG PRO 3 -3.983 -3.098 -25.537 31 HG3 PRO 3 2HG PRO 3 -5.042 -3.985 -26.651 32 HD2 PRO 3 1HD PRO 3 -2.450 -3.451 -27.220 33 HD3 PRO 3 2HD PRO 3 -3.706 -3.568 -28.470 34 H SER 4 H SER 4 -5.131 1.508 -26.613 35 HA SER 4 HA SER 4 -2.969 2.194 -24.832 36 HB2 SER 4 1HB SER 4 -4.086 3.836 -26.373 37 HB3 SER 4 2HB SER 4 -5.518 3.739 -25.348 38 HG SER 4 HG SER 4 -3.137 5.044 -24.931 39 H ILE 5 H ILE 5 -5.810 0.473 -24.465 40 HA ILE 5 HA ILE 5 -6.471 1.359 -21.793 41 HB ILE 5 HB ILE 5 -7.502 -1.148 -23.115 42 HG12 ILE 5 1HG1 ILE 5 -9.480 0.668 -23.545 43 HG13 ILE 5 2HG1 ILE 5 -8.059 1.684 -23.763 44 HG21 ILE 5 1HG2 ILE 5 -9.476 -0.725 -21.716 45 HG22 ILE 5 2HG2 ILE 5 -8.680 0.696 -21.038 46 HG23 ILE 5 3HG2 ILE 5 -8.010 -0.911 -20.751 47 HD11 ILE 5 3HD1 ILE 5 -8.603 -0.886 -25.232 48 HD12 ILE 5 1HD1 ILE 5 -7.228 0.189 -25.479 49 HD13 ILE 5 2HD1 ILE 5 -8.857 0.740 -25.868 50 H ALA 6 H ALA 6 -4.652 -1.233 -23.293 51 HA ALA 6 HA ALA 6 -4.330 -2.712 -20.828 52 HB1 ALA 6 3HB ALA 6 -4.482 -3.833 -23.035 53 HB2 ALA 6 1HB ALA 6 -3.035 -4.266 -22.123 54 HB3 ALA 6 2HB ALA 6 -2.924 -3.123 -23.461 55 H THR 7 H THR 7 -2.604 -0.282 -22.609 56 HA THR 7 HA THR 7 -0.012 -0.677 -21.576 57 HB THR 7 HB THR 7 -0.992 2.074 -22.234 58 HG1 THR 7 HG1 THR 7 -0.797 -0.128 -24.003 59 HG21 THR 7 3HG2 THR 7 1.205 2.191 -23.369 60 HG22 THR 7 1HG2 THR 7 1.527 0.530 -22.871 61 HG23 THR 7 2HG2 THR 7 1.353 1.797 -21.656 62 H GLY 8 H GLY 8 -2.818 1.016 -20.305 63 HA2 GLY 8 1HA GLY 8 -1.352 2.266 -18.147 64 HA3 GLY 8 2HA GLY 8 -3.092 2.289 -18.378 65 H LEU 9 H LEU 9 -3.560 -0.464 -18.518 66 HA LEU 9 HA LEU 9 -3.817 -1.133 -15.804 67 HB2 LEU 9 1HB LEU 9 -4.020 -2.847 -18.282 68 HB3 LEU 9 2HB LEU 9 -4.447 -3.403 -16.674 69 HG LEU 9 HG LEU 9 -5.774 -0.973 -17.830 70 HD11 LEU 9 1HD1 LEU 9 -6.389 -3.855 -18.406 71 HD12 LEU 9 2HD1 LEU 9 -6.189 -2.522 -19.544 72 HD13 LEU 9 3HD1 LEU 9 -7.615 -2.590 -18.509 73 HD21 LEU 9 3HD2 LEU 9 -6.104 -1.403 -15.465 74 HD22 LEU 9 1HD2 LEU 9 -6.612 -3.056 -15.814 75 HD23 LEU 9 2HD2 LEU 9 -7.602 -1.698 -16.349 76 H VAL 10 H VAL 10 -1.500 -2.226 -18.264 77 HA VAL 10 HA VAL 10 -0.232 -4.178 -16.705 78 HB VAL 10 HB VAL 10 1.703 -3.939 -18.252 79 HG11 VAL 10 1HG1 VAL 10 -1.086 -4.202 -19.330 80 HG12 VAL 10 2HG1 VAL 10 0.071 -5.474 -18.928 81 HG13 VAL 10 3HG1 VAL 10 0.333 -4.460 -20.347 82 HG21 VAL 10 3HG2 VAL 10 1.605 -1.537 -18.663 83 HG22 VAL 10 1HG2 VAL 10 0.051 -1.725 -19.477 84 HG23 VAL 10 2HG2 VAL 10 1.508 -2.429 -20.180 85 H GLY 11 H GLY 11 0.369 -0.732 -16.995 86 HA2 GLY 11 1HA GLY 11 2.774 -0.680 -15.475 87 HA3 GLY 11 2HA GLY 11 1.748 0.703 -15.828 88 H ALA 12 H ALA 12 -0.602 0.066 -14.600 89 HA ALA 12 HA ALA 12 0.058 0.590 -11.868 90 HB1 ALA 12 3HB ALA 12 -1.907 1.536 -13.168 91 HB2 ALA 12 1HB ALA 12 -2.233 0.987 -11.525 92 HB3 ALA 12 2HB ALA 12 -2.697 -0.017 -12.898 93 H LEU 13 H LEU 13 -1.333 -2.202 -13.549 94 HA LEU 13 HA LEU 13 -1.878 -3.683 -11.197 95 HB2 LEU 13 1HB LEU 13 -1.684 -4.325 -14.103 96 HB3 LEU 13 2HB LEU 13 -1.692 -5.648 -12.953 97 HG LEU 13 HG LEU 13 -3.854 -4.758 -12.044 98 HD11 LEU 13 1HD1 LEU 13 -3.639 -2.442 -12.811 99 HD12 LEU 13 2HD1 LEU 13 -5.130 -3.181 -13.396 100 HD13 LEU 13 3HD1 LEU 13 -3.757 -2.986 -14.484 101 HD21 LEU 13 3HD2 LEU 13 -3.796 -6.620 -13.614 102 HD22 LEU 13 1HD2 LEU 13 -3.818 -5.491 -14.967 103 HD23 LEU 13 2HD2 LEU 13 -5.210 -5.604 -13.891 104 H LEU 14 H LEU 14 0.938 -3.532 -13.357 105 HA LEU 14 HA LEU 14 2.370 -5.598 -12.022 106 HB2 LEU 14 1HB LEU 14 2.916 -3.656 -14.154 107 HB3 LEU 14 2HB LEU 14 4.319 -4.084 -13.193 108 HG LEU 14 HG LEU 14 3.649 -6.533 -13.674 109 HD11 LEU 14 1HD1 LEU 14 1.403 -5.691 -14.647 110 HD12 LEU 14 2HD1 LEU 14 2.253 -7.010 -15.457 111 HD13 LEU 14 3HD1 LEU 14 2.347 -5.372 -16.103 112 HD21 LEU 14 3HD2 LEU 14 5.633 -5.450 -14.585 113 HD22 LEU 14 1HD2 LEU 14 4.667 -4.753 -15.884 114 HD23 LEU 14 2HD2 LEU 14 4.881 -6.500 -15.785 115 H LEU 15 H LEU 15 2.267 -2.087 -11.715 116 HA LEU 15 HA LEU 15 4.399 -1.910 -9.831 117 HB2 LEU 15 1HB LEU 15 2.518 -0.106 -11.086 118 HB3 LEU 15 2HB LEU 15 2.680 0.258 -9.378 119 HG LEU 15 HG LEU 15 5.299 0.002 -10.126 120 HD11 LEU 15 1HD1 LEU 15 5.585 1.270 -12.188 121 HD12 LEU 15 2HD1 LEU 15 3.838 1.305 -12.417 122 HD13 LEU 15 3HD1 LEU 15 4.704 -0.229 -12.480 123 HD21 LEU 15 3HD2 LEU 15 5.372 2.435 -10.007 124 HD22 LEU 15 1HD2 LEU 15 4.336 1.771 -8.745 125 HD23 LEU 15 2HD2 LEU 15 3.619 2.506 -10.179 126 H LEU 16 H LEU 16 0.890 -2.190 -9.559 127 HA LEU 16 HA LEU 16 0.774 -1.957 -6.728 128 HB2 LEU 16 1HB LEU 16 -1.096 -1.791 -8.583 129 HB3 LEU 16 2HB LEU 16 -1.260 -3.508 -8.271 130 HG LEU 16 HG LEU 16 -1.423 -2.685 -5.755 131 HD11 LEU 16 1HD1 LEU 16 -2.642 -0.575 -5.594 132 HD12 LEU 16 2HD1 LEU 16 -2.433 -0.317 -7.325 133 HD13 LEU 16 3HD1 LEU 16 -1.028 -0.334 -6.259 134 HD21 LEU 16 3HD2 LEU 16 -3.677 -2.523 -7.753 135 HD22 LEU 16 1HD2 LEU 16 -3.862 -2.670 -6.005 136 HD23 LEU 16 2HD2 LEU 16 -3.116 -3.977 -6.925 137 H LEU 17 H LEU 17 1.256 -4.617 -8.957 138 HA LEU 17 HA LEU 17 0.873 -6.723 -7.092 139 HB2 LEU 17 1HB LEU 17 0.931 -6.754 -9.697 140 HB3 LEU 17 2HB LEU 17 2.660 -6.950 -9.488 141 HG LEU 17 HG LEU 17 1.889 -8.932 -7.899 142 HD11 LEU 17 1HD1 LEU 17 -0.082 -10.064 -8.796 143 HD12 LEU 17 2HD1 LEU 17 -0.382 -8.696 -9.868 144 HD13 LEU 17 3HD1 LEU 17 -0.496 -8.488 -8.120 145 HD21 LEU 17 3HD2 LEU 17 1.937 -9.080 -10.910 146 HD22 LEU 17 1HD2 LEU 17 2.122 -10.447 -9.813 147 HD23 LEU 17 2HD2 LEU 17 3.334 -9.166 -9.838 148 H VAL 18 H VAL 18 3.748 -4.974 -8.237 149 HA VAL 18 HA VAL 18 5.628 -6.520 -6.765 150 HB VAL 18 HB VAL 18 5.929 -3.696 -7.815 151 HG11 VAL 18 1HG1 VAL 18 8.342 -4.139 -7.729 152 HG12 VAL 18 2HG1 VAL 18 8.023 -5.704 -6.982 153 HG13 VAL 18 3HG1 VAL 18 7.607 -4.221 -6.126 154 HG21 VAL 18 3HG2 VAL 18 6.673 -6.337 -9.072 155 HG22 VAL 18 1HG2 VAL 18 7.061 -4.744 -9.724 156 HG23 VAL 18 2HG2 VAL 18 5.379 -5.260 -9.596 157 H VAL 19 H VAL 19 3.986 -3.434 -6.109 158 HA VAL 19 HA VAL 19 5.302 -2.895 -3.657 159 HB VAL 19 HB VAL 19 2.604 -1.933 -4.639 160 HG11 VAL 19 1HG1 VAL 19 2.610 -1.600 -2.295 161 HG12 VAL 19 2HG1 VAL 19 3.025 -0.045 -3.014 162 HG13 VAL 19 3HG1 VAL 19 4.286 -1.053 -2.303 163 HG21 VAL 19 3HG2 VAL 19 3.811 0.115 -5.240 164 HG22 VAL 19 1HG2 VAL 19 4.437 -1.289 -6.106 165 HG23 VAL 19 2HG2 VAL 19 5.326 -0.632 -4.730 166 H ALA 20 H ALA 20 2.232 -4.510 -4.423 167 HA ALA 20 HA ALA 20 1.430 -4.954 -1.739 168 HB1 ALA 20 3HB ALA 20 -0.142 -5.019 -3.616 169 HB2 ALA 20 1HB ALA 20 -0.196 -6.507 -2.671 170 HB3 ALA 20 2HB ALA 20 0.643 -6.478 -4.222 171 H LEU 21 H LEU 21 3.319 -6.844 -4.045 172 HA LEU 21 HA LEU 21 3.484 -9.204 -2.469 173 HB2 LEU 21 1HB LEU 21 3.983 -8.804 -5.006 174 HB3 LEU 21 2HB LEU 21 5.596 -8.412 -4.442 175 HG LEU 21 HG LEU 21 5.354 -10.758 -3.220 176 HD11 LEU 21 1HD1 LEU 21 4.145 -12.355 -4.621 177 HD12 LEU 21 2HD1 LEU 21 3.551 -11.031 -5.621 178 HD13 LEU 21 3HD1 LEU 21 3.058 -11.148 -3.933 179 HD21 LEU 21 3HD2 LEU 21 6.473 -11.780 -5.149 180 HD22 LEU 21 1HD2 LEU 21 7.104 -10.170 -4.799 181 HD23 LEU 21 2HD2 LEU 21 5.991 -10.408 -6.147 182 H GLY 22 H GLY 22 5.440 -6.286 -2.739 183 HA2 GLY 22 1HA GLY 22 7.639 -7.175 -1.180 184 HA3 GLY 22 2HA GLY 22 7.219 -5.502 -1.510 185 H ILE 23 H ILE 23 4.875 -5.079 -0.317 186 HA ILE 23 HA ILE 23 5.527 -4.912 2.430 187 HB ILE 23 HB ILE 23 2.747 -4.646 1.270 188 HG12 ILE 23 1HG1 ILE 23 4.567 -2.301 1.694 189 HG13 ILE 23 2HG1 ILE 23 4.726 -3.251 0.220 190 HG21 ILE 23 1HG2 ILE 23 2.821 -4.735 3.701 191 HG22 ILE 23 2HG2 ILE 23 2.397 -3.111 3.161 192 HG23 ILE 23 3HG2 ILE 23 4.032 -3.452 3.729 193 HD11 ILE 23 3HD1 ILE 23 2.219 -1.878 1.162 194 HD12 ILE 23 1HD1 ILE 23 2.397 -2.805 -0.327 195 HD13 ILE 23 2HD1 ILE 23 3.302 -1.307 -0.108 196 H GLY 24 H GLY 24 3.527 -7.153 0.576 197 HA2 GLY 24 1HA GLY 24 2.342 -8.511 2.751 198 HA3 GLY 24 2HA GLY 24 2.541 -9.154 1.127 199 H LEU 25 H LEU 25 5.305 -9.182 0.905 200 HA LEU 25 HA LEU 25 5.946 -11.545 2.380 201 HB2 LEU 25 1HB LEU 25 7.519 -9.809 0.487 202 HB3 LEU 25 2HB LEU 25 8.220 -11.210 1.274 203 HG LEU 25 HG LEU 25 5.706 -11.515 -0.326 204 HD11 LEU 25 1HD1 LEU 25 7.096 -12.016 -2.301 205 HD12 LEU 25 2HD1 LEU 25 8.510 -11.427 -1.428 206 HD13 LEU 25 3HD1 LEU 25 7.189 -10.324 -1.812 207 HD21 LEU 25 3HD2 LEU 25 6.449 -13.393 1.031 208 HD22 LEU 25 1HD2 LEU 25 8.039 -13.333 0.270 209 HD23 LEU 25 2HD2 LEU 25 6.620 -13.764 -0.684 210 H PHE 26 H PHE 26 6.586 -8.148 2.785 211 HA PHE 26 HA PHE 26 8.750 -8.463 4.642 212 HB2 PHE 26 1HB PHE 26 7.246 -6.238 3.455 213 HB3 PHE 26 2HB PHE 26 7.776 -5.945 5.107 214 HD1 PHE 26 HD2 PHE 26 8.848 -6.512 1.659 215 HD2 PHE 26 HD1 PHE 26 10.123 -5.774 5.652 216 HE1 PHE 26 HE2 PHE 26 11.095 -5.950 0.833 217 HE2 PHE 26 HE1 PHE 26 12.372 -5.210 4.832 218 HZ PHE 26 HZ PHE 26 12.862 -5.298 2.420 219 H ILE 27 H ILE 27 5.257 -8.036 4.903 220 HA ILE 27 HA ILE 27 5.338 -7.800 7.789 221 HB ILE 27 HB ILE 27 2.941 -8.145 5.978 222 HG12 ILE 27 1HG1 ILE 27 4.101 -6.085 5.414 223 HG13 ILE 27 2HG1 ILE 27 2.617 -5.702 6.274 224 HG21 ILE 27 1HG2 ILE 27 1.643 -7.268 7.871 225 HG22 ILE 27 2HG2 ILE 27 3.102 -7.276 8.860 226 HG23 ILE 27 3HG2 ILE 27 2.439 -8.794 8.255 227 HD11 ILE 27 3HD1 ILE 27 4.030 -5.456 8.351 228 HD12 ILE 27 1HD1 ILE 27 4.278 -4.244 7.094 229 HD13 ILE 27 2HD1 ILE 27 5.440 -5.555 7.295 230 H ARG 28 H ARG 28 4.707 -10.301 5.400 231 HA ARG 28 HA ARG 28 3.563 -12.208 7.161 232 HB2 ARG 28 1HB ARG 28 4.793 -12.323 4.439 233 HB3 ARG 28 2HB ARG 28 4.477 -13.823 5.298 234 HG2 ARG 28 1HG ARG 28 2.118 -13.223 5.490 235 HG3 ARG 28 2HG ARG 28 2.433 -11.712 4.634 236 HD2 ARG 28 1HD ARG 28 3.062 -14.404 3.451 237 HD3 ARG 28 2HD ARG 28 1.487 -13.635 3.266 238 HE ARG 28 HE ARG 28 3.461 -11.808 2.491 239 HH11 ARG 28 1HH1 ARG 28 2.091 -14.836 1.411 240 HH12 ARG 28 2HH1 ARG 28 2.430 -14.535 -0.260 241 HH21 ARG 28 1HH2 ARG 28 3.903 -11.416 0.295 242 HH22 ARG 28 2HH2 ARG 28 3.459 -12.594 -0.894 243 H ARG 29 H ARG 29 6.834 -11.256 6.517 244 HA ARG 29 HA ARG 29 8.028 -13.625 7.656 245 HB2 ARG 29 1HB ARG 29 9.127 -10.996 6.687 246 HB3 ARG 29 2HB ARG 29 10.142 -12.171 7.512 247 HG2 ARG 29 1HG ARG 29 9.597 -13.832 5.787 248 HG3 ARG 29 2HG ARG 29 8.622 -12.624 4.951 249 HD2 ARG 29 1HD ARG 29 11.532 -12.202 5.582 250 HD3 ARG 29 2HD ARG 29 10.989 -12.982 4.096 251 HE ARG 29 HE ARG 29 9.632 -10.548 4.366 252 HH11 ARG 29 1HH1 ARG 29 12.876 -11.714 3.784 253 HH12 ARG 29 2HH1 ARG 29 13.347 -10.315 2.876 254 HH21 ARG 29 1HH2 ARG 29 10.255 -8.714 3.174 255 HH22 ARG 29 2HH2 ARG 29 11.860 -8.613 2.532 256 H ARG 30 H ARG 30 7.203 -10.385 8.706 257 HA ARG 30 HA ARG 30 8.545 -10.680 11.261 258 HB2 ARG 30 1HB ARG 30 6.897 -8.486 10.021 259 HB3 ARG 30 2HB ARG 30 7.412 -8.427 11.701 260 HG2 ARG 30 1HG ARG 30 9.749 -8.542 10.988 261 HG3 ARG 30 2HG ARG 30 9.228 -8.593 9.304 262 HD2 ARG 30 1HD ARG 30 9.803 -6.349 9.705 263 HD3 ARG 30 2HD ARG 30 8.042 -6.393 9.763 264 HE ARG 30 HE ARG 30 9.018 -6.746 12.361 265 HH11 ARG 30 1HH1 ARG 30 8.879 -4.258 9.908 266 HH12 ARG 30 2HH1 ARG 30 8.886 -2.958 11.052 267 HH21 ARG 30 1HH2 ARG 30 9.026 -5.034 13.859 268 HH22 ARG 30 2HH2 ARG 30 8.969 -3.399 13.293 269 H HIS 31 H HIS 31 5.428 -11.257 9.930 270 HA HIS 31 HA HIS 31 3.877 -11.007 12.300 271 HB2 HIS 31 1HB HIS 31 3.159 -11.120 9.778 272 HB3 HIS 31 2HB HIS 31 3.098 -12.852 10.076 273 HD1 HIS 31 HD1 HIS 31 1.224 -9.735 10.593 274 HD2 HIS 31 HD2 HIS 31 1.152 -13.621 12.066 275 HE1 HIS 31 HE1 HIS 31 -1.005 -9.983 11.727 276 HE2 HIS 31 HE2 HIS 31 -1.062 -12.369 12.532 277 H ILE 32 H ILE 32 6.097 -13.377 11.262 278 HA ILE 32 HA ILE 32 4.901 -15.591 12.685 279 HB ILE 32 HB ILE 32 7.757 -15.544 11.742 280 HG12 ILE 32 1HG1 ILE 32 5.625 -16.529 9.905 281 HG13 ILE 32 2HG1 ILE 32 5.860 -14.788 10.012 282 HG21 ILE 32 1HG2 ILE 32 5.691 -17.734 11.961 283 HG22 ILE 32 2HG2 ILE 32 7.045 -17.461 13.058 284 HG23 ILE 32 3HG2 ILE 32 7.346 -17.942 11.387 285 HD11 ILE 32 3HD1 ILE 32 7.938 -16.828 9.253 286 HD12 ILE 32 1HD1 ILE 32 8.224 -15.095 9.419 287 HD13 ILE 32 2HD1 ILE 32 7.128 -15.693 8.174 288 H VAL 33 H VAL 33 6.720 -12.901 13.561 289 HA VAL 33 HA VAL 33 8.054 -14.190 15.814 290 HB VAL 33 HB VAL 33 8.070 -11.228 15.266 291 HG11 VAL 33 1HG1 VAL 33 8.980 -11.951 17.402 292 HG12 VAL 33 2HG1 VAL 33 10.265 -11.343 16.358 293 HG13 VAL 33 3HG1 VAL 33 10.057 -13.081 16.578 294 HG21 VAL 33 3HG2 VAL 33 10.103 -11.545 13.925 295 HG22 VAL 33 1HG2 VAL 33 8.697 -12.294 13.171 296 HG23 VAL 33 2HG2 VAL 33 9.881 -13.292 14.015 297 H ARG 34 H ARG 34 5.589 -11.706 15.202 298 HA ARG 34 HA ARG 34 4.674 -12.032 17.985 299 HB2 ARG 34 1HB ARG 34 4.732 -9.566 16.248 300 HB3 ARG 34 2HB ARG 34 3.740 -9.675 17.695 301 HG2 ARG 34 1HG ARG 34 5.807 -10.144 19.000 302 HG3 ARG 34 2HG ARG 34 6.740 -9.833 17.535 303 HD2 ARG 34 1HD ARG 34 5.803 -7.572 17.425 304 HD3 ARG 34 2HD ARG 34 4.879 -7.886 18.895 305 HE ARG 34 HE ARG 34 7.583 -8.369 19.429 306 HH11 ARG 34 1HH1 ARG 34 5.478 -5.679 18.685 307 HH12 ARG 34 2HH1 ARG 34 6.447 -4.526 19.540 308 HH21 ARG 34 1HH2 ARG 34 8.853 -6.851 20.551 309 HH22 ARG 34 2HH2 ARG 34 8.362 -5.190 20.598 310 H LYS 35 H LYS 35 2.650 -12.720 18.255 311 HA LYS 35 HA LYS 35 0.743 -12.439 16.035 312 HB2 LYS 35 1HB LYS 35 1.399 -14.936 17.587 313 HB3 LYS 35 2HB LYS 35 -0.122 -14.748 16.726 314 HG2 LYS 35 1HG LYS 35 1.105 -14.439 14.632 315 HG3 LYS 35 2HG LYS 35 2.627 -14.640 15.501 316 HD2 LYS 35 1HD LYS 35 1.953 -16.903 16.153 317 HD3 LYS 35 2HD LYS 35 0.433 -16.700 15.279 318 HE2 LYS 35 1HE LYS 35 3.122 -16.433 13.957 319 HE3 LYS 35 2HE LYS 35 2.269 -17.971 14.078 320 HZ1 LYS 35 3HZ LYS 35 1.835 -16.904 11.965 321 HZ2 LYS 35 1HZ LYS 35 1.249 -15.520 12.745 322 HZ3 LYS 35 2HZ LYS 35 0.412 -16.984 12.874 323 H ARG 36 H ARG 36 1.169 -13.118 19.494 324 HA ARG 36 HA ARG 36 -1.354 -11.720 20.003 325 HB2 ARG 36 1HB ARG 36 -0.474 -14.371 21.130 326 HB3 ARG 36 2HB ARG 36 -1.678 -13.375 21.935 327 HG2 ARG 36 1HG ARG 36 -3.101 -13.481 19.955 328 HG3 ARG 36 2HG ARG 36 -1.889 -14.469 19.137 329 HD2 ARG 36 1HD ARG 36 -2.141 -16.193 20.859 330 HD3 ARG 36 2HD ARG 36 -3.356 -15.204 21.667 331 HE ARG 36 HE ARG 36 -4.149 -15.606 19.010 332 HH11 ARG 36 1HH1 ARG 36 -3.748 -17.433 21.962 333 HH12 ARG 36 2HH1 ARG 36 -4.971 -18.591 21.557 334 HH21 ARG 36 1HH2 ARG 36 -5.756 -17.128 18.482 335 HH22 ARG 36 2HH2 ARG 36 -6.110 -18.417 19.583 336 H THR 37 H THR 37 1.526 -10.965 20.165 337 HA THR 37 HA THR 37 2.087 -10.705 22.992 338 HB THR 37 HB THR 37 4.027 -9.283 22.159 339 HG1 THR 37 HG1 THR 37 4.087 -10.238 19.679 340 HG21 THR 37 3HG2 THR 37 4.296 -11.637 22.757 341 HG22 THR 37 1HG2 THR 37 5.300 -11.225 21.365 342 HG23 THR 37 2HG2 THR 37 3.794 -12.115 21.134 343 H LEU 38 H LEU 38 0.935 -8.653 20.377 344 HA LEU 38 HA LEU 38 0.895 -6.306 22.086 345 HB2 LEU 38 1HB LEU 38 0.792 -6.799 19.204 346 HB3 LEU 38 2HB LEU 38 -0.341 -5.575 19.737 347 HG LEU 38 HG LEU 38 1.642 -4.450 19.063 348 HD11 LEU 38 1HD1 LEU 38 1.895 -3.076 20.840 349 HD12 LEU 38 2HD1 LEU 38 2.194 -4.398 21.965 350 HD13 LEU 38 3HD1 LEU 38 0.547 -4.022 21.466 351 HD21 LEU 38 3HD2 LEU 38 3.238 -6.163 20.956 352 HD22 LEU 38 1HD2 LEU 38 3.846 -4.973 19.804 353 HD23 LEU 38 2HD2 LEU 38 3.110 -6.465 19.223 354 H ARG 39 H ARG 39 -1.291 -8.507 20.495 355 HA ARG 39 HA ARG 39 -3.732 -7.287 21.090 356 HB2 ARG 39 1HB ARG 39 -2.985 -10.154 20.517 357 HB3 ARG 39 2HB ARG 39 -4.645 -9.655 20.806 358 HG2 ARG 39 1HG ARG 39 -4.530 -8.148 18.887 359 HG3 ARG 39 2HG ARG 39 -2.862 -8.643 18.599 360 HD2 ARG 39 1HD ARG 39 -3.611 -10.945 18.240 361 HD3 ARG 39 2HD ARG 39 -5.277 -10.448 18.531 362 HE ARG 39 HE ARG 39 -4.241 -8.869 16.471 363 HH11 ARG 39 1HH1 ARG 39 -5.102 -12.206 17.050 364 HH12 ARG 39 2HH1 ARG 39 -5.480 -12.525 15.390 365 HH21 ARG 39 1HH2 ARG 39 -4.739 -9.291 14.292 366 HH22 ARG 39 2HH2 ARG 39 -5.272 -10.871 13.826 367 H ARG 40 H ARG 40 -1.532 -9.300 22.878 368 HA ARG 40 HA ARG 40 -3.289 -9.949 25.033 369 HB2 ARG 40 1HB ARG 40 -0.404 -10.142 24.479 370 HB3 ARG 40 2HB ARG 40 -0.779 -9.841 26.170 371 HG2 ARG 40 1HG ARG 40 -2.224 -11.811 26.202 372 HG3 ARG 40 2HG ARG 40 -1.845 -12.114 24.504 373 HD2 ARG 40 1HD ARG 40 0.513 -12.392 25.073 374 HD3 ARG 40 2HD ARG 40 0.148 -12.063 26.767 375 HE ARG 40 HE ARG 40 -1.444 -14.201 25.930 376 HH11 ARG 40 1HH1 ARG 40 1.932 -13.495 26.488 377 HH12 ARG 40 2HH1 ARG 40 2.336 -15.131 26.884 378 HH21 ARG 40 1HH2 ARG 40 -0.911 -16.349 26.452 379 HH22 ARG 40 2HH2 ARG 40 0.723 -16.751 26.863 380 H LEU 41 H LEU 41 -1.593 -7.237 23.954 381 HA LEU 41 HA LEU 41 -2.189 -5.693 26.366 382 HB2 LEU 41 1HB LEU 41 -0.233 -5.064 24.148 383 HB3 LEU 41 2HB LEU 41 -0.497 -4.101 25.588 384 HG LEU 41 HG LEU 41 0.337 -6.930 25.976 385 HD11 LEU 41 1HD1 LEU 41 2.702 -6.309 25.722 386 HD12 LEU 41 2HD1 LEU 41 2.208 -4.750 25.064 387 HD13 LEU 41 3HD1 LEU 41 1.821 -6.236 24.197 388 HD21 LEU 41 3HD2 LEU 41 1.305 -4.434 27.338 389 HD22 LEU 41 1HD2 LEU 41 1.348 -6.095 27.929 390 HD23 LEU 41 2HD2 LEU 41 -0.192 -5.244 27.803 391 H LEU 42 H LEU 42 -2.760 -6.076 22.919 392 HA LEU 42 HA LEU 42 -3.958 -3.443 22.644 393 HB2 LEU 42 1HB LEU 42 -2.803 -5.168 20.870 394 HB3 LEU 42 2HB LEU 42 -4.508 -5.431 20.554 395 HG LEU 42 HG LEU 42 -3.461 -2.633 20.621 396 HD11 LEU 42 1HD1 LEU 42 -2.938 -2.770 18.239 397 HD12 LEU 42 2HD1 LEU 42 -3.233 -4.508 18.272 398 HD13 LEU 42 3HD1 LEU 42 -1.892 -3.823 19.190 399 HD21 LEU 42 3HD2 LEU 42 -5.622 -4.017 19.036 400 HD22 LEU 42 1HD2 LEU 42 -5.241 -2.296 18.977 401 HD23 LEU 42 2HD2 LEU 42 -5.867 -3.011 20.463 402 H GLN 43 H GLN 43 -5.138 -6.801 22.524 403 HA GLN 43 HA GLN 43 -7.893 -5.994 22.455 404 HB2 GLN 43 1HB GLN 43 -6.518 -8.656 22.756 405 HB3 GLN 43 2HB GLN 43 -8.266 -8.495 22.864 406 HG2 GLN 43 1HG GLN 43 -8.321 -7.570 20.604 407 HG3 GLN 43 2HG GLN 43 -6.570 -7.734 20.495 408 HE21 GLN 43 2HE2 GLN 43 -9.612 -9.408 20.542 409 HE22 GLN 43 1HE2 GLN 43 -9.014 -10.932 19.987 410 H GLU 44 H GLU 44 -5.600 -6.200 24.894 411 HA GLU 44 HA GLU 44 -7.397 -7.011 27.017 412 HB2 GLU 44 1HB GLU 44 -4.757 -7.253 26.796 413 HB3 GLU 44 2HB GLU 44 -4.790 -5.688 27.596 414 HG2 GLU 44 1HG GLU 44 -6.086 -6.651 29.430 415 HG3 GLU 44 2HG GLU 44 -6.050 -8.220 28.628 416 H ARG 45 H ARG 45 -5.828 -4.001 25.967 417 HA ARG 45 HA ARG 45 -7.258 -2.454 27.965 418 HB2 ARG 45 1HB ARG 45 -5.161 -1.782 25.914 419 HB3 ARG 45 2HB ARG 45 -6.019 -0.525 26.793 420 HG2 ARG 45 1HG ARG 45 -4.719 -2.709 28.341 421 HG3 ARG 45 2HG ARG 45 -3.710 -1.444 27.636 422 HD2 ARG 45 1HD ARG 45 -5.047 0.256 28.786 423 HD3 ARG 45 2HD ARG 45 -6.053 -1.010 29.488 424 HE ARG 45 HE ARG 45 -3.391 -1.533 30.159 425 HH11 ARG 45 1HH1 ARG 45 -5.860 0.844 30.842 426 HH12 ARG 45 2HH1 ARG 45 -5.233 1.227 32.410 427 HH21 ARG 45 1HH2 ARG 45 -2.569 -1.029 32.221 428 HH22 ARG 45 2HH2 ARG 45 -3.366 0.164 33.192 429 H GLU 46 H GLU 46 -7.807 -3.541 24.826 430 HA GLU 46 HA GLU 46 -9.136 -1.361 23.642 431 HB2 GLU 46 1HB GLU 46 -8.379 -3.729 22.711 432 HB3 GLU 46 2HB GLU 46 -10.046 -4.147 23.082 433 HG2 GLU 46 1HG GLU 46 -10.822 -2.324 21.651 434 HG3 GLU 46 2HG GLU 46 -9.148 -1.910 21.278 435 H LEU 47 H LEU 47 -10.176 -3.723 25.995 436 HA LEU 47 HA LEU 47 -12.903 -2.655 25.873 437 HB2 LEU 47 1HB LEU 47 -11.777 -5.271 26.780 438 HB3 LEU 47 2HB LEU 47 -13.286 -4.715 27.469 439 HG LEU 47 HG LEU 47 -13.710 -6.269 25.659 440 HD11 LEU 47 1HD1 LEU 47 -15.129 -4.146 26.040 441 HD12 LEU 47 2HD1 LEU 47 -15.384 -5.102 24.579 442 HD13 LEU 47 3HD1 LEU 47 -14.443 -3.611 24.505 443 HD21 LEU 47 3HD2 LEU 47 -13.079 -5.796 23.359 444 HD22 LEU 47 1HD2 LEU 47 -11.651 -5.923 24.386 445 HD23 LEU 47 2HD2 LEU 47 -12.233 -4.338 23.877 446 H VAL 48 H VAL 48 -10.256 -1.850 27.313 447 HA VAL 48 HA VAL 48 -11.577 -1.173 29.861 448 HB VAL 48 HB VAL 48 -8.598 -1.605 29.696 449 HG11 VAL 48 1HG1 VAL 48 -9.424 -0.338 31.602 450 HG12 VAL 48 2HG1 VAL 48 -8.811 -1.907 32.121 451 HG13 VAL 48 3HG1 VAL 48 -10.550 -1.636 31.997 452 HG21 VAL 48 3HG2 VAL 48 -9.769 -3.692 29.010 453 HG22 VAL 48 1HG2 VAL 48 -10.598 -3.687 30.568 454 HG23 VAL 48 2HG2 VAL 48 -8.843 -3.852 30.503 455 H GLU 49 H GLU 49 -11.914 0.559 27.917 456 HA GLU 49 HA GLU 49 -9.853 2.634 28.256 457 HB2 GLU 49 1HB GLU 49 -11.809 2.104 26.027 458 HB3 GLU 49 2HB GLU 49 -10.990 3.650 26.195 459 HG2 GLU 49 1HG GLU 49 -8.828 2.530 26.010 460 HG3 GLU 49 2HG GLU 49 -9.650 0.978 25.843 461 HA PRO 50 HA PRO 50 -12.877 4.899 30.614 462 HB2 PRO 50 1HB PRO 50 -11.639 7.320 30.652 463 HB3 PRO 50 2HB PRO 50 -11.081 5.943 31.620 464 HG2 PRO 50 1HG PRO 50 -10.016 6.992 29.048 465 HG3 PRO 50 2HG PRO 50 -9.144 6.384 30.469 466 HD2 PRO 50 1HD PRO 50 -9.547 4.900 28.221 467 HD3 PRO 50 2HD PRO 50 -9.369 4.197 29.841 468 H LEU 51 H LEU 51 -14.733 5.858 30.058 469 HA LEU 51 HA LEU 51 -14.810 7.777 27.883 470 HB2 LEU 51 1HB LEU 51 -16.478 5.264 27.972 471 HB3 LEU 51 2HB LEU 51 -16.866 6.640 26.959 472 HG LEU 51 HG LEU 51 -14.154 5.429 26.698 473 HD11 LEU 51 1HD1 LEU 51 -16.661 4.236 25.523 474 HD12 LEU 51 2HD1 LEU 51 -15.607 3.483 26.721 475 HD13 LEU 51 3HD1 LEU 51 -15.011 3.790 25.090 476 HD21 LEU 51 3HD2 LEU 51 -14.476 6.076 24.362 477 HD22 LEU 51 1HD2 LEU 51 -14.730 7.442 25.448 478 HD23 LEU 51 2HD2 LEU 51 -16.114 6.614 24.735 479 H THR 52 H THR 52 -15.173 9.286 29.505 480 HA THR 52 HA THR 52 -17.942 9.356 30.467 481 HB THR 52 HB THR 52 -17.062 10.387 32.632 482 HG1 THR 52 HG1 THR 52 -14.729 8.897 32.313 483 HG21 THR 52 3HG2 THR 52 -18.062 8.158 32.552 484 HG22 THR 52 1HG2 THR 52 -16.715 8.199 33.689 485 HG23 THR 52 2HG2 THR 52 -16.506 7.465 32.100 486 HA PRO 53 HA PRO 53 -17.551 13.481 28.805 487 HB2 PRO 53 1HB PRO 53 -19.960 14.451 29.596 488 HB3 PRO 53 2HB PRO 53 -19.790 13.293 28.264 489 HG2 PRO 53 1HG PRO 53 -20.617 12.815 31.080 490 HG3 PRO 53 2HG PRO 53 -21.252 12.113 29.580 491 HD2 PRO 53 1HD PRO 53 -19.507 10.812 31.226 492 HD3 PRO 53 2HD PRO 53 -19.622 10.516 29.480 493 H SER 54 H SER 54 -17.231 15.620 29.485 494 HA SER 54 HA SER 54 -16.514 17.286 30.848 495 HB2 SER 54 1HB SER 54 -18.426 16.019 32.828 496 HB3 SER 54 2HB SER 54 -17.703 17.619 32.995 497 HG SER 54 HG SER 54 -18.869 18.334 31.281 498 H GLY 55 H GLY 55 -15.235 14.533 30.933 499 HA2 GLY 55 1HA GLY 55 -13.063 14.166 31.865 500 HA3 GLY 55 2HA GLY 55 -13.553 15.084 33.282 501 H GLU 56 H GLU 56 -12.722 13.323 34.547 502 HA GLU 56 HA GLU 56 -14.415 10.917 34.530 503 HB2 GLU 56 1HB GLU 56 -11.609 11.401 35.510 504 HB3 GLU 56 2HB GLU 56 -12.531 9.988 36.004 505 HG2 GLU 56 1HG GLU 56 -12.752 9.311 33.669 506 HG3 GLU 56 2HG GLU 56 -11.829 10.731 33.172 507 H LYS 57 H LYS 57 -15.172 10.062 36.517 508 HA LYS 57 HA LYS 57 -15.920 12.106 38.417 509 HB2 LYS 57 1HB LYS 57 -16.698 9.218 38.076 510 HB3 LYS 57 2HB LYS 57 -17.240 10.181 39.443 511 HG2 LYS 57 1HG LYS 57 -18.319 11.750 37.909 512 HG3 LYS 57 2HG LYS 57 -17.783 10.775 36.539 513 HD2 LYS 57 1HD LYS 57 -19.078 8.878 37.382 514 HD3 LYS 57 2HD LYS 57 -19.610 9.849 38.757 515 HE2 LYS 57 1HE LYS 57 -20.704 11.410 37.220 516 HE3 LYS 57 2HE LYS 57 -20.173 10.435 35.852 517 HZ1 LYS 57 3HZ LYS 57 -21.486 8.593 36.701 518 HZ2 LYS 57 1HZ LYS 57 -22.463 9.952 36.447 519 HZ3 LYS 57 2HZ LYS 57 -21.994 9.528 38.016 520 H LEU 58 H LEU 58 -13.564 9.626 38.185 521 HA LEU 58 HA LEU 58 -13.210 8.970 40.897 522 HB2 LEU 58 1HB LEU 58 -11.307 8.901 38.566 523 HB3 LEU 58 2HB LEU 58 -10.896 8.286 40.155 524 HG LEU 58 HG LEU 58 -13.126 6.884 39.789 525 HD11 LEU 58 1HD1 LEU 58 -13.668 7.893 37.639 526 HD12 LEU 58 2HD1 LEU 58 -13.331 6.170 37.460 527 HD13 LEU 58 3HD1 LEU 58 -12.118 7.361 36.987 528 HD21 LEU 58 3HD2 LEU 58 -11.725 5.054 38.948 529 HD22 LEU 58 1HD2 LEU 58 -10.935 5.945 40.248 530 HD23 LEU 58 2HD2 LEU 58 -10.450 6.213 38.573 531 H TRP 59 H TRP 59 -12.632 11.890 39.350 532 HA TRP 59 HA TRP 59 -10.986 12.792 41.605 533 HB2 TRP 59 1HB TRP 59 -9.617 14.196 40.123 534 HB3 TRP 59 2HB TRP 59 -9.449 12.489 39.732 535 HD1 TRP 59 HD1 TRP 59 -10.257 11.691 37.344 536 HE1 TRP 59 HE1 TRP 59 -10.929 12.960 35.207 537 HE3 TRP 59 HE3 TRP 59 -10.822 16.378 39.318 538 HZ2 TRP 59 HZ2 TRP 59 -11.608 15.593 34.458 539 HZ3 TRP 59 HZ3 TRP 59 -11.484 18.215 37.821 540 HH2 TRP 59 HH2 TRP 59 -11.868 17.829 35.442 541 H SER 60 H SER 60 -13.603 13.298 39.489 542 HA SER 60 HA SER 60 -13.904 16.105 40.270 543 HB2 SER 60 1HB SER 60 -15.488 14.452 38.287 544 HB3 SER 60 2HB SER 60 -15.701 16.177 38.587 545 HG SER 60 HG SER 60 -13.192 15.135 37.839 546 H1 LYS 61 1H LYS 61 -2.546 10.759 -32.525 547 H2 LYS 61 2H LYS 61 -1.909 11.982 -31.544 548 H3 LYS 61 3H LYS 61 -2.953 10.826 -30.884 549 HA LYS 61 HA LYS 61 -1.355 9.086 -31.275 550 HB2 LYS 61 1HB LYS 61 0.241 11.367 -32.433 551 HB3 LYS 61 2HB LYS 61 0.997 9.871 -31.903 552 HG2 LYS 61 1HG LYS 61 -0.359 8.616 -33.500 553 HG3 LYS 61 2HG LYS 61 -1.121 10.117 -34.030 554 HD2 LYS 61 1HD LYS 61 1.055 10.965 -34.758 555 HD3 LYS 61 2HD LYS 61 1.819 9.466 -34.222 556 HE2 LYS 61 1HE LYS 61 0.465 8.209 -35.829 557 HE3 LYS 61 2HE LYS 61 -0.290 9.709 -36.365 558 HZ1 LYS 61 3HZ LYS 61 1.492 9.021 -37.849 559 HZ2 LYS 61 1HZ LYS 61 2.604 9.066 -36.573 560 HZ3 LYS 61 2HZ LYS 61 1.869 10.493 -37.106 561 H ILE 62 H ILE 62 -0.474 8.471 -29.405 562 HA ILE 62 HA ILE 62 0.669 10.500 -27.621 563 HB ILE 62 HB ILE 62 -0.435 9.240 -25.682 564 HG12 ILE 62 1HG1 ILE 62 -2.726 8.609 -27.438 565 HG13 ILE 62 2HG1 ILE 62 -1.337 7.544 -27.623 566 HG21 ILE 62 1HG2 ILE 62 -2.112 10.926 -27.535 567 HG22 ILE 62 2HG2 ILE 62 -1.013 11.512 -26.287 568 HG23 ILE 62 3HG2 ILE 62 -2.464 10.617 -25.835 569 HD11 ILE 62 3HD1 ILE 62 -2.931 6.654 -26.023 570 HD12 ILE 62 1HD1 ILE 62 -2.789 8.118 -25.050 571 HD13 ILE 62 2HD1 ILE 62 -1.401 7.044 -25.238 572 HA PRO 63 HA PRO 63 3.905 7.526 -27.084 573 HB2 PRO 63 1HB PRO 63 4.830 8.259 -24.617 574 HB3 PRO 63 2HB PRO 63 5.153 9.187 -26.094 575 HG2 PRO 63 1HG PRO 63 3.141 9.683 -23.958 576 HG3 PRO 63 2HG PRO 63 4.166 10.835 -24.836 577 HD2 PRO 63 1HD PRO 63 1.554 10.457 -25.439 578 HD3 PRO 63 2HD PRO 63 2.768 10.902 -26.655 579 H SER 64 H SER 64 4.231 5.523 -26.239 580 HA SER 64 HA SER 64 2.128 4.386 -24.628 581 HB2 SER 64 1HB SER 64 3.185 3.209 -26.579 582 HB3 SER 64 2HB SER 64 4.652 3.042 -25.614 583 HG SER 64 HG SER 64 2.280 1.661 -25.473 584 H ILE 65 H ILE 65 4.987 5.965 -23.919 585 HA ILE 65 HA ILE 65 5.732 4.413 -21.593 586 HB ILE 65 HB ILE 65 6.731 7.183 -22.248 587 HG12 ILE 65 1HG1 ILE 65 8.684 5.552 -23.205 588 HG13 ILE 65 2HG1 ILE 65 7.252 4.623 -23.632 589 HG21 ILE 65 1HG2 ILE 65 8.748 6.418 -21.075 590 HG22 ILE 65 2HG2 ILE 65 7.969 4.866 -20.766 591 HG23 ILE 65 3HG2 ILE 65 7.316 6.338 -20.047 592 HD11 ILE 65 3HD1 ILE 65 7.759 7.488 -24.396 593 HD12 ILE 65 1HD1 ILE 65 6.371 6.510 -24.869 594 HD13 ILE 65 2HD1 ILE 65 7.983 6.087 -25.444 595 H ALA 66 H ALA 66 3.875 7.299 -22.303 596 HA ALA 66 HA ALA 66 3.643 8.082 -19.527 597 HB1 ALA 66 3HB ALA 66 3.726 9.741 -21.369 598 HB2 ALA 66 1HB ALA 66 2.313 9.914 -20.326 599 HB3 ALA 66 2HB ALA 66 2.152 9.159 -21.912 600 H THR 67 H THR 67 1.849 6.193 -21.822 601 HA THR 67 HA THR 67 -0.707 6.292 -20.638 602 HB THR 67 HB THR 67 0.239 3.814 -22.023 603 HG1 THR 67 HG1 THR 67 -0.006 6.401 -23.147 604 HG21 THR 67 3HG2 THR 67 -1.995 3.987 -23.076 605 HG22 THR 67 1HG2 THR 67 -2.294 5.459 -22.150 606 HG23 THR 67 2HG2 THR 67 -2.084 3.920 -21.316 607 H GLY 68 H GLY 68 2.133 4.340 -19.947 608 HA2 GLY 68 1HA GLY 68 0.733 2.562 -18.142 609 HA3 GLY 68 2HA GLY 68 2.466 2.608 -18.430 610 H LEU 69 H LEU 69 2.941 5.303 -17.861 611 HA LEU 69 HA LEU 69 3.293 5.241 -15.077 612 HB2 LEU 69 1HB LEU 69 3.419 7.544 -17.025 613 HB3 LEU 69 2HB LEU 69 3.902 7.663 -15.343 614 HG LEU 69 HG LEU 69 5.179 5.625 -17.139 615 HD11 LEU 69 1HD1 LEU 69 5.788 8.560 -16.962 616 HD12 LEU 69 2HD1 LEU 69 5.543 7.570 -18.402 617 HD13 LEU 69 3HD1 LEU 69 7.003 7.373 -17.431 618 HD21 LEU 69 3HD2 LEU 69 5.590 5.424 -14.756 619 HD22 LEU 69 1HD2 LEU 69 6.093 7.113 -14.678 620 HD23 LEU 69 2HD2 LEU 69 7.058 5.947 -15.582 621 H VAL 70 H VAL 70 0.899 6.930 -17.086 622 HA VAL 70 HA VAL 70 -0.309 8.400 -15.032 623 HB VAL 70 HB VAL 70 -2.296 8.565 -16.521 624 HG11 VAL 70 1HG1 VAL 70 0.459 9.113 -17.584 625 HG12 VAL 70 2HG1 VAL 70 -0.679 10.231 -16.826 626 HG13 VAL 70 3HG1 VAL 70 -0.994 9.621 -18.451 627 HG21 VAL 70 3HG2 VAL 70 -2.221 6.355 -17.547 628 HG22 VAL 70 1HG2 VAL 70 -0.695 6.756 -18.336 629 HG23 VAL 70 2HG2 VAL 70 -2.170 7.613 -18.782 630 H GLY 71 H GLY 71 -0.933 5.148 -16.190 631 HA2 GLY 71 1HA GLY 71 -3.285 4.689 -14.659 632 HA3 GLY 71 2HA GLY 71 -2.280 3.452 -15.394 633 H ALA 72 H ALA 72 0.113 3.755 -14.121 634 HA ALA 72 HA ALA 72 -0.457 2.531 -11.601 635 HB1 ALA 72 3HB ALA 72 1.458 1.968 -13.167 636 HB2 ALA 72 1HB ALA 72 1.843 2.070 -11.449 637 HB3 ALA 72 2HB ALA 72 2.264 3.400 -12.528 638 H LEU 73 H LEU 73 0.889 5.673 -12.538 639 HA LEU 73 HA LEU 73 1.520 6.489 -9.901 640 HB2 LEU 73 1HB LEU 73 1.231 7.869 -12.531 641 HB3 LEU 73 2HB LEU 73 1.283 8.846 -11.075 642 HG LEU 73 HG LEU 73 3.471 7.759 -10.503 643 HD11 LEU 73 1HD1 LEU 73 3.220 5.722 -11.841 644 HD12 LEU 73 2HD1 LEU 73 4.694 6.594 -12.262 645 HD13 LEU 73 3HD1 LEU 73 3.285 6.685 -13.317 646 HD21 LEU 73 3HD2 LEU 73 3.368 9.964 -11.528 647 HD22 LEU 73 1HD2 LEU 73 3.340 9.230 -13.131 648 HD23 LEU 73 2HD2 LEU 73 4.768 9.063 -12.110 649 H LEU 74 H LEU 74 -1.368 6.896 -11.930 650 HA LEU 74 HA LEU 74 -2.745 8.534 -10.054 651 HB2 LEU 74 1HB LEU 74 -3.371 7.215 -12.601 652 HB3 LEU 74 2HB LEU 74 -4.739 7.371 -11.514 653 HG LEU 74 HG LEU 74 -4.075 9.863 -11.360 654 HD11 LEU 74 1HD1 LEU 74 -1.867 9.316 -12.596 655 HD12 LEU 74 2HD1 LEU 74 -2.737 10.796 -13.002 656 HD13 LEU 74 3HD1 LEU 74 -2.861 9.383 -14.051 657 HD21 LEU 74 3HD2 LEU 74 -6.093 9.048 -12.456 658 HD22 LEU 74 1HD2 LEU 74 -5.174 8.718 -13.925 659 HD23 LEU 74 2HD2 LEU 74 -5.376 10.378 -13.365 660 H LEU 75 H LEU 75 -2.647 5.066 -10.679 661 HA LEU 75 HA LEU 75 -4.717 4.393 -8.837 662 HB2 LEU 75 1HB LEU 75 -2.888 2.988 -10.582 663 HB3 LEU 75 2HB LEU 75 -2.994 2.191 -9.024 664 HG LEU 75 HG LEU 75 -5.635 2.621 -9.591 665 HD11 LEU 75 1HD1 LEU 75 -5.995 1.935 -11.902 666 HD12 LEU 75 2HD1 LEU 75 -4.255 1.969 -12.191 667 HD13 LEU 75 3HD1 LEU 75 -5.118 3.463 -11.821 668 HD21 LEU 75 3HD2 LEU 75 -5.715 0.242 -10.111 669 HD22 LEU 75 1HD2 LEU 75 -4.634 0.557 -8.754 670 HD23 LEU 75 2HD2 LEU 75 -3.969 0.225 -10.353 671 H LEU 76 H LEU 76 -1.200 4.608 -8.618 672 HA LEU 76 HA LEU 76 -0.991 3.644 -5.952 673 HB2 LEU 76 1HB LEU 76 0.817 3.978 -7.848 674 HB3 LEU 76 2HB LEU 76 0.998 5.554 -7.105 675 HG LEU 76 HG LEU 76 1.242 4.102 -4.898 676 HD11 LEU 76 1HD1 LEU 76 2.458 2.028 -5.334 677 HD12 LEU 76 2HD1 LEU 76 2.188 2.230 -7.066 678 HD13 LEU 76 3HD1 LEU 76 0.819 1.963 -5.984 679 HD21 LEU 76 3HD2 LEU 76 3.427 4.479 -6.942 680 HD22 LEU 76 1HD2 LEU 76 3.671 4.165 -5.224 681 HD23 LEU 76 2HD2 LEU 76 2.901 5.662 -5.745 682 H LEU 77 H LEU 77 -1.535 6.791 -7.391 683 HA LEU 77 HA LEU 77 -1.080 8.340 -5.055 684 HB2 LEU 77 1HB LEU 77 -1.225 9.049 -7.558 685 HB3 LEU 77 2HB LEU 77 -2.945 9.177 -7.247 686 HG LEU 77 HG LEU 77 -2.112 10.677 -5.222 687 HD11 LEU 77 1HD1 LEU 77 -0.168 12.014 -5.857 688 HD12 LEU 77 2HD1 LEU 77 0.090 10.974 -7.259 689 HD13 LEU 77 3HD1 LEU 77 0.261 10.319 -5.631 690 HD21 LEU 77 3HD2 LEU 77 -2.261 11.607 -8.087 691 HD22 LEU 77 1HD2 LEU 77 -2.402 12.639 -6.665 692 HD23 LEU 77 2HD2 LEU 77 -3.620 11.404 -6.982 693 H VAL 78 H VAL 78 -3.999 6.937 -6.522 694 HA VAL 78 HA VAL 78 -5.822 8.036 -4.634 695 HB VAL 78 HB VAL 78 -6.171 5.584 -6.374 696 HG11 VAL 78 1HG1 VAL 78 -8.577 5.978 -6.094 697 HG12 VAL 78 2HG1 VAL 78 -8.227 7.296 -4.976 698 HG13 VAL 78 3HG1 VAL 78 -7.789 5.641 -4.553 699 HG21 VAL 78 3HG2 VAL 78 -6.944 8.458 -6.872 700 HG22 VAL 78 1HG2 VAL 78 -7.361 7.090 -7.904 701 HG23 VAL 78 2HG2 VAL 78 -5.673 7.561 -7.704 702 H VAL 79 H VAL 79 -4.172 4.893 -4.862 703 HA VAL 79 HA VAL 79 -5.408 3.728 -2.594 704 HB VAL 79 HB VAL 79 -2.749 3.067 -3.883 705 HG11 VAL 79 1HG1 VAL 79 -2.677 2.133 -1.707 706 HG12 VAL 79 2HG1 VAL 79 -3.124 0.818 -2.795 707 HG13 VAL 79 3HG1 VAL 79 -4.356 1.599 -1.803 708 HG21 VAL 79 3HG2 VAL 79 -3.985 1.242 -4.958 709 HG22 VAL 79 1HG2 VAL 79 -4.633 2.820 -5.405 710 HG23 VAL 79 2HG2 VAL 79 -5.477 1.824 -4.220 711 H ALA 80 H ALA 80 -2.358 5.500 -3.014 712 HA ALA 80 HA ALA 80 -1.465 5.230 -0.335 713 HB1 ALA 80 3HB ALA 80 0.044 5.791 -2.181 714 HB2 ALA 80 1HB ALA 80 0.137 6.979 -0.882 715 HB3 ALA 80 2HB ALA 80 -0.756 7.354 -2.356 716 H LEU 81 H LEU 81 -3.423 7.648 -2.004 717 HA LEU 81 HA LEU 81 -3.523 9.515 0.141 718 HB2 LEU 81 1HB LEU 81 -4.109 9.788 -2.395 719 HB3 LEU 81 2HB LEU 81 -5.703 9.256 -1.899 720 HG LEU 81 HG LEU 81 -5.410 11.202 -0.115 721 HD11 LEU 81 1HD1 LEU 81 -4.242 13.115 -1.090 722 HD12 LEU 81 2HD1 LEU 81 -3.687 12.100 -2.422 723 HD13 LEU 81 3HD1 LEU 81 -3.138 11.776 -0.777 724 HD21 LEU 81 3HD2 LEU 81 -6.589 12.688 -1.671 725 HD22 LEU 81 1HD2 LEU 81 -7.214 11.039 -1.734 726 HD23 LEU 81 2HD2 LEU 81 -6.147 11.625 -3.009 727 H GLY 82 H GLY 82 -5.501 6.759 -0.816 728 HA2 GLY 82 1HA GLY 82 -7.642 7.201 0.992 729 HA3 GLY 82 2HA GLY 82 -7.241 5.673 0.222 730 H ILE 83 H ILE 83 -4.861 4.963 1.185 731 HA ILE 83 HA ILE 83 -5.422 4.080 3.813 732 HB ILE 83 HB ILE 83 -2.682 4.139 2.531 733 HG12 ILE 83 1HG1 ILE 83 -4.498 1.758 2.388 734 HG13 ILE 83 2HG1 ILE 83 -4.701 3.059 1.220 735 HG21 ILE 83 1HG2 ILE 83 -2.675 3.591 4.902 736 HG22 ILE 83 2HG2 ILE 83 -2.277 2.166 3.941 737 HG23 ILE 83 3HG2 ILE 83 -3.889 2.338 4.635 738 HD11 ILE 83 3HD1 ILE 83 -2.170 1.499 1.687 739 HD12 ILE 83 1HD1 ILE 83 -2.394 2.783 0.498 740 HD13 ILE 83 2HD1 ILE 83 -3.297 1.275 0.349 741 H GLY 84 H GLY 84 -3.474 6.738 2.543 742 HA2 GLY 84 1HA GLY 84 -2.211 7.485 4.957 743 HA3 GLY 84 2HA GLY 84 -2.460 8.528 3.565 744 H LEU 85 H LEU 85 -5.231 8.602 3.450 745 HA LEU 85 HA LEU 85 -5.811 10.495 5.512 746 HB2 LEU 85 1HB LEU 85 -7.455 9.308 3.287 747 HB3 LEU 85 2HB LEU 85 -8.123 10.451 4.435 748 HG LEU 85 HG LEU 85 -5.662 11.173 2.886 749 HD11 LEU 85 1HD1 LEU 85 -7.114 12.167 1.159 750 HD12 LEU 85 2HD1 LEU 85 -8.502 11.365 1.895 751 HD13 LEU 85 3HD1 LEU 85 -7.200 10.406 1.191 752 HD21 LEU 85 3HD2 LEU 85 -6.352 12.629 4.711 753 HD22 LEU 85 1HD2 LEU 85 -7.967 12.763 4.015 754 HD23 LEU 85 2HD2 LEU 85 -6.579 13.434 3.159 755 H PHE 86 H PHE 86 -6.452 7.108 5.038 756 HA PHE 86 HA PHE 86 -8.553 6.917 6.982 757 HB2 PHE 86 1HB PHE 86 -7.099 5.086 5.204 758 HB3 PHE 86 2HB PHE 86 -7.575 4.369 6.740 759 HD1 PHE 86 HD2 PHE 86 -8.758 5.812 3.598 760 HD2 PHE 86 HD1 PHE 86 -9.902 4.050 7.299 761 HE1 PHE 86 HE2 PHE 86 -11.036 5.476 2.729 762 HE2 PHE 86 HE1 PHE 86 -12.181 3.710 6.437 763 HZ PHE 86 HZ PHE 86 -12.750 4.424 4.150 764 H ILE 87 H ILE 87 -5.055 6.452 7.007 765 HA ILE 87 HA ILE 87 -5.041 5.469 9.731 766 HB ILE 87 HB ILE 87 -2.704 6.287 7.993 767 HG12 ILE 87 1HG1 ILE 87 -3.890 4.440 6.951 768 HG13 ILE 87 2HG1 ILE 87 -2.381 3.852 7.631 769 HG21 ILE 87 1HG2 ILE 87 -1.347 4.951 9.547 770 HG22 ILE 87 2HG2 ILE 87 -2.772 4.694 10.553 771 HG23 ILE 87 3HG2 ILE 87 -2.122 6.320 10.344 772 HD11 ILE 87 3HD1 ILE 87 -3.724 3.066 9.617 773 HD12 ILE 87 1HD1 ILE 87 -4.020 2.223 8.095 774 HD13 ILE 87 2HD1 ILE 87 -5.168 3.430 8.671 775 H ARG 88 H ARG 88 -4.478 8.511 8.059 776 HA ARG 88 HA ARG 88 -3.268 9.896 10.218 777 HB2 ARG 88 1HB ARG 88 -4.586 10.712 7.662 778 HB3 ARG 88 2HB ARG 88 -4.235 11.938 8.874 779 HG2 ARG 88 1HG ARG 88 -1.875 11.318 8.824 780 HG3 ARG 88 2HG ARG 88 -2.226 10.082 7.613 781 HD2 ARG 88 1HD ARG 88 -2.882 12.987 7.197 782 HD3 ARG 88 2HD ARG 88 -1.315 12.301 6.764 783 HE ARG 88 HE ARG 88 -3.323 10.731 5.605 784 HH11 ARG 88 1HH1 ARG 88 -1.976 13.942 5.309 785 HH12 ARG 88 2HH1 ARG 88 -2.372 14.088 3.630 786 HH21 ARG 88 1HH2 ARG 88 -3.841 10.923 3.399 787 HH22 ARG 88 2HH2 ARG 88 -3.431 12.374 2.547 788 H ARG 89 H ARG 89 -6.562 9.132 9.456 789 HA ARG 89 HA ARG 89 -7.707 11.115 11.215 790 HB2 ARG 89 1HB ARG 89 -8.850 8.826 9.631 791 HB3 ARG 89 2HB ARG 89 -9.831 9.739 10.766 792 HG2 ARG 89 1HG ARG 89 -9.338 11.796 9.519 793 HG3 ARG 89 2HG ARG 89 -8.395 10.851 8.364 794 HD2 ARG 89 1HD ARG 89 -11.285 10.268 8.959 795 HD3 ARG 89 2HD ARG 89 -10.789 11.410 7.711 796 HE ARG 89 HE ARG 89 -9.434 8.998 7.291 797 HH11 ARG 89 1HH1 ARG 89 -12.690 10.260 7.142 798 HH12 ARG 89 2HH1 ARG 89 -13.198 9.146 5.918 799 HH21 ARG 89 1HH2 ARG 89 -10.104 7.535 5.683 800 HH22 ARG 89 2HH2 ARG 89 -11.731 7.600 5.090 801 H ARG 90 H ARG 90 -6.862 7.716 11.354 802 HA ARG 90 HA ARG 90 -8.117 7.328 13.940 803 HB2 ARG 90 1HB ARG 90 -6.521 5.541 12.115 804 HB3 ARG 90 2HB ARG 90 -6.979 5.042 13.737 805 HG2 ARG 90 1HG ARG 90 -9.339 5.329 13.159 806 HG3 ARG 90 2HG ARG 90 -8.874 5.821 11.529 807 HD2 ARG 90 1HD ARG 90 -9.446 3.548 11.349 808 HD3 ARG 90 2HD ARG 90 -7.683 3.583 11.358 809 HE ARG 90 HE ARG 90 -8.569 3.240 13.988 810 HH11 ARG 90 1HH1 ARG 90 -8.525 1.481 10.968 811 HH12 ARG 90 2HH1 ARG 90 -8.499 -0.073 11.732 812 HH21 ARG 90 1HH2 ARG 90 -8.535 1.197 14.988 813 HH22 ARG 90 2HH2 ARG 90 -8.505 -0.234 14.012 814 H HIS 91 H HIS 91 -5.043 8.246 12.703 815 HA HIS 91 HA HIS 91 -3.416 7.391 14.871 816 HB2 HIS 91 1HB HIS 91 -2.781 8.163 12.444 817 HB3 HIS 91 2HB HIS 91 -2.702 9.757 13.184 818 HD1 HIS 91 HD1 HIS 91 -0.826 6.623 12.804 819 HD2 HIS 91 HD2 HIS 91 -0.689 9.988 15.238 820 HE1 HIS 91 HE1 HIS 91 1.442 6.575 13.888 821 HE2 HIS 91 HE2 HIS 91 1.535 8.668 15.288 822 H ILE 92 H ILE 92 -5.659 9.941 14.565 823 HA ILE 92 HA ILE 92 -4.405 11.711 16.476 824 HB ILE 92 HB ILE 92 -7.292 11.900 15.649 825 HG12 ILE 92 1HG1 ILE 92 -5.217 13.340 14.063 826 HG13 ILE 92 2HG1 ILE 92 -5.458 11.630 13.720 827 HG21 ILE 92 1HG2 ILE 92 -5.209 13.966 16.364 828 HG22 ILE 92 2HG2 ILE 92 -6.527 13.409 17.395 829 HG23 ILE 92 3HG2 ILE 92 -6.882 14.309 15.920 830 HD11 ILE 92 3HD1 ILE 92 -7.550 13.789 13.590 831 HD12 ILE 92 1HD1 ILE 92 -7.838 12.073 13.307 832 HD13 ILE 92 2HD1 ILE 92 -6.782 12.979 12.226 833 H VAL 93 H VAL 93 -6.205 8.877 16.678 834 HA VAL 93 HA VAL 93 -7.457 9.527 19.235 835 HB VAL 93 HB VAL 93 -7.504 6.810 17.931 836 HG11 VAL 93 1HG1 VAL 93 -8.341 6.947 20.211 837 HG12 VAL 93 2HG1 VAL 93 -9.662 6.626 19.087 838 HG13 VAL 93 3HG1 VAL 93 -9.439 8.248 19.748 839 HG21 VAL 93 3HG2 VAL 93 -9.581 7.459 16.789 840 HG22 VAL 93 1HG2 VAL 93 -8.195 8.385 16.210 841 HG23 VAL 93 2HG2 VAL 93 -9.347 9.123 17.324 842 H ARG 94 H ARG 94 -5.026 7.301 17.910 843 HA ARG 94 HA ARG 94 -4.016 6.890 20.650 844 HB2 ARG 94 1HB ARG 94 -4.144 4.965 18.334 845 HB3 ARG 94 2HB ARG 94 -3.103 4.698 19.723 846 HG2 ARG 94 1HG ARG 94 -5.123 4.799 21.174 847 HG3 ARG 94 2HG ARG 94 -6.107 4.878 19.711 848 HD2 ARG 94 1HD ARG 94 -5.183 2.729 18.982 849 HD3 ARG 94 2HD ARG 94 -4.210 2.651 20.451 850 HE ARG 94 HE ARG 94 -6.893 2.966 21.184 851 HH11 ARG 94 1HH1 ARG 94 -4.826 0.574 19.693 852 HH12 ARG 94 2HH1 ARG 94 -5.770 -0.768 20.247 853 HH21 ARG 94 1HH2 ARG 94 -8.131 1.202 21.911 854 HH22 ARG 94 2HH2 ARG 94 -7.646 -0.410 21.506 855 H LYS 95 H LYS 95 -1.983 7.492 21.025 856 HA LYS 95 HA LYS 95 -0.151 7.810 18.745 857 HB2 LYS 95 1HB LYS 95 -0.744 9.813 20.917 858 HB3 LYS 95 2HB LYS 95 0.747 9.865 19.986 859 HG2 LYS 95 1HG LYS 95 -0.551 10.107 17.927 860 HG3 LYS 95 2HG LYS 95 -2.043 10.067 18.867 861 HD2 LYS 95 1HD LYS 95 -1.337 12.085 20.065 862 HD3 LYS 95 2HD LYS 95 0.151 12.123 19.119 863 HE2 LYS 95 1HE LYS 95 -2.580 12.199 17.863 864 HE3 LYS 95 2HE LYS 95 -1.718 13.657 18.353 865 HZ1 LYS 95 3HZ LYS 95 -1.359 13.181 16.021 866 HZ2 LYS 95 1HZ LYS 95 -0.754 11.643 16.392 867 HZ3 LYS 95 2HZ LYS 95 0.095 13.026 16.873 868 H ARG 96 H ARG 96 -0.459 7.560 22.272 869 HA ARG 96 HA ARG 96 2.074 6.090 22.314 870 HB2 ARG 96 1HB ARG 96 1.244 8.351 24.123 871 HB3 ARG 96 2HB ARG 96 2.469 7.185 24.600 872 HG2 ARG 96 1HG ARG 96 3.824 7.809 22.669 873 HG3 ARG 96 2HG ARG 96 2.592 8.972 22.179 874 HD2 ARG 96 1HD ARG 96 2.908 10.186 24.283 875 HD3 ARG 96 2HD ARG 96 4.147 9.027 24.763 876 HE ARG 96 HE ARG 96 4.851 10.112 22.278 877 HH11 ARG 96 1HH1 ARG 96 4.556 11.103 25.618 878 HH12 ARG 96 2HH1 ARG 96 5.771 12.331 25.488 879 HH21 ARG 96 1HH2 ARG 96 6.447 11.726 22.113 880 HH22 ARG 96 2HH2 ARG 96 6.842 12.685 23.501 881 H THR 97 H THR 97 -0.803 5.305 22.369 882 HA THR 97 HA THR 97 -1.270 4.314 25.047 883 HB THR 97 HB THR 97 -3.243 3.150 23.936 884 HG1 THR 97 HG1 THR 97 -3.382 4.720 21.796 885 HG21 THR 97 3HG2 THR 97 -3.481 5.266 25.137 886 HG22 THR 97 1HG2 THR 97 -4.533 5.226 23.721 887 HG23 THR 97 2HG2 THR 97 -3.033 6.152 23.681 888 H LEU 98 H LEU 98 -0.215 3.021 21.950 889 HA LEU 98 HA LEU 98 -0.127 0.310 22.983 890 HB2 LEU 98 1HB LEU 98 -0.119 1.539 20.328 891 HB3 LEU 98 2HB LEU 98 1.026 0.222 20.486 892 HG LEU 98 HG LEU 98 -0.985 -0.696 19.606 893 HD11 LEU 98 1HD1 LEU 98 -1.183 -2.487 20.970 894 HD12 LEU 98 2HD1 LEU 98 -1.440 -1.506 22.411 895 HD13 LEU 98 3HD1 LEU 98 0.188 -1.731 21.777 896 HD21 LEU 98 3HD2 LEU 98 -2.509 0.456 21.934 897 HD22 LEU 98 1HD2 LEU 98 -3.159 -0.394 20.533 898 HD23 LEU 98 2HD2 LEU 98 -2.438 1.201 20.336 899 H ARG 99 H ARG 99 2.013 2.860 21.951 900 HA ARG 99 HA ARG 99 4.467 1.537 22.124 901 HB2 ARG 99 1HB ARG 99 3.714 4.451 22.346 902 HB3 ARG 99 2HB ARG 99 5.381 3.901 22.438 903 HG2 ARG 99 1HG ARG 99 5.196 2.947 20.199 904 HG3 ARG 99 2HG ARG 99 3.519 3.493 20.105 905 HD2 ARG 99 1HD ARG 99 4.267 5.814 20.335 906 HD3 ARG 99 2HD ARG 99 5.940 5.265 20.431 907 HE ARG 99 HE ARG 99 4.829 4.274 18.065 908 HH11 ARG 99 1HH1 ARG 99 5.724 7.347 19.468 909 HH12 ARG 99 2HH1 ARG 99 6.047 8.091 17.938 910 HH21 ARG 99 1HH2 ARG 99 5.255 5.254 16.056 911 HH22 ARG 99 2HH2 ARG 99 5.780 6.902 16.002 912 H ARG 100 H ARG 100 2.337 3.003 24.448 913 HA ARG 100 HA ARG 100 4.169 3.075 26.639 914 HB2 ARG 100 1HB ARG 100 1.267 3.392 26.251 915 HB3 ARG 100 2HB ARG 100 1.696 2.663 27.792 916 HG2 ARG 100 1HG ARG 100 3.151 4.562 28.288 917 HG3 ARG 100 2HG ARG 100 2.716 5.295 26.742 918 HD2 ARG 100 1HD ARG 100 0.381 5.403 27.444 919 HD3 ARG 100 2HD ARG 100 0.800 4.646 28.980 920 HE ARG 100 HE ARG 100 2.374 6.936 28.676 921 HH11 ARG 100 1HH1 ARG 100 -0.986 6.093 29.143 922 HH12 ARG 100 2HH1 ARG 100 -1.369 7.567 29.968 923 HH21 ARG 100 1HH2 ARG 100 1.867 8.870 29.759 924 HH22 ARG 100 2HH2 ARG 100 0.250 9.143 30.316 925 H LEU 101 H LEU 101 2.426 0.731 24.946 926 HA LEU 101 HA LEU 101 3.094 -1.388 26.849 927 HB2 LEU 101 1HB LEU 101 1.061 -1.423 24.611 928 HB3 LEU 101 2HB LEU 101 1.370 -2.728 25.738 929 HG LEU 101 HG LEU 101 0.562 -0.101 26.881 930 HD11 LEU 101 1HD1 LEU 101 -1.813 -0.647 26.554 931 HD12 LEU 101 2HD1 LEU 101 -1.348 -1.976 25.494 932 HD13 LEU 101 3HD1 LEU 101 -0.984 -0.314 25.033 933 HD21 LEU 101 3HD2 LEU 101 -0.369 -2.872 27.575 934 HD22 LEU 101 1HD2 LEU 101 -0.388 -1.424 28.579 935 HD23 LEU 101 2HD2 LEU 101 1.144 -2.205 28.185 936 H LEU 102 H LEU 102 3.552 -0.114 23.604 937 HA LEU 102 HA LEU 102 4.728 -2.578 22.612 938 HB2 LEU 102 1HB LEU 102 3.522 -0.453 21.390 939 HB3 LEU 102 2HB LEU 102 5.216 -0.111 21.096 940 HG LEU 102 HG LEU 102 4.159 -2.834 20.464 941 HD11 LEU 102 1HD1 LEU 102 3.558 -2.082 18.219 942 HD12 LEU 102 2HD1 LEU 102 3.862 -0.412 18.697 943 HD13 LEU 102 3HD1 LEU 102 2.549 -1.317 19.449 944 HD21 LEU 102 3HD2 LEU 102 6.273 -1.073 19.226 945 HD22 LEU 102 1HD2 LEU 102 5.882 -2.721 18.732 946 HD23 LEU 102 2HD2 LEU 102 6.560 -2.417 20.331 947 H GLN 103 H GLN 103 5.919 0.699 23.334 948 HA GLN 103 HA GLN 103 8.667 -0.050 22.964 949 HB2 GLN 103 1HB GLN 103 7.313 2.436 23.996 950 HB3 GLN 103 2HB GLN 103 9.062 2.260 24.000 951 HG2 GLN 103 1HG GLN 103 9.039 1.958 21.577 952 HG3 GLN 103 2HG GLN 103 7.285 2.136 21.574 953 HE21 GLN 103 2HE2 GLN 103 10.334 3.755 21.953 954 HE22 GLN 103 1HE2 GLN 103 9.726 5.367 21.836 955 H GLU 104 H GLU 104 6.457 -0.498 25.447 956 HA GLU 104 HA GLU 104 8.326 -0.263 27.647 957 HB2 GLU 104 1HB GLU 104 5.682 0.017 27.586 958 HB3 GLU 104 2HB GLU 104 5.735 -1.702 27.947 959 HG2 GLU 104 1HG GLU 104 7.096 -1.246 29.925 960 HG3 GLU 104 2HG GLU 104 7.039 0.478 29.563 961 H ARG 105 H ARG 105 6.710 -2.899 25.900 962 HA ARG 105 HA ARG 105 8.200 -4.910 27.376 963 HB2 ARG 105 1HB ARG 105 6.032 -5.032 25.292 964 HB3 ARG 105 2HB ARG 105 6.914 -6.471 25.782 965 HG2 ARG 105 1HG ARG 105 5.676 -4.773 27.889 966 HG3 ARG 105 2HG ARG 105 4.638 -5.815 26.912 967 HD2 ARG 105 1HD ARG 105 6.006 -7.749 27.532 968 HD3 ARG 105 2HD ARG 105 7.040 -6.708 28.508 969 HE ARG 105 HE ARG 105 4.404 -6.388 29.381 970 HH11 ARG 105 1HH1 ARG 105 6.885 -8.851 29.336 971 HH12 ARG 105 2HH1 ARG 105 6.308 -9.632 30.770 972 HH21 ARG 105 1HH2 ARG 105 3.649 -7.418 31.264 973 HH22 ARG 105 2HH2 ARG 105 4.472 -8.819 31.864 974 H GLU 106 H GLU 106 8.649 -3.037 24.614 975 HA GLU 106 HA GLU 106 9.926 -4.824 22.857 976 HB2 GLU 106 1HB GLU 106 9.149 -2.300 22.603 977 HB3 GLU 106 2HB GLU 106 10.829 -1.985 23.014 978 HG2 GLU 106 1HG GLU 106 11.550 -3.367 21.132 979 HG3 GLU 106 2HG GLU 106 9.864 -3.678 20.719 980 H LEU 107 H LEU 107 11.056 -3.155 25.709 981 HA LEU 107 HA LEU 107 13.772 -4.143 25.221 982 HB2 LEU 107 1HB LEU 107 12.688 -1.860 26.818 983 HB3 LEU 107 2HB LEU 107 14.217 -2.570 27.286 984 HG LEU 107 HG LEU 107 14.587 -0.595 25.932 985 HD11 LEU 107 1HD1 LEU 107 16.009 -2.737 25.698 986 HD12 LEU 107 2HD1 LEU 107 16.218 -1.432 24.530 987 HD13 LEU 107 3HD1 LEU 107 15.269 -2.855 24.101 988 HD21 LEU 107 3HD2 LEU 107 13.878 -0.452 23.611 989 HD22 LEU 107 1HD2 LEU 107 12.485 -0.606 24.683 990 HD23 LEU 107 2HD2 LEU 107 13.043 -2.000 23.758 991 H VAL 108 H VAL 108 11.171 -5.308 26.490 992 HA VAL 108 HA VAL 108 12.573 -6.622 28.724 993 HB VAL 108 HB VAL 108 9.592 -6.175 28.778 994 HG11 VAL 108 1HG1 VAL 108 10.475 -7.893 30.259 995 HG12 VAL 108 2HG1 VAL 108 9.889 -6.515 31.191 996 HG13 VAL 108 3HG1 VAL 108 11.620 -6.737 30.941 997 HG21 VAL 108 3HG2 VAL 108 10.750 -3.977 28.623 998 HG22 VAL 108 1HG2 VAL 108 11.629 -4.385 30.096 999 HG23 VAL 108 2HG2 VAL 108 9.874 -4.217 30.137 1000 H GLU 109 H GLU 109 12.838 -7.784 26.386 1001 HA GLU 109 HA GLU 109 10.779 -9.884 26.239 1002 HB2 GLU 109 1HB GLU 109 12.662 -8.781 24.162 1003 HB3 GLU 109 2HB GLU 109 11.843 -10.321 23.947 1004 HG2 GLU 109 1HG GLU 109 9.682 -9.201 24.134 1005 HG3 GLU 109 2HG GLU 109 10.503 -7.655 24.352 1006 HA PRO 110 HA PRO 110 13.872 -12.673 27.821 1007 HB2 PRO 110 1HB PRO 110 12.625 -15.026 27.267 1008 HB3 PRO 110 2HB PRO 110 12.103 -13.952 28.579 1009 HG2 PRO 110 1HG PRO 110 10.949 -14.297 25.859 1010 HG3 PRO 110 2HG PRO 110 10.129 -14.086 27.418 1011 HD2 PRO 110 1HD PRO 110 10.463 -12.065 25.624 1012 HD3 PRO 110 2HD PRO 110 10.342 -11.809 27.376 1013 H LEU 111 H LEU 111 15.703 -13.446 26.972 1014 HA LEU 111 HA LEU 111 15.699 -14.729 24.370 1015 HB2 LEU 111 1HB LEU 111 17.380 -12.319 25.057 1016 HB3 LEU 111 2HB LEU 111 17.728 -13.380 23.707 1017 HG LEU 111 HG LEU 111 15.014 -12.155 23.862 1018 HD11 LEU 111 1HD1 LEU 111 17.485 -10.686 22.957 1019 HD12 LEU 111 2HD1 LEU 111 16.476 -10.277 24.345 1020 HD13 LEU 111 3HD1 LEU 111 15.824 -10.149 22.711 1021 HD21 LEU 111 3HD2 LEU 111 15.256 -12.169 21.429 1022 HD22 LEU 111 1HD2 LEU 111 15.539 -13.771 22.110 1023 HD23 LEU 111 2HD2 LEU 111 16.902 -12.778 21.593 1024 H THR 112 H THR 112 16.109 -16.608 25.527 1025 HA THR 112 HA THR 112 18.907 -16.914 26.346 1026 HB THR 112 HB THR 112 18.097 -18.479 28.193 1027 HG1 THR 112 HG1 THR 112 15.761 -16.968 28.353 1028 HG21 THR 112 3HG2 THR 112 19.104 -16.302 28.665 1029 HG22 THR 112 1HG2 THR 112 17.795 -16.645 29.797 1030 HG23 THR 112 2HG2 THR 112 17.536 -15.523 28.461 1031 HA PRO 113 HA PRO 113 18.444 -20.464 23.677 1032 HB2 PRO 113 1HB PRO 113 20.873 -21.597 24.106 1033 HB3 PRO 113 2HB PRO 113 20.665 -20.130 23.130 1034 HG2 PRO 113 1HG PRO 113 21.589 -20.402 25.944 1035 HG3 PRO 113 2HG PRO 113 22.175 -19.328 24.658 1036 HD2 PRO 113 1HD PRO 113 20.491 -18.513 26.644 1037 HD3 PRO 113 2HD PRO 113 20.549 -17.770 25.034 1038 H SER 114 H SER 114 18.137 -22.707 23.785 1039 HA SER 114 HA SER 114 17.459 -24.675 24.687 1040 HB2 SER 114 1HB SER 114 19.441 -23.961 26.864 1041 HB3 SER 114 2HB SER 114 18.717 -25.552 26.631 1042 HG SER 114 HG SER 114 19.823 -25.790 24.753 1043 H GLY 115 H GLY 115 16.196 -22.046 25.532 1044 HA2 GLY 115 1HA GLY 115 14.057 -21.945 26.599 1045 HA3 GLY 115 2HA GLY 115 14.589 -23.198 27.710 1046 H GLU 116 H GLU 116 13.810 -21.833 29.418 1047 HA GLU 116 HA GLU 116 15.512 -19.499 29.973 1048 HB2 GLU 116 1HB GLU 116 12.738 -20.234 30.886 1049 HB3 GLU 116 2HB GLU 116 13.683 -18.997 31.702 1050 HG2 GLU 116 1HG GLU 116 13.828 -17.732 29.618 1051 HG3 GLU 116 2HG GLU 116 12.883 -18.976 28.799 1052 H LYS 117 H LYS 117 16.339 -19.189 32.089 1053 HA LYS 117 HA LYS 117 17.141 -21.655 33.362 1054 HB2 LYS 117 1HB LYS 117 17.919 -18.775 33.762 1055 HB3 LYS 117 2HB LYS 117 18.502 -20.059 34.811 1056 HG2 LYS 117 1HG LYS 117 19.524 -21.169 32.885 1057 HG3 LYS 117 2HG LYS 117 18.946 -19.873 31.837 1058 HD2 LYS 117 1HD LYS 117 20.276 -18.256 33.104 1059 HD3 LYS 117 2HD LYS 117 20.850 -19.550 34.157 1060 HE2 LYS 117 1HE LYS 117 21.886 -20.651 32.230 1061 HE3 LYS 117 2HE LYS 117 21.314 -19.354 31.182 1062 HZ1 LYS 117 3HZ LYS 117 22.662 -17.793 32.439 1063 HZ2 LYS 117 1HZ LYS 117 23.623 -19.033 31.806 1064 HZ3 LYS 117 2HZ LYS 117 23.211 -19.037 33.447 1065 H LEU 118 H LEU 118 14.790 -19.213 33.866 1066 HA LEU 118 HA LEU 118 14.529 -19.289 36.665 1067 HB2 LEU 118 1HB LEU 118 12.551 -18.622 34.498 1068 HB3 LEU 118 2HB LEU 118 12.195 -18.445 36.205 1069 HG LEU 118 HG LEU 118 14.419 -16.986 36.145 1070 HD11 LEU 118 1HD1 LEU 118 14.884 -17.395 33.789 1071 HD12 LEU 118 2HD1 LEU 118 14.547 -15.689 34.078 1072 HD13 LEU 118 3HD1 LEU 118 13.315 -16.719 33.351 1073 HD21 LEU 118 3HD2 LEU 118 12.998 -15.007 35.859 1074 HD22 LEU 118 1HD2 LEU 118 12.246 -16.210 36.906 1075 HD23 LEU 118 2HD2 LEU 118 11.706 -16.034 35.236 1076 H TRP 119 H TRP 119 13.888 -21.705 34.428 1077 HA TRP 119 HA TRP 119 12.314 -23.173 36.423 1078 HB2 TRP 119 1HB TRP 119 10.890 -24.147 34.672 1079 HB3 TRP 119 2HB TRP 119 10.716 -22.398 34.748 1080 HD1 TRP 119 HD1 TRP 119 11.447 -21.000 32.626 1081 HE1 TRP 119 HE1 TRP 119 12.041 -21.663 30.211 1082 HE3 TRP 119 HE3 TRP 119 12.057 -26.037 33.286 1083 HZ2 TRP 119 HZ2 TRP 119 12.684 -24.007 28.776 1084 HZ3 TRP 119 HZ3 TRP 119 12.660 -27.416 31.340 1085 HH2 TRP 119 HH2 TRP 119 12.967 -26.420 29.132 1086 H SER 120 H SER 120 14.855 -23.097 34.163 1087 HA SER 120 HA SER 120 15.169 -26.009 34.173 1088 HB2 SER 120 1HB SER 120 16.695 -23.889 32.637 1089 HB3 SER 120 2HB SER 120 16.911 -25.630 32.468 1090 HG SER 120 HG SER 120 14.382 -24.441 32.106 Start of MODEL 3 1 H1 LYS 1 1H LYS 1 2.674 -2.346 -34.090 2 H2 LYS 1 2H LYS 1 1.879 -3.742 -33.562 3 H3 LYS 1 3H LYS 1 2.967 -2.951 -32.537 4 HA LYS 1 HA LYS 1 1.544 -1.028 -32.423 5 HB2 LYS 1 1HB LYS 1 -0.154 -2.677 -34.292 6 HB3 LYS 1 2HB LYS 1 -0.815 -1.344 -33.355 7 HG2 LYS 1 1HG LYS 1 0.748 0.193 -34.433 8 HG3 LYS 1 2HG LYS 1 1.412 -1.144 -35.373 9 HD2 LYS 1 1HD LYS 1 -0.779 -1.505 -36.406 10 HD3 LYS 1 2HD LYS 1 -1.442 -0.169 -35.464 11 HE2 LYS 1 1HE LYS 1 0.115 1.371 -36.556 12 HE3 LYS 1 2HE LYS 1 0.780 0.034 -37.495 13 HZ1 LYS 1 3HZ LYS 1 -0.828 1.299 -38.776 14 HZ2 LYS 1 1HZ LYS 1 -2.025 1.006 -37.617 15 HZ3 LYS 1 2HZ LYS 1 -1.389 -0.276 -38.518 16 H ILE 2 H ILE 2 0.364 -0.884 -30.585 17 HA ILE 2 HA ILE 2 -0.875 -3.316 -29.518 18 HB ILE 2 HB ILE 2 0.022 -2.584 -27.212 19 HG12 ILE 2 1HG1 ILE 2 2.506 -1.676 -27.756 20 HG13 ILE 2 2HG1 ILE 2 1.617 -0.878 -29.048 21 HG21 ILE 2 1HG2 ILE 2 1.869 -3.796 -29.262 22 HG22 ILE 2 2HG2 ILE 2 0.657 -4.649 -28.306 23 HG23 ILE 2 3HG2 ILE 2 2.054 -3.924 -27.512 24 HD11 ILE 2 3HD1 ILE 2 0.132 0.136 -27.399 25 HD12 ILE 2 1HD1 ILE 2 1.820 0.555 -27.101 26 HD13 ILE 2 2HD1 ILE 2 1.025 -0.665 -26.105 27 HA PRO 3 HA PRO 3 -4.242 -0.671 -28.376 28 HB2 PRO 3 1HB PRO 3 -4.552 -2.113 -25.825 29 HB3 PRO 3 2HB PRO 3 -5.654 -2.033 -27.210 30 HG2 PRO 3 1HG PRO 3 -4.323 -4.265 -26.608 31 HG3 PRO 3 2HG PRO 3 -4.669 -3.795 -28.286 32 HD2 PRO 3 1HD PRO 3 -2.118 -3.543 -26.747 33 HD3 PRO 3 2HD PRO 3 -2.377 -4.028 -28.434 34 H SER 4 H SER 4 -4.720 1.138 -27.181 35 HA SER 4 HA SER 4 -2.611 2.193 -25.524 36 HB2 SER 4 1HB SER 4 -5.280 3.381 -26.313 37 HB3 SER 4 2HB SER 4 -3.985 4.248 -25.489 38 HG SER 4 HG SER 4 -2.894 3.136 -27.597 39 H ILE 5 H ILE 5 -5.617 0.599 -25.015 40 HA ILE 5 HA ILE 5 -6.007 1.577 -22.320 41 HB ILE 5 HB ILE 5 -7.410 -0.807 -23.518 42 HG12 ILE 5 1HG1 ILE 5 -9.164 1.233 -23.922 43 HG13 ILE 5 2HG1 ILE 5 -7.639 2.047 -24.253 44 HG21 ILE 5 1HG2 ILE 5 -9.238 -0.097 -22.043 45 HG22 ILE 5 2HG2 ILE 5 -8.243 1.239 -21.463 46 HG23 ILE 5 3HG2 ILE 5 -7.758 -0.426 -21.141 47 HD11 ILE 5 3HD1 ILE 5 -8.641 1.155 -26.280 48 HD12 ILE 5 1HD1 ILE 5 -8.616 -0.467 -25.588 49 HD13 ILE 5 2HD1 ILE 5 -7.101 0.369 -25.932 50 H ALA 6 H ALA 6 -4.331 -1.016 -23.855 51 HA ALA 6 HA ALA 6 -4.207 -2.698 -21.504 52 HB1 ALA 6 3HB ALA 6 -4.262 -3.691 -23.740 53 HB2 ALA 6 1HB ALA 6 -2.806 -4.153 -22.860 54 HB3 ALA 6 2HB ALA 6 -2.722 -2.921 -24.119 55 H THR 7 H THR 7 -2.169 -0.349 -23.137 56 HA THR 7 HA THR 7 0.262 -0.899 -21.821 57 HB THR 7 HB THR 7 -0.395 1.905 -22.612 58 HG1 THR 7 HG1 THR 7 -1.048 1.221 -24.505 59 HG21 THR 7 3HG2 THR 7 1.855 1.355 -21.826 60 HG22 THR 7 1HG2 THR 7 1.881 1.817 -23.529 61 HG23 THR 7 2HG2 THR 7 1.996 0.116 -23.076 62 H GLY 8 H GLY 8 -2.573 0.874 -20.827 63 HA2 GLY 8 1HA GLY 8 -1.272 2.207 -18.615 64 HA3 GLY 8 2HA GLY 8 -2.991 2.206 -18.969 65 H LEU 9 H LEU 9 -3.523 -0.496 -19.011 66 HA LEU 9 HA LEU 9 -3.877 -1.081 -16.287 67 HB2 LEU 9 1HB LEU 9 -4.057 -2.882 -18.706 68 HB3 LEU 9 2HB LEU 9 -4.588 -3.335 -17.098 69 HG LEU 9 HG LEU 9 -5.736 -0.900 -18.421 70 HD11 LEU 9 1HD1 LEU 9 -7.556 -2.325 -19.287 71 HD12 LEU 9 2HD1 LEU 9 -6.616 -3.752 -18.845 72 HD13 LEU 9 3HD1 LEU 9 -6.006 -2.638 -20.070 73 HD21 LEU 9 3HD2 LEU 9 -6.805 -2.877 -16.409 74 HD22 LEU 9 1HD2 LEU 9 -7.665 -1.466 -17.021 75 HD23 LEU 9 2HD2 LEU 9 -6.203 -1.258 -16.057 76 H VAL 10 H VAL 10 -1.530 -2.298 -18.655 77 HA VAL 10 HA VAL 10 -0.362 -4.255 -17.024 78 HB VAL 10 HB VAL 10 1.617 -4.107 -18.528 79 HG11 VAL 10 1HG1 VAL 10 -1.152 -4.319 -19.676 80 HG12 VAL 10 2HG1 VAL 10 -0.050 -5.612 -19.199 81 HG13 VAL 10 3HG1 VAL 10 0.290 -4.651 -20.638 82 HG21 VAL 10 3HG2 VAL 10 1.702 -1.778 -19.059 83 HG22 VAL 10 1HG2 VAL 10 0.068 -1.809 -19.721 84 HG23 VAL 10 2HG2 VAL 10 1.373 -2.647 -20.558 85 H GLY 11 H GLY 11 0.414 -0.851 -17.429 86 HA2 GLY 11 1HA GLY 11 2.761 -0.840 -15.836 87 HA3 GLY 11 2HA GLY 11 1.804 0.570 -16.261 88 H ALA 12 H ALA 12 -0.604 0.053 -15.067 89 HA ALA 12 HA ALA 12 0.020 0.662 -12.346 90 HB1 ALA 12 3HB ALA 12 -1.873 1.644 -13.707 91 HB2 ALA 12 1HB ALA 12 -2.270 1.142 -12.064 92 HB3 ALA 12 2HB ALA 12 -2.730 0.127 -13.430 93 H LEU 13 H LEU 13 -1.534 -2.121 -13.918 94 HA LEU 13 HA LEU 13 -2.140 -3.470 -11.509 95 HB2 LEU 13 1HB LEU 13 -1.966 -4.263 -14.382 96 HB3 LEU 13 2HB LEU 13 -2.079 -5.519 -13.163 97 HG LEU 13 HG LEU 13 -4.181 -4.419 -12.331 98 HD11 LEU 13 1HD1 LEU 13 -5.326 -2.830 -13.748 99 HD12 LEU 13 2HD1 LEU 13 -3.993 -2.849 -14.900 100 HD13 LEU 13 3HD1 LEU 13 -3.753 -2.180 -13.287 101 HD21 LEU 13 3HD2 LEU 13 -4.241 -6.382 -13.771 102 HD22 LEU 13 1HD2 LEU 13 -4.168 -5.350 -15.199 103 HD23 LEU 13 2HD2 LEU 13 -5.576 -5.291 -14.139 104 H LEU 14 H LEU 14 0.695 -3.544 -13.643 105 HA LEU 14 HA LEU 14 1.995 -5.639 -12.211 106 HB2 LEU 14 1HB LEU 14 2.673 -3.830 -14.426 107 HB3 LEU 14 2HB LEU 14 4.037 -4.340 -13.452 108 HG LEU 14 HG LEU 14 3.166 -6.739 -13.843 109 HD11 LEU 14 1HD1 LEU 14 0.985 -5.803 -14.820 110 HD12 LEU 14 2HD1 LEU 14 1.754 -7.156 -15.650 111 HD13 LEU 14 3HD1 LEU 14 1.927 -5.519 -16.285 112 HD21 LEU 14 3HD2 LEU 14 4.317 -5.127 -16.117 113 HD22 LEU 14 1HD2 LEU 14 4.381 -6.884 -15.962 114 HD23 LEU 14 2HD2 LEU 14 5.227 -5.864 -14.799 115 H LEU 15 H LEU 15 2.113 -2.115 -12.080 116 HA LEU 15 HA LEU 15 4.261 -1.996 -10.202 117 HB2 LEU 15 1HB LEU 15 2.525 -0.123 -11.563 118 HB3 LEU 15 2HB LEU 15 2.719 0.319 -9.877 119 HG LEU 15 HG LEU 15 5.302 -0.140 -10.543 120 HD11 LEU 15 1HD1 LEU 15 3.999 0.968 -13.024 121 HD12 LEU 15 2HD1 LEU 15 4.769 -0.612 -12.874 122 HD13 LEU 15 3HD1 LEU 15 5.733 0.857 -12.724 123 HD21 LEU 15 3HD2 LEU 15 3.799 2.441 -10.957 124 HD22 LEU 15 1HD2 LEU 15 5.534 2.279 -10.700 125 HD23 LEU 15 2HD2 LEU 15 4.408 1.838 -9.417 126 H LEU 16 H LEU 16 0.750 -2.070 -9.942 127 HA LEU 16 HA LEU 16 0.639 -1.623 -7.132 128 HB2 LEU 16 1HB LEU 16 -1.211 -1.474 -9.016 129 HB3 LEU 16 2HB LEU 16 -1.490 -3.145 -8.568 130 HG LEU 16 HG LEU 16 -1.617 -2.141 -6.131 131 HD11 LEU 16 1HD1 LEU 16 -2.514 0.072 -6.031 132 HD12 LEU 16 2HD1 LEU 16 -2.522 0.206 -7.788 133 HD13 LEU 16 3HD1 LEU 16 -0.991 0.139 -6.917 134 HD21 LEU 16 3HD2 LEU 16 -3.414 -3.339 -7.244 135 HD22 LEU 16 1HD2 LEU 16 -3.830 -1.895 -8.166 136 HD23 LEU 16 2HD2 LEU 16 -4.043 -1.915 -6.415 137 H LEU 17 H LEU 17 0.862 -4.478 -9.177 138 HA LEU 17 HA LEU 17 0.368 -6.396 -7.148 139 HB2 LEU 17 1HB LEU 17 0.370 -6.612 -9.753 140 HB3 LEU 17 2HB LEU 17 2.074 -6.968 -9.543 141 HG LEU 17 HG LEU 17 0.156 -8.533 -7.897 142 HD11 LEU 17 1HD1 LEU 17 -0.239 -10.103 -9.737 143 HD12 LEU 17 2HD1 LEU 17 0.553 -8.988 -10.852 144 HD13 LEU 17 3HD1 LEU 17 -0.952 -8.523 -10.057 145 HD21 LEU 17 3HD2 LEU 17 2.664 -9.235 -9.422 146 HD22 LEU 17 1HD2 LEU 17 1.776 -10.306 -8.339 147 HD23 LEU 17 2HD2 LEU 17 2.569 -8.867 -7.700 148 H VAL 18 H VAL 18 3.369 -5.035 -8.502 149 HA VAL 18 HA VAL 18 5.120 -6.627 -6.922 150 HB VAL 18 HB VAL 18 5.685 -3.972 -8.265 151 HG11 VAL 18 1HG1 VAL 18 8.039 -4.661 -8.179 152 HG12 VAL 18 2HG1 VAL 18 7.583 -6.099 -7.266 153 HG13 VAL 18 3HG1 VAL 18 7.350 -4.499 -6.563 154 HG21 VAL 18 3HG2 VAL 18 6.110 -6.793 -9.250 155 HG22 VAL 18 1HG2 VAL 18 6.638 -5.326 -10.075 156 HG23 VAL 18 2HG2 VAL 18 4.916 -5.646 -9.858 157 H VAL 19 H VAL 19 3.871 -3.311 -6.547 158 HA VAL 19 HA VAL 19 5.327 -2.715 -4.190 159 HB VAL 19 HB VAL 19 2.777 -1.497 -5.271 160 HG11 VAL 19 1HG1 VAL 19 2.848 -1.042 -2.909 161 HG12 VAL 19 2HG1 VAL 19 3.302 0.422 -3.781 162 HG13 VAL 19 3HG1 VAL 19 4.543 -0.565 -3.010 163 HG21 VAL 19 3HG2 VAL 19 4.298 0.347 -5.933 164 HG22 VAL 19 1HG2 VAL 19 4.654 -1.176 -6.747 165 HG23 VAL 19 2HG2 VAL 19 5.664 -0.635 -5.406 166 H ALA 20 H ALA 20 2.057 -4.008 -4.721 167 HA ALA 20 HA ALA 20 1.299 -4.045 -1.985 168 HB1 ALA 20 3HB ALA 20 -0.337 -4.123 -3.806 169 HB2 ALA 20 1HB ALA 20 -0.536 -5.478 -2.695 170 HB3 ALA 20 2HB ALA 20 0.244 -5.726 -4.257 171 H LEU 21 H LEU 21 2.823 -6.426 -4.112 172 HA LEU 21 HA LEU 21 2.771 -8.583 -2.262 173 HB2 LEU 21 1HB LEU 21 3.219 -8.518 -4.853 174 HB3 LEU 21 2HB LEU 21 4.890 -8.332 -4.358 175 HG LEU 21 HG LEU 21 4.299 -10.468 -2.878 176 HD11 LEU 21 1HD1 LEU 21 2.455 -10.703 -5.254 177 HD12 LEU 21 2HD1 LEU 21 1.963 -10.563 -3.565 178 HD13 LEU 21 3HD1 LEU 21 2.841 -11.991 -4.113 179 HD21 LEU 21 3HD2 LEU 21 5.225 -11.849 -4.684 180 HD22 LEU 21 1HD2 LEU 21 6.104 -10.331 -4.496 181 HD23 LEU 21 2HD2 LEU 21 4.958 -10.528 -5.821 182 H GLY 22 H GLY 22 5.048 -5.982 -2.930 183 HA2 GLY 22 1HA GLY 22 7.197 -6.965 -1.353 184 HA3 GLY 22 2HA GLY 22 6.971 -5.299 -1.868 185 H ILE 23 H ILE 23 4.742 -4.463 -0.650 186 HA ILE 23 HA ILE 23 5.552 -4.077 2.038 187 HB ILE 23 HB ILE 23 2.784 -3.548 0.941 188 HG12 ILE 23 1HG1 ILE 23 4.952 -1.474 1.045 189 HG13 ILE 23 2HG1 ILE 23 4.856 -2.563 -0.334 190 HG21 ILE 23 1HG2 ILE 23 2.956 -3.396 3.366 191 HG22 ILE 23 2HG2 ILE 23 2.727 -1.795 2.663 192 HG23 ILE 23 3HG2 ILE 23 4.326 -2.295 3.216 193 HD11 ILE 23 3HD1 ILE 23 2.704 -0.682 0.608 194 HD12 ILE 23 1HD1 ILE 23 2.556 -1.809 -0.741 195 HD13 ILE 23 2HD1 ILE 23 3.725 -0.490 -0.818 196 H GLY 24 H GLY 24 3.242 -6.250 0.508 197 HA2 GLY 24 1HA GLY 24 1.952 -7.162 2.856 198 HA3 GLY 24 2HA GLY 24 2.013 -8.015 1.320 199 H LEU 25 H LEU 25 4.713 -8.466 1.032 200 HA LEU 25 HA LEU 25 5.110 -10.662 2.827 201 HB2 LEU 25 1HB LEU 25 6.799 -9.491 0.623 202 HB3 LEU 25 2HB LEU 25 7.303 -10.877 1.570 203 HG LEU 25 HG LEU 25 4.669 -10.955 0.153 204 HD11 LEU 25 1HD1 LEU 25 7.355 -11.468 -1.111 205 HD12 LEU 25 2HD1 LEU 25 6.208 -10.205 -1.555 206 HD13 LEU 25 3HD1 LEU 25 5.798 -11.899 -1.818 207 HD21 LEU 25 3HD2 LEU 25 5.182 -13.346 0.053 208 HD22 LEU 25 1HD2 LEU 25 5.237 -12.746 1.710 209 HD23 LEU 25 2HD2 LEU 25 6.736 -13.046 0.831 210 H PHE 26 H PHE 26 6.190 -7.369 2.690 211 HA PHE 26 HA PHE 26 8.451 -7.709 4.430 212 HB2 PHE 26 1HB PHE 26 7.946 -5.821 2.680 213 HB3 PHE 26 2HB PHE 26 7.088 -5.072 4.022 214 HD1 PHE 26 HD1 PHE 26 8.283 -4.234 5.951 215 HD2 PHE 26 HD2 PHE 26 10.352 -6.047 2.704 216 HE1 PHE 26 HE1 PHE 26 10.405 -3.316 6.795 217 HE2 PHE 26 HE2 PHE 26 12.477 -5.133 3.543 218 HZ PHE 26 HZ PHE 26 12.506 -3.766 5.591 219 H ILE 27 H ILE 27 5.077 -6.737 4.822 220 HA ILE 27 HA ILE 27 5.411 -6.132 7.635 221 HB ILE 27 HB ILE 27 2.874 -6.321 6.001 222 HG12 ILE 27 1HG1 ILE 27 4.290 -4.539 5.151 223 HG13 ILE 27 2HG1 ILE 27 2.930 -3.841 6.016 224 HG21 ILE 27 1HG2 ILE 27 3.324 -5.155 8.746 225 HG22 ILE 27 2HG2 ILE 27 2.433 -6.629 8.369 226 HG23 ILE 27 3HG2 ILE 27 1.821 -5.068 7.825 227 HD11 ILE 27 3HD1 ILE 27 4.810 -2.563 6.606 228 HD12 ILE 27 1HD1 ILE 27 5.801 -3.996 6.883 229 HD13 ILE 27 2HD1 ILE 27 4.491 -3.601 7.995 230 H ARG 28 H ARG 28 4.213 -8.796 5.669 231 HA ARG 28 HA ARG 28 2.935 -10.247 7.735 232 HB2 ARG 28 1HB ARG 28 2.970 -10.524 5.086 233 HB3 ARG 28 2HB ARG 28 4.214 -11.704 5.474 234 HG2 ARG 28 1HG ARG 28 2.645 -12.882 6.931 235 HG3 ARG 28 2HG ARG 28 1.397 -11.695 6.544 236 HD2 ARG 28 1HD ARG 28 2.787 -13.327 4.436 237 HD3 ARG 28 2HD ARG 28 1.335 -13.890 5.262 238 HE ARG 28 HE ARG 28 0.846 -11.322 4.261 239 HH11 ARG 28 1HH1 ARG 28 1.407 -14.559 3.071 240 HH12 ARG 28 2HH1 ARG 28 0.488 -14.320 1.622 241 HH21 ARG 28 1HH2 ARG 28 -0.361 -11.010 2.356 242 HH22 ARG 28 2HH2 ARG 28 -0.514 -12.305 1.219 243 H ARG 29 H ARG 29 6.263 -9.928 6.793 244 HA ARG 29 HA ARG 29 7.169 -12.248 8.258 245 HB2 ARG 29 1HB ARG 29 8.575 -10.025 6.793 246 HB3 ARG 29 2HB ARG 29 9.460 -11.202 7.752 247 HG2 ARG 29 1HG ARG 29 8.566 -13.007 6.371 248 HG3 ARG 29 2HG ARG 29 7.676 -11.826 5.408 249 HD2 ARG 29 1HD ARG 29 9.785 -10.776 4.750 250 HD3 ARG 29 2HD ARG 29 10.674 -11.957 5.713 251 HE ARG 29 HE ARG 29 9.052 -13.337 3.897 252 HH11 ARG 29 1HH1 ARG 29 11.855 -11.249 3.876 253 HH12 ARG 29 2HH1 ARG 29 12.509 -11.937 2.428 254 HH21 ARG 29 1HH2 ARG 29 9.915 -14.238 1.996 255 HH22 ARG 29 2HH2 ARG 29 11.408 -13.633 1.360 256 H ARG 30 H ARG 30 6.467 -8.982 8.979 257 HA ARG 30 HA ARG 30 8.249 -8.782 11.251 258 HB2 ARG 30 1HB ARG 30 6.118 -6.985 10.116 259 HB3 ARG 30 2HB ARG 30 6.913 -6.633 11.645 260 HG2 ARG 30 1HG ARG 30 9.075 -6.573 10.509 261 HG3 ARG 30 2HG ARG 30 8.277 -6.929 8.975 262 HD2 ARG 30 1HD ARG 30 8.592 -4.599 8.984 263 HD3 ARG 30 2HD ARG 30 6.892 -4.839 9.386 264 HE ARG 30 HE ARG 30 8.350 -4.694 11.770 265 HH11 ARG 30 1HH1 ARG 30 7.430 -2.624 9.109 266 HH12 ARG 30 2HH1 ARG 30 7.452 -1.179 10.063 267 HH21 ARG 30 1HH2 ARG 30 8.378 -2.794 13.021 268 HH22 ARG 30 2HH2 ARG 30 7.991 -1.276 12.282 269 H HIS 31 H HIS 31 5.038 -9.872 10.644 270 HA HIS 31 HA HIS 31 4.127 -9.578 13.372 271 HB2 HIS 31 1HB HIS 31 2.949 -10.718 10.860 272 HB3 HIS 31 2HB HIS 31 2.210 -11.074 12.417 273 HD1 HIS 31 HD1 HIS 31 2.428 -8.493 9.820 274 HD2 HIS 31 HD2 HIS 31 1.228 -8.726 13.791 275 HE1 HIS 31 HE1 HIS 31 1.079 -6.411 10.239 276 HE2 HIS 31 HE2 HIS 31 0.294 -6.617 12.623 277 H ILE 32 H ILE 32 5.833 -11.927 11.538 278 HA ILE 32 HA ILE 32 5.150 -14.170 13.234 279 HB ILE 32 HB ILE 32 7.437 -14.114 11.277 280 HG12 ILE 32 1HG1 ILE 32 5.526 -13.288 10.027 281 HG13 ILE 32 2HG1 ILE 32 5.863 -14.943 9.540 282 HG21 ILE 32 1HG2 ILE 32 6.942 -16.512 11.070 283 HG22 ILE 32 2HG2 ILE 32 5.650 -16.337 12.257 284 HG23 ILE 32 3HG2 ILE 32 7.325 -16.051 12.729 285 HD11 ILE 32 3HD1 ILE 32 3.476 -14.544 9.725 286 HD12 ILE 32 1HD1 ILE 32 3.671 -14.060 11.411 287 HD13 ILE 32 2HD1 ILE 32 4.005 -15.723 10.926 288 H VAL 33 H VAL 33 7.675 -11.774 12.997 289 HA VAL 33 HA VAL 33 9.315 -13.145 14.996 290 HB VAL 33 HB VAL 33 10.032 -10.482 13.806 291 HG11 VAL 33 1HG1 VAL 33 11.673 -12.843 14.724 292 HG12 VAL 33 2HG1 VAL 33 11.415 -11.341 15.613 293 HG13 VAL 33 3HG1 VAL 33 12.317 -11.325 14.098 294 HG21 VAL 33 3HG2 VAL 33 10.469 -13.156 12.474 295 HG22 VAL 33 1HG2 VAL 33 11.167 -11.622 11.953 296 HG23 VAL 33 2HG2 VAL 33 9.422 -11.862 11.892 297 H ARG 34 H ARG 34 6.747 -11.073 14.986 298 HA ARG 34 HA ARG 34 7.629 -9.399 17.201 299 HB2 ARG 34 1HB ARG 34 6.045 -8.785 15.156 300 HB3 ARG 34 2HB ARG 34 4.806 -9.400 16.239 301 HG2 ARG 34 1HG ARG 34 5.662 -7.796 17.970 302 HG3 ARG 34 2HG ARG 34 6.674 -7.092 16.708 303 HD2 ARG 34 1HD ARG 34 4.622 -6.681 15.372 304 HD3 ARG 34 2HD ARG 34 3.663 -7.265 16.730 305 HE ARG 34 HE ARG 34 5.343 -5.226 17.649 306 HH11 ARG 34 1HH1 ARG 34 2.590 -5.625 15.533 307 HH12 ARG 34 2HH1 ARG 34 1.995 -4.022 15.803 308 HH21 ARG 34 1HH2 ARG 34 4.558 -3.120 18.001 309 HH22 ARG 34 2HH2 ARG 34 3.112 -2.600 17.202 310 H LYS 35 H LYS 35 6.405 -9.267 19.189 311 HA LYS 35 HA LYS 35 5.546 -11.906 20.094 312 HB2 LYS 35 1HB LYS 35 6.308 -9.370 21.532 313 HB3 LYS 35 2HB LYS 35 5.572 -10.729 22.370 314 HG2 LYS 35 1HG LYS 35 7.427 -12.163 21.683 315 HG3 LYS 35 2HG LYS 35 8.165 -10.800 20.840 316 HD2 LYS 35 1HD LYS 35 8.343 -9.588 22.960 317 HD3 LYS 35 2HD LYS 35 7.603 -10.950 23.802 318 HE2 LYS 35 1HE LYS 35 9.468 -12.381 23.123 319 HE3 LYS 35 2HE LYS 35 10.207 -11.019 22.281 320 HZ1 LYS 35 3HZ LYS 35 10.394 -9.862 24.396 321 HZ2 LYS 35 1HZ LYS 35 11.194 -11.352 24.457 322 HZ3 LYS 35 2HZ LYS 35 9.687 -11.170 25.201 323 H ARG 36 H ARG 36 3.631 -12.153 21.418 324 HA ARG 36 HA ARG 36 1.408 -10.618 20.366 325 HB2 ARG 36 1HB ARG 36 1.600 -13.150 21.985 326 HB3 ARG 36 2HB ARG 36 0.062 -12.354 21.684 327 HG2 ARG 36 1HG ARG 36 0.403 -12.603 19.277 328 HG3 ARG 36 2HG ARG 36 1.947 -13.400 19.580 329 HD2 ARG 36 1HD ARG 36 0.786 -15.180 20.795 330 HD3 ARG 36 2HD ARG 36 -0.757 -14.381 20.492 331 HE ARG 36 HE ARG 36 0.509 -14.819 18.035 332 HH11 ARG 36 1HH1 ARG 36 -0.958 -16.665 20.616 333 HH12 ARG 36 2HH1 ARG 36 -1.430 -17.970 19.580 334 HH21 ARG 36 1HH2 ARG 36 -0.114 -16.535 16.678 335 HH22 ARG 36 2HH2 ARG 36 -0.951 -17.895 17.346 336 H THR 37 H THR 37 3.262 -9.416 22.318 337 HA THR 37 HA THR 37 1.790 -9.198 24.797 338 HB THR 37 HB THR 37 3.541 -7.422 25.316 339 HG1 THR 37 HG1 THR 37 5.190 -7.155 23.904 340 HG21 THR 37 3HG2 THR 37 4.486 -10.207 24.624 341 HG22 THR 37 1HG2 THR 37 3.721 -9.717 26.136 342 HG23 THR 37 2HG2 THR 37 5.308 -9.082 25.705 343 H LEU 38 H LEU 38 1.651 -7.690 21.779 344 HA LEU 38 HA LEU 38 0.669 -5.147 22.789 345 HB2 LEU 38 1HB LEU 38 1.264 -6.177 20.027 346 HB3 LEU 38 2HB LEU 38 0.395 -4.678 20.279 347 HG LEU 38 HG LEU 38 2.639 -4.070 19.872 348 HD11 LEU 38 1HD1 LEU 38 3.150 -2.765 21.697 349 HD12 LEU 38 2HD1 LEU 38 2.666 -4.001 22.858 350 HD13 LEU 38 3HD1 LEU 38 1.441 -3.104 21.964 351 HD21 LEU 38 3HD2 LEU 38 3.671 -6.250 20.199 352 HD22 LEU 38 1HD2 LEU 38 3.472 -6.095 21.946 353 HD23 LEU 38 2HD2 LEU 38 4.549 -4.999 21.080 354 H ARG 39 H ARG 39 -0.467 -8.147 21.858 355 HA ARG 39 HA ARG 39 -3.181 -7.277 21.251 356 HB2 ARG 39 1HB ARG 39 -1.707 -9.876 20.851 357 HB3 ARG 39 2HB ARG 39 -3.461 -9.797 20.774 358 HG2 ARG 39 1HG ARG 39 -3.391 -8.332 18.900 359 HG3 ARG 39 2HG ARG 39 -1.649 -8.110 19.066 360 HD2 ARG 39 1HD ARG 39 -2.831 -10.826 18.605 361 HD3 ARG 39 2HD ARG 39 -2.524 -9.729 17.259 362 HE ARG 39 HE ARG 39 -0.274 -10.167 19.023 363 HH11 ARG 39 1HH1 ARG 39 -1.929 -11.199 16.122 364 HH12 ARG 39 2HH1 ARG 39 -0.525 -11.953 15.440 365 HH21 ARG 39 1HH2 ARG 39 1.568 -11.157 18.124 366 HH22 ARG 39 2HH2 ARG 39 1.457 -11.929 16.577 367 H ARG 40 H ARG 40 -1.161 -9.101 23.435 368 HA ARG 40 HA ARG 40 -3.297 -10.034 25.119 369 HB2 ARG 40 1HB ARG 40 -0.300 -9.935 25.370 370 HB3 ARG 40 2HB ARG 40 -1.294 -10.354 26.758 371 HG2 ARG 40 1HG ARG 40 -2.251 -12.225 25.510 372 HG3 ARG 40 2HG ARG 40 -1.253 -11.802 24.117 373 HD2 ARG 40 1HD ARG 40 0.764 -12.185 25.450 374 HD3 ARG 40 2HD ARG 40 -0.234 -12.605 26.841 375 HE ARG 40 HE ARG 40 -0.958 -14.258 24.703 376 HH11 ARG 40 1HH1 ARG 40 1.768 -13.727 26.824 377 HH12 ARG 40 2HH1 ARG 40 2.322 -15.365 26.726 378 HH21 ARG 40 1HH2 ARG 40 -0.229 -16.410 24.578 379 HH22 ARG 40 2HH2 ARG 40 1.189 -16.887 25.451 380 H LEU 41 H LEU 41 -1.567 -7.168 24.656 381 HA LEU 41 HA LEU 41 -2.531 -6.006 27.159 382 HB2 LEU 41 1HB LEU 41 -0.183 -5.470 25.422 383 HB3 LEU 41 2HB LEU 41 -0.934 -4.082 26.181 384 HG LEU 41 HG LEU 41 0.886 -4.748 27.561 385 HD11 LEU 41 1HD1 LEU 41 -1.439 -4.281 28.615 386 HD12 LEU 41 2HD1 LEU 41 -0.129 -4.897 29.621 387 HD13 LEU 41 3HD1 LEU 41 -1.386 -5.991 29.045 388 HD21 LEU 41 3HD2 LEU 41 1.289 -6.972 26.786 389 HD22 LEU 41 1HD2 LEU 41 -0.254 -7.533 27.430 390 HD23 LEU 41 2HD2 LEU 41 1.032 -7.035 28.529 391 H LEU 42 H LEU 42 -2.872 -6.061 23.724 392 HA LEU 42 HA LEU 42 -3.942 -3.472 23.300 393 HB2 LEU 42 1HB LEU 42 -3.241 -5.248 21.571 394 HB3 LEU 42 2HB LEU 42 -4.855 -5.899 21.781 395 HG LEU 42 HG LEU 42 -4.677 -3.006 21.160 396 HD11 LEU 42 1HD1 LEU 42 -4.402 -3.440 18.764 397 HD12 LEU 42 2HD1 LEU 42 -4.083 -5.138 19.112 398 HD13 LEU 42 3HD1 LEU 42 -2.967 -3.897 19.681 399 HD21 LEU 42 3HD2 LEU 42 -6.633 -3.542 19.802 400 HD22 LEU 42 1HD2 LEU 42 -6.824 -4.136 21.452 401 HD23 LEU 42 2HD2 LEU 42 -6.416 -5.257 20.153 402 H GLN 43 H GLN 43 -5.504 -6.538 24.123 403 HA GLN 43 HA GLN 43 -8.084 -5.210 24.404 404 HB2 GLN 43 1HB GLN 43 -7.541 -7.613 23.396 405 HB3 GLN 43 2HB GLN 43 -7.696 -8.089 25.080 406 HG2 GLN 43 1HG GLN 43 -9.943 -7.134 25.144 407 HG3 GLN 43 2HG GLN 43 -9.787 -6.653 23.456 408 HE21 GLN 43 2HE2 GLN 43 -9.836 -8.228 21.851 409 HE22 GLN 43 1HE2 GLN 43 -10.427 -9.824 22.148 410 H GLU 44 H GLU 44 -5.384 -5.935 26.292 411 HA GLU 44 HA GLU 44 -6.823 -6.364 28.778 412 HB2 GLU 44 1HB GLU 44 -4.366 -7.125 27.969 413 HB3 GLU 44 2HB GLU 44 -3.949 -5.666 28.860 414 HG2 GLU 44 1HG GLU 44 -5.079 -6.545 30.836 415 HG3 GLU 44 2HG GLU 44 -5.501 -8.006 29.944 416 H ARG 45 H ARG 45 -4.880 -3.762 27.336 417 HA ARG 45 HA ARG 45 -5.455 -1.992 29.567 418 HB2 ARG 45 1HB ARG 45 -3.749 -1.763 27.101 419 HB3 ARG 45 2HB ARG 45 -4.114 -0.351 28.082 420 HG2 ARG 45 1HG ARG 45 -3.036 -2.772 29.431 421 HG3 ARG 45 2HG ARG 45 -1.941 -1.771 28.480 422 HD2 ARG 45 1HD ARG 45 -2.597 0.189 29.792 423 HD3 ARG 45 2HD ARG 45 -3.691 -0.814 30.743 424 HE ARG 45 HE ARG 45 -1.129 -1.926 30.885 425 HH11 ARG 45 1HH1 ARG 45 -2.827 0.936 31.952 426 HH12 ARG 45 2HH1 ARG 45 -1.824 1.161 33.344 427 HH21 ARG 45 1HH2 ARG 45 0.187 -1.628 32.716 428 HH22 ARG 45 2HH2 ARG 45 -0.114 -0.294 33.778 429 H GLU 46 H GLU 46 -6.953 -2.827 26.673 430 HA GLU 46 HA GLU 46 -7.960 -0.365 25.763 431 HB2 GLU 46 1HB GLU 46 -8.032 -2.830 24.766 432 HB3 GLU 46 2HB GLU 46 -9.628 -2.820 25.503 433 HG2 GLU 46 1HG GLU 46 -10.212 -0.828 24.216 434 HG3 GLU 46 2HG GLU 46 -8.610 -0.837 23.479 435 H LEU 47 H LEU 47 -9.607 -2.834 27.779 436 HA LEU 47 HA LEU 47 -10.955 -0.729 29.252 437 HB2 LEU 47 1HB LEU 47 -12.315 -1.434 27.142 438 HB3 LEU 47 2HB LEU 47 -12.682 -2.876 28.067 439 HG LEU 47 HG LEU 47 -13.416 -1.099 29.895 440 HD11 LEU 47 1HD1 LEU 47 -12.727 0.852 28.610 441 HD12 LEU 47 2HD1 LEU 47 -14.473 0.847 28.860 442 HD13 LEU 47 3HD1 LEU 47 -13.804 0.379 27.295 443 HD21 LEU 47 3HD2 LEU 47 -15.068 -1.853 27.487 444 HD22 LEU 47 1HD2 LEU 47 -15.705 -1.273 29.027 445 HD23 LEU 47 2HD2 LEU 47 -14.853 -2.814 28.950 446 H VAL 48 H VAL 48 -9.010 -2.873 29.766 447 HA VAL 48 HA VAL 48 -10.474 -4.251 31.919 448 HB VAL 48 HB VAL 48 -8.098 -5.511 30.558 449 HG11 VAL 48 1HG1 VAL 48 -8.697 -6.378 32.751 450 HG12 VAL 48 2HG1 VAL 48 -9.033 -7.574 31.500 451 HG13 VAL 48 3HG1 VAL 48 -10.355 -6.646 32.209 452 HG21 VAL 48 3HG2 VAL 48 -9.560 -6.811 29.158 453 HG22 VAL 48 1HG2 VAL 48 -9.868 -5.099 28.866 454 HG23 VAL 48 2HG2 VAL 48 -10.984 -6.040 29.857 455 H GLU 49 H GLU 49 -9.576 -2.016 32.735 456 HA GLU 49 HA GLU 49 -6.807 -2.232 33.645 457 HB2 GLU 49 1HB GLU 49 -8.822 0.008 33.676 458 HB3 GLU 49 2HB GLU 49 -7.310 0.105 34.567 459 HG2 GLU 49 1HG GLU 49 -6.063 -0.182 32.487 460 HG3 GLU 49 2HG GLU 49 -7.581 -0.280 31.594 461 HA PRO 50 HA PRO 50 -7.899 -3.615 37.708 462 HB2 PRO 50 1HB PRO 50 -5.849 -2.547 39.164 463 HB3 PRO 50 2HB PRO 50 -5.655 -3.952 38.099 464 HG2 PRO 50 1HG PRO 50 -4.954 -1.103 37.604 465 HG3 PRO 50 2HG PRO 50 -4.061 -2.578 37.183 466 HD2 PRO 50 1HD PRO 50 -5.539 -1.203 35.377 467 HD3 PRO 50 2HD PRO 50 -5.312 -2.961 35.297 468 H LEU 51 H LEU 51 -9.285 -2.930 39.219 469 HA LEU 51 HA LEU 51 -9.200 -0.190 40.170 470 HB2 LEU 51 1HB LEU 51 -10.840 -0.512 38.174 471 HB3 LEU 51 2HB LEU 51 -11.846 -1.341 39.345 472 HG LEU 51 HG LEU 51 -11.473 0.890 40.731 473 HD11 LEU 51 1HD1 LEU 51 -9.951 1.907 39.124 474 HD12 LEU 51 2HD1 LEU 51 -11.439 2.844 39.262 475 HD13 LEU 51 3HD1 LEU 51 -11.184 1.794 37.868 476 HD21 LEU 51 3HD2 LEU 51 -13.401 0.613 38.428 477 HD22 LEU 51 1HD2 LEU 51 -13.568 1.736 39.778 478 HD23 LEU 51 2HD2 LEU 51 -13.631 -0.004 40.064 479 H THR 52 H THR 52 -8.469 -1.097 42.088 480 HA THR 52 HA THR 52 -10.288 -2.872 43.539 481 HB THR 52 HB THR 52 -8.384 -2.937 45.234 482 HG1 THR 52 HG1 THR 52 -6.312 -2.377 44.092 483 HG21 THR 52 3HG2 THR 52 -7.840 -3.932 42.434 484 HG22 THR 52 1HG2 THR 52 -8.796 -4.763 43.661 485 HG23 THR 52 2HG2 THR 52 -7.065 -4.523 43.904 486 HA PRO 53 HA PRO 53 -11.838 0.310 46.212 487 HB2 PRO 53 1HB PRO 53 -11.590 -1.480 48.538 488 HB3 PRO 53 2HB PRO 53 -13.051 -0.828 47.775 489 HG2 PRO 53 1HG PRO 53 -12.408 -3.412 47.592 490 HG3 PRO 53 2HG PRO 53 -13.208 -2.541 46.270 491 HD2 PRO 53 1HD PRO 53 -10.330 -3.299 46.554 492 HD3 PRO 53 2HD PRO 53 -11.377 -3.351 45.121 493 H SER 54 H SER 54 -10.682 2.006 46.807 494 HA SER 54 HA SER 54 -8.226 1.627 48.362 495 HB2 SER 54 1HB SER 54 -7.775 4.020 47.736 496 HB3 SER 54 2HB SER 54 -7.898 2.926 46.359 497 HG SER 54 HG SER 54 -10.275 3.678 46.530 498 H GLY 55 H GLY 55 -11.454 2.436 48.780 499 HA2 GLY 55 1HA GLY 55 -10.869 4.017 51.207 500 HA3 GLY 55 2HA GLY 55 -12.374 4.100 50.306 501 H GLU 56 H GLU 56 -13.991 2.666 50.730 502 HA GLU 56 HA GLU 56 -13.572 0.918 53.050 503 HB2 GLU 56 1HB GLU 56 -16.038 2.188 51.875 504 HB3 GLU 56 2HB GLU 56 -16.132 0.902 53.070 505 HG2 GLU 56 1HG GLU 56 -14.876 2.278 54.651 506 HG3 GLU 56 2HG GLU 56 -14.782 3.567 53.452 507 H LYS 57 H LYS 57 -14.327 -1.221 53.063 508 HA LYS 57 HA LYS 57 -14.233 -2.516 50.482 509 HB2 LYS 57 1HB LYS 57 -14.269 -3.533 53.316 510 HB3 LYS 57 2HB LYS 57 -14.404 -4.619 51.938 511 HG2 LYS 57 1HG LYS 57 -12.242 -3.838 51.108 512 HG3 LYS 57 2HG LYS 57 -12.106 -2.750 52.492 513 HD2 LYS 57 1HD LYS 57 -12.156 -4.673 54.007 514 HD3 LYS 57 2HD LYS 57 -12.296 -5.761 52.623 515 HE2 LYS 57 1HE LYS 57 -10.124 -4.989 51.801 516 HE3 LYS 57 2HE LYS 57 -9.986 -3.901 53.183 517 HZ1 LYS 57 3HZ LYS 57 -10.010 -5.825 54.648 518 HZ2 LYS 57 1HZ LYS 57 -8.742 -5.940 53.533 519 HZ3 LYS 57 2HZ LYS 57 -10.142 -6.865 53.321 520 H LEU 58 H LEU 58 -16.548 -2.143 53.137 521 HA LEU 58 HA LEU 58 -18.585 -3.597 51.673 522 HB2 LEU 58 1HB LEU 58 -18.397 -2.452 54.435 523 HB3 LEU 58 2HB LEU 58 -19.961 -2.878 53.773 524 HG LEU 58 HG LEU 58 -19.179 -4.673 55.168 525 HD11 LEU 58 1HD1 LEU 58 -18.706 -5.740 52.419 526 HD12 LEU 58 2HD1 LEU 58 -20.290 -5.112 52.872 527 HD13 LEU 58 3HD1 LEU 58 -19.586 -6.459 53.768 528 HD21 LEU 58 3HD2 LEU 58 -16.723 -4.750 53.421 529 HD22 LEU 58 1HD2 LEU 58 -17.119 -5.904 54.695 530 HD23 LEU 58 2HD2 LEU 58 -16.792 -4.219 55.101 531 H TRP 59 H TRP 59 -17.471 -0.458 51.812 532 HA TRP 59 HA TRP 59 -19.998 0.560 50.705 533 HB2 TRP 59 1HB TRP 59 -18.205 1.918 52.719 534 HB3 TRP 59 2HB TRP 59 -19.407 2.787 51.771 535 HD1 TRP 59 HD1 TRP 59 -21.972 2.411 52.392 536 HE1 TRP 59 HE1 TRP 59 -23.123 1.444 54.479 537 HE3 TRP 59 HE3 TRP 59 -17.941 0.124 54.561 538 HZ2 TRP 59 HZ2 TRP 59 -22.419 -0.084 56.744 539 HZ3 TRP 59 HZ3 TRP 59 -18.268 -1.068 56.689 540 HH2 TRP 59 HH2 TRP 59 -20.462 -1.168 57.756 541 H SER 60 H SER 60 -19.826 2.009 49.015 542 HA SER 60 HA SER 60 -17.170 2.155 47.779 543 HB2 SER 60 1HB SER 60 -18.453 2.716 45.692 544 HB3 SER 60 2HB SER 60 -18.812 1.121 46.352 545 HG SER 60 HG SER 60 -20.770 1.784 46.948 546 H1 LYS 61 1H LYS 61 -3.801 11.163 -32.182 547 H2 LYS 61 2H LYS 61 -2.982 12.376 -31.334 548 H3 LYS 61 3H LYS 61 -4.040 11.340 -30.516 549 HA LYS 61 HA LYS 61 -2.622 9.460 -30.957 550 HB2 LYS 61 1HB LYS 61 -0.980 11.548 -32.386 551 HB3 LYS 61 2HB LYS 61 -0.294 10.020 -31.852 552 HG2 LYS 61 1HG LYS 61 -1.899 8.811 -33.243 553 HG3 LYS 61 2HG LYS 61 -2.589 10.344 -33.776 554 HD2 LYS 61 1HD LYS 61 -0.431 10.973 -34.752 555 HD3 LYS 61 2HD LYS 61 0.257 9.439 -34.215 556 HE2 LYS 61 1HE LYS 61 -1.344 8.232 -35.619 557 HE3 LYS 61 2HE LYS 61 -2.031 9.764 -36.153 558 HZ1 LYS 61 3HZ LYS 61 -0.475 8.885 -37.772 559 HZ2 LYS 61 1HZ LYS 61 0.763 8.869 -36.618 560 HZ3 LYS 61 2HZ LYS 61 0.103 10.339 -37.130 561 H ILE 62 H ILE 62 -1.382 8.845 -29.261 562 HA ILE 62 HA ILE 62 -0.097 10.919 -27.636 563 HB ILE 62 HB ILE 62 -0.919 9.607 -25.575 564 HG12 ILE 62 1HG1 ILE 62 -3.424 8.861 -26.252 565 HG13 ILE 62 2HG1 ILE 62 -2.583 8.434 -27.738 566 HG21 ILE 62 1HG2 ILE 62 -2.828 11.304 -27.173 567 HG22 ILE 62 2HG2 ILE 62 -1.581 11.883 -26.068 568 HG23 ILE 62 3HG2 ILE 62 -2.955 10.969 -25.446 569 HD11 ILE 62 3HD1 ILE 62 -1.048 7.029 -26.463 570 HD12 ILE 62 1HD1 ILE 62 -2.727 6.541 -26.228 571 HD13 ILE 62 2HD1 ILE 62 -1.892 7.460 -24.974 572 HA PRO 63 HA PRO 63 3.294 8.083 -27.341 573 HB2 PRO 63 1HB PRO 63 3.696 8.810 -24.512 574 HB3 PRO 63 2HB PRO 63 4.750 9.100 -25.906 575 HG2 PRO 63 1HG PRO 63 3.450 11.092 -24.698 576 HG3 PRO 63 2HG PRO 63 3.738 11.077 -26.450 577 HD2 PRO 63 1HD PRO 63 1.238 10.420 -24.946 578 HD3 PRO 63 2HD PRO 63 1.443 11.331 -26.455 579 H SER 64 H SER 64 3.804 6.028 -26.677 580 HA SER 64 HA SER 64 1.747 4.567 -25.284 581 HB2 SER 64 1HB SER 64 4.383 3.638 -26.444 582 HB3 SER 64 2HB SER 64 3.113 2.581 -25.831 583 HG SER 64 HG SER 64 1.958 4.200 -27.539 584 H ILE 65 H ILE 65 4.776 5.986 -24.475 585 HA ILE 65 HA ILE 65 5.249 4.339 -22.143 586 HB ILE 65 HB ILE 65 6.622 6.959 -22.723 587 HG12 ILE 65 1HG1 ILE 65 8.354 5.104 -23.704 588 HG13 ILE 65 2HG1 ILE 65 6.814 4.398 -24.187 589 HG21 ILE 65 1HG2 ILE 65 8.497 5.897 -21.546 590 HG22 ILE 65 2HG2 ILE 65 7.516 4.451 -21.303 591 HG23 ILE 65 3HG2 ILE 65 7.049 5.972 -20.543 592 HD11 ILE 65 3HD1 ILE 65 7.752 5.793 -25.941 593 HD12 ILE 65 1HD1 ILE 65 7.757 7.177 -24.849 594 HD13 ILE 65 2HD1 ILE 65 6.229 6.455 -25.349 595 H ALA 66 H ALA 66 3.536 7.235 -22.891 596 HA ALA 66 HA ALA 66 3.497 8.243 -20.180 597 HB1 ALA 66 3HB ALA 66 3.483 9.788 -22.079 598 HB2 ALA 66 1HB ALA 66 2.059 9.996 -21.060 599 HB3 ALA 66 2HB ALA 66 1.927 9.136 -22.594 600 H THR 67 H THR 67 1.395 6.393 -22.300 601 HA THR 67 HA THR 67 -0.987 6.570 -20.805 602 HB THR 67 HB THR 67 -0.369 4.073 -22.325 603 HG1 THR 67 HG1 THR 67 0.224 5.231 -23.993 604 HG21 THR 67 3HG2 THR 67 -2.590 4.389 -21.347 605 HG22 THR 67 1HG2 THR 67 -2.673 4.387 -23.109 606 HG23 THR 67 2HG2 THR 67 -2.767 5.910 -22.223 607 H GLY 68 H GLY 68 1.871 4.611 -20.406 608 HA2 GLY 68 1HA GLY 68 0.639 2.741 -18.575 609 HA3 GLY 68 2HA GLY 68 2.346 2.842 -18.974 610 H LEU 69 H LEU 69 2.887 5.463 -18.327 611 HA LEU 69 HA LEU 69 3.335 5.319 -15.559 612 HB2 LEU 69 1HB LEU 69 3.441 7.689 -17.428 613 HB3 LEU 69 2HB LEU 69 4.029 7.709 -15.777 614 HG LEU 69 HG LEU 69 5.120 5.709 -17.727 615 HD11 LEU 69 1HD1 LEU 69 6.916 7.320 -18.250 616 HD12 LEU 69 2HD1 LEU 69 6.000 8.576 -17.419 617 HD13 LEU 69 3HD1 LEU 69 5.344 7.819 -18.871 618 HD21 LEU 69 3HD2 LEU 69 6.265 7.097 -15.303 619 HD22 LEU 69 1HD2 LEU 69 7.098 5.898 -16.293 620 HD23 LEU 69 2HD2 LEU 69 5.669 5.439 -15.368 621 H VAL 70 H VAL 70 0.916 7.101 -17.446 622 HA VAL 70 HA VAL 70 -0.188 8.558 -15.322 623 HB VAL 70 HB VAL 70 -2.216 8.799 -16.747 624 HG11 VAL 70 1HG1 VAL 70 0.513 9.316 -17.889 625 HG12 VAL 70 2HG1 VAL 70 -0.566 10.436 -17.055 626 HG13 VAL 70 3HG1 VAL 70 -0.958 9.883 -18.683 627 HG21 VAL 70 3HG2 VAL 70 -2.329 6.689 -17.864 628 HG22 VAL 70 1HG2 VAL 70 -0.718 6.900 -18.549 629 HG23 VAL 70 2HG2 VAL 70 -2.048 7.921 -19.094 630 H GLY 71 H GLY 71 -0.991 5.375 -16.578 631 HA2 GLY 71 1HA GLY 71 -3.284 4.938 -14.965 632 HA3 GLY 71 2HA GLY 71 -2.348 3.692 -15.775 633 H ALA 72 H ALA 72 0.100 3.890 -14.568 634 HA ALA 72 HA ALA 72 -0.434 2.588 -12.081 635 HB1 ALA 72 3HB ALA 72 1.407 2.005 -13.714 636 HB2 ALA 72 1HB ALA 72 1.861 2.060 -12.012 637 HB3 ALA 72 2HB ALA 72 2.281 3.400 -13.080 638 H LEU 73 H LEU 73 1.078 5.693 -12.924 639 HA LEU 73 HA LEU 73 1.770 6.367 -10.267 640 HB2 LEU 73 1HB LEU 73 1.503 7.884 -12.825 641 HB3 LEU 73 2HB LEU 73 1.663 8.777 -11.324 642 HG LEU 73 HG LEU 73 3.787 7.507 -10.881 643 HD11 LEU 73 1HD1 LEU 73 4.877 6.349 -12.701 644 HD12 LEU 73 2HD1 LEU 73 3.505 6.663 -13.762 645 HD13 LEU 73 3HD1 LEU 73 3.316 5.594 -12.374 646 HD21 LEU 73 3HD2 LEU 73 3.806 9.778 -11.756 647 HD22 LEU 73 1HD2 LEU 73 3.683 9.155 -13.402 648 HD23 LEU 73 2HD2 LEU 73 5.125 8.827 -12.442 649 H LEU 74 H LEU 74 -1.135 6.983 -12.211 650 HA LEU 74 HA LEU 74 -2.377 8.625 -10.238 651 HB2 LEU 74 1HB LEU 74 -3.136 7.456 -12.826 652 HB3 LEU 74 2HB LEU 74 -4.464 7.687 -11.707 653 HG LEU 74 HG LEU 74 -3.596 10.110 -11.486 654 HD11 LEU 74 1HD1 LEU 74 -1.454 9.469 -12.747 655 HD12 LEU 74 2HD1 LEU 74 -2.244 10.989 -13.167 656 HD13 LEU 74 3HD1 LEU 74 -2.445 9.575 -14.202 657 HD21 LEU 74 3HD2 LEU 74 -4.830 9.143 -14.063 658 HD22 LEU 74 1HD2 LEU 74 -4.881 10.797 -13.452 659 HD23 LEU 74 2HD2 LEU 74 -5.693 9.505 -12.567 660 H LEU 75 H LEU 75 -2.505 5.190 -11.029 661 HA LEU 75 HA LEU 75 -4.590 4.574 -9.177 662 HB2 LEU 75 1HB LEU 75 -2.910 3.130 -11.038 663 HB3 LEU 75 2HB LEU 75 -3.048 2.260 -9.521 664 HG LEU 75 HG LEU 75 -5.651 2.867 -9.956 665 HD11 LEU 75 1HD1 LEU 75 -4.436 2.452 -12.684 666 HD12 LEU 75 2HD1 LEU 75 -5.193 3.934 -12.100 667 HD13 LEU 75 3HD1 LEU 75 -6.160 2.473 -12.307 668 HD21 LEU 75 3HD2 LEU 75 -4.174 0.491 -11.081 669 HD22 LEU 75 1HD2 LEU 75 -5.899 0.572 -10.732 670 HD23 LEU 75 2HD2 LEU 75 -4.728 0.667 -9.417 671 H LEU 76 H LEU 76 -1.072 4.592 -9.024 672 HA LEU 76 HA LEU 76 -0.870 3.428 -6.433 673 HB2 LEU 76 1HB LEU 76 0.916 3.785 -8.352 674 HB3 LEU 76 2HB LEU 76 1.217 5.282 -7.493 675 HG LEU 76 HG LEU 76 1.421 3.677 -5.408 676 HD11 LEU 76 1HD1 LEU 76 2.311 1.517 -5.920 677 HD12 LEU 76 2HD1 LEU 76 2.259 1.849 -7.651 678 HD13 LEU 76 3HD1 LEU 76 0.758 1.677 -6.741 679 HD21 LEU 76 3HD2 LEU 76 3.185 5.132 -6.229 680 HD22 LEU 76 1HD2 LEU 76 3.563 3.979 -7.511 681 HD23 LEU 76 2HD2 LEU 76 3.834 3.543 -5.823 682 H LEU 77 H LEU 77 -1.149 6.716 -7.654 683 HA LEU 77 HA LEU 77 -0.579 8.040 -5.211 684 HB2 LEU 77 1HB LEU 77 -0.666 8.930 -7.667 685 HB3 LEU 77 2HB LEU 77 -2.359 9.210 -7.315 686 HG LEU 77 HG LEU 77 -0.381 10.300 -5.382 687 HD11 LEU 77 1HD1 LEU 77 -0.041 12.298 -6.760 688 HD12 LEU 77 2HD1 LEU 77 -0.875 11.509 -8.099 689 HD13 LEU 77 3HD1 LEU 77 0.653 10.859 -7.507 690 HD21 LEU 77 3HD2 LEU 77 -2.936 11.364 -6.586 691 HD22 LEU 77 1HD2 LEU 77 -2.008 12.120 -5.291 692 HD23 LEU 77 2HD2 LEU 77 -2.784 10.560 -5.024 693 H VAL 78 H VAL 78 -3.628 7.067 -6.773 694 HA VAL 78 HA VAL 78 -5.319 8.183 -4.773 695 HB VAL 78 HB VAL 78 -5.941 5.970 -6.744 696 HG11 VAL 78 1HG1 VAL 78 -8.286 6.602 -6.403 697 HG12 VAL 78 2HG1 VAL 78 -7.794 7.753 -5.162 698 HG13 VAL 78 3HG1 VAL 78 -7.545 6.026 -4.909 699 HG21 VAL 78 3HG2 VAL 78 -6.386 8.948 -6.943 700 HG22 VAL 78 1HG2 VAL 78 -6.947 7.745 -8.105 701 HG23 VAL 78 2HG2 VAL 78 -5.219 8.004 -7.870 702 H VAL 79 H VAL 79 -4.073 4.891 -5.321 703 HA VAL 79 HA VAL 79 -5.451 3.692 -3.154 704 HB VAL 79 HB VAL 79 -2.945 2.810 -4.601 705 HG11 VAL 79 1HG1 VAL 79 -2.938 1.753 -2.440 706 HG12 VAL 79 2HG1 VAL 79 -3.428 0.566 -3.649 707 HG13 VAL 79 3HG1 VAL 79 -4.638 1.312 -2.603 708 HG21 VAL 79 3HG2 VAL 79 -4.495 1.197 -5.671 709 HG22 VAL 79 1HG2 VAL 79 -4.871 2.878 -6.045 710 HG23 VAL 79 2HG2 VAL 79 -5.839 2.001 -4.861 711 H ALA 80 H ALA 80 -2.196 5.093 -3.438 712 HA ALA 80 HA ALA 80 -1.347 4.419 -0.814 713 HB1 ALA 80 3HB ALA 80 0.229 4.976 -2.605 714 HB2 ALA 80 1HB ALA 80 0.470 5.994 -1.186 715 HB3 ALA 80 2HB ALA 80 -0.361 6.639 -2.602 716 H LEU 81 H LEU 81 -2.930 7.265 -2.192 717 HA LEU 81 HA LEU 81 -2.806 8.863 0.154 718 HB2 LEU 81 1HB LEU 81 -3.341 9.477 -2.347 719 HB3 LEU 81 2HB LEU 81 -4.995 9.160 -1.863 720 HG LEU 81 HG LEU 81 -4.346 10.838 0.102 721 HD11 LEU 81 1HD1 LEU 81 -2.581 11.692 -2.188 722 HD12 LEU 81 2HD1 LEU 81 -2.034 11.118 -0.612 723 HD13 LEU 81 3HD1 LEU 81 -2.923 12.636 -0.739 724 HD21 LEU 81 3HD2 LEU 81 -5.326 12.637 -1.247 725 HD22 LEU 81 1HD2 LEU 81 -6.206 11.120 -1.433 726 HD23 LEU 81 2HD2 LEU 81 -5.103 11.662 -2.698 727 H GLY 82 H GLY 82 -5.116 6.518 -1.093 728 HA2 GLY 82 1HA GLY 82 -7.207 7.044 0.755 729 HA3 GLY 82 2HA GLY 82 -7.005 5.572 -0.184 730 H ILE 83 H ILE 83 -4.741 4.457 0.698 731 HA ILE 83 HA ILE 83 -5.463 3.379 3.218 732 HB ILE 83 HB ILE 83 -2.736 3.167 1.929 733 HG12 ILE 83 1HG1 ILE 83 -4.908 1.126 1.559 734 HG13 ILE 83 2HG1 ILE 83 -4.853 2.540 0.511 735 HG21 ILE 83 1HG2 ILE 83 -2.827 2.385 4.233 736 HG22 ILE 83 2HG2 ILE 83 -2.629 1.024 3.129 737 HG23 ILE 83 3HG2 ILE 83 -4.206 1.355 3.846 738 HD11 ILE 83 3HD1 ILE 83 -2.679 0.488 0.855 739 HD12 ILE 83 1HD1 ILE 83 -2.571 1.927 -0.156 740 HD13 ILE 83 2HD1 ILE 83 -3.748 0.671 -0.536 741 H GLY 84 H GLY 84 -3.194 5.885 2.231 742 HA2 GLY 84 1HA GLY 84 -1.824 6.158 4.692 743 HA3 GLY 84 2HA GLY 84 -1.933 7.382 3.436 744 H LEU 85 H LEU 85 -4.639 7.880 3.365 745 HA LEU 85 HA LEU 85 -4.966 9.529 5.685 746 HB2 LEU 85 1HB LEU 85 -6.732 8.968 3.309 747 HB3 LEU 85 2HB LEU 85 -7.198 10.055 4.602 748 HG LEU 85 HG LEU 85 -4.612 10.514 3.169 749 HD11 LEU 85 1HD1 LEU 85 -7.337 11.328 2.172 750 HD12 LEU 85 2HD1 LEU 85 -6.211 10.228 1.375 751 HD13 LEU 85 3HD1 LEU 85 -5.802 11.935 1.550 752 HD21 LEU 85 3HD2 LEU 85 -5.118 12.843 3.713 753 HD22 LEU 85 1HD2 LEU 85 -5.121 11.832 5.157 754 HD23 LEU 85 2HD2 LEU 85 -6.647 12.344 4.437 755 H PHE 86 H PHE 86 -6.064 6.381 4.728 756 HA PHE 86 HA PHE 86 -8.264 6.245 6.573 757 HB2 PHE 86 1HB PHE 86 -7.825 4.883 4.373 758 HB3 PHE 86 2HB PHE 86 -6.927 3.813 5.442 759 HD1 PHE 86 HD1 PHE 86 -8.061 2.494 7.125 760 HD2 PHE 86 HD2 PHE 86 -10.229 5.083 4.534 761 HE1 PHE 86 HE1 PHE 86 -10.157 1.377 7.770 762 HE2 PHE 86 HE2 PHE 86 -12.329 3.973 5.176 763 HZ PHE 86 HZ PHE 86 -12.294 2.118 6.795 764 H ILE 87 H ILE 87 -4.883 5.219 6.583 765 HA ILE 87 HA ILE 87 -5.126 3.899 9.149 766 HB ILE 87 HB ILE 87 -2.643 4.520 7.537 767 HG12 ILE 87 1HG1 ILE 87 -4.096 3.015 6.298 768 HG13 ILE 87 2HG1 ILE 87 -2.710 2.121 6.905 769 HG21 ILE 87 1HG2 ILE 87 -3.006 2.675 9.896 770 HG22 ILE 87 2HG2 ILE 87 -2.122 4.201 9.887 771 HG23 ILE 87 3HG2 ILE 87 -1.537 2.837 8.934 772 HD11 ILE 87 3HD1 ILE 87 -4.576 0.725 7.202 773 HD12 ILE 87 1HD1 ILE 87 -5.549 2.033 7.878 774 HD13 ILE 87 2HD1 ILE 87 -4.206 1.365 8.804 775 H ARG 88 H ARG 88 -3.983 6.989 7.908 776 HA ARG 88 HA ARG 88 -2.630 7.856 10.237 777 HB2 ARG 88 1HB ARG 88 -2.751 8.816 7.756 778 HB3 ARG 88 2HB ARG 88 -3.975 9.848 8.480 779 HG2 ARG 88 1HG ARG 88 -2.355 10.611 10.141 780 HG3 ARG 88 2HG ARG 88 -1.126 9.571 9.417 781 HD2 ARG 88 1HD ARG 88 -2.578 11.691 7.856 782 HD3 ARG 88 2HD ARG 88 -1.097 12.026 8.751 783 HE ARG 88 HE ARG 88 -0.653 9.811 7.097 784 HH11 ARG 88 1HH1 ARG 88 -1.240 13.244 6.816 785 HH12 ARG 88 2HH1 ARG 88 -0.370 13.396 5.325 786 HH21 ARG 88 1HH2 ARG 88 0.488 10.012 5.140 787 HH22 ARG 88 2HH2 ARG 88 0.608 11.562 4.374 788 H ARG 89 H ARG 89 -5.988 7.779 9.357 789 HA ARG 89 HA ARG 89 -6.834 9.630 11.407 790 HB2 ARG 89 1HB ARG 89 -8.300 7.862 9.460 791 HB3 ARG 89 2HB ARG 89 -9.146 8.744 10.723 792 HG2 ARG 89 1HG ARG 89 -8.288 10.851 9.831 793 HG3 ARG 89 2HG ARG 89 -7.437 9.967 8.565 794 HD2 ARG 89 1HD ARG 89 -9.573 9.116 7.726 795 HD3 ARG 89 2HD ARG 89 -10.424 10.001 8.993 796 HE ARG 89 HE ARG 89 -8.857 11.814 7.548 797 HH11 ARG 89 1HH1 ARG 89 -11.668 9.792 7.076 798 HH12 ARG 89 2HH1 ARG 89 -12.368 10.832 5.880 799 HH21 ARG 89 1HH2 ARG 89 -9.779 13.177 5.978 800 HH22 ARG 89 2HH2 ARG 89 -11.295 12.752 5.257 801 H ARG 90 H ARG 90 -6.124 6.294 11.226 802 HA ARG 90 HA ARG 90 -7.830 5.499 13.425 803 HB2 ARG 90 1HB ARG 90 -5.745 4.070 11.790 804 HB3 ARG 90 2HB ARG 90 -6.490 3.327 13.198 805 HG2 ARG 90 1HG ARG 90 -8.690 3.558 12.159 806 HG3 ARG 90 2HG ARG 90 -7.941 4.304 10.745 807 HD2 ARG 90 1HD ARG 90 -8.266 2.052 10.156 808 HD3 ARG 90 2HD ARG 90 -6.553 2.186 10.548 809 HE ARG 90 HE ARG 90 -7.931 1.418 12.860 810 HH11 ARG 90 1HH1 ARG 90 -7.110 0.119 9.721 811 HH12 ARG 90 2HH1 ARG 90 -7.106 -1.526 10.266 812 HH21 ARG 90 1HH2 ARG 90 -7.926 -0.743 13.571 813 HH22 ARG 90 2HH2 ARG 90 -7.570 -2.014 12.450 814 H HIS 91 H HIS 91 -4.635 6.724 13.016 815 HA HIS 91 HA HIS 91 -3.634 5.731 15.540 816 HB2 HIS 91 1HB HIS 91 -2.537 7.492 13.376 817 HB3 HIS 91 2HB HIS 91 -1.745 7.433 14.946 818 HD1 HIS 91 HD1 HIS 91 -2.060 5.619 11.774 819 HD2 HIS 91 HD2 HIS 91 -0.728 4.812 15.627 820 HE1 HIS 91 HE1 HIS 91 -0.710 3.506 11.590 821 HE2 HIS 91 HE2 HIS 91 0.158 3.085 13.917 822 H ILE 92 H ILE 92 -5.392 8.470 14.442 823 HA ILE 92 HA ILE 92 -4.641 10.195 16.642 824 HB ILE 92 HB ILE 92 -6.994 10.643 14.816 825 HG12 ILE 92 1HG1 ILE 92 -5.129 10.180 13.330 826 HG13 ILE 92 2HG1 ILE 92 -5.475 11.903 13.305 827 HG21 ILE 92 1HG2 ILE 92 -6.495 13.013 15.226 828 HG22 ILE 92 2HG2 ILE 92 -5.164 12.541 16.283 829 HG23 ILE 92 3HG2 ILE 92 -6.824 12.133 16.720 830 HD11 ILE 92 3HD1 ILE 92 -3.085 11.480 13.299 831 HD12 ILE 92 1HD1 ILE 92 -3.226 10.572 14.805 832 HD13 ILE 92 2HD1 ILE 92 -3.567 12.303 14.783 833 H VAL 93 H VAL 93 -7.183 7.933 15.873 834 HA VAL 93 HA VAL 93 -8.751 8.728 18.212 835 HB VAL 93 HB VAL 93 -9.518 6.465 16.393 836 HG11 VAL 93 1HG1 VAL 93 -11.117 8.495 17.951 837 HG12 VAL 93 2HG1 VAL 93 -10.837 6.815 18.408 838 HG13 VAL 93 3HG1 VAL 93 -11.789 7.191 16.972 839 HG21 VAL 93 3HG2 VAL 93 -9.988 9.391 15.821 840 HG22 VAL 93 1HG2 VAL 93 -10.710 8.044 14.941 841 HG23 VAL 93 2HG2 VAL 93 -8.965 8.299 14.887 842 H ARG 94 H ARG 94 -6.194 6.740 17.576 843 HA ARG 94 HA ARG 94 -7.008 4.542 19.305 844 HB2 ARG 94 1HB ARG 94 -5.496 4.490 17.118 845 HB3 ARG 94 2HB ARG 94 -4.218 4.807 18.283 846 HG2 ARG 94 1HG ARG 94 -5.024 2.803 19.563 847 HG3 ARG 94 2HG ARG 94 -6.081 2.448 18.193 848 HD2 ARG 94 1HD ARG 94 -4.077 2.409 16.728 849 HD3 ARG 94 2HD ARG 94 -3.069 2.623 18.161 850 HE ARG 94 HE ARG 94 -4.727 0.406 18.570 851 HH11 ARG 94 1HH1 ARG 94 -2.045 1.358 16.542 852 HH12 ARG 94 2HH1 ARG 94 -1.448 -0.259 16.361 853 HH21 ARG 94 1HH2 ARG 94 -3.940 -1.713 18.332 854 HH22 ARG 94 2HH2 ARG 94 -2.523 -2.000 17.378 855 H LYS 95 H LYS 95 -5.718 3.902 21.147 856 HA LYS 95 HA LYS 95 -4.818 6.215 22.680 857 HB2 LYS 95 1HB LYS 95 -5.543 3.387 23.431 858 HB3 LYS 95 2HB LYS 95 -4.773 4.483 24.570 859 HG2 LYS 95 1HG LYS 95 -6.643 6.038 24.344 860 HG3 LYS 95 2HG LYS 95 -7.416 4.941 23.199 861 HD2 LYS 95 1HD LYS 95 -7.528 3.216 24.933 862 HD3 LYS 95 2HD LYS 95 -6.754 4.315 26.076 863 HE2 LYS 95 1HE LYS 95 -8.636 5.865 25.858 864 HE3 LYS 95 2HE LYS 95 -9.408 4.766 24.714 865 HZ1 LYS 95 3HZ LYS 95 -9.529 3.096 26.457 866 HZ2 LYS 95 1HZ LYS 95 -10.320 4.514 26.934 867 HZ3 LYS 95 2HZ LYS 95 -8.790 4.150 27.553 868 H ARG 96 H ARG 96 -2.860 6.116 23.958 869 HA ARG 96 HA ARG 96 -0.679 4.919 22.468 870 HB2 ARG 96 1HB ARG 96 -0.805 6.938 24.699 871 HB3 ARG 96 2HB ARG 96 0.718 6.256 24.148 872 HG2 ARG 96 1HG ARG 96 0.298 7.123 21.903 873 HG3 ARG 96 2HG ARG 96 -1.231 7.807 22.455 874 HD2 ARG 96 1HD ARG 96 -0.022 9.213 24.054 875 HD3 ARG 96 2HD ARG 96 1.506 8.527 23.502 876 HE ARG 96 HE ARG 96 0.160 9.587 21.288 877 HH11 ARG 96 1HH1 ARG 96 1.720 10.700 24.212 878 HH12 ARG 96 2HH1 ARG 96 2.164 12.232 23.538 879 HH21 ARG 96 1HH2 ARG 96 0.745 11.601 20.406 880 HH22 ARG 96 2HH2 ARG 96 1.611 12.744 21.379 881 H THR 97 H THR 97 -2.474 3.240 24.099 882 HA THR 97 HA THR 97 -0.919 2.388 26.384 883 HB THR 97 HB THR 97 -2.660 0.530 26.479 884 HG1 THR 97 HG1 THR 97 -4.356 0.636 25.103 885 HG21 THR 97 3HG2 THR 97 -3.615 3.396 26.572 886 HG22 THR 97 1HG2 THR 97 -2.802 2.532 27.876 887 HG23 THR 97 2HG2 THR 97 -4.405 2.023 27.346 888 H LEU 98 H LEU 98 -0.889 1.722 23.075 889 HA LEU 98 HA LEU 98 0.117 -0.992 23.351 890 HB2 LEU 98 1HB LEU 98 -0.567 0.722 20.976 891 HB3 LEU 98 2HB LEU 98 0.304 -0.787 20.798 892 HG LEU 98 HG LEU 98 -1.955 -1.278 20.321 893 HD11 LEU 98 1HD1 LEU 98 -2.410 -3.016 21.757 894 HD12 LEU 98 2HD1 LEU 98 -1.883 -2.126 23.185 895 HD13 LEU 98 3HD1 LEU 98 -0.692 -2.752 22.046 896 HD21 LEU 98 3HD2 LEU 98 -2.966 0.736 21.242 897 HD22 LEU 98 1HD2 LEU 98 -2.710 0.131 22.879 898 HD23 LEU 98 2HD2 LEU 98 -3.820 -0.706 21.794 899 H ARG 99 H ARG 99 1.235 2.153 23.199 900 HA ARG 99 HA ARG 99 3.921 1.484 22.295 901 HB2 ARG 99 1HB ARG 99 2.446 4.090 22.640 902 HB3 ARG 99 2HB ARG 99 4.197 4.041 22.485 903 HG2 ARG 99 1HG ARG 99 4.059 3.117 20.297 904 HG3 ARG 99 2HG ARG 99 2.321 2.852 20.457 905 HD2 ARG 99 1HD ARG 99 3.498 5.598 20.683 906 HD3 ARG 99 2HD ARG 99 3.143 4.890 19.109 907 HE ARG 99 HE ARG 99 0.954 4.842 20.998 908 HH11 ARG 99 1HH1 ARG 99 2.517 6.604 18.415 909 HH12 ARG 99 2HH1 ARG 99 1.094 7.503 18.001 910 HH21 ARG 99 1HH2 ARG 99 -0.912 6.025 20.452 911 HH22 ARG 99 2HH2 ARG 99 -0.849 7.174 19.159 912 H ARG 100 H ARG 100 1.984 2.665 24.947 913 HA ARG 100 HA ARG 100 4.179 3.135 26.744 914 HB2 ARG 100 1HB ARG 100 1.193 2.959 27.059 915 HB3 ARG 100 2HB ARG 100 2.235 3.006 28.475 916 HG2 ARG 100 1HG ARG 100 3.156 5.141 27.728 917 HG3 ARG 100 2HG ARG 100 2.111 5.093 26.307 918 HD2 ARG 100 1HD ARG 100 0.141 5.106 27.760 919 HD3 ARG 100 2HD ARG 100 1.187 5.153 29.179 920 HE ARG 100 HE ARG 100 1.846 7.310 27.526 921 HH11 ARG 100 1HH1 ARG 100 -0.810 6.229 29.523 922 HH12 ARG 100 2HH1 ARG 100 -1.359 7.835 29.876 923 HH21 ARG 100 1HH2 ARG 100 1.123 9.417 27.991 924 HH22 ARG 100 2HH2 ARG 100 -0.263 9.642 29.006 925 H LEU 101 H LEU 101 2.422 0.481 25.605 926 HA LEU 101 HA LEU 101 3.464 -1.291 27.684 927 HB2 LEU 101 1HB LEU 101 1.057 -1.365 25.947 928 HB3 LEU 101 2HB LEU 101 1.826 -2.899 26.292 929 HG LEU 101 HG LEU 101 0.058 -2.625 27.858 930 HD11 LEU 101 1HD1 LEU 101 2.414 -3.341 28.675 931 HD12 LEU 101 2HD1 LEU 101 1.140 -3.015 29.849 932 HD13 LEU 101 3HD1 LEU 101 2.381 -1.804 29.540 933 HD21 LEU 101 3HD2 LEU 101 -0.364 -0.278 27.705 934 HD22 LEU 101 1HD2 LEU 101 1.205 0.102 28.420 935 HD23 LEU 101 2HD2 LEU 101 -0.046 -0.672 29.394 936 H LEU 102 H LEU 102 3.689 -0.339 24.374 937 HA LEU 102 HA LEU 102 4.734 -2.722 23.253 938 HB2 LEU 102 1HB LEU 102 3.984 -0.559 22.072 939 HB3 LEU 102 2HB LEU 102 5.606 0.023 22.392 940 HG LEU 102 HG LEU 102 5.394 -2.609 21.041 941 HD11 LEU 102 1HD1 LEU 102 5.042 -1.566 18.854 942 HD12 LEU 102 2HD1 LEU 102 4.743 -0.018 19.643 943 HD13 LEU 102 3HD1 LEU 102 3.640 -1.370 19.904 944 HD21 LEU 102 3HD2 LEU 102 7.308 -1.728 19.807 945 HD22 LEU 102 1HD2 LEU 102 7.555 -1.585 21.546 946 HD23 LEU 102 2HD2 LEU 102 7.108 -0.165 20.600 947 H GLN 103 H GLN 103 6.335 0.030 24.795 948 HA GLN 103 HA GLN 103 8.918 -1.315 24.634 949 HB2 GLN 103 1HB GLN 103 8.352 1.266 24.307 950 HB3 GLN 103 2HB GLN 103 8.567 1.287 26.052 951 HG2 GLN 103 1HG GLN 103 10.810 0.356 25.789 952 HG3 GLN 103 2HG GLN 103 10.594 0.335 24.039 953 HE21 GLN 103 2HE2 GLN 103 10.597 2.275 22.901 954 HE22 GLN 103 1HE2 GLN 103 11.204 3.740 23.586 955 H GLU 104 H GLU 104 6.286 -1.120 26.734 956 HA GLU 104 HA GLU 104 7.809 -1.349 29.196 957 HB2 GLU 104 1HB GLU 104 5.330 -0.415 28.697 958 HB3 GLU 104 2HB GLU 104 4.937 -2.057 29.188 959 HG2 GLU 104 1HG GLU 104 6.136 -1.720 31.288 960 HG3 GLU 104 2HG GLU 104 6.534 -0.075 30.795 961 H ARG 105 H ARG 105 5.808 -3.493 27.190 962 HA ARG 105 HA ARG 105 6.448 -5.782 28.859 963 HB2 ARG 105 1HB ARG 105 4.660 -5.366 26.480 964 HB3 ARG 105 2HB ARG 105 5.051 -6.984 27.045 965 HG2 ARG 105 1HG ARG 105 4.030 -5.004 29.014 966 HG3 ARG 105 2HG ARG 105 2.899 -5.727 27.871 967 HD2 ARG 105 1HD ARG 105 3.589 -7.959 28.604 968 HD3 ARG 105 2HD ARG 105 4.721 -7.234 29.745 969 HE ARG 105 HE ARG 105 2.168 -6.208 30.259 970 HH11 ARG 105 1HH1 ARG 105 3.888 -9.243 30.483 971 HH12 ARG 105 2HH1 ARG 105 2.932 -9.830 31.801 972 HH21 ARG 105 1HH2 ARG 105 0.913 -6.981 31.991 973 HH22 ARG 105 2HH2 ARG 105 1.243 -8.546 32.657 974 H GLU 106 H GLU 106 7.853 -4.213 26.238 975 HA GLU 106 HA GLU 106 8.818 -6.346 24.683 976 HB2 GLU 106 1HB GLU 106 8.868 -3.706 24.363 977 HB3 GLU 106 2HB GLU 106 10.488 -3.901 25.016 978 HG2 GLU 106 1HG GLU 106 11.019 -5.485 23.235 979 HG3 GLU 106 2HG GLU 106 9.393 -5.291 22.581 980 H LEU 107 H LEU 107 10.543 -4.483 27.217 981 HA LEU 107 HA LEU 107 11.929 -6.894 28.043 982 HB2 LEU 107 1HB LEU 107 13.222 -5.656 26.146 983 HB3 LEU 107 2HB LEU 107 13.627 -4.504 27.403 984 HG LEU 107 HG LEU 107 14.413 -6.693 28.678 985 HD11 LEU 107 1HD1 LEU 107 13.672 -8.243 26.951 986 HD12 LEU 107 2HD1 LEU 107 15.424 -8.296 27.135 987 HD13 LEU 107 3HD1 LEU 107 14.706 -7.440 25.771 988 HD21 LEU 107 3HD2 LEU 107 15.986 -5.330 26.496 989 HD22 LEU 107 1HD2 LEU 107 16.670 -6.290 27.808 990 HD23 LEU 107 2HD2 LEU 107 15.823 -4.783 28.166 991 H VAL 108 H VAL 108 10.013 -4.967 29.164 992 HA VAL 108 HA VAL 108 11.554 -4.194 31.554 993 HB VAL 108 HB VAL 108 9.139 -2.633 30.649 994 HG11 VAL 108 1HG1 VAL 108 9.816 -2.366 32.971 995 HG12 VAL 108 2HG1 VAL 108 10.114 -0.882 32.065 996 HG13 VAL 108 3HG1 VAL 108 11.455 -1.957 32.462 997 HG21 VAL 108 3HG2 VAL 108 10.560 -1.005 29.588 998 HG22 VAL 108 1HG2 VAL 108 10.848 -2.581 28.849 999 HG23 VAL 108 2HG2 VAL 108 12.001 -1.926 30.012 1000 H GLU 109 H GLU 109 10.673 -6.569 31.785 1001 HA GLU 109 HA GLU 109 7.937 -6.609 32.813 1002 HB2 GLU 109 1HB GLU 109 9.942 -8.770 32.190 1003 HB3 GLU 109 2HB GLU 109 8.460 -9.104 33.074 1004 HG2 GLU 109 1HG GLU 109 7.146 -8.289 31.183 1005 HG3 GLU 109 2HG GLU 109 8.633 -7.955 30.297 1006 HA PRO 110 HA PRO 110 9.170 -6.332 37.055 1007 HB2 PRO 110 1HB PRO 110 7.166 -7.753 38.250 1008 HB3 PRO 110 2HB PRO 110 6.943 -6.118 37.596 1009 HG2 PRO 110 1HG PRO 110 6.212 -8.743 36.398 1010 HG3 PRO 110 2HG PRO 110 5.312 -7.212 36.405 1011 HD2 PRO 110 1HD PRO 110 6.723 -8.061 34.256 1012 HD3 PRO 110 2HD PRO 110 6.502 -6.344 34.647 1013 H LEU 111 H LEU 111 10.603 -7.382 38.288 1014 HA LEU 111 HA LEU 111 10.538 -10.277 38.491 1015 HB2 LEU 111 1HB LEU 111 12.113 -9.437 36.596 1016 HB3 LEU 111 2HB LEU 111 13.160 -8.936 37.910 1017 HG LEU 111 HG LEU 111 12.822 -11.455 38.675 1018 HD11 LEU 111 1HD1 LEU 111 11.244 -12.024 36.910 1019 HD12 LEU 111 2HD1 LEU 111 12.732 -12.957 36.749 1020 HD13 LEU 111 3HD1 LEU 111 12.436 -11.580 35.687 1021 HD21 LEU 111 3HD2 LEU 111 14.674 -10.577 36.461 1022 HD22 LEU 111 1HD2 LEU 111 14.883 -12.013 37.464 1023 HD23 LEU 111 2HD2 LEU 111 14.961 -10.408 38.194 1024 H THR 112 H THR 112 9.875 -9.905 40.604 1025 HA THR 112 HA THR 112 11.750 -8.563 42.408 1026 HB THR 112 HB THR 112 9.905 -8.952 44.124 1027 HG1 THR 112 HG1 THR 112 7.792 -9.204 42.945 1028 HG21 THR 112 3HG2 THR 112 9.271 -7.262 41.701 1029 HG22 THR 112 1HG2 THR 112 10.271 -6.777 43.069 1030 HG23 THR 112 2HG2 THR 112 8.549 -7.079 43.299 1031 HA PRO 113 HA PRO 113 13.375 -12.327 44.103 1032 HB2 PRO 113 1HB PRO 113 13.213 -11.207 46.823 1033 HB3 PRO 113 2HB PRO 113 14.644 -11.630 45.868 1034 HG2 PRO 113 1HG PRO 113 14.007 -9.091 46.387 1035 HG3 PRO 113 2HG PRO 113 14.758 -9.585 44.856 1036 HD2 PRO 113 1HD PRO 113 11.895 -8.939 45.425 1037 HD3 PRO 113 2HD PRO 113 12.894 -8.510 44.022 1038 H SER 114 H SER 114 12.231 -14.123 44.271 1039 HA SER 114 HA SER 114 9.830 -14.176 45.953 1040 HB2 SER 114 1HB SER 114 9.348 -16.323 44.737 1041 HB3 SER 114 2HB SER 114 9.429 -14.907 43.692 1042 HG SER 114 HG SER 114 11.807 -15.666 43.582 1043 H GLY 115 H GLY 115 13.067 -15.052 46.036 1044 HA2 GLY 115 1HA GLY 115 12.556 -17.214 47.984 1045 HA3 GLY 115 2HA GLY 115 14.029 -17.052 47.043 1046 H GLU 116 H GLU 116 15.666 -15.771 47.772 1047 HA GLU 116 HA GLU 116 15.332 -14.692 50.482 1048 HB2 GLU 116 1HB GLU 116 17.752 -15.601 48.933 1049 HB3 GLU 116 2HB GLU 116 17.892 -14.672 50.418 1050 HG2 GLU 116 1HG GLU 116 16.684 -16.417 51.625 1051 HG3 GLU 116 2HG GLU 116 16.543 -17.348 50.136 1052 H LYS 117 H LYS 117 16.097 -12.629 51.028 1053 HA LYS 117 HA LYS 117 15.923 -10.704 48.880 1054 HB2 LYS 117 1HB LYS 117 16.057 -10.462 51.877 1055 HB3 LYS 117 2HB LYS 117 16.152 -9.055 50.829 1056 HG2 LYS 117 1HG LYS 117 13.959 -9.600 49.897 1057 HG3 LYS 117 2HG LYS 117 13.865 -11.013 50.951 1058 HD2 LYS 117 1HD LYS 117 13.974 -9.552 52.913 1059 HD3 LYS 117 2HD LYS 117 14.074 -8.141 51.857 1060 HE2 LYS 117 1HE LYS 117 11.871 -8.681 50.935 1061 HE3 LYS 117 2HE LYS 117 11.775 -10.091 51.990 1062 HZ1 LYS 117 3HZ LYS 117 11.857 -8.617 53.905 1063 HZ2 LYS 117 1HZ LYS 117 10.553 -8.221 52.902 1064 HZ3 LYS 117 2HZ LYS 117 11.948 -7.267 52.893 1065 H LEU 118 H LEU 118 18.323 -11.747 51.266 1066 HA LEU 118 HA LEU 118 20.318 -9.953 50.167 1067 HB2 LEU 118 1HB LEU 118 20.217 -11.780 52.537 1068 HB3 LEU 118 2HB LEU 118 21.759 -11.190 51.957 1069 HG LEU 118 HG LEU 118 21.032 -9.825 53.797 1070 HD11 LEU 118 1HD1 LEU 118 20.472 -8.077 51.442 1071 HD12 LEU 118 2HD1 LEU 118 22.067 -8.796 51.661 1072 HD13 LEU 118 3HD1 LEU 118 21.400 -7.734 52.901 1073 HD21 LEU 118 3HD2 LEU 118 18.520 -9.304 52.215 1074 HD22 LEU 118 1HD2 LEU 118 18.963 -8.521 53.733 1075 HD23 LEU 118 2HD2 LEU 118 18.642 -10.255 53.696 1076 H TRP 119 H TRP 119 19.194 -13.024 49.516 1077 HA TRP 119 HA TRP 119 21.680 -13.705 48.097 1078 HB2 TRP 119 1HB TRP 119 19.947 -15.550 49.747 1079 HB3 TRP 119 2HB TRP 119 21.114 -16.136 48.564 1080 HD1 TRP 119 HD1 TRP 119 23.700 -15.924 49.175 1081 HE1 TRP 119 HE1 TRP 119 24.924 -15.531 51.404 1082 HE3 TRP 119 HE3 TRP 119 19.754 -14.301 52.001 1083 HZ2 TRP 119 HZ2 TRP 119 24.302 -14.652 54.011 1084 HZ3 TRP 119 HZ3 TRP 119 20.158 -13.705 54.354 1085 HH2 TRP 119 HH2 TRP 119 22.385 -13.878 55.337 1086 H SER 120 H SER 120 21.444 -14.663 46.095 1087 HA SER 120 HA SER 120 18.747 -14.493 44.953 1088 HB2 SER 120 1HB SER 120 19.957 -14.483 42.750 1089 HB3 SER 120 2HB SER 120 20.345 -13.114 43.793 1090 HG SER 120 HG SER 120 22.318 -13.902 44.129 Start of MODEL 4 1 H1 LYS 1 1H LYS 1 0.537 -1.461 -34.700 2 H2 LYS 1 2H LYS 1 -0.125 -2.877 -34.055 3 H3 LYS 1 3H LYS 1 1.046 -2.021 -33.186 4 HA LYS 1 HA LYS 1 -0.436 -0.157 -32.926 5 HB2 LYS 1 1HB LYS 1 -2.278 -1.913 -34.546 6 HB3 LYS 1 2HB LYS 1 -2.875 -0.589 -33.554 7 HG2 LYS 1 1HG LYS 1 -1.525 0.989 -34.843 8 HG3 LYS 1 2HG LYS 1 -0.924 -0.340 -35.836 9 HD2 LYS 1 1HD LYS 1 -3.208 -0.812 -36.583 10 HD3 LYS 1 2HD LYS 1 -3.807 0.516 -35.589 11 HE2 LYS 1 1HE LYS 1 -2.463 2.094 -36.890 12 HE3 LYS 1 2HE LYS 1 -1.863 0.766 -37.881 13 HZ1 LYS 1 3HZ LYS 1 -4.700 1.621 -37.670 14 HZ2 LYS 1 1HZ LYS 1 -4.125 0.345 -38.623 15 HZ3 LYS 1 2HZ LYS 1 -3.668 1.935 -38.974 16 H ILE 2 H ILE 2 -1.158 -0.062 -30.896 17 HA ILE 2 HA ILE 2 -2.334 -2.457 -29.677 18 HB ILE 2 HB ILE 2 -1.009 -1.848 -27.553 19 HG12 ILE 2 1HG1 ILE 2 1.394 -1.063 -28.501 20 HG13 ILE 2 2HG1 ILE 2 0.344 -0.177 -29.603 21 HG21 ILE 2 1HG2 ILE 2 0.378 -3.095 -29.918 22 HG22 ILE 2 2HG2 ILE 2 -0.699 -3.910 -28.784 23 HG23 ILE 2 3HG2 ILE 2 0.857 -3.288 -28.231 24 HD11 ILE 2 3HD1 ILE 2 0.283 -0.022 -26.597 25 HD12 ILE 2 1HD1 ILE 2 -0.768 0.867 -27.700 26 HD13 ILE 2 2HD1 ILE 2 0.967 1.181 -27.692 27 HA PRO 3 HA PRO 3 -5.281 0.417 -28.047 28 HB2 PRO 3 1HB PRO 3 -6.142 -0.966 -25.855 29 HB3 PRO 3 2HB PRO 3 -6.606 -1.391 -27.513 30 HG2 PRO 3 1HG PRO 3 -4.537 -2.621 -25.763 31 HG3 PRO 3 2HG PRO 3 -5.690 -3.395 -26.868 32 HD2 PRO 3 1HD PRO 3 -3.089 -3.007 -27.512 33 HD3 PRO 3 2HD PRO 3 -4.391 -3.004 -28.718 34 H SER 4 H SER 4 -5.352 2.112 -26.663 35 HA SER 4 HA SER 4 -3.102 2.536 -24.911 36 HB2 SER 4 1HB SER 4 -5.501 4.286 -25.502 37 HB3 SER 4 2HB SER 4 -4.079 4.784 -24.587 38 HG SER 4 HG SER 4 -4.119 3.935 -27.297 39 H ILE 5 H ILE 5 -6.071 1.063 -24.526 40 HA ILE 5 HA ILE 5 -6.609 1.940 -21.823 41 HB ILE 5 HB ILE 5 -7.870 -0.443 -23.176 42 HG12 ILE 5 1HG1 ILE 5 -9.692 1.542 -23.543 43 HG13 ILE 5 2HG1 ILE 5 -8.193 2.437 -23.768 44 HG21 ILE 5 1HG2 ILE 5 -9.779 0.117 -21.736 45 HG22 ILE 5 2HG2 ILE 5 -8.861 1.458 -21.051 46 HG23 ILE 5 3HG2 ILE 5 -8.320 -0.201 -20.797 47 HD11 ILE 5 3HD1 ILE 5 -8.983 -0.048 -25.268 48 HD12 ILE 5 1HD1 ILE 5 -7.519 0.901 -25.519 49 HD13 ILE 5 2HD1 ILE 5 -9.096 1.604 -25.874 50 H ALA 6 H ALA 6 -5.047 -0.764 -23.413 51 HA ALA 6 HA ALA 6 -4.804 -2.318 -20.984 52 HB1 ALA 6 3HB ALA 6 -5.096 -3.395 -23.186 53 HB2 ALA 6 1HB ALA 6 -3.644 -3.937 -22.344 54 HB3 ALA 6 2HB ALA 6 -3.517 -2.780 -23.669 55 H THR 7 H THR 7 -2.897 -0.033 -22.784 56 HA THR 7 HA THR 7 -0.337 -0.662 -21.779 57 HB THR 7 HB THR 7 -1.071 2.163 -22.442 58 HG1 THR 7 HG1 THR 7 -0.448 0.636 -24.631 59 HG21 THR 7 3HG2 THR 7 1.118 2.078 -23.595 60 HG22 THR 7 1HG2 THR 7 1.294 0.396 -23.090 61 HG23 THR 7 2HG2 THR 7 1.244 1.680 -21.881 62 H GLY 8 H GLY 8 -2.974 1.260 -20.480 63 HA2 GLY 8 1HA GLY 8 -1.381 2.400 -18.349 64 HA3 GLY 8 2HA GLY 8 -3.117 2.558 -18.555 65 H LEU 9 H LEU 9 -3.814 -0.143 -18.669 66 HA LEU 9 HA LEU 9 -4.070 -0.782 -15.949 67 HB2 LEU 9 1HB LEU 9 -4.458 -2.483 -18.413 68 HB3 LEU 9 2HB LEU 9 -4.896 -2.998 -16.795 69 HG LEU 9 HG LEU 9 -6.047 -0.472 -17.942 70 HD11 LEU 9 1HD1 LEU 9 -8.020 -1.918 -18.589 71 HD12 LEU 9 2HD1 LEU 9 -6.928 -3.297 -18.465 72 HD13 LEU 9 3HD1 LEU 9 -6.603 -2.015 -19.633 73 HD21 LEU 9 3HD2 LEU 9 -7.899 -1.045 -16.421 74 HD22 LEU 9 1HD2 LEU 9 -6.366 -0.854 -15.569 75 HD23 LEU 9 2HD2 LEU 9 -7.001 -2.467 -15.889 76 H VAL 10 H VAL 10 -1.907 -2.079 -18.452 77 HA VAL 10 HA VAL 10 -0.760 -4.113 -16.907 78 HB VAL 10 HB VAL 10 1.151 -4.036 -18.496 79 HG11 VAL 10 1HG1 VAL 10 -1.672 -4.073 -19.519 80 HG12 VAL 10 2HG1 VAL 10 -0.616 -5.435 -19.131 81 HG13 VAL 10 3HG1 VAL 10 -0.297 -4.450 -20.560 82 HG21 VAL 10 3HG2 VAL 10 1.257 -1.645 -18.922 83 HG22 VAL 10 1HG2 VAL 10 -0.336 -1.689 -19.677 84 HG23 VAL 10 2HG2 VAL 10 1.023 -2.520 -20.434 85 H GLY 11 H GLY 11 0.065 -0.722 -17.207 86 HA2 GLY 11 1HA GLY 11 2.513 -0.833 -15.756 87 HA3 GLY 11 2HA GLY 11 1.572 0.615 -16.080 88 H ALA 12 H ALA 12 -0.776 0.148 -14.789 89 HA ALA 12 HA ALA 12 -0.015 0.606 -12.074 90 HB1 ALA 12 3HB ALA 12 -1.938 1.696 -13.312 91 HB2 ALA 12 1HB ALA 12 -2.266 1.151 -11.668 92 HB3 ALA 12 2HB ALA 12 -2.828 0.198 -13.041 93 H LEU 13 H LEU 13 -1.644 -2.069 -13.728 94 HA LEU 13 HA LEU 13 -2.241 -3.529 -11.382 95 HB2 LEU 13 1HB LEU 13 -2.119 -4.166 -14.295 96 HB3 LEU 13 2HB LEU 13 -2.206 -5.490 -13.151 97 HG LEU 13 HG LEU 13 -4.297 -4.469 -12.219 98 HD11 LEU 13 1HD1 LEU 13 -3.949 -2.164 -12.945 99 HD12 LEU 13 2HD1 LEU 13 -5.476 -2.797 -13.558 100 HD13 LEU 13 3HD1 LEU 13 -4.082 -2.665 -14.630 101 HD21 LEU 13 3HD2 LEU 13 -4.334 -5.162 -15.153 102 HD22 LEU 13 1HD2 LEU 13 -5.722 -5.196 -14.064 103 HD23 LEU 13 2HD2 LEU 13 -4.376 -6.308 -13.812 104 H LEU 14 H LEU 14 0.531 -3.602 -13.615 105 HA LEU 14 HA LEU 14 1.847 -5.742 -12.286 106 HB2 LEU 14 1HB LEU 14 2.485 -3.859 -14.449 107 HB3 LEU 14 2HB LEU 14 3.870 -4.407 -13.527 108 HG LEU 14 HG LEU 14 2.972 -6.789 -13.979 109 HD11 LEU 14 1HD1 LEU 14 0.781 -5.822 -14.877 110 HD12 LEU 14 2HD1 LEU 14 1.537 -7.127 -15.791 111 HD13 LEU 14 3HD1 LEU 14 1.691 -5.458 -16.341 112 HD21 LEU 14 3HD2 LEU 14 4.148 -6.868 -16.121 113 HD22 LEU 14 1HD2 LEU 14 5.023 -5.895 -14.938 114 HD23 LEU 14 2HD2 LEU 14 4.096 -5.107 -16.214 115 H LEU 15 H LEU 15 1.994 -2.232 -12.005 116 HA LEU 15 HA LEU 15 4.201 -2.192 -10.199 117 HB2 LEU 15 1HB LEU 15 2.425 -0.271 -11.417 118 HB3 LEU 15 2HB LEU 15 2.637 0.091 -9.715 119 HG LEU 15 HG LEU 15 5.222 -0.368 -10.549 120 HD11 LEU 15 1HD1 LEU 15 3.774 1.129 -12.728 121 HD12 LEU 15 2HD1 LEU 15 4.525 -0.460 -12.883 122 HD13 LEU 15 3HD1 LEU 15 5.523 0.961 -12.571 123 HD21 LEU 15 3HD2 LEU 15 5.489 2.045 -10.340 124 HD22 LEU 15 1HD2 LEU 15 4.447 1.412 -9.066 125 HD23 LEU 15 2HD2 LEU 15 3.742 2.258 -10.443 126 H LEU 16 H LEU 16 0.706 -2.333 -9.817 127 HA LEU 16 HA LEU 16 0.669 -1.989 -6.996 128 HB2 LEU 16 1HB LEU 16 -1.248 -1.791 -8.757 129 HB3 LEU 16 2HB LEU 16 -1.433 -3.514 -8.493 130 HG LEU 16 HG LEU 16 -1.533 -2.759 -5.950 131 HD11 LEU 16 1HD1 LEU 16 -1.115 -0.401 -6.394 132 HD12 LEU 16 2HD1 LEU 16 -2.724 -0.639 -5.710 133 HD13 LEU 16 3HD1 LEU 16 -2.537 -0.335 -7.437 134 HD21 LEU 16 3HD2 LEU 16 -3.268 -3.996 -7.118 135 HD22 LEU 16 1HD2 LEU 16 -3.823 -2.515 -7.899 136 HD23 LEU 16 2HD2 LEU 16 -3.978 -2.703 -6.152 137 H LEU 17 H LEU 17 0.875 -4.792 -9.130 138 HA LEU 17 HA LEU 17 0.565 -6.759 -7.106 139 HB2 LEU 17 1HB LEU 17 1.699 -6.830 -9.890 140 HB3 LEU 17 2HB LEU 17 1.698 -8.248 -8.860 141 HG LEU 17 HG LEU 17 -0.867 -6.793 -9.388 142 HD11 LEU 17 1HD1 LEU 17 0.392 -8.854 -11.193 143 HD12 LEU 17 2HD1 LEU 17 0.109 -7.158 -11.586 144 HD13 LEU 17 3HD1 LEU 17 -1.258 -8.241 -11.320 145 HD21 LEU 17 3HD2 LEU 17 -1.802 -9.042 -9.072 146 HD22 LEU 17 1HD2 LEU 17 -0.855 -8.522 -7.677 147 HD23 LEU 17 2HD2 LEU 17 -0.175 -9.675 -8.824 148 H VAL 18 H VAL 18 3.399 -5.200 -8.565 149 HA VAL 18 HA VAL 18 5.331 -6.794 -7.211 150 HB VAL 18 HB VAL 18 5.640 -4.042 -8.434 151 HG11 VAL 18 1HG1 VAL 18 8.044 -4.527 -8.474 152 HG12 VAL 18 2HG1 VAL 18 7.751 -6.032 -7.601 153 HG13 VAL 18 3HG1 VAL 18 7.418 -4.483 -6.826 154 HG21 VAL 18 3HG2 VAL 18 6.622 -5.243 -10.335 155 HG22 VAL 18 1HG2 VAL 18 4.944 -5.716 -10.058 156 HG23 VAL 18 2HG2 VAL 18 6.256 -6.778 -9.545 157 H VAL 19 H VAL 19 3.877 -3.624 -6.511 158 HA VAL 19 HA VAL 19 5.457 -3.123 -4.190 159 HB VAL 19 HB VAL 19 2.807 -1.919 -5.022 160 HG11 VAL 19 1HG1 VAL 19 4.751 -0.995 -2.907 161 HG12 VAL 19 2HG1 VAL 19 3.141 -1.657 -2.622 162 HG13 VAL 19 3HG1 VAL 19 3.325 -0.110 -3.448 163 HG21 VAL 19 3HG2 VAL 19 5.631 -0.899 -5.314 164 HG22 VAL 19 1HG2 VAL 19 4.170 -0.012 -5.745 165 HG23 VAL 19 2HG2 VAL 19 4.596 -1.486 -6.616 166 H ALA 20 H ALA 20 2.282 -4.595 -4.722 167 HA ALA 20 HA ALA 20 1.589 -4.803 -1.967 168 HB1 ALA 20 3HB ALA 20 -0.092 -4.847 -3.748 169 HB2 ALA 20 1HB ALA 20 -0.200 -6.274 -2.718 170 HB3 ALA 20 2HB ALA 20 0.546 -6.391 -4.311 171 H LEU 21 H LEU 21 3.165 -6.973 -4.272 172 HA LEU 21 HA LEU 21 3.251 -9.230 -2.537 173 HB2 LEU 21 1HB LEU 21 3.566 -9.000 -5.150 174 HB3 LEU 21 2HB LEU 21 5.256 -8.843 -4.714 175 HG LEU 21 HG LEU 21 4.718 -11.061 -3.338 176 HD11 LEU 21 1HD1 LEU 21 3.211 -12.510 -4.601 177 HD12 LEU 21 2HD1 LEU 21 2.789 -11.157 -5.652 178 HD13 LEU 21 3HD1 LEU 21 2.357 -11.114 -3.943 179 HD21 LEU 21 3HD2 LEU 21 6.464 -10.828 -5.009 180 HD22 LEU 21 1HD2 LEU 21 5.268 -10.948 -6.301 181 HD23 LEU 21 2HD2 LEU 21 5.576 -12.332 -5.253 182 H GLY 22 H GLY 22 5.576 -6.671 -3.353 183 HA2 GLY 22 1HA GLY 22 7.714 -7.698 -1.783 184 HA3 GLY 22 2HA GLY 22 7.578 -6.057 -2.396 185 H ILE 23 H ILE 23 5.580 -4.894 -1.190 186 HA ILE 23 HA ILE 23 6.454 -4.502 1.475 187 HB ILE 23 HB ILE 23 3.813 -3.629 0.290 188 HG12 ILE 23 1HG1 ILE 23 5.605 -2.832 -1.147 189 HG13 ILE 23 2HG1 ILE 23 4.951 -1.484 -0.229 190 HG21 ILE 23 1HG2 ILE 23 5.392 -2.534 2.614 191 HG22 ILE 23 2HG2 ILE 23 3.873 -3.426 2.704 192 HG23 ILE 23 3HG2 ILE 23 3.915 -1.829 1.957 193 HD11 ILE 23 3HD1 ILE 23 7.561 -2.913 0.214 194 HD12 ILE 23 1HD1 ILE 23 6.886 -1.734 1.342 195 HD13 ILE 23 2HD1 ILE 23 7.310 -1.244 -0.298 196 H GLY 24 H GLY 24 3.882 -6.430 0.045 197 HA2 GLY 24 1HA GLY 24 2.459 -7.017 2.420 198 HA3 GLY 24 2HA GLY 24 2.428 -7.967 0.942 199 H LEU 25 H LEU 25 5.012 -8.820 0.710 200 HA LEU 25 HA LEU 25 5.121 -10.896 2.679 201 HB2 LEU 25 1HB LEU 25 6.934 -10.148 0.392 202 HB3 LEU 25 2HB LEU 25 7.260 -11.504 1.454 203 HG LEU 25 HG LEU 25 4.640 -11.334 0.005 204 HD11 LEU 25 1HD1 LEU 25 6.353 -11.011 -1.700 205 HD12 LEU 25 2HD1 LEU 25 5.608 -12.603 -1.840 206 HD13 LEU 25 3HD1 LEU 25 7.210 -12.438 -1.119 207 HD21 LEU 25 3HD2 LEU 25 6.348 -13.623 0.984 208 HD22 LEU 25 1HD2 LEU 25 4.799 -13.783 0.155 209 HD23 LEU 25 2HD2 LEU 25 4.874 -13.019 1.742 210 H PHE 26 H PHE 26 6.619 -7.798 2.298 211 HA PHE 26 HA PHE 26 8.851 -8.280 4.028 212 HB2 PHE 26 1HB PHE 26 8.493 -6.433 2.193 213 HB3 PHE 26 2HB PHE 26 7.763 -5.535 3.520 214 HD1 PHE 26 HD1 PHE 26 10.860 -6.923 2.166 215 HD2 PHE 26 HD2 PHE 26 9.103 -4.736 5.367 216 HE1 PHE 26 HE1 PHE 26 13.097 -6.206 2.900 217 HE2 PHE 26 HE2 PHE 26 11.335 -4.016 6.106 218 HZ PHE 26 HZ PHE 26 13.336 -4.751 4.873 219 H ILE 27 H ILE 27 5.624 -6.877 4.428 220 HA ILE 27 HA ILE 27 6.089 -6.234 7.213 221 HB ILE 27 HB ILE 27 3.491 -6.157 5.666 222 HG12 ILE 27 1HG1 ILE 27 5.088 -4.651 4.624 223 HG13 ILE 27 2HG1 ILE 27 3.886 -3.713 5.497 224 HG21 ILE 27 1HG2 ILE 27 2.726 -4.638 7.437 225 HG22 ILE 27 2HG2 ILE 27 4.244 -4.892 8.300 226 HG23 ILE 27 3HG2 ILE 27 3.128 -6.238 8.062 227 HD11 ILE 27 3HD1 ILE 27 5.981 -2.690 5.880 228 HD12 ILE 27 1HD1 ILE 27 6.742 -4.231 6.276 229 HD13 ILE 27 2HD1 ILE 27 5.553 -3.527 7.372 230 H ARG 28 H ARG 28 4.552 -8.789 5.355 231 HA ARG 28 HA ARG 28 3.096 -9.994 7.457 232 HB2 ARG 28 1HB ARG 28 3.128 -10.379 4.819 233 HB3 ARG 28 2HB ARG 28 4.209 -11.688 5.276 234 HG2 ARG 28 1HG ARG 28 2.489 -12.601 6.751 235 HG3 ARG 28 2HG ARG 28 1.404 -11.287 6.296 236 HD2 ARG 28 1HD ARG 28 1.474 -12.036 3.968 237 HD3 ARG 28 2HD ARG 28 2.560 -13.349 4.424 238 HE ARG 28 HE ARG 28 0.253 -13.536 5.992 239 HH11 ARG 28 1HH1 ARG 28 1.199 -13.884 2.644 240 HH12 ARG 28 2HH1 ARG 28 -0.047 -15.031 2.283 241 HH21 ARG 28 1HH2 ARG 28 -1.382 -15.044 5.513 242 HH22 ARG 28 2HH2 ARG 28 -1.511 -15.689 3.911 243 H ARG 29 H ARG 29 6.450 -10.094 6.585 244 HA ARG 29 HA ARG 29 7.056 -12.465 8.115 245 HB2 ARG 29 1HB ARG 29 8.740 -10.441 6.655 246 HB3 ARG 29 2HB ARG 29 9.462 -11.693 7.656 247 HG2 ARG 29 1HG ARG 29 7.504 -12.492 5.562 248 HG3 ARG 29 2HG ARG 29 9.136 -12.033 5.075 249 HD2 ARG 29 1HD ARG 29 10.059 -13.710 6.602 250 HD3 ARG 29 2HD ARG 29 8.427 -14.167 7.089 251 HE ARG 29 HE ARG 29 8.622 -14.401 4.306 252 HH11 ARG 29 1HH1 ARG 29 9.882 -15.931 7.183 253 HH12 ARG 29 2HH1 ARG 29 10.081 -17.475 6.424 254 HH21 ARG 29 1HH2 ARG 29 8.884 -16.430 3.312 255 HH22 ARG 29 2HH2 ARG 29 9.515 -17.756 4.228 256 H ARG 30 H ARG 30 6.703 -9.132 8.767 257 HA ARG 30 HA ARG 30 8.456 -9.050 11.057 258 HB2 ARG 30 1HB ARG 30 6.480 -7.118 9.870 259 HB3 ARG 30 2HB ARG 30 7.251 -6.807 11.419 260 HG2 ARG 30 1HG ARG 30 9.448 -6.924 10.346 261 HG3 ARG 30 2HG ARG 30 8.664 -7.210 8.791 262 HD2 ARG 30 1HD ARG 30 7.565 -5.045 8.926 263 HD3 ARG 30 2HD ARG 30 8.279 -4.765 10.514 264 HE ARG 30 HE ARG 30 10.341 -5.260 8.687 265 HH11 ARG 30 1HH1 ARG 30 7.937 -2.815 9.362 266 HH12 ARG 30 2HH1 ARG 30 8.891 -1.523 8.714 267 HH21 ARG 30 1HH2 ARG 30 11.592 -3.562 7.835 268 HH22 ARG 30 2HH2 ARG 30 10.963 -1.947 7.845 269 H HIS 31 H HIS 31 5.178 -9.922 10.454 270 HA HIS 31 HA HIS 31 4.119 -9.413 13.047 271 HB2 HIS 31 1HB HIS 31 3.225 -11.098 10.722 272 HB3 HIS 31 2HB HIS 31 2.358 -11.129 12.255 273 HD1 HIS 31 HD1 HIS 31 0.839 -9.170 12.781 274 HD2 HIS 31 HD2 HIS 31 3.100 -8.602 9.341 275 HE1 HIS 31 HE1 HIS 31 -0.112 -7.116 11.682 276 HE2 HIS 31 HE2 HIS 31 1.216 -6.844 9.559 277 H ILE 32 H ILE 32 5.934 -12.045 11.661 278 HA ILE 32 HA ILE 32 5.321 -13.892 13.804 279 HB ILE 32 HB ILE 32 7.581 -14.276 11.858 280 HG12 ILE 32 1HG1 ILE 32 4.884 -15.312 11.144 281 HG13 ILE 32 2HG1 ILE 32 5.178 -13.598 10.873 282 HG21 ILE 32 1HG2 ILE 32 5.675 -16.184 13.212 283 HG22 ILE 32 2HG2 ILE 32 7.354 -15.890 13.665 284 HG23 ILE 32 3HG2 ILE 32 6.977 -16.643 12.114 285 HD11 ILE 32 3HD1 ILE 32 6.655 -15.928 9.683 286 HD12 ILE 32 1HD1 ILE 32 7.202 -14.256 9.554 287 HD13 ILE 32 2HD1 ILE 32 5.657 -14.734 8.852 288 H VAL 33 H VAL 33 7.463 -11.314 13.358 289 HA VAL 33 HA VAL 33 9.465 -12.359 15.217 290 HB VAL 33 HB VAL 33 9.566 -9.610 14.001 291 HG11 VAL 33 1HG1 VAL 33 11.186 -10.132 15.739 292 HG12 VAL 33 2HG1 VAL 33 11.988 -9.960 14.179 293 HG13 VAL 33 3HG1 VAL 33 11.702 -11.565 14.851 294 HG21 VAL 33 3HG2 VAL 33 9.158 -11.120 12.134 295 HG22 VAL 33 1HG2 VAL 33 10.478 -12.160 12.668 296 HG23 VAL 33 2HG2 VAL 33 10.819 -10.526 12.101 297 H ARG 34 H ARG 34 6.593 -10.639 15.316 298 HA ARG 34 HA ARG 34 7.320 -8.992 17.611 299 HB2 ARG 34 1HB ARG 34 5.683 -8.427 15.589 300 HB3 ARG 34 2HB ARG 34 4.509 -9.200 16.642 301 HG2 ARG 34 1HG ARG 34 5.157 -7.612 18.438 302 HG3 ARG 34 2HG ARG 34 6.195 -6.788 17.272 303 HD2 ARG 34 1HD ARG 34 4.212 -6.399 15.844 304 HD3 ARG 34 2HD ARG 34 3.204 -7.136 17.089 305 HE ARG 34 HE ARG 34 4.669 -5.078 18.274 306 HH11 ARG 34 1HH1 ARG 34 2.143 -5.461 15.889 307 HH12 ARG 34 2HH1 ARG 34 1.436 -3.912 16.208 308 HH21 ARG 34 1HH2 ARG 34 3.739 -3.044 18.691 309 HH22 ARG 34 2HH2 ARG 34 2.342 -2.541 17.797 310 H LYS 35 H LYS 35 6.061 -9.074 19.591 311 HA LYS 35 HA LYS 35 5.497 -11.826 20.369 312 HB2 LYS 35 1HB LYS 35 6.896 -9.954 21.654 313 HB3 LYS 35 2HB LYS 35 5.310 -9.574 22.311 314 HG2 LYS 35 1HG LYS 35 5.084 -11.860 23.123 315 HG3 LYS 35 2HG LYS 35 6.658 -12.265 22.437 316 HD2 LYS 35 1HD LYS 35 7.720 -10.616 23.904 317 HD3 LYS 35 2HD LYS 35 6.144 -10.208 24.586 318 HE2 LYS 35 1HE LYS 35 5.907 -12.503 25.402 319 HE3 LYS 35 2HE LYS 35 7.481 -12.908 24.720 320 HZ1 LYS 35 3HZ LYS 35 7.635 -12.451 27.083 321 HZ2 LYS 35 1HZ LYS 35 6.988 -10.904 26.855 322 HZ3 LYS 35 2HZ LYS 35 8.498 -11.294 26.202 323 H ARG 36 H ARG 36 3.587 -12.407 21.536 324 HA ARG 36 HA ARG 36 1.226 -11.048 20.544 325 HB2 ARG 36 1HB ARG 36 1.681 -13.693 21.904 326 HB3 ARG 36 2HB ARG 36 0.065 -13.055 21.640 327 HG2 ARG 36 1HG ARG 36 0.478 -13.004 19.230 328 HG3 ARG 36 2HG ARG 36 2.100 -13.644 19.498 329 HD2 ARG 36 1HD ARG 36 1.136 -15.667 20.487 330 HD3 ARG 36 2HD ARG 36 -0.485 -15.026 20.216 331 HE ARG 36 HE ARG 36 0.877 -15.050 17.771 332 HH11 ARG 36 1HH1 ARG 36 -0.415 -17.316 20.097 333 HH12 ARG 36 2HH1 ARG 36 -0.707 -18.550 18.918 334 HH21 ARG 36 1HH2 ARG 36 0.494 -16.674 16.223 335 HH22 ARG 36 2HH2 ARG 36 -0.191 -18.186 16.721 336 H THR 37 H THR 37 2.980 -10.043 22.818 337 HA THR 37 HA THR 37 1.257 -10.149 25.137 338 HB THR 37 HB THR 37 2.924 -8.465 26.067 339 HG1 THR 37 HG1 THR 37 3.660 -8.322 23.562 340 HG21 THR 37 3HG2 THR 37 3.047 -10.850 26.587 341 HG22 THR 37 1HG2 THR 37 4.663 -10.163 26.412 342 HG23 THR 37 2HG2 THR 37 3.971 -11.134 25.111 343 H LEU 38 H LEU 38 1.498 -8.215 22.359 344 HA LEU 38 HA LEU 38 0.338 -5.845 23.579 345 HB2 LEU 38 1HB LEU 38 1.239 -6.458 20.767 346 HB3 LEU 38 2HB LEU 38 0.418 -4.970 21.199 347 HG LEU 38 HG LEU 38 2.936 -5.781 22.618 348 HD11 LEU 38 1HD1 LEU 38 2.796 -4.229 20.038 349 HD12 LEU 38 2HD1 LEU 38 3.408 -5.874 20.210 350 HD13 LEU 38 3HD1 LEU 38 4.241 -4.536 21.002 351 HD21 LEU 38 3HD2 LEU 38 3.158 -3.336 22.871 352 HD22 LEU 38 1HD2 LEU 38 1.670 -3.955 23.587 353 HD23 LEU 38 2HD2 LEU 38 1.624 -3.128 22.030 354 H ARG 39 H ARG 39 -0.641 -8.709 22.335 355 HA ARG 39 HA ARG 39 -3.242 -7.828 21.358 356 HB2 ARG 39 1HB ARG 39 -1.768 -10.462 21.183 357 HB3 ARG 39 2HB ARG 39 -3.472 -10.309 20.780 358 HG2 ARG 39 1HG ARG 39 -2.917 -8.695 19.032 359 HG3 ARG 39 2HG ARG 39 -1.207 -8.846 19.439 360 HD2 ARG 39 1HD ARG 39 -1.282 -11.221 18.862 361 HD3 ARG 39 2HD ARG 39 -2.992 -11.072 18.460 362 HE ARG 39 HE ARG 39 -1.571 -9.204 16.943 363 HH11 ARG 39 1HH1 ARG 39 -1.911 -12.672 17.206 364 HH12 ARG 39 2HH1 ARG 39 -1.540 -12.959 15.538 365 HH21 ARG 39 1HH2 ARG 39 -1.083 -9.584 14.754 366 HH22 ARG 39 2HH2 ARG 39 -1.070 -11.207 14.147 367 H ARG 40 H ARG 40 -1.504 -9.593 23.783 368 HA ARG 40 HA ARG 40 -3.836 -10.534 25.204 369 HB2 ARG 40 1HB ARG 40 -0.894 -10.418 25.900 370 HB3 ARG 40 2HB ARG 40 -2.109 -11.008 27.025 371 HG2 ARG 40 1HG ARG 40 -2.723 -12.768 25.443 372 HG3 ARG 40 2HG ARG 40 -1.505 -12.173 24.312 373 HD2 ARG 40 1HD ARG 40 -0.492 -13.983 25.421 374 HD3 ARG 40 2HD ARG 40 0.184 -12.540 26.174 375 HE ARG 40 HE ARG 40 -2.054 -13.344 27.649 376 HH11 ARG 40 1HH1 ARG 40 1.175 -14.464 26.928 377 HH12 ARG 40 2HH1 ARG 40 1.346 -15.322 28.422 378 HH21 ARG 40 1HH2 ARG 40 -1.828 -14.472 29.612 379 HH22 ARG 40 2HH2 ARG 40 -0.360 -15.326 29.946 380 H LEU 41 H LEU 41 -1.858 -7.757 25.022 381 HA LEU 41 HA LEU 41 -3.046 -6.539 27.392 382 HB2 LEU 41 1HB LEU 41 -0.659 -5.894 25.695 383 HB3 LEU 41 2HB LEU 41 -1.398 -4.639 26.671 384 HG LEU 41 HG LEU 41 -0.527 -7.230 27.918 385 HD11 LEU 41 1HD1 LEU 41 1.191 -4.808 27.392 386 HD12 LEU 41 2HD1 LEU 41 1.424 -6.432 26.741 387 HD13 LEU 41 3HD1 LEU 41 1.615 -6.138 28.468 388 HD21 LEU 41 3HD2 LEU 41 -0.279 -5.774 29.900 389 HD22 LEU 41 1HD2 LEU 41 -1.928 -5.797 29.272 390 HD23 LEU 41 2HD2 LEU 41 -0.880 -4.416 28.948 391 H LEU 42 H LEU 42 -3.190 -6.642 23.953 392 HA LEU 42 HA LEU 42 -4.222 -4.063 23.408 393 HB2 LEU 42 1HB LEU 42 -3.420 -5.820 21.746 394 HB3 LEU 42 2HB LEU 42 -5.000 -6.563 21.920 395 HG LEU 42 HG LEU 42 -5.722 -4.019 21.320 396 HD11 LEU 42 1HD1 LEU 42 -3.225 -4.536 19.714 397 HD12 LEU 42 2HD1 LEU 42 -3.350 -3.369 21.030 398 HD13 LEU 42 3HD1 LEU 42 -4.318 -3.159 19.571 399 HD21 LEU 42 3HD2 LEU 42 -5.058 -6.225 19.372 400 HD22 LEU 42 1HD2 LEU 42 -6.110 -4.847 19.045 401 HD23 LEU 42 2HD2 LEU 42 -6.570 -6.037 20.262 402 H GLN 43 H GLN 43 -5.881 -7.128 24.083 403 HA GLN 43 HA GLN 43 -8.458 -5.793 24.214 404 HB2 GLN 43 1HB GLN 43 -7.590 -8.669 24.465 405 HB3 GLN 43 2HB GLN 43 -9.237 -8.161 24.811 406 HG2 GLN 43 1HG GLN 43 -9.457 -7.310 22.534 407 HG3 GLN 43 2HG GLN 43 -7.804 -7.814 22.186 408 HE21 GLN 43 2HE2 GLN 43 -7.336 -10.005 21.980 409 HE22 GLN 43 1HE2 GLN 43 -8.571 -11.188 21.733 410 H GLU 44 H GLU 44 -5.888 -6.398 26.295 411 HA GLU 44 HA GLU 44 -7.472 -6.773 28.699 412 HB2 GLU 44 1HB GLU 44 -4.970 -7.525 28.093 413 HB3 GLU 44 2HB GLU 44 -4.613 -6.000 28.890 414 HG2 GLU 44 1HG GLU 44 -4.486 -7.521 30.617 415 HG3 GLU 44 2HG GLU 44 -6.124 -6.891 30.779 416 H ARG 45 H ARG 45 -5.629 -4.156 27.192 417 HA ARG 45 HA ARG 45 -6.278 -2.324 29.351 418 HB2 ARG 45 1HB ARG 45 -4.061 -2.490 27.909 419 HB3 ARG 45 2HB ARG 45 -4.951 -1.422 26.834 420 HG2 ARG 45 1HG ARG 45 -3.798 0.072 28.145 421 HG3 ARG 45 2HG ARG 45 -5.348 -0.014 28.982 422 HD2 ARG 45 1HD ARG 45 -4.418 -1.604 30.574 423 HD3 ARG 45 2HD ARG 45 -2.877 -1.584 29.718 424 HE ARG 45 HE ARG 45 -3.514 1.041 30.446 425 HH11 ARG 45 1HH1 ARG 45 -2.633 -1.981 31.967 426 HH12 ARG 45 2HH1 ARG 45 -1.887 -1.218 33.331 427 HH21 ARG 45 1HH2 ARG 45 -2.532 2.039 32.240 428 HH22 ARG 45 2HH2 ARG 45 -1.830 1.062 33.485 429 H GLU 46 H GLU 46 -7.697 -3.343 26.465 430 HA GLU 46 HA GLU 46 -9.076 -0.809 25.996 431 HB2 GLU 46 1HB GLU 46 -8.779 -3.343 24.425 432 HB3 GLU 46 2HB GLU 46 -10.093 -2.231 24.061 433 HG2 GLU 46 1HG GLU 46 -8.454 -0.442 23.693 434 HG3 GLU 46 2HG GLU 46 -7.152 -1.585 24.015 435 H LEU 47 H LEU 47 -9.610 -3.945 27.379 436 HA LEU 47 HA LEU 47 -12.496 -3.554 27.405 437 HB2 LEU 47 1HB LEU 47 -11.260 -5.789 26.900 438 HB3 LEU 47 2HB LEU 47 -11.111 -5.900 28.642 439 HG LEU 47 HG LEU 47 -13.731 -5.490 28.543 440 HD11 LEU 47 1HD1 LEU 47 -14.726 -6.629 26.621 441 HD12 LEU 47 2HD1 LEU 47 -13.129 -6.798 25.893 442 HD13 LEU 47 3HD1 LEU 47 -13.826 -5.194 26.128 443 HD21 LEU 47 3HD2 LEU 47 -12.647 -7.414 29.557 444 HD22 LEU 47 1HD2 LEU 47 -12.388 -8.129 27.967 445 HD23 LEU 47 2HD2 LEU 47 -14.027 -7.925 28.586 446 H VAL 48 H VAL 48 -10.030 -2.540 29.176 447 HA VAL 48 HA VAL 48 -11.647 -2.405 31.634 448 HB VAL 48 HB VAL 48 -8.639 -2.535 31.753 449 HG11 VAL 48 1HG1 VAL 48 -9.060 -3.219 34.071 450 HG12 VAL 48 2HG1 VAL 48 -10.796 -3.092 33.789 451 HG13 VAL 48 3HG1 VAL 48 -9.784 -1.651 33.712 452 HG21 VAL 48 3HG2 VAL 48 -9.575 -4.589 30.647 453 HG22 VAL 48 1HG2 VAL 48 -10.453 -4.907 32.144 454 HG23 VAL 48 2HG2 VAL 48 -8.689 -4.880 32.146 455 H GLU 49 H GLU 49 -12.021 -0.429 29.995 456 HA GLU 49 HA GLU 49 -10.207 1.746 30.803 457 HB2 GLU 49 1HB GLU 49 -11.959 1.402 28.375 458 HB3 GLU 49 2HB GLU 49 -11.310 2.968 28.839 459 HG2 GLU 49 1HG GLU 49 -9.041 2.083 28.650 460 HG3 GLU 49 2HG GLU 49 -9.693 0.514 28.185 461 HA PRO 50 HA PRO 50 -13.486 3.494 33.220 462 HB2 PRO 50 1HB PRO 50 -12.740 6.119 33.205 463 HB3 PRO 50 2HB PRO 50 -11.906 4.881 34.164 464 HG2 PRO 50 1HG PRO 50 -11.133 6.077 31.549 465 HG3 PRO 50 2HG PRO 50 -10.122 5.667 32.950 466 HD2 PRO 50 1HD PRO 50 -10.272 4.097 30.744 467 HD3 PRO 50 2HD PRO 50 -9.979 3.451 32.370 468 H LEU 51 H LEU 51 -15.518 4.074 32.768 469 HA LEU 51 HA LEU 51 -16.079 5.940 30.618 470 HB2 LEU 51 1HB LEU 51 -16.164 3.443 29.858 471 HB3 LEU 51 2HB LEU 51 -17.672 3.403 30.748 472 HG LEU 51 HG LEU 51 -17.339 5.576 28.746 473 HD11 LEU 51 1HD1 LEU 51 -18.048 4.092 26.928 474 HD12 LEU 51 2HD1 LEU 51 -17.863 2.703 27.997 475 HD13 LEU 51 3HD1 LEU 51 -16.453 3.661 27.543 476 HD21 LEU 51 3HD2 LEU 51 -19.717 5.140 28.403 477 HD22 LEU 51 1HD2 LEU 51 -19.359 5.404 30.110 478 HD23 LEU 51 2HD2 LEU 51 -19.632 3.768 29.509 479 H THR 52 H THR 52 -16.649 7.350 32.270 480 HA THR 52 HA THR 52 -19.305 6.843 33.414 481 HB THR 52 HB THR 52 -18.529 8.118 35.485 482 HG1 THR 52 HG1 THR 52 -15.978 7.330 34.478 483 HG21 THR 52 3HG2 THR 52 -17.611 6.104 36.547 484 HG22 THR 52 1HG2 THR 52 -17.356 5.383 34.957 485 HG23 THR 52 2HG2 THR 52 -18.993 5.717 35.521 486 HA PRO 53 HA PRO 53 -19.967 10.887 31.635 487 HB2 PRO 53 1HB PRO 53 -22.495 11.292 32.535 488 HB3 PRO 53 2HB PRO 53 -22.122 10.162 31.219 489 HG2 PRO 53 1HG PRO 53 -22.680 9.597 34.086 490 HG3 PRO 53 2HG PRO 53 -23.201 8.716 32.637 491 HD2 PRO 53 1HD PRO 53 -21.123 7.920 34.215 492 HD3 PRO 53 2HD PRO 53 -21.250 7.541 32.487 493 H SER 54 H SER 54 -20.186 13.069 32.259 494 HA SER 54 HA SER 54 -19.832 14.901 33.548 495 HB2 SER 54 1HB SER 54 -21.216 13.247 35.675 496 HB3 SER 54 2HB SER 54 -20.918 14.981 35.772 497 HG SER 54 HG SER 54 -22.277 13.928 33.552 498 H GLY 55 H GLY 55 -17.880 12.578 33.567 499 HA2 GLY 55 1HA GLY 55 -15.636 12.764 34.341 500 HA3 GLY 55 2HA GLY 55 -16.225 13.624 35.755 501 H GLU 56 H GLU 56 -15.182 12.323 37.237 502 HA GLU 56 HA GLU 56 -15.890 9.474 37.273 503 HB2 GLU 56 1HB GLU 56 -13.707 11.052 38.623 504 HB3 GLU 56 2HB GLU 56 -14.098 9.405 39.097 505 HG2 GLU 56 1HG GLU 56 -13.608 8.634 36.832 506 HG3 GLU 56 2HG GLU 56 -13.216 10.287 36.358 507 H LYS 57 H LYS 57 -16.751 8.491 39.117 508 HA LYS 57 HA LYS 57 -18.428 10.222 40.711 509 HB2 LYS 57 1HB LYS 57 -18.213 7.233 40.420 510 HB3 LYS 57 2HB LYS 57 -19.235 7.976 41.642 511 HG2 LYS 57 1HG LYS 57 -20.490 9.132 39.893 512 HG3 LYS 57 2HG LYS 57 -19.463 8.387 38.667 513 HD2 LYS 57 1HD LYS 57 -20.219 6.170 39.386 514 HD3 LYS 57 2HD LYS 57 -21.247 6.918 40.610 515 HE2 LYS 57 1HE LYS 57 -21.497 7.533 37.676 516 HE3 LYS 57 2HE LYS 57 -22.379 6.217 38.450 517 HZ1 LYS 57 3HZ LYS 57 -23.716 8.222 38.327 518 HZ2 LYS 57 1HZ LYS 57 -22.551 9.088 39.197 519 HZ3 LYS 57 2HZ LYS 57 -23.397 7.826 39.940 520 H LEU 58 H LEU 58 -15.758 7.957 41.238 521 HA LEU 58 HA LEU 58 -15.717 8.533 44.080 522 HB2 LEU 58 1HB LEU 58 -14.080 6.686 42.355 523 HB3 LEU 58 2HB LEU 58 -13.782 6.911 44.067 524 HG LEU 58 HG LEU 58 -16.354 6.254 44.232 525 HD11 LEU 58 1HD1 LEU 58 -15.427 4.871 41.718 526 HD12 LEU 58 2HD1 LEU 58 -16.695 6.091 41.826 527 HD13 LEU 58 3HD1 LEU 58 -16.914 4.521 42.600 528 HD21 LEU 58 3HD2 LEU 58 -14.096 4.292 43.842 529 HD22 LEU 58 1HD2 LEU 58 -15.640 3.938 44.617 530 HD23 LEU 58 2HD2 LEU 58 -14.532 5.098 45.348 531 H TRP 59 H TRP 59 -14.434 9.882 41.315 532 HA TRP 59 HA TRP 59 -12.348 11.253 42.870 533 HB2 TRP 59 1HB TRP 59 -12.110 10.141 40.073 534 HB3 TRP 59 2HB TRP 59 -10.998 11.341 40.722 535 HD1 TRP 59 HD1 TRP 59 -11.916 7.651 40.990 536 HE1 TRP 59 HE1 TRP 59 -10.072 6.425 42.299 537 HE3 TRP 59 HE3 TRP 59 -9.194 11.695 42.550 538 HZ2 TRP 59 HZ2 TRP 59 -7.771 7.080 43.794 539 HZ3 TRP 59 HZ3 TRP 59 -7.186 11.304 43.917 540 HH2 TRP 59 HH2 TRP 59 -6.490 9.045 44.525 541 H SER 60 H SER 60 -12.104 13.423 42.489 542 HA SER 60 HA SER 60 -13.943 14.642 40.539 543 HB2 SER 60 1HB SER 60 -14.235 16.523 42.181 544 HB3 SER 60 2HB SER 60 -14.923 14.988 42.712 545 HG SER 60 HG SER 60 -13.727 15.242 44.412 546 H1 LYS 61 1H LYS 61 -1.689 10.477 -33.074 547 H2 LYS 61 2H LYS 61 -1.000 11.679 -32.104 548 H3 LYS 61 3H LYS 61 -2.144 10.620 -31.451 549 HA LYS 61 HA LYS 61 -0.664 8.761 -31.736 550 HB2 LYS 61 1HB LYS 61 1.131 10.886 -32.901 551 HB3 LYS 61 2HB LYS 61 1.754 9.352 -32.311 552 HG2 LYS 61 1HG LYS 61 0.356 8.160 -33.920 553 HG3 LYS 61 2HG LYS 61 -0.273 9.700 -34.512 554 HD2 LYS 61 1HD LYS 61 1.986 10.361 -35.185 555 HD3 LYS 61 2HD LYS 61 2.614 8.821 -34.592 556 HE2 LYS 61 1HE LYS 61 1.220 7.634 -36.216 557 HE3 LYS 61 2HE LYS 61 0.592 9.171 -36.805 558 HZ1 LYS 61 3HZ LYS 61 3.430 8.304 -36.920 559 HZ2 LYS 61 1HZ LYS 61 2.830 9.781 -37.485 560 HZ3 LYS 61 2HZ LYS 61 2.355 8.335 -38.224 561 H ILE 62 H ILE 62 0.127 8.141 -29.826 562 HA ILE 62 HA ILE 62 1.351 10.139 -28.064 563 HB ILE 62 HB ILE 62 0.096 8.990 -26.130 564 HG12 ILE 62 1HG1 ILE 62 -2.340 8.469 -27.169 565 HG13 ILE 62 2HG1 ILE 62 -1.333 7.907 -28.498 566 HG21 ILE 62 1HG2 ILE 62 -1.365 10.807 -28.038 567 HG22 ILE 62 2HG2 ILE 62 -0.246 11.301 -26.767 568 HG23 ILE 62 3HG2 ILE 62 -1.785 10.549 -26.346 569 HD11 ILE 62 3HD1 ILE 62 -1.172 6.972 -25.643 570 HD12 ILE 62 1HD1 ILE 62 -0.161 6.407 -26.972 571 HD13 ILE 62 2HD1 ILE 62 -1.897 6.094 -26.990 572 HA PRO 63 HA PRO 63 4.339 6.952 -27.342 573 HB2 PRO 63 1HB PRO 63 5.279 7.718 -24.893 574 HB3 PRO 63 2HB PRO 63 5.689 8.563 -26.398 575 HG2 PRO 63 1HG PRO 63 3.686 9.285 -24.318 576 HG3 PRO 63 2HG PRO 63 4.804 10.325 -25.222 577 HD2 PRO 63 1HD PRO 63 2.181 10.107 -25.857 578 HD3 PRO 63 2HD PRO 63 3.443 10.426 -27.064 579 H SER 64 H SER 64 4.449 4.955 -26.452 580 HA SER 64 HA SER 64 2.257 4.078 -24.797 581 HB2 SER 64 1HB SER 64 4.627 2.554 -25.905 582 HB3 SER 64 2HB SER 64 3.233 1.827 -25.106 583 HG SER 64 HG SER 64 3.187 3.354 -27.498 584 H ILE 65 H ILE 65 5.242 5.412 -24.140 585 HA ILE 65 HA ILE 65 5.868 3.861 -21.779 586 HB ILE 65 HB ILE 65 7.093 6.520 -22.503 587 HG12 ILE 65 1HG1 ILE 65 8.893 4.708 -23.437 588 HG13 ILE 65 2HG1 ILE 65 7.383 3.897 -23.837 589 HG21 ILE 65 1HG2 ILE 65 9.046 5.612 -21.325 590 HG22 ILE 65 2HG2 ILE 65 8.146 4.135 -20.984 591 HG23 ILE 65 3HG2 ILE 65 7.621 5.668 -20.288 592 HD11 ILE 65 3HD1 ILE 65 8.134 6.692 -24.663 593 HD12 ILE 65 1HD1 ILE 65 6.657 5.833 -25.104 594 HD13 ILE 65 2HD1 ILE 65 8.219 5.256 -25.683 595 H ALA 66 H ALA 66 4.265 6.880 -22.554 596 HA ALA 66 HA ALA 66 4.111 7.744 -19.796 597 HB1 ALA 66 3HB ALA 66 4.334 9.360 -21.649 598 HB2 ALA 66 1HB ALA 66 2.912 9.657 -20.648 599 HB3 ALA 66 2HB ALA 66 2.735 8.885 -22.223 600 H THR 67 H THR 67 2.134 6.001 -22.067 601 HA THR 67 HA THR 67 -0.387 6.334 -20.847 602 HB THR 67 HB THR 67 0.311 3.784 -22.250 603 HG1 THR 67 HG1 THR 67 -0.378 5.826 -23.941 604 HG21 THR 67 3HG2 THR 67 -1.915 4.158 -23.267 605 HG22 THR 67 1HG2 THR 67 -2.066 5.647 -22.334 606 HG23 THR 67 2HG2 THR 67 -1.983 4.093 -21.506 607 H GLY 68 H GLY 68 2.281 4.150 -20.184 608 HA2 GLY 68 1HA GLY 68 0.757 2.485 -18.373 609 HA3 GLY 68 2HA GLY 68 2.485 2.394 -18.672 610 H LEU 69 H LEU 69 3.188 5.034 -18.100 611 HA LEU 69 HA LEU 69 3.538 4.941 -15.317 612 HB2 LEU 69 1HB LEU 69 3.851 7.228 -17.262 613 HB3 LEU 69 2HB LEU 69 4.346 7.305 -15.582 614 HG LEU 69 HG LEU 69 5.446 5.172 -17.387 615 HD11 LEU 69 1HD1 LEU 69 7.403 6.747 -17.699 616 HD12 LEU 69 2HD1 LEU 69 6.321 8.040 -17.182 617 HD13 LEU 69 3HD1 LEU 69 5.951 7.107 -18.633 618 HD21 LEU 69 3HD2 LEU 69 7.351 5.336 -15.831 619 HD22 LEU 69 1HD2 LEU 69 5.845 4.923 -15.009 620 HD23 LEU 69 2HD2 LEU 69 6.478 6.566 -14.916 621 H VAL 70 H VAL 70 1.299 6.839 -17.321 622 HA VAL 70 HA VAL 70 0.212 8.392 -15.259 623 HB VAL 70 HB VAL 70 -1.752 8.726 -16.749 624 HG11 VAL 70 1HG1 VAL 70 1.035 9.040 -17.821 625 HG12 VAL 70 2HG1 VAL 70 0.000 10.249 -17.055 626 HG13 VAL 70 3HG1 VAL 70 -0.371 9.671 -18.680 627 HG21 VAL 70 3HG2 VAL 70 -1.881 6.528 -17.780 628 HG22 VAL 70 1HG2 VAL 70 -0.315 6.774 -18.552 629 HG23 VAL 70 2HG2 VAL 70 -1.693 7.769 -19.019 630 H GLY 71 H GLY 71 -0.638 5.194 -16.406 631 HA2 GLY 71 1HA GLY 71 -3.035 4.912 -14.897 632 HA3 GLY 71 2HA GLY 71 -2.112 3.602 -15.618 633 H ALA 72 H ALA 72 0.281 3.728 -14.331 634 HA ALA 72 HA ALA 72 -0.392 2.571 -11.806 635 HB1 ALA 72 3HB ALA 72 1.485 1.851 -13.349 636 HB2 ALA 72 1HB ALA 72 1.870 1.949 -11.632 637 HB3 ALA 72 2HB ALA 72 2.389 3.230 -12.726 638 H LEU 73 H LEU 73 1.193 5.592 -12.757 639 HA LEU 73 HA LEU 73 1.874 6.392 -10.132 640 HB2 LEU 73 1HB LEU 73 1.658 7.766 -12.772 641 HB3 LEU 73 2HB LEU 73 1.790 8.746 -11.324 642 HG LEU 73 HG LEU 73 3.905 7.526 -10.763 643 HD11 LEU 73 1HD1 LEU 73 3.523 5.490 -12.054 644 HD12 LEU 73 2HD1 LEU 73 5.032 6.268 -12.531 645 HD13 LEU 73 3HD1 LEU 73 3.602 6.415 -13.552 646 HD21 LEU 73 3HD2 LEU 73 3.848 8.963 -13.412 647 HD22 LEU 73 1HD2 LEU 73 5.271 8.717 -12.401 648 HD23 LEU 73 2HD2 LEU 73 3.940 9.719 -11.822 649 H LEU 74 H LEU 74 -0.969 7.034 -12.175 650 HA LEU 74 HA LEU 74 -2.230 8.746 -10.289 651 HB2 LEU 74 1HB LEU 74 -2.949 7.491 -12.847 652 HB3 LEU 74 2HB LEU 74 -4.301 7.772 -11.767 653 HG LEU 74 HG LEU 74 -3.407 10.194 -11.610 654 HD11 LEU 74 1HD1 LEU 74 -1.250 9.504 -12.802 655 HD12 LEU 74 2HD1 LEU 74 -2.032 10.999 -13.319 656 HD13 LEU 74 3HD1 LEU 74 -2.211 9.533 -14.281 657 HD21 LEU 74 3HD2 LEU 74 -4.654 10.824 -13.617 658 HD22 LEU 74 1HD2 LEU 74 -5.493 9.573 -12.701 659 HD23 LEU 74 2HD2 LEU 74 -4.613 9.150 -14.170 660 H LEU 75 H LEU 75 -2.384 5.285 -10.930 661 HA LEU 75 HA LEU 75 -4.529 4.764 -9.124 662 HB2 LEU 75 1HB LEU 75 -2.805 3.236 -10.861 663 HB3 LEU 75 2HB LEU 75 -2.961 2.440 -9.307 664 HG LEU 75 HG LEU 75 -5.571 3.089 -9.906 665 HD11 LEU 75 1HD1 LEU 75 -4.202 2.220 -12.447 666 HD12 LEU 75 2HD1 LEU 75 -4.951 3.791 -12.156 667 HD13 LEU 75 3HD1 LEU 75 -5.944 2.335 -12.193 668 HD21 LEU 75 3HD2 LEU 75 -5.841 0.705 -10.325 669 HD22 LEU 75 1HD2 LEU 75 -4.754 0.985 -8.966 670 HD23 LEU 75 2HD2 LEU 75 -4.099 0.533 -10.539 671 H LEU 76 H LEU 76 -1.024 4.815 -8.837 672 HA LEU 76 HA LEU 76 -0.894 3.745 -6.206 673 HB2 LEU 76 1HB LEU 76 0.962 4.024 -8.021 674 HB3 LEU 76 2HB LEU 76 1.164 5.619 -7.323 675 HG LEU 76 HG LEU 76 1.347 4.226 -5.070 676 HD11 LEU 76 1HD1 LEU 76 0.903 2.064 -6.100 677 HD12 LEU 76 2HD1 LEU 76 2.535 2.120 -5.431 678 HD13 LEU 76 3HD1 LEU 76 2.289 2.279 -7.171 679 HD21 LEU 76 3HD2 LEU 76 3.045 5.732 -5.931 680 HD22 LEU 76 1HD2 LEU 76 3.568 4.510 -7.090 681 HD23 LEU 76 2HD2 LEU 76 3.782 4.235 -5.361 682 H LEU 77 H LEU 77 -1.159 7.007 -7.525 683 HA LEU 77 HA LEU 77 -0.773 8.379 -5.069 684 HB2 LEU 77 1HB LEU 77 -1.999 9.171 -7.698 685 HB3 LEU 77 2HB LEU 77 -1.957 10.270 -6.334 686 HG LEU 77 HG LEU 77 0.583 9.014 -7.308 687 HD11 LEU 77 1HD1 LEU 77 -0.727 11.470 -8.470 688 HD12 LEU 77 2HD1 LEU 77 -0.465 9.936 -9.302 689 HD13 LEU 77 3HD1 LEU 77 0.914 10.919 -8.809 690 HD21 LEU 77 3HD2 LEU 77 1.537 11.106 -6.448 691 HD22 LEU 77 1HD2 LEU 77 0.636 10.236 -5.206 692 HD23 LEU 77 2HD2 LEU 77 -0.077 11.646 -5.990 693 H VAL 78 H VAL 78 -3.661 7.242 -6.790 694 HA VAL 78 HA VAL 78 -5.538 8.418 -5.002 695 HB VAL 78 HB VAL 78 -5.901 6.081 -6.891 696 HG11 VAL 78 1HG1 VAL 78 -8.302 6.548 -6.722 697 HG12 VAL 78 2HG1 VAL 78 -7.975 7.774 -5.497 698 HG13 VAL 78 3HG1 VAL 78 -7.622 6.078 -5.165 699 HG21 VAL 78 3HG2 VAL 78 -6.939 7.733 -8.377 700 HG22 VAL 78 1HG2 VAL 78 -5.253 8.124 -8.043 701 HG23 VAL 78 2HG2 VAL 78 -6.542 9.011 -7.227 702 H VAL 79 H VAL 79 -4.076 5.183 -5.204 703 HA VAL 79 HA VAL 79 -5.579 4.085 -3.044 704 HB VAL 79 HB VAL 79 -2.964 3.153 -4.249 705 HG11 VAL 79 1HG1 VAL 79 -4.842 1.699 -2.385 706 HG12 VAL 79 2HG1 VAL 79 -3.220 2.271 -1.991 707 HG13 VAL 79 3HG1 VAL 79 -3.438 0.993 -3.187 708 HG21 VAL 79 3HG2 VAL 79 -5.802 2.232 -4.702 709 HG22 VAL 79 1HG2 VAL 79 -4.359 1.495 -5.400 710 HG23 VAL 79 2HG2 VAL 79 -4.808 3.144 -5.839 711 H ALA 80 H ALA 80 -2.419 5.659 -3.278 712 HA ALA 80 HA ALA 80 -1.632 5.144 -0.589 713 HB1 ALA 80 3HB ALA 80 -0.011 5.658 -2.352 714 HB2 ALA 80 1HB ALA 80 0.136 6.767 -0.988 715 HB3 ALA 80 2HB ALA 80 -0.661 7.293 -2.470 716 H LEU 81 H LEU 81 -3.275 7.833 -2.192 717 HA LEU 81 HA LEU 81 -3.293 9.558 0.074 718 HB2 LEU 81 1HB LEU 81 -3.696 10.017 -2.497 719 HB3 LEU 81 2HB LEU 81 -5.372 9.744 -2.059 720 HG LEU 81 HG LEU 81 -4.777 11.528 -0.171 721 HD11 LEU 81 1HD1 LEU 81 -3.308 13.263 -1.063 722 HD12 LEU 81 2HD1 LEU 81 -2.926 12.234 -2.444 723 HD13 LEU 81 3HD1 LEU 81 -2.439 11.748 -0.819 724 HD21 LEU 81 3HD2 LEU 81 -6.579 11.732 -1.787 725 HD22 LEU 81 1HD2 LEU 81 -5.426 12.191 -3.040 726 HD23 LEU 81 2HD2 LEU 81 -5.693 13.251 -1.657 727 H GLY 82 H GLY 82 -5.655 7.290 -1.305 728 HA2 GLY 82 1HA GLY 82 -7.734 7.862 0.550 729 HA3 GLY 82 2HA GLY 82 -7.626 6.439 -0.475 730 H ILE 83 H ILE 83 -5.594 5.011 0.318 731 HA ILE 83 HA ILE 83 -6.380 3.931 2.815 732 HB ILE 83 HB ILE 83 -3.784 3.409 1.355 733 HG12 ILE 83 1HG1 ILE 83 -5.626 3.009 -0.179 734 HG13 ILE 83 2HG1 ILE 83 -4.949 1.470 0.332 735 HG21 ILE 83 1HG2 ILE 83 -5.289 1.739 3.365 736 HG22 ILE 83 2HG2 ILE 83 -3.765 2.583 3.633 737 HG23 ILE 83 3HG2 ILE 83 -3.838 1.237 2.497 738 HD11 ILE 83 3HD1 ILE 83 -7.536 2.721 1.221 739 HD12 ILE 83 1HD1 ILE 83 -6.830 1.294 1.978 740 HD13 ILE 83 2HD1 ILE 83 -7.311 1.246 0.281 741 H GLY 84 H GLY 84 -3.850 6.177 1.854 742 HA2 GLY 84 1HA GLY 84 -2.347 6.130 4.251 743 HA3 GLY 84 2HA GLY 84 -2.360 7.433 3.071 744 H LEU 85 H LEU 85 -4.947 8.305 3.158 745 HA LEU 85 HA LEU 85 -4.980 9.794 5.603 746 HB2 LEU 85 1HB LEU 85 -6.872 9.663 3.263 747 HB3 LEU 85 2HB LEU 85 -7.156 10.692 4.652 748 HG LEU 85 HG LEU 85 -4.587 10.918 3.124 749 HD11 LEU 85 1HD1 LEU 85 -6.357 11.043 1.450 750 HD12 LEU 85 2HD1 LEU 85 -5.610 12.621 1.707 751 HD13 LEU 85 3HD1 LEU 85 -7.188 12.266 2.412 752 HD21 LEU 85 3HD2 LEU 85 -6.250 12.863 4.722 753 HD22 LEU 85 1HD2 LEU 85 -4.731 13.241 3.913 754 HD23 LEU 85 2HD2 LEU 85 -4.755 12.088 5.247 755 H PHE 86 H PHE 86 -6.503 6.896 4.475 756 HA PHE 86 HA PHE 86 -8.675 6.899 6.344 757 HB2 PHE 86 1HB PHE 86 -8.385 5.599 4.081 758 HB3 PHE 86 2HB PHE 86 -7.617 4.387 5.100 759 HD1 PHE 86 HD1 PHE 86 -10.751 6.068 4.262 760 HD2 PHE 86 HD2 PHE 86 -8.897 3.129 6.719 761 HE1 PHE 86 HE1 PHE 86 -12.965 5.175 4.858 762 HE2 PHE 86 HE2 PHE 86 -11.108 2.231 7.319 763 HZ PHE 86 HZ PHE 86 -13.144 3.253 6.388 764 H ILE 87 H ILE 87 -5.443 5.455 6.257 765 HA ILE 87 HA ILE 87 -5.817 4.104 8.791 766 HB ILE 87 HB ILE 87 -3.273 4.446 7.193 767 HG12 ILE 87 1HG1 ILE 87 -4.911 3.258 5.847 768 HG13 ILE 87 2HG1 ILE 87 -3.683 2.129 6.402 769 HG21 ILE 87 1HG2 ILE 87 -2.455 2.521 8.478 770 HG22 ILE 87 2HG2 ILE 87 -3.942 2.535 9.426 771 HG23 ILE 87 3HG2 ILE 87 -2.829 3.899 9.512 772 HD11 ILE 87 3HD1 ILE 87 -5.769 1.032 6.575 773 HD12 ILE 87 1HD1 ILE 87 -6.509 2.414 7.386 774 HD13 ILE 87 2HD1 ILE 87 -5.288 1.453 8.220 775 H ARG 88 H ARG 88 -4.331 7.063 7.615 776 HA ARG 88 HA ARG 88 -2.800 7.683 9.909 777 HB2 ARG 88 1HB ARG 88 -2.919 8.744 7.467 778 HB3 ARG 88 2HB ARG 88 -3.979 9.884 8.284 779 HG2 ARG 88 1HG ARG 88 -2.206 10.387 9.889 780 HG3 ARG 88 2HG ARG 88 -1.142 9.241 9.071 781 HD2 ARG 88 1HD ARG 88 -1.288 10.574 7.023 782 HD3 ARG 88 2HD ARG 88 -2.351 11.717 7.842 783 HE ARG 88 HE ARG 88 0.008 11.498 9.326 784 HH11 ARG 88 1HH1 ARG 88 -1.048 12.704 6.221 785 HH12 ARG 88 2HH1 ARG 88 0.190 13.911 6.131 786 HH21 ARG 88 1HH2 ARG 88 1.632 13.086 9.206 787 HH22 ARG 88 2HH2 ARG 88 1.711 14.128 7.824 788 H ARG 89 H ARG 89 -6.182 7.992 9.206 789 HA ARG 89 HA ARG 89 -6.726 9.879 11.323 790 HB2 ARG 89 1HB ARG 89 -8.465 8.299 9.441 791 HB3 ARG 89 2HB ARG 89 -9.150 9.244 10.758 792 HG2 ARG 89 1HG ARG 89 -7.258 10.570 8.881 793 HG3 ARG 89 2HG ARG 89 -8.909 10.248 8.347 794 HD2 ARG 89 1HD ARG 89 -9.772 11.464 10.288 795 HD3 ARG 89 2HD ARG 89 -8.123 11.784 10.822 796 HE ARG 89 HE ARG 89 -8.410 12.736 8.206 797 HH11 ARG 89 1HH1 ARG 89 -9.565 13.455 11.424 798 HH12 ARG 89 2HH1 ARG 89 -9.783 15.143 11.103 799 HH21 ARG 89 1HH2 ARG 89 -8.695 14.954 7.785 800 HH22 ARG 89 2HH2 ARG 89 -9.290 15.993 9.038 801 H ARG 90 H ARG 90 -6.365 6.493 11.068 802 HA ARG 90 HA ARG 90 -8.041 5.808 13.316 803 HB2 ARG 90 1HB ARG 90 -6.116 4.262 11.598 804 HB3 ARG 90 2HB ARG 90 -6.834 3.553 13.037 805 HG2 ARG 90 1HG ARG 90 -9.067 3.938 12.104 806 HG3 ARG 90 2HG ARG 90 -8.333 4.623 10.654 807 HD2 ARG 90 1HD ARG 90 -7.241 2.503 10.182 808 HD3 ARG 90 2HD ARG 90 -7.901 1.814 11.664 809 HE ARG 90 HE ARG 90 -10.022 2.762 10.100 810 HH11 ARG 90 1HH1 ARG 90 -7.608 0.235 10.032 811 HH12 ARG 90 2HH1 ARG 90 -8.587 -0.846 9.101 812 HH21 ARG 90 1HH2 ARG 90 -11.307 1.338 8.877 813 HH22 ARG 90 2HH2 ARG 90 -10.687 -0.220 8.444 814 H HIS 91 H HIS 91 -4.783 6.822 12.852 815 HA HIS 91 HA HIS 91 -3.638 5.657 15.183 816 HB2 HIS 91 1HB HIS 91 -2.815 7.895 13.352 817 HB3 HIS 91 2HB HIS 91 -1.896 7.528 14.809 818 HD1 HIS 91 HD1 HIS 91 -0.370 5.506 14.754 819 HD2 HIS 91 HD2 HIS 91 -2.747 5.848 11.363 820 HE1 HIS 91 HE1 HIS 91 0.535 3.816 13.125 821 HE2 HIS 91 HE2 HIS 91 -0.866 4.102 11.051 822 H ILE 92 H ILE 92 -5.486 8.551 14.596 823 HA ILE 92 HA ILE 92 -4.796 9.779 17.124 824 HB ILE 92 HB ILE 92 -7.118 10.646 15.425 825 HG12 ILE 92 1HG1 ILE 92 -4.440 11.845 14.916 826 HG13 ILE 92 2HG1 ILE 92 -4.750 10.259 14.215 827 HG21 ILE 92 1HG2 ILE 92 -5.158 12.143 17.165 828 HG22 ILE 92 2HG2 ILE 92 -6.822 11.734 17.580 829 HG23 ILE 92 3HG2 ILE 92 -6.494 12.867 16.269 830 HD11 ILE 92 3HD1 ILE 92 -6.257 12.813 13.727 831 HD12 ILE 92 1HD1 ILE 92 -6.816 11.231 13.184 832 HD13 ILE 92 2HD1 ILE 92 -5.293 11.882 12.580 833 H VAL 93 H VAL 93 -6.962 7.396 16.092 834 HA VAL 93 HA VAL 93 -8.897 7.911 18.226 835 HB VAL 93 HB VAL 93 -9.049 5.573 16.339 836 HG11 VAL 93 1HG1 VAL 93 -10.608 5.616 18.206 837 HG12 VAL 93 2HG1 VAL 93 -11.463 5.854 16.682 838 HG13 VAL 93 3HG1 VAL 93 -11.148 7.229 17.740 839 HG21 VAL 93 3HG2 VAL 93 -8.698 7.521 14.917 840 HG22 VAL 93 1HG2 VAL 93 -9.995 8.380 15.750 841 HG23 VAL 93 2HG2 VAL 93 -10.361 6.948 14.786 842 H ARG 94 H ARG 94 -6.030 6.236 17.776 843 HA ARG 94 HA ARG 94 -6.688 4.044 19.583 844 HB2 ARG 94 1HB ARG 94 -5.122 4.033 17.430 845 HB3 ARG 94 2HB ARG 94 -3.909 4.510 18.610 846 HG2 ARG 94 1HG ARG 94 -4.504 2.503 19.948 847 HG3 ARG 94 2HG ARG 94 -5.584 2.009 18.643 848 HD2 ARG 94 1HD ARG 94 -3.653 2.017 17.098 849 HD3 ARG 94 2HD ARG 94 -2.600 2.408 18.456 850 HE ARG 94 HE ARG 94 -4.033 0.104 19.111 851 HH11 ARG 94 1HH1 ARG 94 -1.587 1.109 16.827 852 HH12 ARG 94 2HH1 ARG 94 -0.877 -0.467 16.704 853 HH21 ARG 94 1HH2 ARG 94 -3.098 -1.964 18.951 854 HH22 ARG 94 2HH2 ARG 94 -1.734 -2.210 17.910 855 H LYS 95 H LYS 95 -5.362 3.610 21.473 856 HA LYS 95 HA LYS 95 -4.760 6.066 22.924 857 HB2 LYS 95 1HB LYS 95 -6.123 3.917 23.721 858 HB3 LYS 95 2HB LYS 95 -4.519 3.386 24.203 859 HG2 LYS 95 1HG LYS 95 -4.255 5.380 25.576 860 HG3 LYS 95 2HG LYS 95 -5.850 5.943 25.073 861 HD2 LYS 95 1HD LYS 95 -6.870 3.965 26.091 862 HD3 LYS 95 2HD LYS 95 -5.274 3.399 26.591 863 HE2 LYS 95 1HE LYS 95 -4.999 5.403 27.970 864 HE3 LYS 95 2HE LYS 95 -6.593 5.964 27.470 865 HZ1 LYS 95 3HZ LYS 95 -6.670 4.904 29.636 866 HZ2 LYS 95 1HZ LYS 95 -6.038 3.474 28.989 867 HZ3 LYS 95 2HZ LYS 95 -7.567 4.014 28.512 868 H ARG 96 H ARG 96 -2.811 6.331 24.138 869 HA ARG 96 HA ARG 96 -0.489 5.288 22.745 870 HB2 ARG 96 1HB ARG 96 -0.887 7.484 24.766 871 HB3 ARG 96 2HB ARG 96 0.716 6.945 24.289 872 HG2 ARG 96 1HG ARG 96 0.223 7.523 21.966 873 HG3 ARG 96 2HG ARG 96 -1.388 8.063 22.446 874 HD2 ARG 96 1HD ARG 96 -0.380 9.761 23.895 875 HD3 ARG 96 2HD ARG 96 1.226 9.221 23.412 876 HE ARG 96 HE ARG 96 -0.217 9.877 21.106 877 HH11 ARG 96 1HH1 ARG 96 1.163 11.462 23.900 878 HH12 ARG 96 2HH1 ARG 96 1.421 12.963 23.074 879 HH21 ARG 96 1HH2 ARG 96 0.124 11.850 20.025 880 HH22 ARG 96 2HH2 ARG 96 0.830 13.183 20.877 881 H THR 97 H THR 97 -2.172 3.716 24.736 882 HA THR 97 HA THR 97 -0.371 3.220 26.945 883 HB THR 97 HB THR 97 -2.014 1.343 27.456 884 HG1 THR 97 HG1 THR 97 -2.834 1.858 25.029 885 HG21 THR 97 3HG2 THR 97 -2.109 3.510 28.585 886 HG22 THR 97 1HG2 THR 97 -3.732 2.885 28.291 887 HG23 THR 97 2HG2 THR 97 -3.080 4.164 27.266 888 H LEU 98 H LEU 98 -0.713 2.078 23.766 889 HA LEU 98 HA LEU 98 0.476 -0.523 24.283 890 HB2 LEU 98 1HB LEU 98 -0.515 0.800 21.763 891 HB3 LEU 98 2HB LEU 98 0.311 -0.746 21.763 892 HG LEU 98 HG LEU 98 -2.153 -0.346 23.429 893 HD11 LEU 98 1HD1 LEU 98 -2.106 -1.169 20.529 894 HD12 LEU 98 2HD1 LEU 98 -2.704 0.371 21.145 895 HD13 LEU 98 3HD1 LEU 98 -3.516 -1.130 21.587 896 HD21 LEU 98 3HD2 LEU 98 -2.377 -2.772 23.041 897 HD22 LEU 98 1HD2 LEU 98 -0.863 -2.355 23.843 898 HD23 LEU 98 2HD2 LEU 98 -0.872 -2.748 22.123 899 H ARG 99 H ARG 99 1.424 2.571 23.801 900 HA ARG 99 HA ARG 99 3.989 1.987 22.541 901 HB2 ARG 99 1HB ARG 99 2.521 4.569 23.111 902 HB3 ARG 99 2HB ARG 99 4.210 4.535 22.625 903 HG2 ARG 99 1HG ARG 99 3.591 3.431 20.536 904 HG3 ARG 99 2HG ARG 99 1.895 3.463 21.024 905 HD2 ARG 99 1HD ARG 99 1.961 5.907 21.084 906 HD3 ARG 99 2HD ARG 99 3.657 5.876 20.602 907 HE ARG 99 HE ARG 99 2.176 4.462 18.697 908 HH11 ARG 99 1HH1 ARG 99 2.542 7.743 19.847 909 HH12 ARG 99 2HH1 ARG 99 2.116 8.453 18.325 910 HH21 ARG 99 1HH2 ARG 99 1.618 5.398 16.701 911 HH22 ARG 99 2HH2 ARG 99 1.592 7.123 16.541 912 H ARG 100 H ARG 100 2.341 3.049 25.400 913 HA ARG 100 HA ARG 100 4.722 3.596 26.939 914 HB2 ARG 100 1HB ARG 100 1.805 3.290 27.678 915 HB3 ARG 100 2HB ARG 100 3.059 3.571 28.876 916 HG2 ARG 100 1HG ARG 100 3.628 5.684 27.790 917 HG3 ARG 100 2HG ARG 100 2.371 5.402 26.586 918 HD2 ARG 100 1HD ARG 100 1.403 6.854 28.161 919 HD3 ARG 100 2HD ARG 100 0.746 5.261 28.532 920 HE ARG 100 HE ARG 100 3.038 5.662 30.092 921 HH11 ARG 100 1HH1 ARG 100 -0.212 6.917 29.796 922 HH12 ARG 100 2HH1 ARG 100 -0.327 7.354 31.468 923 HH21 ARG 100 1HH2 ARG 100 2.882 6.237 32.287 924 HH22 ARG 100 2HH2 ARG 100 1.428 6.968 32.881 925 H LEU 101 H LEU 101 2.727 0.956 26.104 926 HA LEU 101 HA LEU 101 3.988 -0.834 28.031 927 HB2 LEU 101 1HB LEU 101 1.543 -1.025 26.305 928 HB3 LEU 101 2HB LEU 101 2.309 -2.487 26.894 929 HG LEU 101 HG LEU 101 1.491 -0.317 28.803 930 HD11 LEU 101 1HD1 LEU 101 -0.253 -2.524 27.720 931 HD12 LEU 101 2HD1 LEU 101 -0.502 -0.788 27.524 932 HD13 LEU 101 3HD1 LEU 101 -0.636 -1.525 29.121 933 HD21 LEU 101 3HD2 LEU 101 1.303 -2.241 30.344 934 HD22 LEU 101 1HD2 LEU 101 2.931 -2.047 29.688 935 HD23 LEU 101 2HD2 LEU 101 1.866 -3.300 29.049 936 H LEU 102 H LEU 102 4.017 0.163 24.736 937 HA LEU 102 HA LEU 102 5.020 -2.179 23.502 938 HB2 LEU 102 1HB LEU 102 4.171 -0.051 22.385 939 HB3 LEU 102 2HB LEU 102 5.759 0.626 22.693 940 HG LEU 102 HG LEU 102 6.449 -1.668 21.425 941 HD11 LEU 102 1HD1 LEU 102 3.902 -0.760 20.095 942 HD12 LEU 102 2HD1 LEU 102 4.065 -2.230 21.055 943 HD13 LEU 102 3HD1 LEU 102 4.982 -2.047 19.560 944 HD21 LEU 102 3HD2 LEU 102 5.731 0.967 20.146 945 HD22 LEU 102 1HD2 LEU 102 6.764 -0.271 19.434 946 HD23 LEU 102 2HD2 LEU 102 7.271 0.560 20.905 947 H GLN 103 H GLN 103 6.715 0.611 24.900 948 HA GLN 103 HA GLN 103 9.287 -0.699 24.590 949 HB2 GLN 103 1HB GLN 103 8.443 2.007 25.613 950 HB3 GLN 103 2HB GLN 103 10.098 1.432 25.759 951 HG2 GLN 103 1HG GLN 103 10.237 1.208 23.333 952 HG3 GLN 103 2HG GLN 103 8.575 1.778 23.184 953 HE21 GLN 103 2HE2 GLN 103 8.111 3.944 23.573 954 HE22 GLN 103 1HE2 GLN 103 9.342 5.157 23.604 955 H GLU 104 H GLU 104 6.792 -0.673 26.841 956 HA GLU 104 HA GLU 104 8.456 -0.931 29.205 957 HB2 GLU 104 1HB GLU 104 5.939 -0.058 28.901 958 HB3 GLU 104 2HB GLU 104 5.602 -1.740 29.283 959 HG2 GLU 104 1HG GLU 104 5.540 -0.723 31.351 960 HG3 GLU 104 2HG GLU 104 7.180 -1.367 31.288 961 H ARG 105 H ARG 105 6.551 -3.071 27.129 962 HA ARG 105 HA ARG 105 7.266 -5.401 28.710 963 HB2 ARG 105 1HB ARG 105 5.002 -4.873 27.438 964 HB3 ARG 105 2HB ARG 105 5.851 -5.619 26.091 965 HG2 ARG 105 1HG ARG 105 4.735 -7.410 27.005 966 HG3 ARG 105 2HG ARG 105 6.313 -7.537 27.783 967 HD2 ARG 105 1HD ARG 105 5.443 -6.424 29.766 968 HD3 ARG 105 2HD ARG 105 3.876 -6.226 28.985 969 HE ARG 105 HE ARG 105 4.525 -8.947 28.981 970 HH11 ARG 105 1HH1 ARG 105 3.710 -6.432 31.266 971 HH12 ARG 105 2HH1 ARG 105 3.006 -7.527 32.408 972 HH21 ARG 105 1HH2 ARG 105 3.598 -10.382 30.483 973 HH22 ARG 105 2HH2 ARG 105 2.943 -9.769 31.963 974 H GLU 106 H GLU 106 8.591 -3.656 26.147 975 HA GLU 106 HA GLU 106 9.943 -5.974 24.986 976 HB2 GLU 106 1HB GLU 106 9.606 -3.118 24.141 977 HB3 GLU 106 2HB GLU 106 10.901 -4.091 23.457 978 HG2 GLU 106 1HG GLU 106 9.243 -5.728 22.689 979 HG3 GLU 106 2HG GLU 106 7.957 -4.715 23.342 980 H LEU 107 H LEU 107 10.538 -3.306 27.122 981 HA LEU 107 HA LEU 107 13.422 -3.678 26.948 982 HB2 LEU 107 1HB LEU 107 12.178 -1.394 27.085 983 HB3 LEU 107 2HB LEU 107 12.087 -1.744 28.800 984 HG LEU 107 HG LEU 107 14.701 -2.101 28.511 985 HD11 LEU 107 1HD1 LEU 107 15.637 -0.496 26.921 986 HD12 LEU 107 2HD1 LEU 107 14.016 -0.149 26.316 987 HD13 LEU 107 3HD1 LEU 107 14.714 -1.754 26.100 988 HD21 LEU 107 3HD2 LEU 107 13.661 -0.515 30.028 989 HD22 LEU 107 1HD2 LEU 107 13.352 0.591 28.689 990 HD23 LEU 107 2HD2 LEU 107 15.009 0.240 29.179 991 H VAL 108 H VAL 108 11.011 -5.131 28.474 992 HA VAL 108 HA VAL 108 12.708 -5.895 30.756 993 HB VAL 108 HB VAL 108 9.706 -5.815 31.005 994 HG11 VAL 108 1HG1 VAL 108 10.208 -5.759 33.406 995 HG12 VAL 108 2HG1 VAL 108 11.932 -5.800 33.042 996 HG13 VAL 108 3HG1 VAL 108 10.912 -7.176 32.625 997 HG21 VAL 108 3HG2 VAL 108 10.614 -3.540 30.444 998 HG22 VAL 108 1HG2 VAL 108 11.542 -3.619 31.942 999 HG23 VAL 108 2HG2 VAL 108 9.780 -3.654 31.995 1000 H GLU 109 H GLU 109 13.018 -7.372 28.646 1001 HA GLU 109 HA GLU 109 11.222 -9.692 28.916 1002 HB2 GLU 109 1HB GLU 109 12.895 -8.717 26.607 1003 HB3 GLU 109 2HB GLU 109 12.254 -10.353 26.666 1004 HG2 GLU 109 1HG GLU 109 9.983 -9.460 26.791 1005 HG3 GLU 109 2HG GLU 109 10.627 -7.820 26.732 1006 HA PRO 110 HA PRO 110 14.573 -11.996 30.682 1007 HB2 PRO 110 1HB PRO 110 13.816 -14.529 30.006 1008 HB3 PRO 110 2HB PRO 110 13.019 -13.589 31.282 1009 HG2 PRO 110 1HG PRO 110 12.155 -14.063 28.475 1010 HG3 PRO 110 2HG PRO 110 11.192 -14.037 29.965 1011 HD2 PRO 110 1HD PRO 110 11.276 -11.946 28.244 1012 HD3 PRO 110 2HD PRO 110 11.039 -11.749 29.991 1013 H LEU 111 H LEU 111 16.586 -12.429 30.027 1014 HA LEU 111 HA LEU 111 17.066 -13.665 27.447 1015 HB2 LEU 111 1HB LEU 111 17.137 -11.056 27.363 1016 HB3 LEU 111 2HB LEU 111 18.675 -11.243 28.181 1017 HG LEU 111 HG LEU 111 18.266 -12.818 25.693 1018 HD11 LEU 111 1HD1 LEU 111 18.920 -10.908 24.303 1019 HD12 LEU 111 2HD1 LEU 111 18.776 -9.848 25.704 1020 HD13 LEU 111 3HD1 LEU 111 17.348 -10.660 25.063 1021 HD21 LEU 111 3HD2 LEU 111 20.633 -12.297 25.397 1022 HD22 LEU 111 1HD2 LEU 111 20.331 -13.001 26.985 1023 HD23 LEU 111 2HD2 LEU 111 20.589 -11.264 26.825 1024 H THR 112 H THR 112 17.685 -15.455 28.653 1025 HA THR 112 HA THR 112 20.380 -15.253 29.799 1026 HB THR 112 HB THR 112 19.667 -17.028 31.489 1027 HG1 THR 112 HG1 THR 112 17.087 -16.017 30.809 1028 HG21 THR 112 3HG2 THR 112 18.796 -15.366 33.071 1029 HG22 THR 112 1HG2 THR 112 18.491 -14.256 31.735 1030 HG23 THR 112 2HG2 THR 112 20.144 -14.719 32.135 1031 HA PRO 113 HA PRO 113 20.964 -18.689 27.004 1032 HB2 PRO 113 1HB PRO 113 23.519 -19.305 27.682 1033 HB3 PRO 113 2HB PRO 113 23.108 -17.870 26.721 1034 HG2 PRO 113 1HG PRO 113 23.764 -18.073 29.615 1035 HG3 PRO 113 2HG PRO 113 24.240 -16.841 28.429 1036 HD2 PRO 113 1HD PRO 113 22.220 -16.493 30.230 1037 HD3 PRO 113 2HD PRO 113 22.290 -15.676 28.657 1038 H SER 114 H SER 114 21.194 -20.956 27.028 1039 HA SER 114 HA SER 114 20.875 -23.064 27.805 1040 HB2 SER 114 1HB SER 114 22.338 -22.016 30.241 1041 HB3 SER 114 2HB SER 114 22.035 -23.717 29.893 1042 HG SER 114 HG SER 114 23.324 -22.115 27.980 1043 H GLY 115 H GLY 115 18.937 -20.835 28.497 1044 HA2 GLY 115 1HA GLY 115 16.718 -21.227 29.269 1045 HA3 GLY 115 2HA GLY 115 17.349 -22.424 30.388 1046 H GLU 116 H GLU 116 16.361 -21.559 32.192 1047 HA GLU 116 HA GLU 116 17.084 -18.818 32.947 1048 HB2 GLU 116 1HB GLU 116 14.940 -20.703 33.911 1049 HB3 GLU 116 2HB GLU 116 15.353 -19.235 34.786 1050 HG2 GLU 116 1HG GLU 116 14.792 -17.902 32.819 1051 HG3 GLU 116 2HG GLU 116 14.377 -19.374 31.941 1052 H LYS 117 H LYS 117 18.011 -18.346 34.955 1053 HA LYS 117 HA LYS 117 19.732 -20.425 35.985 1054 HB2 LYS 117 1HB LYS 117 19.520 -17.466 36.492 1055 HB3 LYS 117 2HB LYS 117 20.581 -18.497 37.443 1056 HG2 LYS 117 1HG LYS 117 21.772 -19.151 35.412 1057 HG3 LYS 117 2HG LYS 117 20.707 -18.116 34.458 1058 HD2 LYS 117 1HD LYS 117 21.497 -16.161 35.706 1059 HD3 LYS 117 2HD LYS 117 22.561 -17.199 36.657 1060 HE2 LYS 117 1HE LYS 117 22.710 -17.024 33.658 1061 HE3 LYS 117 2HE LYS 117 23.623 -15.952 34.719 1062 HZ1 LYS 117 3HZ LYS 117 24.947 -17.849 34.032 1063 HZ2 LYS 117 1HZ LYS 117 23.808 -18.917 34.682 1064 HZ3 LYS 117 2HZ LYS 117 24.684 -17.891 35.701 1065 H LEU 118 H LEU 118 17.092 -18.389 37.174 1066 HA LEU 118 HA LEU 118 17.143 -19.688 39.766 1067 HB2 LEU 118 1HB LEU 118 15.458 -17.462 38.639 1068 HB3 LEU 118 2HB LEU 118 15.216 -18.128 40.243 1069 HG LEU 118 HG LEU 118 17.794 -17.525 40.488 1070 HD11 LEU 118 1HD1 LEU 118 16.790 -15.537 38.454 1071 HD12 LEU 118 2HD1 LEU 118 18.057 -16.739 38.197 1072 HD13 LEU 118 3HD1 LEU 118 18.307 -15.425 39.348 1073 HD21 LEU 118 3HD2 LEU 118 15.533 -15.540 40.700 1074 HD22 LEU 118 1HD2 LEU 118 17.104 -15.393 41.488 1075 HD23 LEU 118 2HD2 LEU 118 16.016 -16.710 41.928 1076 H TRP 119 H TRP 119 15.762 -20.272 36.789 1077 HA TRP 119 HA TRP 119 13.723 -22.012 38.002 1078 HB2 TRP 119 1HB TRP 119 13.396 -20.210 35.601 1079 HB3 TRP 119 2HB TRP 119 12.301 -21.542 35.951 1080 HD1 TRP 119 HD1 TRP 119 13.246 -18.047 37.142 1081 HE1 TRP 119 HE1 TRP 119 11.451 -17.213 38.789 1082 HE3 TRP 119 HE3 TRP 119 10.559 -22.368 37.683 1083 HZ2 TRP 119 HZ2 TRP 119 9.199 -18.246 40.136 1084 HZ3 TRP 119 HZ3 TRP 119 8.600 -22.359 39.170 1085 HH2 TRP 119 HH2 TRP 119 7.935 -20.340 40.371 1086 H SER 120 H SER 120 13.458 -24.009 37.073 1087 HA SER 120 HA SER 120 15.225 -24.668 34.812 1088 HB2 SER 120 1HB SER 120 15.563 -26.910 35.894 1089 HB3 SER 120 2HB SER 120 16.274 -25.565 36.786 1090 HG SER 120 HG SER 120 15.136 -26.260 38.400 Start of MODEL 5 1 H1 LYS 1 1H LYS 1 -0.702 0.419 -33.988 2 H2 LYS 1 2H LYS 1 -0.682 0.545 -32.302 3 H3 LYS 1 3H LYS 1 -2.079 0.014 -33.094 4 HA LYS 1 HA LYS 1 -0.963 -1.968 -33.842 5 HB2 LYS 1 1HB LYS 1 1.317 -0.603 -33.633 6 HB3 LYS 1 2HB LYS 1 1.362 -1.394 -32.065 7 HG2 LYS 1 1HG LYS 1 1.192 -3.574 -33.157 8 HG3 LYS 1 2HG LYS 1 1.149 -2.778 -34.731 9 HD2 LYS 1 1HD LYS 1 3.373 -1.842 -34.319 10 HD3 LYS 1 2HD LYS 1 3.415 -2.637 -32.743 11 HE2 LYS 1 1HE LYS 1 3.260 -4.818 -33.841 12 HE3 LYS 1 2HE LYS 1 3.218 -4.024 -35.414 13 HZ1 LYS 1 3HZ LYS 1 5.426 -3.138 -34.985 14 HZ2 LYS 1 1HZ LYS 1 5.431 -4.828 -34.892 15 HZ3 LYS 1 2HZ LYS 1 5.467 -3.903 -33.477 16 H ILE 2 H ILE 2 -0.665 -0.390 -30.686 17 HA ILE 2 HA ILE 2 -1.897 -2.771 -29.468 18 HB ILE 2 HB ILE 2 -0.642 -2.055 -27.333 19 HG12 ILE 2 1HG1 ILE 2 1.741 -1.185 -28.259 20 HG13 ILE 2 2HG1 ILE 2 0.673 -0.371 -29.397 21 HG21 ILE 2 1HG2 ILE 2 0.846 -3.292 -29.645 22 HG22 ILE 2 2HG2 ILE 2 -0.216 -4.129 -28.511 23 HG23 ILE 2 3HG2 ILE 2 1.299 -3.425 -27.945 24 HD11 ILE 2 3HD1 ILE 2 -0.519 0.662 -27.537 25 HD12 ILE 2 1HD1 ILE 2 1.200 1.054 -27.507 26 HD13 ILE 2 2HD1 ILE 2 0.552 -0.155 -26.399 27 HA PRO 3 HA PRO 3 -5.002 -0.001 -27.959 28 HB2 PRO 3 1HB PRO 3 -5.838 -1.373 -25.746 29 HB3 PRO 3 2HB PRO 3 -6.254 -1.853 -27.402 30 HG2 PRO 3 1HG PRO 3 -4.162 -2.951 -25.591 31 HG3 PRO 3 2HG PRO 3 -5.260 -3.799 -26.697 32 HD2 PRO 3 1HD PRO 3 -2.668 -3.308 -27.308 33 HD3 PRO 3 2HD PRO 3 -3.948 -3.391 -28.534 34 H SER 4 H SER 4 -5.164 1.727 -26.629 35 HA SER 4 HA SER 4 -2.974 2.287 -24.839 36 HB2 SER 4 1HB SER 4 -3.990 3.991 -26.380 37 HB3 SER 4 2HB SER 4 -5.429 3.972 -25.362 38 HG SER 4 HG SER 4 -3.060 5.233 -24.974 39 H ILE 5 H ILE 5 -5.891 0.709 -24.482 40 HA ILE 5 HA ILE 5 -6.528 1.633 -21.815 41 HB ILE 5 HB ILE 5 -7.663 -0.834 -23.127 42 HG12 ILE 5 1HG1 ILE 5 -9.548 1.070 -23.600 43 HG13 ILE 5 2HG1 ILE 5 -8.077 2.012 -23.818 44 HG21 ILE 5 1HG2 ILE 5 -8.779 1.091 -21.089 45 HG22 ILE 5 2HG2 ILE 5 -8.182 -0.537 -20.770 46 HG23 ILE 5 3HG2 ILE 5 -9.626 -0.305 -21.753 47 HD11 ILE 5 3HD1 ILE 5 -7.304 0.440 -25.500 48 HD12 ILE 5 1HD1 ILE 5 -8.890 1.087 -25.920 49 HD13 ILE 5 2HD1 ILE 5 -8.748 -0.543 -25.259 50 H ALA 6 H ALA 6 -4.833 -1.056 -23.297 51 HA ALA 6 HA ALA 6 -4.585 -2.529 -20.819 52 HB1 ALA 6 3HB ALA 6 -4.794 -3.673 -22.998 53 HB2 ALA 6 1HB ALA 6 -3.350 -4.149 -22.105 54 HB3 ALA 6 2HB ALA 6 -3.220 -3.026 -23.459 55 H THR 7 H THR 7 -2.752 -0.190 -22.608 56 HA THR 7 HA THR 7 -0.175 -0.703 -21.590 57 HB THR 7 HB THR 7 -1.038 2.090 -22.235 58 HG1 THR 7 HG1 THR 7 -0.856 1.528 -24.475 59 HG21 THR 7 3HG2 THR 7 1.414 0.445 -22.877 60 HG22 THR 7 1HG2 THR 7 1.293 1.721 -21.666 61 HG23 THR 7 2HG2 THR 7 1.159 2.117 -23.379 62 H GLY 8 H GLY 8 -2.890 1.129 -20.306 63 HA2 GLY 8 1HA GLY 8 -1.354 2.293 -18.148 64 HA3 GLY 8 2HA GLY 8 -3.091 2.410 -18.376 65 H LEU 9 H LEU 9 -3.696 -0.323 -18.522 66 HA LEU 9 HA LEU 9 -3.992 -0.973 -15.808 67 HB2 LEU 9 1HB LEU 9 -4.282 -2.674 -18.285 68 HB3 LEU 9 2HB LEU 9 -4.730 -3.212 -16.678 69 HG LEU 9 HG LEU 9 -5.940 -0.715 -17.820 70 HD11 LEU 9 1HD1 LEU 9 -6.690 -3.558 -18.420 71 HD12 LEU 9 2HD1 LEU 9 -6.434 -2.224 -19.545 72 HD13 LEU 9 3HD1 LEU 9 -7.858 -2.241 -18.506 73 HD21 LEU 9 3HD2 LEU 9 -6.877 -2.771 -15.819 74 HD22 LEU 9 1HD2 LEU 9 -7.800 -1.362 -16.344 75 HD23 LEU 9 2HD2 LEU 9 -6.290 -1.146 -15.458 76 H VAL 10 H VAL 10 -1.736 -2.194 -18.264 77 HA VAL 10 HA VAL 10 -0.568 -4.203 -16.698 78 HB VAL 10 HB VAL 10 1.372 -4.074 -18.250 79 HG11 VAL 10 1HG1 VAL 10 -1.429 -4.194 -19.325 80 HG12 VAL 10 2HG1 VAL 10 -0.343 -5.524 -18.912 81 HG13 VAL 10 3HG1 VAL 10 -0.024 -4.535 -20.338 82 HG21 VAL 10 3HG2 VAL 10 1.397 -1.671 -18.671 83 HG22 VAL 10 1HG2 VAL 10 -0.163 -1.785 -19.486 84 HG23 VAL 10 2HG2 VAL 10 1.256 -2.565 -20.184 85 H GLY 11 H GLY 11 0.252 -0.803 -17.041 86 HA2 GLY 11 1HA GLY 11 2.646 -0.872 -15.515 87 HA3 GLY 11 2HA GLY 11 1.701 0.564 -15.882 88 H ALA 12 H ALA 12 -0.683 0.060 -14.640 89 HA ALA 12 HA ALA 12 0.013 0.593 -11.920 90 HB1 ALA 12 3HB ALA 12 -1.901 1.627 -13.220 91 HB2 ALA 12 1HB ALA 12 -2.256 1.108 -11.574 92 HB3 ALA 12 2HB ALA 12 -2.772 0.119 -12.938 93 H LEU 13 H LEU 13 -1.601 -2.132 -13.528 94 HA LEU 13 HA LEU 13 -2.187 -3.538 -11.150 95 HB2 LEU 13 1HB LEU 13 -2.053 -4.253 -14.044 96 HB3 LEU 13 2HB LEU 13 -2.147 -5.544 -12.861 97 HG LEU 13 HG LEU 13 -4.238 -4.474 -11.968 98 HD11 LEU 13 1HD1 LEU 13 -3.844 -2.206 -12.838 99 HD12 LEU 13 2HD1 LEU 13 -5.407 -2.850 -13.342 100 HD13 LEU 13 3HD1 LEU 13 -4.060 -2.811 -14.480 101 HD21 LEU 13 3HD2 LEU 13 -4.267 -5.310 -14.865 102 HD22 LEU 13 1HD2 LEU 13 -5.658 -5.290 -13.780 103 HD23 LEU 13 2HD2 LEU 13 -4.314 -6.389 -13.471 104 H LEU 14 H LEU 14 0.618 -3.596 -13.329 105 HA LEU 14 HA LEU 14 1.923 -5.724 -11.959 106 HB2 LEU 14 1HB LEU 14 2.581 -3.871 -14.143 107 HB3 LEU 14 2HB LEU 14 3.956 -4.405 -13.197 108 HG LEU 14 HG LEU 14 3.071 -6.793 -13.627 109 HD11 LEU 14 1HD1 LEU 14 0.883 -5.827 -14.559 110 HD12 LEU 14 2HD1 LEU 14 1.638 -7.166 -15.426 111 HD13 LEU 14 3HD1 LEU 14 1.809 -5.517 -16.028 112 HD21 LEU 14 3HD2 LEU 14 5.125 -5.904 -14.585 113 HD22 LEU 14 1HD2 LEU 14 4.202 -5.138 -15.879 114 HD23 LEU 14 2HD2 LEU 14 4.262 -6.897 -15.761 115 H LEU 15 H LEU 15 2.076 -2.205 -11.754 116 HA LEU 15 HA LEU 15 4.244 -2.144 -9.901 117 HB2 LEU 15 1HB LEU 15 2.507 -0.227 -11.199 118 HB3 LEU 15 2HB LEU 15 2.737 0.181 -9.510 119 HG LEU 15 HG LEU 15 5.303 -0.306 -10.246 120 HD11 LEU 15 1HD1 LEU 15 4.703 -0.696 -12.576 121 HD12 LEU 15 2HD1 LEU 15 5.696 0.751 -12.406 122 HD13 LEU 15 3HD1 LEU 15 3.957 0.899 -12.658 123 HD21 LEU 15 3HD2 LEU 15 4.461 1.650 -9.037 124 HD22 LEU 15 1HD2 LEU 15 3.836 2.311 -10.547 125 HD23 LEU 15 2HD2 LEU 15 5.573 2.111 -10.328 126 H LEU 16 H LEU 16 0.736 -2.179 -9.596 127 HA LEU 16 HA LEU 16 0.665 -1.791 -6.775 128 HB2 LEU 16 1HB LEU 16 -1.209 -1.594 -8.639 129 HB3 LEU 16 2HB LEU 16 -1.501 -3.265 -8.204 130 HG LEU 16 HG LEU 16 -1.569 -2.267 -5.752 131 HD11 LEU 16 1HD1 LEU 16 -2.428 0.077 -7.444 132 HD12 LEU 16 2HD1 LEU 16 -0.969 0.006 -6.456 133 HD13 LEU 16 3HD1 LEU 16 -2.555 -0.054 -5.689 134 HD21 LEU 16 3HD2 LEU 16 -3.383 -3.475 -6.823 135 HD22 LEU 16 1HD2 LEU 16 -3.821 -2.035 -7.742 136 HD23 LEU 16 2HD2 LEU 16 -4.000 -2.049 -5.989 137 H LEU 17 H LEU 17 0.857 -4.599 -8.881 138 HA LEU 17 HA LEU 17 0.364 -6.560 -6.891 139 HB2 LEU 17 1HB LEU 17 0.334 -6.732 -9.492 140 HB3 LEU 17 2HB LEU 17 2.044 -7.072 -9.320 141 HG LEU 17 HG LEU 17 1.154 -8.889 -7.602 142 HD11 LEU 17 1HD1 LEU 17 -0.938 -9.886 -8.383 143 HD12 LEU 17 2HD1 LEU 17 -1.151 -8.554 -9.518 144 HD13 LEU 17 3HD1 LEU 17 -1.188 -8.247 -7.783 145 HD21 LEU 17 3HD2 LEU 17 1.094 -9.197 -10.602 146 HD22 LEU 17 1HD2 LEU 17 1.189 -10.517 -9.437 147 HD23 LEU 17 2HD2 LEU 17 2.509 -9.356 -9.564 148 H VAL 18 H VAL 18 3.358 -5.178 -8.236 149 HA VAL 18 HA VAL 18 5.117 -6.807 -6.703 150 HB VAL 18 HB VAL 18 5.678 -4.119 -7.979 151 HG11 VAL 18 1HG1 VAL 18 8.030 -4.816 -7.930 152 HG12 VAL 18 2HG1 VAL 18 7.576 -6.278 -7.057 153 HG13 VAL 18 3HG1 VAL 18 7.354 -4.698 -6.306 154 HG21 VAL 18 3HG2 VAL 18 4.895 -5.741 -9.615 155 HG22 VAL 18 1HG2 VAL 18 6.087 -6.911 -9.048 156 HG23 VAL 18 2HG2 VAL 18 6.615 -5.425 -9.834 157 H VAL 19 H VAL 19 3.855 -3.512 -6.239 158 HA VAL 19 HA VAL 19 5.323 -2.955 -3.879 159 HB VAL 19 HB VAL 19 2.748 -1.747 -4.910 160 HG11 VAL 19 1HG1 VAL 19 2.779 -1.314 -2.569 161 HG12 VAL 19 2HG1 VAL 19 3.317 0.158 -3.378 162 HG13 VAL 19 3HG1 VAL 19 4.494 -0.904 -2.605 163 HG21 VAL 19 3HG2 VAL 19 4.205 0.122 -5.573 164 HG22 VAL 19 1HG2 VAL 19 4.650 -1.385 -6.374 165 HG23 VAL 19 2HG2 VAL 19 5.608 -0.792 -5.017 166 H ALA 20 H ALA 20 2.052 -4.246 -4.410 167 HA ALA 20 HA ALA 20 1.324 -4.376 -1.673 168 HB1 ALA 20 3HB ALA 20 -0.328 -4.414 -3.481 169 HB2 ALA 20 1HB ALA 20 -0.507 -5.801 -2.406 170 HB3 ALA 20 2HB ALA 20 0.261 -5.999 -3.983 171 H LEU 21 H LEU 21 2.849 -6.680 -3.878 172 HA LEU 21 HA LEU 21 2.826 -8.893 -2.098 173 HB2 LEU 21 1HB LEU 21 3.264 -8.743 -4.686 174 HB3 LEU 21 2HB LEU 21 4.935 -8.555 -4.192 175 HG LEU 21 HG LEU 21 4.374 -10.744 -2.780 176 HD11 LEU 21 1HD1 LEU 21 2.925 -12.241 -4.056 177 HD12 LEU 21 2HD1 LEU 21 2.519 -10.921 -5.151 178 HD13 LEU 21 3HD1 LEU 21 2.036 -10.840 -3.457 179 HD21 LEU 21 3HD2 LEU 21 6.170 -10.536 -4.401 180 HD22 LEU 21 1HD2 LEU 21 5.017 -10.702 -5.725 181 HD23 LEU 21 2HD2 LEU 21 5.305 -12.055 -4.631 182 H GLY 22 H GLY 22 5.094 -6.266 -2.698 183 HA2 GLY 22 1HA GLY 22 7.245 -7.284 -1.147 184 HA3 GLY 22 2HA GLY 22 7.015 -5.607 -1.619 185 H ILE 23 H ILE 23 4.728 -4.872 -0.382 186 HA ILE 23 HA ILE 23 5.541 -4.452 2.292 187 HB ILE 23 HB ILE 23 2.756 -4.093 1.162 188 HG12 ILE 23 1HG1 ILE 23 4.749 -1.872 1.456 189 HG13 ILE 23 2HG1 ILE 23 4.815 -2.910 0.036 190 HG21 ILE 23 1HG2 ILE 23 2.546 -3.923 3.478 191 HG22 ILE 23 2HG2 ILE 23 2.752 -2.250 2.960 192 HG23 ILE 23 3HG2 ILE 23 4.111 -3.131 3.658 193 HD11 ILE 23 3HD1 ILE 23 2.503 -2.316 -0.495 194 HD12 ILE 23 1HD1 ILE 23 3.548 -0.897 -0.417 195 HD13 ILE 23 2HD1 ILE 23 2.457 -1.262 0.918 196 H GLY 24 H GLY 24 3.184 -6.664 0.834 197 HA2 GLY 24 1HA GLY 24 2.111 -7.709 3.225 198 HA3 GLY 24 2HA GLY 24 2.097 -8.512 1.661 199 H LEU 25 H LEU 25 4.804 -8.830 1.196 200 HA LEU 25 HA LEU 25 5.393 -11.084 2.854 201 HB2 LEU 25 1HB LEU 25 6.904 -9.710 0.641 202 HB3 LEU 25 2HB LEU 25 7.559 -11.085 1.507 203 HG LEU 25 HG LEU 25 4.878 -11.297 0.184 204 HD11 LEU 25 1HD1 LEU 25 7.552 -11.637 -1.163 205 HD12 LEU 25 2HD1 LEU 25 6.333 -10.422 -1.541 206 HD13 LEU 25 3HD1 LEU 25 5.997 -12.126 -1.838 207 HD21 LEU 25 3HD2 LEU 25 5.571 -13.092 1.675 208 HD22 LEU 25 1HD2 LEU 25 7.078 -13.275 0.780 209 HD23 LEU 25 2HD2 LEU 25 5.542 -13.654 0.004 210 H PHE 26 H PHE 26 6.262 -7.737 2.875 211 HA PHE 26 HA PHE 26 8.632 -7.985 4.458 212 HB2 PHE 26 1HB PHE 26 7.790 -6.011 2.935 213 HB3 PHE 26 2HB PHE 26 6.988 -5.482 4.411 214 HD1 PHE 26 HD1 PHE 26 10.199 -5.989 2.743 215 HD2 PHE 26 HD2 PHE 26 8.266 -4.702 6.310 216 HE1 PHE 26 HE1 PHE 26 12.295 -4.941 3.495 217 HE2 PHE 26 HE2 PHE 26 10.357 -3.651 7.068 218 HZ PHE 26 HZ PHE 26 12.375 -3.770 5.660 219 H ILE 27 H ILE 27 5.214 -7.369 5.155 220 HA ILE 27 HA ILE 27 5.703 -7.039 7.991 221 HB ILE 27 HB ILE 27 3.031 -7.356 6.613 222 HG12 ILE 27 1HG1 ILE 27 4.193 -4.712 7.441 223 HG13 ILE 27 2HG1 ILE 27 4.623 -5.406 5.882 224 HG21 ILE 27 1HG2 ILE 27 2.159 -6.201 8.602 225 HG22 ILE 27 2HG2 ILE 27 3.781 -6.188 9.295 226 HG23 ILE 27 3HG2 ILE 27 2.952 -7.720 9.019 227 HD11 ILE 27 3HD1 ILE 27 1.814 -4.833 6.798 228 HD12 ILE 27 1HD1 ILE 27 2.306 -5.413 5.207 229 HD13 ILE 27 2HD1 ILE 27 2.773 -3.799 5.741 230 H ARG 28 H ARG 28 4.543 -9.569 5.830 231 HA ARG 28 HA ARG 28 3.552 -11.341 7.788 232 HB2 ARG 28 1HB ARG 28 4.482 -11.653 4.960 233 HB3 ARG 28 2HB ARG 28 4.137 -13.084 5.922 234 HG2 ARG 28 1HG ARG 28 1.864 -12.281 6.309 235 HG3 ARG 28 2HG ARG 28 2.208 -10.844 5.348 236 HD2 ARG 28 1HD ARG 28 2.502 -13.629 4.255 237 HD3 ARG 28 2HD ARG 28 0.981 -12.741 4.181 238 HE ARG 28 HE ARG 28 3.007 -11.122 3.123 239 HH11 ARG 28 1HH1 ARG 28 1.299 -14.070 2.345 240 HH12 ARG 28 2HH1 ARG 28 1.492 -13.876 0.633 241 HH21 ARG 28 1HH2 ARG 28 3.259 -10.868 0.877 242 HH22 ARG 28 2HH2 ARG 28 2.604 -12.059 -0.197 243 H ARG 29 H ARG 29 6.782 -10.631 6.732 244 HA ARG 29 HA ARG 29 7.952 -13.013 7.865 245 HB2 ARG 29 1HB ARG 29 9.080 -10.525 6.607 246 HB3 ARG 29 2HB ARG 29 10.119 -11.702 7.398 247 HG2 ARG 29 1HG ARG 29 9.328 -13.434 5.869 248 HG3 ARG 29 2HG ARG 29 8.284 -12.253 5.075 249 HD2 ARG 29 1HD ARG 29 10.249 -10.939 4.446 250 HD3 ARG 29 2HD ARG 29 11.293 -12.116 5.243 251 HE ARG 29 HE ARG 29 9.726 -13.465 3.361 252 HH11 ARG 29 1HH1 ARG 29 12.298 -11.100 3.436 253 HH12 ARG 29 2HH1 ARG 29 12.938 -11.566 1.897 254 HH21 ARG 29 1HH2 ARG 29 10.570 -14.075 1.337 255 HH22 ARG 29 2HH2 ARG 29 11.957 -13.252 0.706 256 H ARG 30 H ARG 30 7.023 -9.931 9.005 257 HA ARG 30 HA ARG 30 8.891 -9.872 11.222 258 HB2 ARG 30 1HB ARG 30 6.650 -8.075 10.332 259 HB3 ARG 30 2HB ARG 30 7.433 -7.861 11.891 260 HG2 ARG 30 1HG ARG 30 9.589 -7.577 10.754 261 HG3 ARG 30 2HG ARG 30 8.776 -7.747 9.198 262 HD2 ARG 30 1HD ARG 30 7.438 -5.769 9.663 263 HD3 ARG 30 2HD ARG 30 8.188 -5.616 11.251 264 HE ARG 30 HE ARG 30 10.161 -5.616 9.222 265 HH11 ARG 30 1HH1 ARG 30 7.691 -3.579 10.623 266 HH12 ARG 30 2HH1 ARG 30 8.494 -2.103 10.200 267 HH21 ARG 30 1HH2 ARG 30 11.212 -3.677 8.668 268 HH22 ARG 30 2HH2 ARG 30 10.492 -2.159 9.091 269 H HIS 31 H HIS 31 5.723 -11.069 10.586 270 HA HIS 31 HA HIS 31 4.704 -11.018 13.243 271 HB2 HIS 31 1HB HIS 31 3.936 -12.444 10.722 272 HB3 HIS 31 2HB HIS 31 3.179 -12.888 12.247 273 HD1 HIS 31 HD1 HIS 31 1.607 -11.137 13.343 274 HD2 HIS 31 HD2 HIS 31 3.144 -9.991 9.658 275 HE1 HIS 31 HE1 HIS 31 0.234 -9.154 12.630 276 HE2 HIS 31 HE2 HIS 31 1.240 -8.425 10.438 277 H ILE 32 H ILE 32 6.742 -13.242 11.484 278 HA ILE 32 HA ILE 32 6.461 -15.372 13.423 279 HB ILE 32 HB ILE 32 8.602 -15.241 11.309 280 HG12 ILE 32 1HG1 ILE 32 6.052 -16.635 10.692 281 HG13 ILE 32 2HG1 ILE 32 6.024 -14.877 10.613 282 HG21 ILE 32 1HG2 ILE 32 8.788 -17.029 12.950 283 HG22 ILE 32 2HG2 ILE 32 8.380 -17.688 11.367 284 HG23 ILE 32 3HG2 ILE 32 7.135 -17.539 12.606 285 HD11 ILE 32 3HD1 ILE 32 7.782 -16.746 9.047 286 HD12 ILE 32 1HD1 ILE 32 7.966 -14.993 9.058 287 HD13 ILE 32 2HD1 ILE 32 6.485 -15.719 8.436 288 H VAL 33 H VAL 33 8.405 -12.579 13.037 289 HA VAL 33 HA VAL 33 10.491 -13.587 14.834 290 HB VAL 33 HB VAL 33 10.452 -10.847 13.576 291 HG11 VAL 33 1HG1 VAL 33 12.694 -12.621 14.545 292 HG12 VAL 33 2HG1 VAL 33 12.062 -11.194 15.369 293 HG13 VAL 33 3HG1 VAL 33 12.887 -11.024 13.820 294 HG21 VAL 33 3HG2 VAL 33 10.189 -12.450 11.761 295 HG22 VAL 33 1HG2 VAL 33 11.565 -13.377 12.362 296 HG23 VAL 33 2HG2 VAL 33 11.806 -11.745 11.738 297 H ARG 34 H ARG 34 7.785 -11.395 14.723 298 HA ARG 34 HA ARG 34 8.467 -10.192 17.292 299 HB2 ARG 34 1HB ARG 34 7.348 -9.068 15.150 300 HB3 ARG 34 2HB ARG 34 5.876 -9.631 15.930 301 HG2 ARG 34 1HG ARG 34 6.665 -8.435 18.009 302 HG3 ARG 34 2HG ARG 34 7.916 -7.702 17.001 303 HD2 ARG 34 1HD ARG 34 6.075 -6.898 15.488 304 HD3 ARG 34 2HD ARG 34 4.929 -7.440 16.714 305 HE ARG 34 HE ARG 34 6.664 -5.817 18.062 306 HH11 ARG 34 1HH1 ARG 34 4.600 -5.422 15.268 307 HH12 ARG 34 2HH1 ARG 34 4.347 -3.731 15.541 308 HH21 ARG 34 1HH2 ARG 34 6.329 -3.596 18.416 309 HH22 ARG 34 2HH2 ARG 34 5.329 -2.695 17.326 310 H LYS 35 H LYS 35 6.958 -10.188 19.066 311 HA LYS 35 HA LYS 35 5.600 -12.759 19.342 312 HB2 LYS 35 1HB LYS 35 6.489 -10.663 21.314 313 HB3 LYS 35 2HB LYS 35 5.418 -11.976 21.780 314 HG2 LYS 35 1HG LYS 35 7.120 -13.599 21.075 315 HG3 LYS 35 2HG LYS 35 8.197 -12.265 20.658 316 HD2 LYS 35 1HD LYS 35 8.175 -11.511 22.982 317 HD3 LYS 35 2HD LYS 35 7.077 -12.826 23.403 318 HE2 LYS 35 1HE LYS 35 8.782 -14.454 22.724 319 HE3 LYS 35 2HE LYS 35 9.879 -13.132 22.326 320 HZ1 LYS 35 3HZ LYS 35 9.830 -12.445 24.644 321 HZ2 LYS 35 1HZ LYS 35 10.356 -14.047 24.507 322 HZ3 LYS 35 2HZ LYS 35 8.780 -13.715 25.025 323 H ARG 36 H ARG 36 3.480 -12.872 20.352 324 HA ARG 36 HA ARG 36 1.706 -10.843 19.282 325 HB2 ARG 36 1HB ARG 36 1.269 -13.579 20.459 326 HB3 ARG 36 2HB ARG 36 -0.074 -12.497 20.115 327 HG2 ARG 36 1HG ARG 36 0.579 -12.431 17.761 328 HG3 ARG 36 2HG ARG 36 1.927 -13.517 18.108 329 HD2 ARG 36 1HD ARG 36 0.350 -15.237 18.842 330 HD3 ARG 36 2HD ARG 36 -0.995 -14.151 18.500 331 HE ARG 36 HE ARG 36 0.536 -14.414 16.174 332 HH11 ARG 36 1HH1 ARG 36 -1.542 -16.363 18.200 333 HH12 ARG 36 2HH1 ARG 36 -2.042 -17.397 16.902 334 HH21 ARG 36 1HH2 ARG 36 -0.125 -15.773 14.473 335 HH22 ARG 36 2HH2 ARG 36 -1.239 -17.062 14.789 336 H THR 37 H THR 37 3.318 -10.065 21.520 337 HA THR 37 HA THR 37 1.630 -10.061 23.867 338 HB THR 37 HB THR 37 3.417 -8.489 24.769 339 HG1 THR 37 HG1 THR 37 4.558 -7.696 23.136 340 HG21 THR 37 3HG2 THR 37 5.052 -10.292 25.079 341 HG22 THR 37 1HG2 THR 37 4.277 -11.215 23.789 342 HG23 THR 37 2HG2 THR 37 3.401 -10.878 25.283 343 H LEU 38 H LEU 38 1.943 -8.153 21.081 344 HA LEU 38 HA LEU 38 0.957 -5.711 22.313 345 HB2 LEU 38 1HB LEU 38 2.082 -6.438 19.658 346 HB3 LEU 38 2HB LEU 38 0.953 -5.100 19.708 347 HG LEU 38 HG LEU 38 3.245 -4.296 19.800 348 HD11 LEU 38 1HD1 LEU 38 2.634 -2.626 21.125 349 HD12 LEU 38 2HD1 LEU 38 2.652 -3.660 22.554 350 HD13 LEU 38 3HD1 LEU 38 1.210 -3.576 21.544 351 HD21 LEU 38 3HD2 LEU 38 3.497 -5.915 22.332 352 HD22 LEU 38 1HD2 LEU 38 4.697 -4.785 21.705 353 HD23 LEU 38 2HD2 LEU 38 4.305 -6.245 20.800 354 H ARG 39 H ARG 39 -0.206 -8.497 20.948 355 HA ARG 39 HA ARG 39 -2.762 -7.412 20.072 356 HB2 ARG 39 1HB ARG 39 -1.267 -9.228 18.808 357 HB3 ARG 39 2HB ARG 39 -2.106 -10.320 19.901 358 HG2 ARG 39 1HG ARG 39 -4.246 -9.593 19.037 359 HG3 ARG 39 2HG ARG 39 -3.448 -8.413 17.996 360 HD2 ARG 39 1HD ARG 39 -2.299 -10.234 16.827 361 HD3 ARG 39 2HD ARG 39 -3.112 -11.407 17.862 362 HE ARG 39 HE ARG 39 -5.059 -9.819 16.630 363 HH11 ARG 39 1HH1 ARG 39 -2.684 -12.232 15.761 364 HH12 ARG 39 2HH1 ARG 39 -3.585 -12.807 14.399 365 HH21 ARG 39 1HH2 ARG 39 -6.241 -10.578 14.841 366 HH22 ARG 39 2HH2 ARG 39 -5.604 -11.867 13.876 367 H ARG 40 H ARG 40 -1.131 -9.474 22.356 368 HA ARG 40 HA ARG 40 -3.507 -10.379 23.709 369 HB2 ARG 40 1HB ARG 40 -0.563 -10.465 24.349 370 HB3 ARG 40 2HB ARG 40 -1.760 -10.951 25.538 371 HG2 ARG 40 1HG ARG 40 -2.597 -12.658 24.004 372 HG3 ARG 40 2HG ARG 40 -1.395 -12.170 22.808 373 HD2 ARG 40 1HD ARG 40 -0.476 -14.052 23.875 374 HD3 ARG 40 2HD ARG 40 0.352 -12.667 24.583 375 HE ARG 40 HE ARG 40 -1.863 -13.279 26.178 376 HH11 ARG 40 1HH1 ARG 40 1.217 -14.673 25.293 377 HH12 ARG 40 2HH1 ARG 40 1.392 -15.542 26.781 378 HH21 ARG 40 1HH2 ARG 40 -1.631 -14.420 28.132 379 HH22 ARG 40 2HH2 ARG 40 -0.225 -15.397 28.392 380 H LEU 41 H LEU 41 -1.534 -7.630 23.650 381 HA LEU 41 HA LEU 41 -2.690 -6.534 26.098 382 HB2 LEU 41 1HB LEU 41 -0.201 -5.991 24.555 383 HB3 LEU 41 2HB LEU 41 -0.946 -4.643 25.394 384 HG LEU 41 HG LEU 41 -0.342 -7.188 26.866 385 HD11 LEU 41 1HD1 LEU 41 1.590 -4.929 26.353 386 HD12 LEU 41 2HD1 LEU 41 1.739 -6.586 25.763 387 HD13 LEU 41 3HD1 LEU 41 1.835 -6.253 27.491 388 HD21 LEU 41 3HD2 LEU 41 -0.532 -4.289 27.682 389 HD22 LEU 41 1HD2 LEU 41 -0.147 -5.630 28.762 390 HD23 LEU 41 2HD2 LEU 41 -1.729 -5.546 27.990 391 H LEU 42 H LEU 42 -2.697 -6.381 22.637 392 HA LEU 42 HA LEU 42 -3.717 -3.737 22.337 393 HB2 LEU 42 1HB LEU 42 -2.746 -5.341 20.549 394 HB3 LEU 42 2HB LEU 42 -4.379 -5.974 20.447 395 HG LEU 42 HG LEU 42 -4.097 -3.035 20.188 396 HD11 LEU 42 1HD1 LEU 42 -3.465 -3.207 17.826 397 HD12 LEU 42 2HD1 LEU 42 -3.198 -4.937 18.029 398 HD13 LEU 42 3HD1 LEU 42 -2.184 -3.782 18.892 399 HD21 LEU 42 3HD2 LEU 42 -6.265 -4.154 20.025 400 HD22 LEU 42 1HD2 LEU 42 -5.665 -5.125 18.680 401 HD23 LEU 42 2HD2 LEU 42 -5.828 -3.378 18.502 402 H GLN 43 H GLN 43 -5.332 -6.899 22.458 403 HA GLN 43 HA GLN 43 -7.955 -5.678 22.506 404 HB2 GLN 43 1HB GLN 43 -7.158 -8.008 21.499 405 HB3 GLN 43 2HB GLN 43 -7.544 -8.568 23.120 406 HG2 GLN 43 1HG GLN 43 -9.817 -7.706 22.878 407 HG3 GLN 43 2HG GLN 43 -9.428 -7.142 21.253 408 HE21 GLN 43 2HE2 GLN 43 -9.163 -8.642 19.599 409 HE22 GLN 43 1HE2 GLN 43 -9.717 -10.272 19.738 410 H GLU 44 H GLU 44 -5.551 -6.301 24.749 411 HA GLU 44 HA GLU 44 -7.283 -6.952 26.983 412 HB2 GLU 44 1HB GLU 44 -4.714 -7.517 26.542 413 HB3 GLU 44 2HB GLU 44 -4.494 -6.010 27.418 414 HG2 GLU 44 1HG GLU 44 -6.206 -8.211 28.514 415 HG3 GLU 44 2HG GLU 44 -4.458 -8.202 28.736 416 H ARG 45 H ARG 45 -5.656 -4.107 25.706 417 HA ARG 45 HA ARG 45 -6.451 -2.467 27.965 418 HB2 ARG 45 1HB ARG 45 -4.253 -2.342 26.485 419 HB3 ARG 45 2HB ARG 45 -5.261 -1.306 25.485 420 HG2 ARG 45 1HG ARG 45 -4.209 0.207 26.870 421 HG3 ARG 45 2HG ARG 45 -5.745 -0.049 27.699 422 HD2 ARG 45 1HD ARG 45 -4.692 -1.614 29.225 423 HD3 ARG 45 2HD ARG 45 -3.165 -1.468 28.357 424 HE ARG 45 HE ARG 45 -3.953 1.084 29.190 425 HH11 ARG 45 1HH1 ARG 45 -2.875 -1.934 30.587 426 HH12 ARG 45 2HH1 ARG 45 -2.160 -1.179 31.974 427 HH21 ARG 45 1HH2 ARG 45 -3.015 2.071 31.012 428 HH22 ARG 45 2HH2 ARG 45 -2.241 1.094 32.213 429 H GLU 46 H GLU 46 -7.809 -3.471 25.050 430 HA GLU 46 HA GLU 46 -9.278 -1.101 24.397 431 HB2 GLU 46 1HB GLU 46 -9.349 -3.954 23.480 432 HB3 GLU 46 2HB GLU 46 -10.652 -2.860 23.037 433 HG2 GLU 46 1HG GLU 46 -9.034 -1.355 21.993 434 HG3 GLU 46 2HG GLU 46 -7.731 -2.459 22.432 435 H LEU 47 H LEU 47 -9.629 -3.477 26.783 436 HA LEU 47 HA LEU 47 -12.451 -2.756 27.155 437 HB2 LEU 47 1HB LEU 47 -11.771 -5.220 26.653 438 HB3 LEU 47 2HB LEU 47 -11.242 -5.234 28.325 439 HG LEU 47 HG LEU 47 -13.703 -4.336 28.747 440 HD11 LEU 47 1HD1 LEU 47 -15.298 -5.391 27.224 441 HD12 LEU 47 2HD1 LEU 47 -13.968 -5.917 26.192 442 HD13 LEU 47 3HD1 LEU 47 -14.304 -4.196 26.392 443 HD21 LEU 47 3HD2 LEU 47 -14.396 -6.659 29.125 444 HD22 LEU 47 1HD2 LEU 47 -12.761 -6.356 29.712 445 HD23 LEU 47 2HD2 LEU 47 -13.007 -7.217 28.193 446 H VAL 48 H VAL 48 -9.571 -1.985 28.198 447 HA VAL 48 HA VAL 48 -10.474 -1.530 30.968 448 HB VAL 48 HB VAL 48 -7.562 -1.882 30.258 449 HG11 VAL 48 1HG1 VAL 48 -9.062 -2.060 32.871 450 HG12 VAL 48 2HG1 VAL 48 -8.034 -0.726 32.350 451 HG13 VAL 48 3HG1 VAL 48 -7.329 -2.312 32.662 452 HG21 VAL 48 3HG2 VAL 48 -9.344 -4.034 31.389 453 HG22 VAL 48 1HG2 VAL 48 -7.644 -4.170 30.943 454 HG23 VAL 48 2HG2 VAL 48 -8.866 -3.939 29.692 455 H GLU 49 H GLU 49 -11.249 0.391 29.543 456 HA GLU 49 HA GLU 49 -9.161 2.423 29.256 457 HB2 GLU 49 1HB GLU 49 -11.054 1.808 27.504 458 HB3 GLU 49 2HB GLU 49 -12.000 2.923 28.481 459 HG2 GLU 49 1HG GLU 49 -10.394 4.688 28.077 460 HG3 GLU 49 2HG GLU 49 -9.371 3.576 27.169 461 HA PRO 50 HA PRO 50 -10.513 4.226 33.116 462 HB2 PRO 50 1HB PRO 50 -9.061 6.520 32.993 463 HB3 PRO 50 2HB PRO 50 -8.334 4.946 33.367 464 HG2 PRO 50 1HG PRO 50 -8.342 6.456 30.803 465 HG3 PRO 50 2HG PRO 50 -7.040 5.517 31.560 466 HD2 PRO 50 1HD PRO 50 -8.575 4.569 29.518 467 HD3 PRO 50 2HD PRO 50 -7.813 3.530 30.737 468 H LEU 51 H LEU 51 -12.247 5.406 33.647 469 HA LEU 51 HA LEU 51 -13.007 7.713 32.059 470 HB2 LEU 51 1HB LEU 51 -14.211 5.312 31.542 471 HB3 LEU 51 2HB LEU 51 -15.281 5.973 32.759 472 HG LEU 51 HG LEU 51 -16.132 6.482 30.557 473 HD11 LEU 51 1HD1 LEU 51 -16.513 8.156 32.273 474 HD12 LEU 51 2HD1 LEU 51 -16.317 8.912 30.692 475 HD13 LEU 51 3HD1 LEU 51 -14.994 8.948 31.856 476 HD21 LEU 51 3HD2 LEU 51 -13.795 6.417 29.506 477 HD22 LEU 51 1HD2 LEU 51 -13.698 8.122 29.949 478 HD23 LEU 51 2HD2 LEU 51 -14.965 7.565 28.857 479 H THR 52 H THR 52 -12.387 8.897 33.862 480 HA THR 52 HA THR 52 -14.238 8.730 36.150 481 HB THR 52 HB THR 52 -12.358 9.816 37.485 482 HG1 THR 52 HG1 THR 52 -10.232 9.135 36.504 483 HG21 THR 52 3HG2 THR 52 -12.991 7.475 37.788 484 HG22 THR 52 1HG2 THR 52 -11.245 7.674 37.930 485 HG23 THR 52 2HG2 THR 52 -11.939 7.008 36.451 486 HA PRO 53 HA PRO 53 -15.377 12.909 35.195 487 HB2 PRO 53 1HB PRO 53 -16.223 13.744 37.652 488 HB3 PRO 53 2HB PRO 53 -17.160 12.637 36.630 489 HG2 PRO 53 1HG PRO 53 -15.420 12.027 38.967 490 HG3 PRO 53 2HG PRO 53 -16.994 11.339 38.517 491 HD2 PRO 53 1HD PRO 53 -14.654 10.055 38.052 492 HD3 PRO 53 2HD PRO 53 -16.078 9.872 37.010 493 H SER 54 H SER 54 -13.979 14.467 34.780 494 HA SER 54 HA SER 54 -12.176 15.386 36.922 495 HB2 SER 54 1HB SER 54 -10.592 16.033 35.082 496 HB3 SER 54 2HB SER 54 -10.844 14.295 35.237 497 HG SER 54 HG SER 54 -12.236 14.378 33.472 498 H GLY 55 H GLY 55 -14.727 16.187 34.903 499 HA2 GLY 55 1HA GLY 55 -15.254 18.681 35.823 500 HA3 GLY 55 2HA GLY 55 -14.091 18.983 34.541 501 H GLU 56 H GLU 56 -16.938 16.877 34.971 502 HA GLU 56 HA GLU 56 -17.820 17.633 32.276 503 HB2 GLU 56 1HB GLU 56 -18.479 15.296 34.059 504 HB3 GLU 56 2HB GLU 56 -19.427 15.672 32.627 505 HG2 GLU 56 1HG GLU 56 -17.432 15.423 31.240 506 HG3 GLU 56 2HG GLU 56 -16.482 15.049 32.676 507 H LYS 57 H LYS 57 -19.929 18.336 31.875 508 HA LYS 57 HA LYS 57 -21.128 19.806 34.054 509 HB2 LYS 57 1HB LYS 57 -21.649 19.693 31.091 510 HB3 LYS 57 2HB LYS 57 -22.707 20.571 32.187 511 HG2 LYS 57 1HG LYS 57 -20.826 21.966 32.888 512 HG3 LYS 57 2HG LYS 57 -19.765 21.082 31.790 513 HD2 LYS 57 1HD LYS 57 -21.124 21.816 29.890 514 HD3 LYS 57 2HD LYS 57 -22.186 22.699 30.988 515 HE2 LYS 57 1HE LYS 57 -19.229 23.226 30.804 516 HE3 LYS 57 2HE LYS 57 -20.409 24.055 29.789 517 HZ1 LYS 57 3HZ LYS 57 -20.358 24.086 32.760 518 HZ2 LYS 57 1HZ LYS 57 -21.490 24.884 31.787 519 HZ3 LYS 57 2HZ LYS 57 -19.865 25.352 31.751 520 H LEU 58 H LEU 58 -22.012 17.145 31.895 521 HA LEU 58 HA LEU 58 -24.577 16.817 33.208 522 HB2 LEU 58 1HB LEU 58 -23.277 15.388 30.898 523 HB3 LEU 58 2HB LEU 58 -24.832 14.924 31.558 524 HG LEU 58 HG LEU 58 -25.393 17.479 31.081 525 HD11 LEU 58 1HD1 LEU 58 -23.160 18.053 30.296 526 HD12 LEU 58 2HD1 LEU 58 -24.345 18.225 29.003 527 HD13 LEU 58 3HD1 LEU 58 -23.274 16.823 29.038 528 HD21 LEU 58 3HD2 LEU 58 -26.616 15.580 30.188 529 HD22 LEU 58 1HD2 LEU 58 -25.351 15.306 28.991 530 HD23 LEU 58 2HD2 LEU 58 -26.326 16.774 28.923 531 H TRP 59 H TRP 59 -21.447 15.785 33.709 532 HA TRP 59 HA TRP 59 -22.383 13.532 35.354 533 HB2 TRP 59 1HB TRP 59 -19.984 13.588 33.520 534 HB3 TRP 59 2HB TRP 59 -20.176 12.399 34.804 535 HD1 TRP 59 HD1 TRP 59 -21.538 13.350 31.371 536 HE1 TRP 59 HE1 TRP 59 -22.955 11.401 30.467 537 HE3 TRP 59 HE3 TRP 59 -21.650 10.409 35.558 538 HZ2 TRP 59 HZ2 TRP 59 -23.984 8.947 31.402 539 HZ3 TRP 59 HZ3 TRP 59 -22.873 8.277 35.467 540 HH2 TRP 59 HH2 TRP 59 -24.017 7.563 33.431 541 H SER 60 H SER 60 -21.598 13.462 37.381 542 HA SER 60 HA SER 60 -19.409 15.302 38.082 543 HB2 SER 60 1HB SER 60 -20.594 15.679 40.266 544 HB3 SER 60 2HB SER 60 -21.443 16.329 38.866 545 HG SER 60 HG SER 60 -22.981 14.866 39.092 546 H1 LYS 61 1H LYS 61 -0.436 8.483 -32.921 547 H2 LYS 61 2H LYS 61 -0.400 7.919 -31.326 548 H3 LYS 61 3H LYS 61 0.972 8.646 -31.997 549 HA LYS 61 HA LYS 61 -0.160 10.750 -32.164 550 HB2 LYS 61 1HB LYS 61 -2.437 9.367 -32.244 551 HB3 LYS 61 2HB LYS 61 -2.426 9.721 -30.521 552 HG2 LYS 61 1HG LYS 61 -2.285 12.112 -31.011 553 HG3 LYS 61 2HG LYS 61 -2.296 11.755 -32.739 554 HD2 LYS 61 1HD LYS 61 -4.510 10.734 -32.511 555 HD3 LYS 61 2HD LYS 61 -4.495 11.088 -30.782 556 HE2 LYS 61 1HE LYS 61 -4.368 13.481 -31.276 557 HE3 LYS 61 2HE LYS 61 -4.381 13.127 -33.003 558 HZ1 LYS 61 3HZ LYS 61 -6.578 12.150 -32.747 559 HZ2 LYS 61 1HZ LYS 61 -6.573 13.756 -32.216 560 HZ3 LYS 61 2HZ LYS 61 -6.565 12.494 -31.090 561 H ILE 62 H ILE 62 -0.358 8.400 -29.521 562 HA ILE 62 HA ILE 62 0.924 10.386 -27.765 563 HB ILE 62 HB ILE 62 -0.263 9.132 -25.852 564 HG12 ILE 62 1HG1 ILE 62 -2.680 8.522 -26.892 565 HG13 ILE 62 2HG1 ILE 62 -1.654 8.040 -28.238 566 HG21 ILE 62 1HG2 ILE 62 -1.820 10.923 -27.708 567 HG22 ILE 62 2HG2 ILE 62 -0.719 11.439 -26.431 568 HG23 ILE 62 3HG2 ILE 62 -2.217 10.604 -26.020 569 HD11 ILE 62 3HD1 ILE 62 -0.405 6.561 -26.755 570 HD12 ILE 62 1HD1 ILE 62 -2.124 6.168 -26.771 571 HD13 ILE 62 2HD1 ILE 62 -1.432 7.047 -25.407 572 HA PRO 63 HA PRO 63 4.066 7.332 -27.136 573 HB2 PRO 63 1HB PRO 63 4.980 8.080 -24.672 574 HB3 PRO 63 2HB PRO 63 5.343 8.980 -26.157 575 HG2 PRO 63 1HG PRO 63 3.318 9.555 -24.055 576 HG3 PRO 63 2HG PRO 63 4.382 10.668 -24.937 577 HD2 PRO 63 1HD PRO 63 1.768 10.343 -25.566 578 HD3 PRO 63 2HD PRO 63 3.007 10.749 -26.772 579 H SER 64 H SER 64 4.262 5.317 -26.311 580 HA SER 64 HA SER 64 2.131 4.299 -24.657 581 HB2 SER 64 1HB SER 64 3.087 3.060 -26.624 582 HB3 SER 64 2HB SER 64 4.562 2.819 -25.685 583 HG SER 64 HG SER 64 2.201 1.490 -25.562 584 H ILE 65 H ILE 65 5.065 5.742 -23.999 585 HA ILE 65 HA ILE 65 5.787 4.155 -21.690 586 HB ILE 65 HB ILE 65 6.890 6.883 -22.348 587 HG12 ILE 65 1HG1 ILE 65 8.749 5.179 -23.365 588 HG13 ILE 65 2HG1 ILE 65 7.267 4.320 -23.772 589 HG21 ILE 65 1HG2 ILE 65 8.064 4.498 -20.923 590 HG22 ILE 65 2HG2 ILE 65 7.485 5.984 -20.169 591 HG23 ILE 65 3HG2 ILE 65 8.896 6.024 -21.226 592 HD11 ILE 65 3HD1 ILE 65 6.446 6.273 -24.958 593 HD12 ILE 65 1HD1 ILE 65 8.015 5.766 -25.586 594 HD13 ILE 65 2HD1 ILE 65 7.901 7.165 -24.517 595 H ALA 66 H ALA 66 4.057 7.130 -22.359 596 HA ALA 66 HA ALA 66 3.898 7.903 -19.574 597 HB1 ALA 66 3HB ALA 66 4.040 9.579 -21.386 598 HB2 ALA 66 1HB ALA 66 2.629 9.797 -20.352 599 HB3 ALA 66 2HB ALA 66 2.448 9.066 -21.946 600 H THR 67 H THR 67 1.996 6.106 -21.851 601 HA THR 67 HA THR 67 -0.543 6.322 -20.650 602 HB THR 67 HB THR 67 0.286 3.799 -22.031 603 HG1 THR 67 HG1 THR 67 0.031 4.925 -24.038 604 HG21 THR 67 3HG2 THR 67 -2.180 5.544 -22.138 605 HG22 THR 67 1HG2 THR 67 -2.023 3.996 -21.306 606 HG23 THR 67 2HG2 THR 67 -1.949 4.061 -23.066 607 H GLY 68 H GLY 68 2.204 4.231 -19.980 608 HA2 GLY 68 1HA GLY 68 0.737 2.537 -18.152 609 HA3 GLY 68 2HA GLY 68 2.465 2.491 -18.460 610 H LEU 69 H LEU 69 3.077 5.169 -17.907 611 HA LEU 69 HA LEU 69 3.466 5.089 -15.129 612 HB2 LEU 69 1HB LEU 69 3.681 7.379 -17.083 613 HB3 LEU 69 2HB LEU 69 4.185 7.482 -15.407 614 HG LEU 69 HG LEU 69 5.344 5.374 -17.202 615 HD11 LEU 69 1HD1 LEU 69 6.087 8.279 -17.062 616 HD12 LEU 69 2HD1 LEU 69 5.788 7.285 -18.488 617 HD13 LEU 69 3HD1 LEU 69 7.245 7.034 -17.528 618 HD21 LEU 69 3HD2 LEU 69 6.358 6.838 -14.766 619 HD22 LEU 69 1HD2 LEU 69 7.255 5.620 -15.671 620 HD23 LEU 69 2HD2 LEU 69 5.775 5.176 -14.823 621 H VAL 70 H VAL 70 1.134 6.901 -17.103 622 HA VAL 70 HA VAL 70 0.028 8.423 -15.028 623 HB VAL 70 HB VAL 70 -1.965 8.697 -16.494 624 HG11 VAL 70 1HG1 VAL 70 0.801 9.105 -17.593 625 HG12 VAL 70 2HG1 VAL 70 -0.264 10.277 -16.812 626 HG13 VAL 70 3HG1 VAL 70 -0.636 9.694 -18.435 627 HG21 VAL 70 3HG2 VAL 70 -2.013 6.486 -17.527 628 HG22 VAL 70 1HG2 VAL 70 -0.481 6.817 -18.336 629 HG23 VAL 70 2HG2 VAL 70 -1.918 7.746 -18.758 630 H GLY 71 H GLY 71 -0.817 5.229 -16.221 631 HA2 GLY 71 1HA GLY 71 -3.158 4.885 -14.650 632 HA3 GLY 71 2HA GLY 71 -2.233 3.599 -15.410 633 H ALA 72 H ALA 72 0.194 3.771 -14.161 634 HA ALA 72 HA ALA 72 -0.415 2.544 -11.653 635 HB1 ALA 72 3HB ALA 72 1.451 1.894 -13.242 636 HB2 ALA 72 1HB ALA 72 1.862 1.965 -11.529 637 HB3 ALA 72 2HB ALA 72 2.338 3.279 -12.605 638 H LEU 73 H LEU 73 1.158 5.601 -12.547 639 HA LEU 73 HA LEU 73 1.829 6.339 -9.905 640 HB2 LEU 73 1HB LEU 73 1.600 7.786 -12.505 641 HB3 LEU 73 2HB LEU 73 1.740 8.722 -11.030 642 HG LEU 73 HG LEU 73 3.856 7.466 -10.518 643 HD11 LEU 73 1HD1 LEU 73 3.422 5.501 -11.937 644 HD12 LEU 73 2HD1 LEU 73 4.970 6.261 -12.306 645 HD13 LEU 73 3HD1 LEU 73 3.587 6.516 -13.369 646 HD21 LEU 73 3HD2 LEU 73 3.791 9.029 -13.094 647 HD22 LEU 73 1HD2 LEU 73 5.217 8.733 -12.099 648 HD23 LEU 73 2HD2 LEU 73 3.889 9.707 -11.469 649 H LEU 74 H LEU 74 -1.046 6.950 -11.897 650 HA LEU 74 HA LEU 74 -2.297 8.642 -9.975 651 HB2 LEU 74 1HB LEU 74 -3.035 7.421 -12.545 652 HB3 LEU 74 2HB LEU 74 -4.376 7.683 -11.447 653 HG LEU 74 HG LEU 74 -3.495 10.105 -11.267 654 HD11 LEU 74 1HD1 LEU 74 -1.342 9.427 -12.491 655 HD12 LEU 74 2HD1 LEU 74 -2.121 10.942 -12.953 656 HD13 LEU 74 3HD1 LEU 74 -2.320 9.507 -13.959 657 HD21 LEU 74 3HD2 LEU 74 -5.583 9.488 -12.355 658 HD22 LEU 74 1HD2 LEU 74 -4.708 9.091 -13.834 659 HD23 LEU 74 2HD2 LEU 74 -4.755 10.757 -13.258 660 H LEU 75 H LEU 75 -2.458 5.193 -10.694 661 HA LEU 75 HA LEU 75 -4.564 4.638 -8.848 662 HB2 LEU 75 1HB LEU 75 -2.879 3.136 -10.660 663 HB3 LEU 75 2HB LEU 75 -3.054 2.298 -9.130 664 HG LEU 75 HG LEU 75 -5.641 2.949 -9.626 665 HD11 LEU 75 1HD1 LEU 75 -5.119 3.939 -11.792 666 HD12 LEU 75 2HD1 LEU 75 -6.110 2.491 -11.973 667 HD13 LEU 75 3HD1 LEU 75 -4.380 2.423 -12.313 668 HD21 LEU 75 3HD2 LEU 75 -4.768 0.748 -9.000 669 HD22 LEU 75 1HD2 LEU 75 -4.196 0.509 -10.651 670 HD23 LEU 75 2HD2 LEU 75 -5.924 0.638 -10.327 671 H LEU 76 H LEU 76 -1.045 4.608 -8.662 672 HA LEU 76 HA LEU 76 -0.883 3.497 -6.045 673 HB2 LEU 76 1HB LEU 76 0.925 3.802 -7.958 674 HB3 LEU 76 2HB LEU 76 1.241 5.304 -7.109 675 HG LEU 76 HG LEU 76 1.386 3.699 -5.009 676 HD11 LEU 76 1HD1 LEU 76 2.177 1.883 -7.282 677 HD12 LEU 76 2HD1 LEU 76 0.752 1.686 -6.262 678 HD13 LEU 76 3HD1 LEU 76 2.365 1.550 -5.560 679 HD21 LEU 76 3HD2 LEU 76 3.169 5.153 -5.787 680 HD22 LEU 76 1HD2 LEU 76 3.570 4.005 -7.065 681 HD23 LEU 76 2HD2 LEU 76 3.807 3.562 -5.375 682 H LEU 77 H LEU 77 -1.133 6.757 -7.336 683 HA LEU 77 HA LEU 77 -0.565 8.132 -4.922 684 HB2 LEU 77 1HB LEU 77 -0.622 8.978 -7.386 685 HB3 LEU 77 2HB LEU 77 -2.323 9.254 -7.074 686 HG LEU 77 HG LEU 77 -1.368 10.561 -4.972 687 HD11 LEU 77 1HD1 LEU 77 0.700 11.737 -5.534 688 HD12 LEU 77 2HD1 LEU 77 0.869 10.749 -6.985 689 HD13 LEU 77 3HD1 LEU 77 0.963 10.000 -5.391 690 HD21 LEU 77 3HD2 LEU 77 -1.407 11.644 -7.786 691 HD22 LEU 77 1HD2 LEU 77 -1.458 12.614 -6.314 692 HD23 LEU 77 2HD2 LEU 77 -2.786 11.519 -6.696 693 H VAL 78 H VAL 78 -3.608 7.135 -6.479 694 HA VAL 78 HA VAL 78 -5.309 8.300 -4.516 695 HB VAL 78 HB VAL 78 -5.924 6.036 -6.430 696 HG11 VAL 78 1HG1 VAL 78 -8.269 6.685 -6.123 697 HG12 VAL 78 2HG1 VAL 78 -7.779 7.870 -4.912 698 HG13 VAL 78 3HG1 VAL 78 -7.540 6.151 -4.609 699 HG21 VAL 78 3HG2 VAL 78 -5.187 8.034 -7.610 700 HG22 VAL 78 1HG2 VAL 78 -6.354 9.009 -6.718 701 HG23 VAL 78 2HG2 VAL 78 -6.916 7.777 -7.848 702 H VAL 79 H VAL 79 -4.045 5.004 -4.972 703 HA VAL 79 HA VAL 79 -5.436 3.842 -2.793 704 HB VAL 79 HB VAL 79 -2.903 2.958 -4.189 705 HG11 VAL 79 1HG1 VAL 79 -2.857 1.927 -2.042 706 HG12 VAL 79 2HG1 VAL 79 -3.429 0.716 -3.188 707 HG13 VAL 79 3HG1 VAL 79 -4.575 1.533 -2.125 708 HG21 VAL 79 3HG2 VAL 79 -4.390 1.321 -5.268 709 HG22 VAL 79 1HG2 VAL 79 -4.854 2.983 -5.631 710 HG23 VAL 79 2HG2 VAL 79 -5.768 2.050 -4.445 711 H ALA 80 H ALA 80 -2.179 5.242 -3.075 712 HA ALA 80 HA ALA 80 -1.360 4.653 -0.426 713 HB1 ALA 80 3HB ALA 80 0.231 5.171 -2.214 714 HB2 ALA 80 1HB ALA 80 0.452 6.231 -0.823 715 HB3 ALA 80 2HB ALA 80 -0.367 6.830 -2.264 716 H LEU 81 H LEU 81 -2.948 7.450 -1.899 717 HA LEU 81 HA LEU 81 -2.855 9.120 0.396 718 HB2 LEU 81 1HB LEU 81 -3.379 9.649 -2.126 719 HB3 LEU 81 2HB LEU 81 -5.034 9.331 -1.642 720 HG LEU 81 HG LEU 81 -4.416 11.078 0.273 721 HD11 LEU 81 1HD1 LEU 81 -3.003 12.862 -0.614 722 HD12 LEU 81 2HD1 LEU 81 -2.642 11.876 -2.030 723 HD13 LEU 81 3HD1 LEU 81 -2.101 11.358 -0.433 724 HD21 LEU 81 3HD2 LEU 81 -6.266 11.293 -1.285 725 HD22 LEU 81 1HD2 LEU 81 -5.158 11.804 -2.558 726 HD23 LEU 81 2HD2 LEU 81 -5.404 12.823 -1.141 727 H GLY 82 H GLY 82 -5.154 6.730 -0.795 728 HA2 GLY 82 1HA GLY 82 -7.246 7.299 1.039 729 HA3 GLY 82 2HA GLY 82 -7.042 5.804 0.138 730 H ILE 83 H ILE 83 -4.715 4.781 1.064 731 HA ILE 83 HA ILE 83 -5.441 3.674 3.559 732 HB ILE 83 HB ILE 83 -2.697 3.635 2.283 733 HG12 ILE 83 1HG1 ILE 83 -4.689 1.405 2.052 734 HG13 ILE 83 2HG1 ILE 83 -4.799 2.779 0.955 735 HG21 ILE 83 1HG2 ILE 83 -2.410 2.866 4.464 736 HG22 ILE 83 2HG2 ILE 83 -2.642 1.385 3.536 737 HG23 ILE 83 3HG2 ILE 83 -3.973 2.048 4.484 738 HD11 ILE 83 3HD1 ILE 83 -2.508 2.353 0.211 739 HD12 ILE 83 1HD1 ILE 83 -3.556 0.960 -0.050 740 HD13 ILE 83 2HD1 ILE 83 -2.419 0.967 1.299 741 H GLY 84 H GLY 84 -3.126 6.200 2.653 742 HA2 GLY 84 1HA GLY 84 -1.968 6.588 5.196 743 HA3 GLY 84 2HA GLY 84 -2.003 7.772 3.897 744 H LEU 85 H LEU 85 -4.722 8.189 3.621 745 HA LEU 85 HA LEU 85 -5.246 9.928 5.832 746 HB2 LEU 85 1HB LEU 85 -6.835 9.175 3.387 747 HB3 LEU 85 2HB LEU 85 -7.454 10.272 4.605 748 HG LEU 85 HG LEU 85 -4.818 10.835 3.295 749 HD11 LEU 85 1HD1 LEU 85 -7.534 11.503 2.171 750 HD12 LEU 85 2HD1 LEU 85 -6.333 10.434 1.448 751 HD13 LEU 85 3HD1 LEU 85 -6.002 12.159 1.598 752 HD21 LEU 85 3HD2 LEU 85 -5.453 12.174 5.223 753 HD22 LEU 85 1HD2 LEU 85 -6.990 12.577 4.457 754 HD23 LEU 85 2HD2 LEU 85 -5.478 13.154 3.758 755 H PHE 86 H PHE 86 -6.128 6.689 5.005 756 HA PHE 86 HA PHE 86 -8.442 6.505 6.675 757 HB2 PHE 86 1HB PHE 86 -7.661 5.000 4.662 758 HB3 PHE 86 2HB PHE 86 -6.813 4.106 5.920 759 HD1 PHE 86 HD1 PHE 86 -10.075 5.019 4.553 760 HD2 PHE 86 HD2 PHE 86 -8.030 2.853 7.591 761 HE1 PHE 86 HE1 PHE 86 -12.149 3.801 5.074 762 HE2 PHE 86 HE2 PHE 86 -10.100 1.630 8.120 763 HZ PHE 86 HZ PHE 86 -12.163 2.105 6.860 764 H ILE 87 H ILE 87 -5.005 5.742 7.074 765 HA ILE 87 HA ILE 87 -5.402 4.679 9.739 766 HB ILE 87 HB ILE 87 -2.775 5.358 8.404 767 HG12 ILE 87 1HG1 ILE 87 -3.920 2.585 8.550 768 HG13 ILE 87 2HG1 ILE 87 -4.400 3.660 7.241 769 HG21 ILE 87 1HG2 ILE 87 -1.843 3.727 9.991 770 HG22 ILE 87 2HG2 ILE 87 -3.440 3.525 10.711 771 HG23 ILE 87 3HG2 ILE 87 -2.615 5.080 10.818 772 HD11 ILE 87 3HD1 ILE 87 -1.564 2.878 7.882 773 HD12 ILE 87 1HD1 ILE 87 -2.106 3.853 6.515 774 HD13 ILE 87 2HD1 ILE 87 -2.564 2.153 6.623 775 H ARG 88 H ARG 88 -4.303 7.693 8.277 776 HA ARG 88 HA ARG 88 -3.239 8.896 10.595 777 HB2 ARG 88 1HB ARG 88 -4.261 9.932 7.981 778 HB3 ARG 88 2HB ARG 88 -3.879 11.063 9.271 779 HG2 ARG 88 1HG ARG 88 -1.597 10.197 9.360 780 HG3 ARG 88 2HG ARG 88 -1.981 9.058 8.068 781 HD2 ARG 88 1HD ARG 88 -2.299 12.031 7.751 782 HD3 ARG 88 2HD ARG 88 -0.785 11.200 7.397 783 HE ARG 88 HE ARG 88 -2.852 9.905 6.022 784 HH11 ARG 88 1HH1 ARG 88 -1.158 12.963 5.982 785 HH12 ARG 88 2HH1 ARG 88 -1.409 13.220 4.288 786 HH21 ARG 88 1HH2 ARG 88 -3.179 10.247 3.796 787 HH22 ARG 88 2HH2 ARG 88 -2.556 11.681 3.048 788 H ARG 89 H ARG 89 -6.505 8.471 9.499 789 HA ARG 89 HA ARG 89 -7.627 10.470 11.255 790 HB2 ARG 89 1HB ARG 89 -8.807 8.391 9.429 791 HB3 ARG 89 2HB ARG 89 -9.815 9.316 10.534 792 HG2 ARG 89 1HG ARG 89 -9.067 11.391 9.483 793 HG3 ARG 89 2HG ARG 89 -8.055 10.464 8.375 794 HD2 ARG 89 1HD ARG 89 -10.046 9.352 7.491 795 HD3 ARG 89 2HD ARG 89 -11.058 10.275 8.602 796 HE ARG 89 HE ARG 89 -9.548 12.076 7.087 797 HH11 ARG 89 1HH1 ARG 89 -12.126 9.761 6.627 798 HH12 ARG 89 2HH1 ARG 89 -12.816 10.610 5.285 799 HH21 ARG 89 1HH2 ARG 89 -10.457 13.188 5.322 800 HH22 ARG 89 2HH2 ARG 89 -11.868 12.553 4.545 801 H ARG 90 H ARG 90 -6.674 7.202 11.517 802 HA ARG 90 HA ARG 90 -8.466 6.556 13.703 803 HB2 ARG 90 1HB ARG 90 -6.264 5.063 12.300 804 HB3 ARG 90 2HB ARG 90 -6.996 4.446 13.775 805 HG2 ARG 90 1HG ARG 90 -9.191 4.460 12.676 806 HG3 ARG 90 2HG ARG 90 -8.428 5.033 11.191 807 HD2 ARG 90 1HD ARG 90 -7.084 3.010 11.077 808 HD3 ARG 90 2HD ARG 90 -7.783 2.443 12.594 809 HE ARG 90 HE ARG 90 -9.823 2.965 10.704 810 HH11 ARG 90 1HH1 ARG 90 -7.315 0.643 11.441 811 HH12 ARG 90 2HH1 ARG 90 -8.139 -0.674 10.673 812 HH21 ARG 90 1HH2 ARG 90 -10.901 1.232 9.697 813 HH22 ARG 90 2HH2 ARG 90 -10.172 -0.339 9.684 814 H HIS 91 H HIS 91 -5.317 7.892 13.296 815 HA HIS 91 HA HIS 91 -4.211 7.152 15.813 816 HB2 HIS 91 1HB HIS 91 -3.521 9.192 13.727 817 HB3 HIS 91 2HB HIS 91 -2.710 9.225 15.290 818 HD1 HIS 91 HD1 HIS 91 -1.109 7.254 15.836 819 HD2 HIS 91 HD2 HIS 91 -2.775 7.104 12.033 820 HE1 HIS 91 HE1 HIS 91 0.229 5.534 14.584 821 HE2 HIS 91 HE2 HIS 91 -0.853 5.397 12.313 822 H ILE 92 H ILE 92 -6.295 9.749 14.764 823 HA ILE 92 HA ILE 92 -5.940 11.301 17.182 824 HB ILE 92 HB ILE 92 -8.152 11.717 15.181 825 HG12 ILE 92 1HG1 ILE 92 -5.617 13.235 14.865 826 HG13 ILE 92 2HG1 ILE 92 -5.599 11.558 14.326 827 HG21 ILE 92 1HG2 ILE 92 -8.275 13.012 17.237 828 HG22 ILE 92 2HG2 ILE 92 -7.915 14.064 15.868 829 HG23 ILE 92 3HG2 ILE 92 -6.632 13.601 16.984 830 HD11 ILE 92 3HD1 ILE 92 -7.400 13.765 13.365 831 HD12 ILE 92 1HD1 ILE 92 -7.593 12.069 12.924 832 HD13 ILE 92 2HD1 ILE 92 -6.130 12.939 12.464 833 H VAL 93 H VAL 93 -7.908 8.696 16.146 834 HA VAL 93 HA VAL 93 -9.928 9.190 18.212 835 HB VAL 93 HB VAL 93 -9.945 6.875 16.281 836 HG11 VAL 93 1HG1 VAL 93 -12.145 8.323 17.754 837 HG12 VAL 93 2HG1 VAL 93 -11.492 6.735 18.154 838 HG13 VAL 93 3HG1 VAL 93 -12.369 6.972 16.643 839 HG21 VAL 93 3HG2 VAL 93 -9.737 8.897 14.939 840 HG22 VAL 93 1HG2 VAL 93 -11.085 9.628 15.807 841 HG23 VAL 93 2HG2 VAL 93 -11.355 8.215 14.789 842 H ARG 94 H ARG 94 -7.238 7.116 17.441 843 HA ARG 94 HA ARG 94 -7.840 5.281 19.628 844 HB2 ARG 94 1HB ARG 94 -6.797 4.760 17.231 845 HB3 ARG 94 2HB ARG 94 -5.299 5.106 18.081 846 HG2 ARG 94 1HG ARG 94 -6.021 3.405 19.799 847 HG3 ARG 94 2HG ARG 94 -7.308 2.954 18.678 848 HD2 ARG 94 1HD ARG 94 -5.523 2.583 16.947 849 HD3 ARG 94 2HD ARG 94 -4.334 2.791 18.233 850 HE ARG 94 HE ARG 94 -6.032 0.864 19.165 851 HH11 ARG 94 1HH1 ARG 94 -4.064 1.223 16.300 852 HH12 ARG 94 2HH1 ARG 94 -3.809 -0.480 16.112 853 HH21 ARG 94 1HH2 ARG 94 -5.694 -1.371 18.917 854 HH22 ARG 94 2HH2 ARG 94 -4.734 -1.951 17.596 855 H LYS 95 H LYS 95 -6.272 4.819 21.287 856 HA LYS 95 HA LYS 95 -4.894 7.235 22.179 857 HB2 LYS 95 1HB LYS 95 -5.725 4.693 23.564 858 HB3 LYS 95 2HB LYS 95 -4.633 5.842 24.322 859 HG2 LYS 95 1HG LYS 95 -6.351 7.584 24.123 860 HG3 LYS 95 2HG LYS 95 -7.448 6.402 23.407 861 HD2 LYS 95 1HD LYS 95 -7.352 5.068 25.451 862 HD3 LYS 95 2HD LYS 95 -6.234 6.232 26.165 863 HE2 LYS 95 1HE LYS 95 -7.954 7.972 25.993 864 HE3 LYS 95 2HE LYS 95 -9.069 6.796 25.300 865 HZ1 LYS 95 3HZ LYS 95 -8.945 5.526 27.355 866 HZ2 LYS 95 1HZ LYS 95 -9.469 7.107 27.659 867 HZ3 LYS 95 2HZ LYS 95 -7.878 6.658 28.019 868 H ARG 96 H ARG 96 -2.741 7.088 23.113 869 HA ARG 96 HA ARG 96 -1.012 5.418 21.493 870 HB2 ARG 96 1HB ARG 96 -0.523 7.754 23.328 871 HB3 ARG 96 2HB ARG 96 0.801 6.805 22.669 872 HG2 ARG 96 1HG ARG 96 0.070 7.354 20.403 873 HG3 ARG 96 2HG ARG 96 -1.261 8.305 21.065 874 HD2 ARG 96 1HD ARG 96 0.347 9.781 22.170 875 HD3 ARG 96 2HD ARG 96 1.677 8.829 21.512 876 HE ARG 96 HE ARG 96 0.070 9.683 19.389 877 HH11 ARG 96 1HH1 ARG 96 2.222 11.044 21.781 878 HH12 ARG 96 2HH1 ARG 96 2.684 12.383 20.785 879 HH21 ARG 96 1HH2 ARG 96 0.679 11.441 18.081 880 HH22 ARG 96 2HH2 ARG 96 1.807 12.608 18.685 881 H THR 97 H THR 97 -2.552 4.076 23.500 882 HA THR 97 HA THR 97 -0.787 3.465 25.708 883 HB THR 97 HB THR 97 -2.549 1.704 26.226 884 HG1 THR 97 HG1 THR 97 -3.748 1.363 24.482 885 HG21 THR 97 3HG2 THR 97 -4.165 3.358 27.052 886 HG22 THR 97 1HG2 THR 97 -3.429 4.587 26.023 887 HG23 THR 97 2HG2 THR 97 -2.505 3.876 27.346 888 H LEU 98 H LEU 98 -1.201 2.351 22.532 889 HA LEU 98 HA LEU 98 -0.184 -0.324 23.049 890 HB2 LEU 98 1HB LEU 98 -1.395 1.067 20.715 891 HB3 LEU 98 2HB LEU 98 -0.271 -0.233 20.376 892 HG LEU 98 HG LEU 98 -2.563 -1.044 20.332 893 HD11 LEU 98 1HD1 LEU 98 -1.914 -3.000 21.152 894 HD12 LEU 98 2HD1 LEU 98 -1.879 -2.374 22.802 895 HD13 LEU 98 3HD1 LEU 98 -0.473 -2.185 21.756 896 HD21 LEU 98 3HD2 LEU 98 -2.723 -0.143 23.205 897 HD22 LEU 98 1HD2 LEU 98 -3.948 -1.076 22.346 898 HD23 LEU 98 2HD2 LEU 98 -3.581 0.572 21.841 899 H ARG 99 H ARG 99 0.944 2.727 22.422 900 HA ARG 99 HA ARG 99 3.464 1.919 21.207 901 HB2 ARG 99 1HB ARG 99 1.936 3.997 20.513 902 HB3 ARG 99 2HB ARG 99 2.815 4.769 21.824 903 HG2 ARG 99 1HG ARG 99 4.922 4.302 20.731 904 HG3 ARG 99 2HG ARG 99 4.085 3.432 19.444 905 HD2 ARG 99 1HD ARG 99 2.905 5.491 18.831 906 HD3 ARG 99 2HD ARG 99 3.758 6.356 20.108 907 HE ARG 99 HE ARG 99 5.655 5.154 18.439 908 HH11 ARG 99 1HH1 ARG 99 3.263 7.698 18.311 909 HH12 ARG 99 2HH1 ARG 99 4.121 8.613 17.118 910 HH21 ARG 99 1HH2 ARG 99 6.781 6.358 16.872 911 HH22 ARG 99 2HH2 ARG 99 6.117 7.852 16.300 912 H ARG 100 H ARG 100 1.920 3.306 24.005 913 HA ARG 100 HA ARG 100 4.343 3.838 25.466 914 HB2 ARG 100 1HB ARG 100 1.422 3.739 26.205 915 HB3 ARG 100 2HB ARG 100 2.662 3.902 27.440 916 HG2 ARG 100 1HG ARG 100 3.454 5.955 26.378 917 HG3 ARG 100 2HG ARG 100 2.211 5.791 25.136 918 HD2 ARG 100 1HD ARG 100 1.336 7.325 26.687 919 HD3 ARG 100 2HD ARG 100 0.525 5.800 27.036 920 HE ARG 100 HE ARG 100 2.796 5.983 28.661 921 HH11 ARG 100 1HH1 ARG 100 -0.306 7.547 28.275 922 HH12 ARG 100 2HH1 ARG 100 -0.427 7.994 29.943 923 HH21 ARG 100 1HH2 ARG 100 2.633 6.572 30.853 924 HH22 ARG 100 2HH2 ARG 100 1.242 7.441 31.406 925 H LEU 101 H LEU 101 2.357 1.190 24.756 926 HA LEU 101 HA LEU 101 3.590 -0.503 26.794 927 HB2 LEU 101 1HB LEU 101 1.049 -0.635 25.247 928 HB3 LEU 101 2HB LEU 101 1.815 -2.151 25.679 929 HG LEU 101 HG LEU 101 1.272 -0.082 27.784 930 HD11 LEU 101 1HD1 LEU 101 -0.687 -2.137 26.763 931 HD12 LEU 101 2HD1 LEU 101 -0.847 -0.385 26.631 932 HD13 LEU 101 3HD1 LEU 101 -0.888 -1.158 28.216 933 HD21 LEU 101 3HD2 LEU 101 1.476 -3.094 27.808 934 HD22 LEU 101 1HD2 LEU 101 1.133 -2.083 29.212 935 HD23 LEU 101 2HD2 LEU 101 2.690 -1.956 28.393 936 H LEU 102 H LEU 102 3.481 0.255 23.414 937 HA LEU 102 HA LEU 102 4.480 -2.215 22.400 938 HB2 LEU 102 1HB LEU 102 3.456 -0.204 21.127 939 HB3 LEU 102 2HB LEU 102 5.086 0.440 21.139 940 HG LEU 102 HG LEU 102 4.783 -2.329 20.132 941 HD11 LEU 102 1HD1 LEU 102 4.073 -1.549 17.918 942 HD12 LEU 102 2HD1 LEU 102 3.822 0.068 18.575 943 HD13 LEU 102 3HD1 LEU 102 2.832 -1.278 19.140 944 HD21 LEU 102 3HD2 LEU 102 6.949 -1.197 20.193 945 HD22 LEU 102 1HD2 LEU 102 6.309 0.089 19.171 946 HD23 LEU 102 2HD2 LEU 102 6.458 -1.549 18.537 947 H GLN 103 H GLN 103 6.110 0.813 23.289 948 HA GLN 103 HA GLN 103 8.728 -0.368 22.928 949 HB2 GLN 103 1HB GLN 103 7.907 2.141 22.593 950 HB3 GLN 103 2HB GLN 103 8.349 2.260 24.290 951 HG2 GLN 103 1HG GLN 103 10.609 1.501 23.756 952 HG3 GLN 103 2HG GLN 103 10.164 1.382 22.054 953 HE21 GLN 103 2HE2 GLN 103 9.852 3.260 20.858 954 HE22 GLN 103 1HE2 GLN 103 10.416 4.798 21.401 955 H GLU 104 H GLU 104 6.403 -0.363 25.336 956 HA GLU 104 HA GLU 104 8.212 -0.310 27.602 957 HB2 GLU 104 1HB GLU 104 5.632 0.340 27.411 958 HB3 GLU 104 2HB GLU 104 5.434 -1.345 27.869 959 HG2 GLU 104 1HG GLU 104 7.192 0.501 29.444 960 HG3 GLU 104 2HG GLU 104 5.452 0.427 29.715 961 H ARG 105 H ARG 105 6.531 -2.730 25.682 962 HA ARG 105 HA ARG 105 7.393 -4.900 27.407 963 HB2 ARG 105 1HB ARG 105 5.147 -4.643 26.020 964 HB3 ARG 105 2HB ARG 105 6.116 -5.377 24.751 965 HG2 ARG 105 1HG ARG 105 5.104 -7.204 25.726 966 HG3 ARG 105 2HG ARG 105 6.668 -7.167 26.541 967 HD2 ARG 105 1HD ARG 105 5.675 -6.060 28.457 968 HD3 ARG 105 2HD ARG 105 4.117 -5.981 27.633 969 HE ARG 105 HE ARG 105 4.921 -8.658 27.743 970 HH11 ARG 105 1HH1 ARG 105 3.903 -6.116 29.915 971 HH12 ARG 105 2HH1 ARG 105 3.234 -7.210 31.078 972 HH21 ARG 105 1HH2 ARG 105 4.039 -10.092 29.274 973 HH22 ARG 105 2HH2 ARG 105 3.311 -9.465 30.714 974 H GLU 106 H GLU 106 8.656 -3.162 24.812 975 HA GLU 106 HA GLU 106 10.093 -5.274 23.511 976 HB2 GLU 106 1HB GLU 106 10.145 -2.280 23.371 977 HB3 GLU 106 2HB GLU 106 11.428 -3.214 22.614 978 HG2 GLU 106 1HG GLU 106 9.770 -4.401 21.268 979 HG3 GLU 106 2HG GLU 106 8.486 -3.457 22.023 980 H LEU 107 H LEU 107 10.534 -3.602 26.423 981 HA LEU 107 HA LEU 107 13.364 -4.382 26.499 982 HB2 LEU 107 1HB LEU 107 12.678 -1.877 26.683 983 HB3 LEU 107 2HB LEU 107 12.205 -2.301 28.316 984 HG LEU 107 HG LEU 107 14.675 -3.268 28.406 985 HD11 LEU 107 1HD1 LEU 107 16.223 -1.844 27.161 986 HD12 LEU 107 2HD1 LEU 107 14.861 -1.074 26.346 987 HD13 LEU 107 3HD1 LEU 107 15.197 -2.784 26.077 988 HD21 LEU 107 3HD2 LEU 107 15.392 -1.121 29.355 989 HD22 LEU 107 1HD2 LEU 107 13.775 -1.574 29.896 990 HD23 LEU 107 2HD2 LEU 107 13.974 -0.345 28.649 991 H VAL 108 H VAL 108 10.516 -5.413 27.400 992 HA VAL 108 HA VAL 108 11.510 -6.571 29.924 993 HB VAL 108 HB VAL 108 8.577 -6.058 29.428 994 HG11 VAL 108 1HG1 VAL 108 10.165 -6.564 31.945 995 HG12 VAL 108 2HG1 VAL 108 9.114 -7.719 31.127 996 HG13 VAL 108 3HG1 VAL 108 8.426 -6.273 31.867 997 HG21 VAL 108 3HG2 VAL 108 10.406 -4.269 31.021 998 HG22 VAL 108 1HG2 VAL 108 8.691 -4.029 30.684 999 HG23 VAL 108 2HG2 VAL 108 9.872 -3.920 29.376 1000 H GLU 109 H GLU 109 12.229 -8.048 28.020 1001 HA GLU 109 HA GLU 109 10.122 -9.946 27.283 1002 HB2 GLU 109 1HB GLU 109 11.960 -8.885 25.690 1003 HB3 GLU 109 2HB GLU 109 12.932 -10.212 26.309 1004 HG2 GLU 109 1HG GLU 109 11.307 -11.818 25.512 1005 HG3 GLU 109 2HG GLU 109 10.257 -10.511 24.961 1006 HA PRO 110 HA PRO 110 11.594 -12.688 30.490 1007 HB2 PRO 110 1HB PRO 110 10.128 -14.877 29.820 1008 HB3 PRO 110 2HB PRO 110 9.422 -13.458 30.615 1009 HG2 PRO 110 1HG PRO 110 9.337 -14.246 27.749 1010 HG3 PRO 110 2HG PRO 110 8.066 -13.543 28.767 1011 HD2 PRO 110 1HD PRO 110 9.537 -12.088 26.995 1012 HD3 PRO 110 2HD PRO 110 8.820 -11.407 28.468 1013 H LEU 111 H LEU 111 13.340 -13.959 30.636 1014 HA LEU 111 HA LEU 111 14.037 -15.767 28.475 1015 HB2 LEU 111 1HB LEU 111 15.233 -13.309 28.564 1016 HB3 LEU 111 2HB LEU 111 16.341 -14.261 29.529 1017 HG LEU 111 HG LEU 111 17.116 -14.170 27.243 1018 HD11 LEU 111 1HD1 LEU 111 17.545 -16.235 28.448 1019 HD12 LEU 111 2HD1 LEU 111 17.293 -16.553 26.732 1020 HD13 LEU 111 3HD1 LEU 111 16.008 -16.898 27.891 1021 HD21 LEU 111 3HD2 LEU 111 14.744 -13.846 26.325 1022 HD22 LEU 111 1HD2 LEU 111 14.656 -15.607 26.310 1023 HD23 LEU 111 2HD2 LEU 111 15.887 -14.779 25.360 1024 H THR 112 H THR 112 13.471 -17.384 29.926 1025 HA THR 112 HA THR 112 15.400 -17.813 32.115 1026 HB THR 112 HB THR 112 13.559 -19.218 33.181 1027 HG1 THR 112 HG1 THR 112 11.406 -18.313 32.483 1028 HG21 THR 112 3HG2 THR 112 14.213 -17.035 34.064 1029 HG22 THR 112 1HG2 THR 112 12.471 -17.271 34.208 1030 HG23 THR 112 2HG2 THR 112 13.118 -16.239 32.932 1031 HA PRO 113 HA PRO 113 16.486 -21.591 30.063 1032 HB2 PRO 113 1HB PRO 113 17.411 -23.035 32.186 1033 HB3 PRO 113 2HB PRO 113 18.318 -21.696 31.459 1034 HG2 PRO 113 1HG PRO 113 16.659 -21.724 33.930 1035 HG3 PRO 113 2HG PRO 113 18.220 -20.937 33.624 1036 HD2 PRO 113 1HD PRO 113 15.871 -19.586 33.589 1037 HD3 PRO 113 2HD PRO 113 17.262 -19.131 32.584 1038 H SER 114 H SER 114 15.067 -22.993 29.301 1039 HA SER 114 HA SER 114 13.334 -24.448 31.189 1040 HB2 SER 114 1HB SER 114 11.688 -24.599 29.296 1041 HB3 SER 114 2HB SER 114 11.951 -22.960 29.893 1042 HG SER 114 HG SER 114 13.283 -22.572 28.123 1043 H GLY 115 H GLY 115 15.814 -24.681 28.945 1044 HA2 GLY 115 1HA GLY 115 16.357 -27.327 29.164 1045 HA3 GLY 115 2HA GLY 115 15.153 -27.289 27.887 1046 H GLU 116 H GLU 116 18.022 -25.356 28.757 1047 HA GLU 116 HA GLU 116 18.810 -25.377 25.930 1048 HB2 GLU 116 1HB GLU 116 19.539 -23.584 28.239 1049 HB3 GLU 116 2HB GLU 116 20.436 -23.569 26.727 1050 HG2 GLU 116 1HG GLU 116 18.398 -22.975 25.520 1051 HG3 GLU 116 2HG GLU 116 17.497 -22.994 27.037 1052 H LYS 117 H LYS 117 20.900 -25.942 25.289 1053 HA LYS 117 HA LYS 117 22.166 -27.925 26.967 1054 HB2 LYS 117 1HB LYS 117 22.589 -27.039 24.121 1055 HB3 LYS 117 2HB LYS 117 23.678 -28.168 24.913 1056 HG2 LYS 117 1HG LYS 117 21.816 -29.707 25.288 1057 HG3 LYS 117 2HG LYS 117 20.722 -28.571 24.495 1058 HD2 LYS 117 1HD LYS 117 22.014 -28.775 22.425 1059 HD3 LYS 117 2HD LYS 117 23.107 -29.909 23.219 1060 HE2 LYS 117 1HE LYS 117 20.146 -30.384 23.003 1061 HE3 LYS 117 2HE LYS 117 21.285 -30.914 21.767 1062 HZ1 LYS 117 3HZ LYS 117 21.334 -31.721 24.627 1063 HZ2 LYS 117 1HZ LYS 117 22.429 -32.231 23.441 1064 HZ3 LYS 117 2HZ LYS 117 20.803 -32.681 23.339 1065 H LEU 118 H LEU 118 22.988 -24.788 25.551 1066 HA LEU 118 HA LEU 118 25.598 -24.803 26.816 1067 HB2 LEU 118 1HB LEU 118 24.228 -22.826 25.005 1068 HB3 LEU 118 2HB LEU 118 25.806 -22.542 25.712 1069 HG LEU 118 HG LEU 118 26.340 -24.882 24.565 1070 HD11 LEU 118 1HD1 LEU 118 24.079 -25.243 23.733 1071 HD12 LEU 118 2HD1 LEU 118 25.220 -25.065 22.400 1072 HD13 LEU 118 3HD1 LEU 118 24.157 -23.726 22.836 1073 HD21 LEU 118 3HD2 LEU 118 27.541 -22.811 24.160 1074 HD22 LEU 118 1HD2 LEU 118 26.237 -22.238 23.118 1075 HD23 LEU 118 2HD2 LEU 118 27.202 -23.634 22.637 1076 H TRP 119 H TRP 119 22.492 -23.951 27.675 1077 HA TRP 119 HA TRP 119 23.490 -22.203 29.819 1078 HB2 TRP 119 1HB TRP 119 21.032 -21.788 28.115 1079 HB3 TRP 119 2HB TRP 119 21.272 -20.976 29.658 1080 HD1 TRP 119 HD1 TRP 119 22.514 -20.989 26.053 1081 HE1 TRP 119 HE1 TRP 119 23.909 -18.867 25.644 1082 HE3 TRP 119 HE3 TRP 119 22.779 -19.245 30.857 1083 HZ2 TRP 119 HZ2 TRP 119 24.980 -16.737 27.152 1084 HZ3 TRP 119 HZ3 TRP 119 24.010 -17.158 31.285 1085 HH2 TRP 119 HH2 TRP 119 25.086 -15.932 29.470 1086 H SER 120 H SER 120 22.775 -22.669 31.819 1087 HA SER 120 HA SER 120 20.603 -24.638 32.088 1088 HB2 SER 120 1HB SER 120 21.857 -25.567 34.058 1089 HB3 SER 120 2HB SER 120 22.657 -25.825 32.508 1090 HG SER 120 HG SER 120 24.208 -24.465 33.058 Start of MODEL 6 1 H1 LYS 1 1H LYS 1 1.751 -2.808 -33.560 2 H2 LYS 1 2H LYS 1 0.993 -4.151 -32.867 3 H3 LYS 1 3H LYS 1 2.079 -3.231 -31.955 4 HA LYS 1 HA LYS 1 0.616 -1.335 -32.031 5 HB2 LYS 1 1HB LYS 1 -1.073 -3.214 -33.678 6 HB3 LYS 1 2HB LYS 1 -1.747 -1.798 -32.885 7 HG2 LYS 1 1HG LYS 1 -0.233 -0.361 -34.152 8 HG3 LYS 1 2HG LYS 1 0.448 -1.782 -34.947 9 HD2 LYS 1 1HD LYS 1 -1.751 -2.297 -35.897 10 HD3 LYS 1 2HD LYS 1 -2.429 -0.878 -35.102 11 HE2 LYS 1 1HE LYS 1 -0.134 -0.718 -37.040 12 HE3 LYS 1 2HE LYS 1 -1.820 -0.624 -37.551 13 HZ1 LYS 1 3HZ LYS 1 -0.490 1.213 -35.631 14 HZ2 LYS 1 1HZ LYS 1 -2.109 1.303 -36.121 15 HZ3 LYS 1 2HZ LYS 1 -0.868 1.573 -37.240 16 H ILE 2 H ILE 2 -0.320 -1.046 -30.110 17 HA ILE 2 HA ILE 2 -1.675 -3.304 -28.818 18 HB ILE 2 HB ILE 2 -0.573 -2.519 -26.623 19 HG12 ILE 2 1HG1 ILE 2 1.936 -1.857 -27.369 20 HG13 ILE 2 2HG1 ILE 2 1.033 -1.061 -28.653 21 HG21 ILE 2 1HG2 ILE 2 1.033 -3.998 -28.700 22 HG22 ILE 2 2HG2 ILE 2 -0.180 -4.690 -27.622 23 HG23 ILE 2 3HG2 ILE 2 1.321 -4.041 -26.961 24 HD11 ILE 2 3HD1 ILE 2 0.650 -0.633 -25.699 25 HD12 ILE 2 1HD1 ILE 2 -0.255 0.167 -26.985 26 HD13 ILE 2 2HD1 ILE 2 1.477 0.456 -26.814 27 HA PRO 3 HA PRO 3 -4.716 -0.259 -27.778 28 HB2 PRO 3 1HB PRO 3 -5.817 -1.412 -25.559 29 HB3 PRO 3 2HB PRO 3 -6.125 -1.989 -27.206 30 HG2 PRO 3 1HG PRO 3 -4.267 -3.069 -25.148 31 HG3 PRO 3 2HG PRO 3 -5.319 -3.932 -26.288 32 HD2 PRO 3 1HD PRO 3 -2.659 -3.638 -26.697 33 HD3 PRO 3 2HD PRO 3 -3.832 -3.734 -28.024 34 H SER 4 H SER 4 -5.114 1.461 -26.398 35 HA SER 4 HA SER 4 -2.949 2.183 -24.637 36 HB2 SER 4 1HB SER 4 -5.497 3.658 -25.336 37 HB3 SER 4 2HB SER 4 -4.148 4.335 -24.426 38 HG SER 4 HG SER 4 -2.977 3.479 -26.497 39 H ILE 5 H ILE 5 -5.826 0.498 -24.240 40 HA ILE 5 HA ILE 5 -6.435 1.413 -21.563 41 HB ILE 5 HB ILE 5 -7.539 -1.063 -22.892 42 HG12 ILE 5 1HG1 ILE 5 -9.495 0.788 -23.241 43 HG13 ILE 5 2HG1 ILE 5 -8.066 1.794 -23.455 44 HG21 ILE 5 1HG2 ILE 5 -9.471 -0.645 -21.438 45 HG22 ILE 5 2HG2 ILE 5 -8.643 0.753 -20.751 46 HG23 ILE 5 3HG2 ILE 5 -7.987 -0.867 -20.510 47 HD11 ILE 5 3HD1 ILE 5 -8.630 -0.738 -24.978 48 HD12 ILE 5 1HD1 ILE 5 -7.288 0.374 -25.240 49 HD13 ILE 5 2HD1 ILE 5 -8.941 0.896 -25.567 50 H ALA 6 H ALA 6 -4.661 -1.199 -23.069 51 HA ALA 6 HA ALA 6 -4.363 -2.701 -20.613 52 HB1 ALA 6 3HB ALA 6 -4.518 -3.794 -22.839 53 HB2 ALA 6 1HB ALA 6 -3.095 -4.266 -21.911 54 HB3 ALA 6 2HB ALA 6 -2.942 -3.111 -23.236 55 H THR 7 H THR 7 -2.600 -0.287 -22.383 56 HA THR 7 HA THR 7 -0.017 -0.713 -21.337 57 HB THR 7 HB THR 7 -0.978 2.043 -22.012 58 HG1 THR 7 HG1 THR 7 -0.219 0.930 -24.260 59 HG21 THR 7 3HG2 THR 7 1.355 1.779 -21.391 60 HG22 THR 7 1HG2 THR 7 1.240 2.154 -23.109 61 HG23 THR 7 2HG2 THR 7 1.555 0.500 -22.588 62 H GLY 8 H GLY 8 -2.812 1.005 -20.077 63 HA2 GLY 8 1HA GLY 8 -1.343 2.245 -17.914 64 HA3 GLY 8 2HA GLY 8 -3.083 2.281 -18.152 65 H LEU 9 H LEU 9 -3.578 -0.464 -18.288 66 HA LEU 9 HA LEU 9 -3.844 -1.129 -15.575 67 HB2 LEU 9 1HB LEU 9 -4.063 -2.843 -18.051 68 HB3 LEU 9 2HB LEU 9 -4.496 -3.392 -16.443 69 HG LEU 9 HG LEU 9 -5.796 -0.948 -17.601 70 HD11 LEU 9 1HD1 LEU 9 -7.651 -2.534 -18.294 71 HD12 LEU 9 2HD1 LEU 9 -6.451 -3.822 -18.175 72 HD13 LEU 9 3HD1 LEU 9 -6.215 -2.501 -19.316 73 HD21 LEU 9 3HD2 LEU 9 -7.635 -1.657 -16.124 74 HD22 LEU 9 1HD2 LEU 9 -6.137 -1.376 -15.238 75 HD23 LEU 9 2HD2 LEU 9 -6.657 -3.023 -15.589 76 H VAL 10 H VAL 10 -1.537 -2.248 -18.034 77 HA VAL 10 HA VAL 10 -0.289 -4.212 -16.474 78 HB VAL 10 HB VAL 10 1.649 -3.994 -18.020 79 HG11 VAL 10 1HG1 VAL 10 -1.144 -4.227 -19.099 80 HG12 VAL 10 2HG1 VAL 10 -0.000 -5.512 -18.697 81 HG13 VAL 10 3HG1 VAL 10 0.275 -4.499 -20.115 82 HG21 VAL 10 3HG2 VAL 10 1.580 -1.592 -18.431 83 HG22 VAL 10 1HG2 VAL 10 0.021 -1.760 -19.240 84 HG23 VAL 10 2HG2 VAL 10 1.465 -2.481 -19.950 85 H GLY 11 H GLY 11 0.350 -0.775 -16.765 86 HA2 GLY 11 1HA GLY 11 2.753 -0.747 -15.244 87 HA3 GLY 11 2HA GLY 11 1.744 0.645 -15.599 88 H ALA 12 H ALA 12 -0.613 0.038 -14.370 89 HA ALA 12 HA ALA 12 0.051 0.558 -11.639 90 HB1 ALA 12 3HB ALA 12 -1.901 1.526 -12.938 91 HB2 ALA 12 1HB ALA 12 -2.237 0.976 -11.296 92 HB3 ALA 12 2HB ALA 12 -2.710 -0.020 -12.672 93 H LEU 13 H LEU 13 -1.372 -2.221 -13.316 94 HA LEU 13 HA LEU 13 -1.934 -3.693 -10.963 95 HB2 LEU 13 1HB LEU 13 -1.746 -4.341 -13.868 96 HB3 LEU 13 2HB LEU 13 -1.769 -5.663 -12.716 97 HG LEU 13 HG LEU 13 -3.921 -4.746 -11.808 98 HD11 LEU 13 1HD1 LEU 13 -3.807 -2.981 -14.252 99 HD12 LEU 13 2HD1 LEU 13 -3.679 -2.434 -12.582 100 HD13 LEU 13 3HD1 LEU 13 -5.180 -3.157 -13.161 101 HD21 LEU 13 3HD2 LEU 13 -3.893 -5.486 -14.730 102 HD22 LEU 13 1HD2 LEU 13 -5.287 -5.582 -13.654 103 HD23 LEU 13 2HD2 LEU 13 -3.884 -6.613 -13.372 104 H LEU 14 H LEU 14 0.885 -3.577 -13.122 105 HA LEU 14 HA LEU 14 2.291 -5.657 -11.783 106 HB2 LEU 14 1HB LEU 14 2.861 -3.726 -13.918 107 HB3 LEU 14 2HB LEU 14 4.258 -4.170 -12.957 108 HG LEU 14 HG LEU 14 3.557 -6.611 -13.434 109 HD11 LEU 14 1HD1 LEU 14 1.323 -5.745 -14.410 110 HD12 LEU 14 2HD1 LEU 14 2.157 -7.072 -15.218 111 HD13 LEU 14 3HD1 LEU 14 2.271 -5.436 -15.865 112 HD21 LEU 14 3HD2 LEU 14 4.601 -4.846 -15.645 113 HD22 LEU 14 1HD2 LEU 14 4.788 -6.597 -15.546 114 HD23 LEU 14 2HD2 LEU 14 5.556 -5.559 -14.346 115 H LEU 15 H LEU 15 2.231 -2.144 -11.483 116 HA LEU 15 HA LEU 15 4.368 -1.990 -9.602 117 HB2 LEU 15 1HB LEU 15 2.508 -0.166 -10.858 118 HB3 LEU 15 2HB LEU 15 2.677 0.200 -9.151 119 HG LEU 15 HG LEU 15 5.290 -0.090 -9.904 120 HD11 LEU 15 1HD1 LEU 15 5.588 1.171 -11.967 121 HD12 LEU 15 2HD1 LEU 15 3.841 1.229 -12.194 122 HD13 LEU 15 3HD1 LEU 15 4.689 -0.317 -12.256 123 HD21 LEU 15 3HD2 LEU 15 5.394 2.344 -9.792 124 HD22 LEU 15 1HD2 LEU 15 4.357 1.691 -8.523 125 HD23 LEU 15 2HD2 LEU 15 3.640 2.433 -9.954 126 H LEU 16 H LEU 16 0.856 -2.227 -9.327 127 HA LEU 16 HA LEU 16 0.745 -1.983 -6.496 128 HB2 LEU 16 1HB LEU 16 -1.124 -1.803 -8.356 129 HB3 LEU 16 2HB LEU 16 -1.312 -3.514 -8.029 130 HG LEU 16 HG LEU 16 -1.461 -2.668 -5.520 131 HD11 LEU 16 1HD1 LEU 16 -2.642 -0.538 -5.370 132 HD12 LEU 16 2HD1 LEU 16 -2.445 -0.299 -7.106 133 HD13 LEU 16 3HD1 LEU 16 -1.031 -0.326 -6.053 134 HD21 LEU 16 3HD2 LEU 16 -3.713 -2.491 -7.519 135 HD22 LEU 16 1HD2 LEU 16 -3.901 -2.616 -5.769 136 HD23 LEU 16 2HD2 LEU 16 -3.175 -3.944 -6.674 137 H LEU 17 H LEU 17 1.184 -4.659 -8.717 138 HA LEU 17 HA LEU 17 0.775 -6.752 -6.845 139 HB2 LEU 17 1HB LEU 17 0.828 -6.792 -9.450 140 HB3 LEU 17 2HB LEU 17 2.554 -7.014 -9.242 141 HG LEU 17 HG LEU 17 1.756 -8.978 -7.644 142 HD11 LEU 17 1HD1 LEU 17 -0.621 -8.502 -7.863 143 HD12 LEU 17 2HD1 LEU 17 -0.232 -10.084 -8.537 144 HD13 LEU 17 3HD1 LEU 17 -0.514 -8.715 -9.611 145 HD21 LEU 17 3HD2 LEU 17 1.963 -10.503 -9.555 146 HD22 LEU 17 1HD2 LEU 17 3.196 -9.242 -9.584 147 HD23 LEU 17 2HD2 LEU 17 1.799 -9.136 -10.655 148 H VAL 18 H VAL 18 3.677 -5.057 -8.005 149 HA VAL 18 HA VAL 18 5.533 -6.626 -6.526 150 HB VAL 18 HB VAL 18 5.884 -3.813 -7.591 151 HG11 VAL 18 1HG1 VAL 18 8.286 -4.300 -7.509 152 HG12 VAL 18 2HG1 VAL 18 7.941 -5.858 -6.757 153 HG13 VAL 18 3HG1 VAL 18 7.556 -4.364 -5.905 154 HG21 VAL 18 3HG2 VAL 18 5.296 -5.376 -9.362 155 HG22 VAL 18 1HG2 VAL 18 6.574 -6.473 -8.839 156 HG23 VAL 18 2HG2 VAL 18 6.986 -4.890 -9.501 157 H VAL 19 H VAL 19 3.952 -3.503 -5.887 158 HA VAL 19 HA VAL 19 5.284 -2.977 -3.441 159 HB VAL 19 HB VAL 19 2.605 -1.966 -4.427 160 HG11 VAL 19 1HG1 VAL 19 2.622 -1.626 -2.079 161 HG12 VAL 19 2HG1 VAL 19 3.053 -0.080 -2.810 162 HG13 VAL 19 3HG1 VAL 19 4.304 -1.099 -2.098 163 HG21 VAL 19 3HG2 VAL 19 4.448 -1.364 -5.896 164 HG22 VAL 19 1HG2 VAL 19 5.353 -0.723 -4.525 165 HG23 VAL 19 2HG2 VAL 19 3.855 0.056 -5.035 166 H ALA 20 H ALA 20 2.180 -4.535 -4.187 167 HA ALA 20 HA ALA 20 1.381 -4.945 -1.496 168 HB1 ALA 20 3HB ALA 20 -0.202 -4.988 -3.365 169 HB2 ALA 20 1HB ALA 20 -0.283 -6.469 -2.410 170 HB3 ALA 20 2HB ALA 20 0.550 -6.466 -3.965 171 H LEU 21 H LEU 21 3.227 -6.883 -3.797 172 HA LEU 21 HA LEU 21 3.345 -9.238 -2.206 173 HB2 LEU 21 1HB LEU 21 3.857 -8.832 -4.754 174 HB3 LEU 21 2HB LEU 21 5.483 -8.530 -4.175 175 HG LEU 21 HG LEU 21 5.086 -10.871 -2.966 176 HD11 LEU 21 1HD1 LEU 21 2.793 -11.129 -3.751 177 HD12 LEU 21 2HD1 LEU 21 3.835 -12.388 -4.417 178 HD13 LEU 21 3HD1 LEU 21 3.345 -11.024 -5.423 179 HD21 LEU 21 3HD2 LEU 21 6.205 -11.933 -4.875 180 HD22 LEU 21 1HD2 LEU 21 6.910 -10.363 -4.486 181 HD23 LEU 21 2HD2 LEU 21 5.827 -10.526 -5.869 182 H GLY 22 H GLY 22 5.350 -6.358 -2.493 183 HA2 GLY 22 1HA GLY 22 7.542 -7.288 -0.943 184 HA3 GLY 22 2HA GLY 22 7.159 -5.608 -1.286 185 H ILE 23 H ILE 23 4.817 -5.139 -0.088 186 HA ILE 23 HA ILE 23 5.490 -4.958 2.657 187 HB ILE 23 HB ILE 23 2.712 -4.632 1.504 188 HG12 ILE 23 1HG1 ILE 23 4.593 -2.333 1.907 189 HG13 ILE 23 2HG1 ILE 23 4.720 -3.293 0.438 190 HG21 ILE 23 1HG2 ILE 23 4.032 -3.451 3.950 191 HG22 ILE 23 2HG2 ILE 23 2.796 -4.709 3.935 192 HG23 ILE 23 3HG2 ILE 23 2.402 -3.081 3.383 193 HD11 ILE 23 3HD1 ILE 23 2.393 -2.794 -0.092 194 HD12 ILE 23 1HD1 ILE 23 3.344 -1.320 0.097 195 HD13 ILE 23 2HD1 ILE 23 2.260 -1.842 1.386 196 H GLY 24 H GLY 24 3.419 -7.158 0.828 197 HA2 GLY 24 1HA GLY 24 2.210 -8.472 3.014 198 HA3 GLY 24 2HA GLY 24 2.394 -9.135 1.397 199 H LEU 25 H LEU 25 5.123 -9.280 1.137 200 HA LEU 25 HA LEU 25 5.723 -11.609 2.683 201 HB2 LEU 25 1HB LEU 25 7.321 -9.996 0.703 202 HB3 LEU 25 2HB LEU 25 7.971 -11.408 1.512 203 HG LEU 25 HG LEU 25 5.412 -11.633 -0.029 204 HD11 LEU 25 1HD1 LEU 25 6.721 -12.235 -2.022 205 HD12 LEU 25 2HD1 LEU 25 8.191 -11.718 -1.194 206 HD13 LEU 25 3HD1 LEU 25 6.930 -10.544 -1.567 207 HD21 LEU 25 3HD2 LEU 25 7.673 -13.545 0.554 208 HD22 LEU 25 1HD2 LEU 25 6.205 -13.930 -0.345 209 HD23 LEU 25 2HD2 LEU 25 6.107 -13.508 1.365 210 H PHE 26 H PHE 26 6.411 -8.227 2.992 211 HA PHE 26 HA PHE 26 8.651 -8.497 4.759 212 HB2 PHE 26 1HB PHE 26 7.909 -6.468 3.271 213 HB3 PHE 26 2HB PHE 26 6.932 -6.043 4.672 214 HD1 PHE 26 HD1 PHE 26 10.323 -6.356 3.351 215 HD2 PHE 26 HD2 PHE 26 7.961 -5.327 6.739 216 HE1 PHE 26 HE1 PHE 26 12.281 -5.283 4.384 217 HE2 PHE 26 HE2 PHE 26 9.915 -4.251 7.778 218 HZ PHE 26 HZ PHE 26 12.078 -4.228 6.601 219 H ILE 27 H ILE 27 5.168 -8.029 5.175 220 HA ILE 27 HA ILE 27 5.386 -7.823 8.055 221 HB ILE 27 HB ILE 27 2.877 -8.132 6.399 222 HG12 ILE 27 1HG1 ILE 27 4.047 -6.137 5.654 223 HG13 ILE 27 2HG1 ILE 27 2.646 -5.668 6.606 224 HG21 ILE 27 1HG2 ILE 27 3.235 -7.056 9.193 225 HG22 ILE 27 2HG2 ILE 27 2.616 -8.656 8.786 226 HG23 ILE 27 3HG2 ILE 27 1.714 -7.215 8.317 227 HD11 ILE 27 3HD1 ILE 27 4.443 -4.234 7.196 228 HD12 ILE 27 1HD1 ILE 27 5.534 -5.599 7.439 229 HD13 ILE 27 2HD1 ILE 27 4.189 -5.337 8.548 230 H ARG 28 H ARG 28 4.617 -10.288 5.678 231 HA ARG 28 HA ARG 28 3.475 -12.186 7.444 232 HB2 ARG 28 1HB ARG 28 4.656 -12.297 4.701 233 HB3 ARG 28 2HB ARG 28 4.352 -13.803 5.555 234 HG2 ARG 28 1HG ARG 28 2.000 -13.193 5.801 235 HG3 ARG 28 2HG ARG 28 2.305 -11.679 4.947 236 HD2 ARG 28 1HD ARG 28 2.990 -12.941 2.964 237 HD3 ARG 28 2HD ARG 28 2.687 -14.452 3.821 238 HE ARG 28 HE ARG 28 0.350 -12.916 3.888 239 HH11 ARG 28 1HH1 ARG 28 2.317 -14.623 1.560 240 HH12 ARG 28 2HH1 ARG 28 0.992 -14.956 0.497 241 HH21 ARG 28 1HH2 ARG 28 -1.390 -13.356 2.492 242 HH22 ARG 28 2HH2 ARG 28 -1.113 -14.236 1.027 243 H ARG 29 H ARG 29 6.751 -11.287 6.760 244 HA ARG 29 HA ARG 29 7.924 -13.681 7.869 245 HB2 ARG 29 1HB ARG 29 9.051 -11.064 6.902 246 HB3 ARG 29 2HB ARG 29 10.059 -12.261 7.703 247 HG2 ARG 29 1HG ARG 29 9.492 -13.894 5.976 248 HG3 ARG 29 2HG ARG 29 8.479 -12.693 5.174 249 HD2 ARG 29 1HD ARG 29 10.439 -11.264 4.845 250 HD3 ARG 29 2HD ARG 29 11.450 -12.467 5.646 251 HE ARG 29 HE ARG 29 10.122 -13.706 3.519 252 HH11 ARG 29 1HH1 ARG 29 12.589 -11.286 4.040 253 HH12 ARG 29 2HH1 ARG 29 13.396 -11.608 2.540 254 HH21 ARG 29 1HH2 ARG 29 11.183 -14.127 1.551 255 HH22 ARG 29 2HH2 ARG 29 12.596 -13.218 1.129 256 H ARG 30 H ARG 30 6.724 -10.728 9.088 257 HA ARG 30 HA ARG 30 8.360 -10.669 11.468 258 HB2 ARG 30 1HB ARG 30 5.996 -9.059 10.532 259 HB3 ARG 30 2HB ARG 30 6.672 -8.865 12.142 260 HG2 ARG 30 1HG ARG 30 8.829 -8.261 11.165 261 HG3 ARG 30 2HG ARG 30 8.150 -8.458 9.549 262 HD2 ARG 30 1HD ARG 30 8.071 -6.148 9.975 263 HD3 ARG 30 2HD ARG 30 6.425 -6.722 10.227 264 HE ARG 30 HE ARG 30 7.762 -6.777 12.684 265 HH11 ARG 30 1HH1 ARG 30 6.591 -4.437 10.366 266 HH12 ARG 30 2HH1 ARG 30 6.343 -3.202 11.555 267 HH21 ARG 30 1HH2 ARG 30 7.434 -5.152 14.241 268 HH22 ARG 30 2HH2 ARG 30 6.821 -3.608 13.753 269 H HIS 31 H HIS 31 5.411 -12.144 10.488 270 HA HIS 31 HA HIS 31 4.167 -12.390 13.030 271 HB2 HIS 31 1HB HIS 31 3.817 -13.798 10.398 272 HB3 HIS 31 2HB HIS 31 2.925 -14.309 11.828 273 HD1 HIS 31 HD1 HIS 31 2.848 -11.913 9.087 274 HD2 HIS 31 HD2 HIS 31 1.207 -12.194 12.894 275 HE1 HIS 31 HE1 HIS 31 0.965 -10.247 9.133 276 HE2 HIS 31 HE2 HIS 31 -0.066 -10.496 11.417 277 H ILE 32 H ILE 32 6.851 -13.971 11.649 278 HA ILE 32 HA ILE 32 6.563 -16.440 13.132 279 HB ILE 32 HB ILE 32 9.099 -15.524 11.790 280 HG12 ILE 32 1HG1 ILE 32 7.183 -17.224 10.279 281 HG13 ILE 32 2HG1 ILE 32 6.799 -15.510 10.399 282 HG21 ILE 32 1HG2 ILE 32 7.915 -18.253 12.296 283 HG22 ILE 32 2HG2 ILE 32 9.253 -17.516 13.178 284 HG23 ILE 32 3HG2 ILE 32 9.443 -17.936 11.475 285 HD11 ILE 32 3HD1 ILE 32 8.012 -15.952 8.365 286 HD12 ILE 32 1HD1 ILE 32 9.322 -16.706 9.274 287 HD13 ILE 32 2HD1 ILE 32 9.005 -14.979 9.451 288 H VAL 33 H VAL 33 7.848 -13.315 13.698 289 HA VAL 33 HA VAL 33 9.563 -14.233 15.888 290 HB VAL 33 HB VAL 33 9.186 -11.353 15.077 291 HG11 VAL 33 1HG1 VAL 33 11.475 -12.832 16.375 292 HG12 VAL 33 2HG1 VAL 33 10.336 -11.756 17.184 293 HG13 VAL 33 3HG1 VAL 33 11.452 -11.111 15.981 294 HG21 VAL 33 3HG2 VAL 33 9.773 -12.563 13.045 295 HG22 VAL 33 1HG2 VAL 33 11.136 -13.316 13.871 296 HG23 VAL 33 2HG2 VAL 33 11.128 -11.575 13.594 297 H ARG 34 H ARG 34 6.801 -12.074 15.298 298 HA ARG 34 HA ARG 34 6.214 -12.135 18.185 299 HB2 ARG 34 1HB ARG 34 5.598 -10.057 16.085 300 HB3 ARG 34 2HB ARG 34 4.823 -10.066 17.662 301 HG2 ARG 34 1HG ARG 34 6.985 -9.816 18.749 302 HG3 ARG 34 2HG ARG 34 7.786 -9.851 17.178 303 HD2 ARG 34 1HD ARG 34 6.507 -7.835 16.527 304 HD3 ARG 34 2HD ARG 34 5.820 -7.781 18.150 305 HE ARG 34 HE ARG 34 8.525 -7.802 18.542 306 HH11 ARG 34 1HH1 ARG 34 6.312 -5.758 16.770 307 HH12 ARG 34 2HH1 ARG 34 7.283 -4.335 16.956 308 HH21 ARG 34 1HH2 ARG 34 9.798 -5.932 18.784 309 HH22 ARG 34 2HH2 ARG 34 9.261 -4.434 18.098 310 H LYS 35 H LYS 35 4.458 -13.196 18.813 311 HA LYS 35 HA LYS 35 2.258 -13.579 16.901 312 HB2 LYS 35 1HB LYS 35 3.614 -15.681 18.581 313 HB3 LYS 35 2HB LYS 35 1.987 -15.899 17.951 314 HG2 LYS 35 1HG LYS 35 2.832 -15.649 15.673 315 HG3 LYS 35 2HG LYS 35 4.466 -15.429 16.306 316 HD2 LYS 35 1HD LYS 35 4.384 -17.672 17.287 317 HD3 LYS 35 2HD LYS 35 2.751 -17.889 16.657 318 HE2 LYS 35 1HE LYS 35 5.110 -17.284 14.890 319 HE3 LYS 35 2HE LYS 35 4.636 -18.928 15.313 320 HZ1 LYS 35 3HZ LYS 35 3.695 -18.256 13.195 321 HZ2 LYS 35 1HZ LYS 35 2.921 -16.938 13.924 322 HZ3 LYS 35 2HZ LYS 35 2.466 -18.516 14.328 323 H ARG 36 H ARG 36 0.595 -12.516 17.721 324 HA ARG 36 HA ARG 36 -0.975 -11.688 19.134 325 HB2 ARG 36 1HB ARG 36 -0.377 -14.366 20.339 326 HB3 ARG 36 2HB ARG 36 -1.525 -13.285 21.118 327 HG2 ARG 36 1HG ARG 36 -2.861 -13.234 19.071 328 HG3 ARG 36 2HG ARG 36 -1.709 -14.320 18.295 329 HD2 ARG 36 1HD ARG 36 -2.194 -16.032 19.977 330 HD3 ARG 36 2HD ARG 36 -3.345 -14.944 20.750 331 HE ARG 36 HE ARG 36 -4.071 -15.231 18.063 332 HH11 ARG 36 1HH1 ARG 36 -3.931 -17.151 20.981 333 HH12 ARG 36 2HH1 ARG 36 -5.233 -18.189 20.506 334 HH21 ARG 36 1HH2 ARG 36 -5.780 -16.598 17.443 335 HH22 ARG 36 2HH2 ARG 36 -6.280 -17.877 18.500 336 H THR 37 H THR 37 1.855 -10.969 19.627 337 HA THR 37 HA THR 37 2.090 -10.655 22.494 338 HB THR 37 HB THR 37 4.131 -9.267 21.861 339 HG1 THR 37 HG1 THR 37 3.357 -10.230 19.295 340 HG21 THR 37 3HG2 THR 37 5.463 -11.242 21.269 341 HG22 THR 37 1HG2 THR 37 3.985 -12.124 20.888 342 HG23 THR 37 2HG2 THR 37 4.301 -11.608 22.545 343 H LEU 38 H LEU 38 1.195 -8.686 19.737 344 HA LEU 38 HA LEU 38 1.044 -6.268 21.336 345 HB2 LEU 38 1HB LEU 38 1.899 -6.398 18.913 346 HB3 LEU 38 2HB LEU 38 0.211 -6.530 18.462 347 HG LEU 38 HG LEU 38 -0.226 -4.335 19.521 348 HD11 LEU 38 1HD1 LEU 38 1.979 -2.966 19.864 349 HD12 LEU 38 2HD1 LEU 38 2.672 -4.554 20.191 350 HD13 LEU 38 3HD1 LEU 38 1.331 -3.957 21.171 351 HD21 LEU 38 3HD2 LEU 38 0.080 -4.190 17.224 352 HD22 LEU 38 1HD2 LEU 38 1.792 -4.601 17.327 353 HD23 LEU 38 2HD2 LEU 38 1.233 -3.015 17.856 354 H ARG 39 H ARG 39 -1.008 -8.599 19.793 355 HA ARG 39 HA ARG 39 -3.498 -7.335 20.138 356 HB2 ARG 39 1HB ARG 39 -2.709 -10.219 19.703 357 HB3 ARG 39 2HB ARG 39 -4.386 -9.711 19.858 358 HG2 ARG 39 1HG ARG 39 -4.225 -8.364 17.886 359 HG3 ARG 39 2HG ARG 39 -2.486 -8.642 17.782 360 HD2 ARG 39 1HD ARG 39 -2.891 -11.026 17.416 361 HD3 ARG 39 2HD ARG 39 -4.628 -10.752 17.528 362 HE ARG 39 HE ARG 39 -3.597 -9.083 15.533 363 HH11 ARG 39 1HH1 ARG 39 -4.102 -12.489 16.125 364 HH12 ARG 39 2HH1 ARG 39 -4.272 -12.882 14.448 365 HH21 ARG 39 1HH2 ARG 39 -3.823 -9.602 13.329 366 HH22 ARG 39 2HH2 ARG 39 -4.114 -11.244 12.862 367 H ARG 40 H ARG 40 -1.403 -9.302 22.093 368 HA ARG 40 HA ARG 40 -3.281 -9.858 24.181 369 HB2 ARG 40 1HB ARG 40 -0.361 -10.120 23.784 370 HB3 ARG 40 2HB ARG 40 -0.854 -9.841 25.449 371 HG2 ARG 40 1HG ARG 40 -2.330 -11.784 25.340 372 HG3 ARG 40 2HG ARG 40 -1.838 -12.063 23.669 373 HD2 ARG 40 1HD ARG 40 0.474 -12.384 24.407 374 HD3 ARG 40 2HD ARG 40 -0.018 -12.102 26.076 375 HE ARG 40 HE ARG 40 -1.566 -14.189 25.039 376 HH11 ARG 40 1HH1 ARG 40 1.757 -13.548 25.914 377 HH12 ARG 40 2HH1 ARG 40 2.104 -15.201 26.296 378 HH21 ARG 40 1HH2 ARG 40 -1.106 -16.360 25.542 379 HH22 ARG 40 2HH2 ARG 40 0.480 -16.796 26.084 380 H LEU 41 H LEU 41 -1.563 -7.220 23.051 381 HA LEU 41 HA LEU 41 -2.126 -5.598 25.417 382 HB2 LEU 41 1HB LEU 41 -0.172 -5.090 23.167 383 HB3 LEU 41 2HB LEU 41 -0.451 -4.020 24.526 384 HG LEU 41 HG LEU 41 0.444 -6.830 25.041 385 HD11 LEU 41 1HD1 LEU 41 2.175 -4.554 24.106 386 HD12 LEU 41 2HD1 LEU 41 2.035 -6.170 23.414 387 HD13 LEU 41 3HD1 LEU 41 2.798 -5.949 24.988 388 HD21 LEU 41 3HD2 LEU 41 1.222 -5.985 27.065 389 HD22 LEU 41 1HD2 LEU 41 -0.280 -5.098 26.806 390 HD23 LEU 41 2HD2 LEU 41 1.269 -4.327 26.466 391 H LEU 42 H LEU 42 -2.706 -6.081 21.979 392 HA LEU 42 HA LEU 42 -3.992 -3.472 21.719 393 HB2 LEU 42 1HB LEU 42 -2.645 -4.969 19.932 394 HB3 LEU 42 2HB LEU 42 -4.282 -5.476 19.565 395 HG LEU 42 HG LEU 42 -3.593 -2.558 19.671 396 HD11 LEU 42 1HD1 LEU 42 -3.300 -4.351 17.266 397 HD12 LEU 42 2HD1 LEU 42 -1.969 -3.630 18.169 398 HD13 LEU 42 3HD1 LEU 42 -3.105 -2.600 17.299 399 HD21 LEU 42 3HD2 LEU 42 -5.457 -2.400 18.094 400 HD22 LEU 42 1HD2 LEU 42 -5.951 -3.185 19.594 401 HD23 LEU 42 2HD2 LEU 42 -5.655 -4.152 18.149 402 H GLN 43 H GLN 43 -5.055 -6.836 21.130 403 HA GLN 43 HA GLN 43 -7.813 -6.153 21.069 404 HB2 GLN 43 1HB GLN 43 -6.313 -8.749 21.222 405 HB3 GLN 43 2HB GLN 43 -8.065 -8.712 21.356 406 HG2 GLN 43 1HG GLN 43 -8.101 -7.490 19.162 407 HG3 GLN 43 2HG GLN 43 -6.377 -7.842 19.027 408 HE21 GLN 43 2HE2 GLN 43 -5.706 -9.962 18.702 409 HE22 GLN 43 1HE2 GLN 43 -6.789 -11.198 18.170 410 H GLU 44 H GLU 44 -5.615 -6.849 23.635 411 HA GLU 44 HA GLU 44 -7.679 -7.580 25.532 412 HB2 GLU 44 1HB GLU 44 -4.710 -7.153 25.749 413 HB3 GLU 44 2HB GLU 44 -5.712 -7.373 27.177 414 HG2 GLU 44 1HG GLU 44 -5.789 -9.352 24.935 415 HG3 GLU 44 2HG GLU 44 -4.521 -9.412 26.157 416 H ARG 45 H ARG 45 -6.229 -4.689 24.402 417 HA ARG 45 HA ARG 45 -6.894 -3.149 26.774 418 HB2 ARG 45 1HB ARG 45 -4.866 -2.861 25.093 419 HB3 ARG 45 2HB ARG 45 -6.026 -1.876 24.215 420 HG2 ARG 45 1HG ARG 45 -5.703 -1.334 27.111 421 HG3 ARG 45 2HG ARG 45 -4.383 -0.866 26.037 422 HD2 ARG 45 1HD ARG 45 -5.947 0.423 24.674 423 HD3 ARG 45 2HD ARG 45 -7.274 -0.057 25.732 424 HE ARG 45 HE ARG 45 -5.296 1.161 27.293 425 HH11 ARG 45 1HH1 ARG 45 -7.594 2.019 24.803 426 HH12 ARG 45 2HH1 ARG 45 -7.755 3.657 25.344 427 HH21 ARG 45 1HH2 ARG 45 -5.509 3.311 28.001 428 HH22 ARG 45 2HH2 ARG 45 -6.571 4.389 27.158 429 H GLU 46 H GLU 46 -8.488 -4.169 23.975 430 HA GLU 46 HA GLU 46 -10.415 -1.949 24.172 431 HB2 GLU 46 1HB GLU 46 -9.512 -3.581 21.822 432 HB3 GLU 46 2HB GLU 46 -11.077 -2.780 21.803 433 HG2 GLU 46 1HG GLU 46 -9.730 -1.235 20.765 434 HG3 GLU 46 2HG GLU 46 -9.720 -0.663 22.433 435 H LEU 47 H LEU 47 -10.091 -5.463 23.820 436 HA LEU 47 HA LEU 47 -12.961 -5.812 24.062 437 HB2 LEU 47 1HB LEU 47 -10.671 -7.662 23.521 438 HB3 LEU 47 2HB LEU 47 -12.215 -8.314 24.021 439 HG LEU 47 HG LEU 47 -12.041 -8.446 21.626 440 HD11 LEU 47 1HD1 LEU 47 -13.890 -6.132 22.014 441 HD12 LEU 47 2HD1 LEU 47 -14.216 -7.678 22.796 442 HD13 LEU 47 3HD1 LEU 47 -14.098 -7.586 21.039 443 HD21 LEU 47 3HD2 LEU 47 -10.388 -6.703 21.251 444 HD22 LEU 47 1HD2 LEU 47 -11.578 -5.466 21.656 445 HD23 LEU 47 2HD2 LEU 47 -11.795 -6.462 20.216 446 H VAL 48 H VAL 48 -10.886 -5.000 26.232 447 HA VAL 48 HA VAL 48 -12.174 -6.558 28.358 448 HB VAL 48 HB VAL 48 -9.260 -5.880 28.635 449 HG11 VAL 48 1HG1 VAL 48 -10.484 -6.534 30.635 450 HG12 VAL 48 2HG1 VAL 48 -9.297 -7.767 30.204 451 HG13 VAL 48 3HG1 VAL 48 -11.005 -8.024 29.847 452 HG21 VAL 48 3HG2 VAL 48 -10.162 -8.561 27.627 453 HG22 VAL 48 1HG2 VAL 48 -8.532 -7.889 27.678 454 HG23 VAL 48 2HG2 VAL 48 -9.710 -7.259 26.525 455 H GLU 49 H GLU 49 -12.852 -3.987 27.476 456 HA GLU 49 HA GLU 49 -11.752 -2.174 29.499 457 HB2 GLU 49 1HB GLU 49 -13.347 -1.714 26.984 458 HB3 GLU 49 2HB GLU 49 -13.114 -0.447 28.182 459 HG2 GLU 49 1HG GLU 49 -10.695 -0.619 27.895 460 HG3 GLU 49 2HG GLU 49 -10.928 -1.889 26.695 461 HA PRO 50 HA PRO 50 -15.390 -2.555 32.010 462 HB2 PRO 50 1HB PRO 50 -15.270 -0.192 33.361 463 HB3 PRO 50 2HB PRO 50 -14.179 -1.552 33.696 464 HG2 PRO 50 1HG PRO 50 -13.680 0.917 32.108 465 HG3 PRO 50 2HG PRO 50 -12.615 0.071 33.250 466 HD2 PRO 50 1HD PRO 50 -12.378 -0.180 30.559 467 HD3 PRO 50 2HD PRO 50 -11.947 -1.474 31.694 468 H LEU 51 H LEU 51 -17.487 -1.607 32.403 469 HA LEU 51 HA LEU 51 -18.293 0.582 30.677 470 HB2 LEU 51 1HB LEU 51 -19.523 -2.171 30.590 471 HB3 LEU 51 2HB LEU 51 -20.306 -0.746 29.936 472 HG LEU 51 HG LEU 51 -17.920 -0.613 28.659 473 HD11 LEU 51 1HD1 LEU 51 -18.537 -3.547 28.967 474 HD12 LEU 51 2HD1 LEU 51 -17.132 -2.710 29.626 475 HD13 LEU 51 3HD1 LEU 51 -17.337 -2.848 27.880 476 HD21 LEU 51 3HD2 LEU 51 -19.095 -1.562 26.726 477 HD22 LEU 51 1HD2 LEU 51 -20.110 -0.431 27.623 478 HD23 LEU 51 2HD2 LEU 51 -20.356 -2.168 27.799 479 H THR 52 H THR 52 -18.534 1.731 32.589 480 HA THR 52 HA THR 52 -20.750 0.876 34.334 481 HB THR 52 HB THR 52 -19.786 2.594 35.953 482 HG1 THR 52 HG1 THR 52 -17.330 2.270 34.641 483 HG21 THR 52 3HG2 THR 52 -19.514 0.187 36.286 484 HG22 THR 52 1HG2 THR 52 -18.060 1.054 36.780 485 HG23 THR 52 2HG2 THR 52 -18.093 0.192 35.243 486 HA PRO 53 HA PRO 53 -23.173 4.286 32.869 487 HB2 PRO 53 1HB PRO 53 -24.775 4.707 35.040 488 HB3 PRO 53 2HB PRO 53 -24.976 3.330 33.939 489 HG2 PRO 53 1HG PRO 53 -23.672 3.431 36.613 490 HG3 PRO 53 2HG PRO 53 -24.728 2.187 35.915 491 HD2 PRO 53 1HD PRO 53 -22.034 1.922 36.021 492 HD3 PRO 53 2HD PRO 53 -23.024 1.204 34.734 493 H SER 54 H SER 54 -22.456 6.281 32.622 494 HA SER 54 HA SER 54 -21.709 7.844 35.005 495 HB2 SER 54 1HB SER 54 -20.361 7.899 32.293 496 HB3 SER 54 2HB SER 54 -19.974 8.965 33.645 497 HG SER 54 HG SER 54 -19.647 6.843 34.805 498 H GLY 55 H GLY 55 -23.697 7.557 32.320 499 HA2 GLY 55 1HA GLY 55 -24.563 10.353 32.621 500 HA3 GLY 55 2HA GLY 55 -24.244 9.726 31.010 501 H GLU 56 H GLU 56 -25.956 8.530 33.901 502 HA GLU 56 HA GLU 56 -28.164 7.692 32.159 503 HB2 GLU 56 1HB GLU 56 -27.315 6.845 34.924 504 HB3 GLU 56 2HB GLU 56 -28.885 6.418 34.260 505 HG2 GLU 56 1HG GLU 56 -26.367 5.777 32.776 506 HG3 GLU 56 2HG GLU 56 -26.949 4.736 34.073 507 H LYS 57 H LYS 57 -30.152 8.553 32.316 508 HA LYS 57 HA LYS 57 -30.499 10.894 33.973 509 HB2 LYS 57 1HB LYS 57 -32.151 9.630 31.796 510 HB3 LYS 57 2HB LYS 57 -32.751 10.978 32.754 511 HG2 LYS 57 1HG LYS 57 -30.872 12.349 32.007 512 HG3 LYS 57 2HG LYS 57 -30.267 10.996 31.049 513 HD2 LYS 57 1HD LYS 57 -32.330 11.015 29.728 514 HD3 LYS 57 2HD LYS 57 -32.932 12.367 30.690 515 HE2 LYS 57 1HE LYS 57 -31.056 13.741 29.931 516 HE3 LYS 57 2HE LYS 57 -30.453 12.390 28.971 517 HZ1 LYS 57 3HZ LYS 57 -32.489 12.456 27.669 518 HZ2 LYS 57 1HZ LYS 57 -31.698 13.950 27.614 519 HZ3 LYS 57 2HZ LYS 57 -33.066 13.753 28.589 520 H LEU 58 H LEU 58 -31.966 7.690 33.634 521 HA LEU 58 HA LEU 58 -33.736 8.169 35.881 522 HB2 LEU 58 1HB LEU 58 -33.384 5.819 34.033 523 HB3 LEU 58 2HB LEU 58 -34.491 5.811 35.391 524 HG LEU 58 HG LEU 58 -35.400 8.008 34.198 525 HD11 LEU 58 1HD1 LEU 58 -34.256 6.387 31.927 526 HD12 LEU 58 2HD1 LEU 58 -33.736 7.998 32.420 527 HD13 LEU 58 3HD1 LEU 58 -35.356 7.756 31.768 528 HD21 LEU 58 3HD2 LEU 58 -36.043 5.189 33.339 529 HD22 LEU 58 1HD2 LEU 58 -37.073 6.598 33.087 530 HD23 LEU 58 2HD2 LEU 58 -36.725 6.041 34.724 531 H TRP 59 H TRP 59 -30.599 7.160 35.460 532 HA TRP 59 HA TRP 59 -29.018 6.214 36.782 533 HB2 TRP 59 1HB TRP 59 -31.122 6.694 38.898 534 HB3 TRP 59 2HB TRP 59 -29.515 6.074 39.262 535 HD1 TRP 59 HD1 TRP 59 -31.332 9.259 38.215 536 HE1 TRP 59 HE1 TRP 59 -29.734 11.257 38.483 537 HE3 TRP 59 HE3 TRP 59 -27.009 6.717 39.231 538 HZ2 TRP 59 HZ2 TRP 59 -27.006 11.699 39.048 539 HZ3 TRP 59 HZ3 TRP 59 -24.951 8.005 39.623 540 HH2 TRP 59 HH2 TRP 59 -24.950 10.445 39.533 541 H SER 60 H SER 60 -28.386 4.185 36.660 542 HA SER 60 HA SER 60 -30.275 2.052 37.402 543 HB2 SER 60 1HB SER 60 -29.973 2.268 34.916 544 HB3 SER 60 2HB SER 60 -28.269 1.879 35.143 545 HG SER 60 HG SER 60 -30.353 0.204 36.073 546 H1 LYS 61 1H LYS 61 -2.859 11.474 -31.581 547 H2 LYS 61 2H LYS 61 -2.072 12.593 -30.587 548 H3 LYS 61 3H LYS 61 -3.131 11.461 -29.911 549 HA LYS 61 HA LYS 61 -1.680 9.658 -30.530 550 HB2 LYS 61 1HB LYS 61 -0.038 11.910 -31.684 551 HB3 LYS 61 2HB LYS 61 0.656 10.339 -31.310 552 HG2 LYS 61 1HG LYS 61 -0.907 9.275 -32.859 553 HG3 LYS 61 2HG LYS 61 -1.608 10.852 -33.232 554 HD2 LYS 61 1HD LYS 61 0.560 11.609 -34.087 555 HD3 LYS 61 2HD LYS 61 1.259 10.033 -33.712 556 HE2 LYS 61 1HE LYS 61 -1.100 10.374 -35.548 557 HE3 LYS 61 2HE LYS 61 0.566 10.425 -36.122 558 HZ1 LYS 61 3HZ LYS 61 -0.706 8.145 -34.705 559 HZ2 LYS 61 1HZ LYS 61 0.893 8.191 -35.255 560 HZ3 LYS 61 2HZ LYS 61 -0.384 8.220 -36.364 561 H ILE 62 H ILE 62 -0.681 8.880 -28.783 562 HA ILE 62 HA ILE 62 0.725 10.727 -26.991 563 HB ILE 62 HB ILE 62 -0.306 9.393 -25.042 564 HG12 ILE 62 1HG1 ILE 62 -2.841 8.938 -25.852 565 HG13 ILE 62 2HG1 ILE 62 -1.984 8.509 -27.329 566 HG21 ILE 62 1HG2 ILE 62 -1.973 11.356 -26.607 567 HG22 ILE 62 2HG2 ILE 62 -0.723 11.747 -25.427 568 HG23 ILE 62 3HG2 ILE 62 -2.203 10.942 -24.908 569 HD11 ILE 62 3HD1 ILE 62 -1.507 7.325 -24.604 570 HD12 ILE 62 1HD1 ILE 62 -0.649 6.892 -26.083 571 HD13 ILE 62 2HD1 ILE 62 -2.375 6.562 -25.935 572 HA PRO 63 HA PRO 63 3.786 7.531 -26.886 573 HB2 PRO 63 1HB PRO 63 4.966 8.069 -24.480 574 HB3 PRO 63 2HB PRO 63 5.220 9.058 -25.930 575 HG2 PRO 63 1HG PRO 63 3.437 9.554 -23.600 576 HG3 PRO 63 2HG PRO 63 4.454 10.691 -24.510 577 HD2 PRO 63 1HD PRO 63 1.781 10.500 -24.892 578 HD3 PRO 63 2HD PRO 63 2.911 10.946 -26.187 579 H SER 64 H SER 64 4.223 5.512 -26.017 580 HA SER 64 HA SER 64 2.114 4.346 -24.436 581 HB2 SER 64 1HB SER 64 4.631 3.116 -25.582 582 HB3 SER 64 2HB SER 64 3.310 2.219 -24.834 583 HG SER 64 HG SER 64 2.074 3.581 -26.568 584 H ILE 65 H ILE 65 5.010 5.880 -23.709 585 HA ILE 65 HA ILE 65 5.704 4.302 -21.385 586 HB ILE 65 HB ILE 65 6.774 7.044 -22.057 587 HG12 ILE 65 1HG1 ILE 65 8.708 5.356 -22.943 588 HG13 ILE 65 2HG1 ILE 65 7.270 4.435 -23.364 589 HG21 ILE 65 1HG2 ILE 65 8.751 6.268 -20.828 590 HG22 ILE 65 2HG2 ILE 65 7.942 4.735 -20.503 591 HG23 ILE 65 3HG2 ILE 65 7.301 6.233 -19.826 592 HD11 ILE 65 3HD1 ILE 65 7.794 7.279 -24.191 593 HD12 ILE 65 1HD1 ILE 65 6.439 6.268 -24.689 594 HD13 ILE 65 2HD1 ILE 65 8.077 5.858 -25.196 595 H ALA 66 H ALA 66 3.893 7.208 -22.096 596 HA ALA 66 HA ALA 66 3.683 8.014 -19.324 597 HB1 ALA 66 3HB ALA 66 3.769 9.652 -21.191 598 HB2 ALA 66 1HB ALA 66 2.380 9.857 -20.126 599 HB3 ALA 66 2HB ALA 66 2.177 9.090 -21.700 600 H THR 67 H THR 67 1.851 6.139 -21.604 601 HA THR 67 HA THR 67 -0.692 6.265 -20.397 602 HB THR 67 HB THR 67 0.233 3.785 -21.801 603 HG1 THR 67 HG1 THR 67 -0.597 5.445 -23.652 604 HG21 THR 67 3HG2 THR 67 -2.077 3.868 -21.054 605 HG22 THR 67 1HG2 THR 67 -2.022 3.955 -22.815 606 HG23 THR 67 2HG2 THR 67 -2.312 5.414 -21.869 607 H GLY 68 H GLY 68 2.135 4.290 -19.724 608 HA2 GLY 68 1HA GLY 68 0.734 2.520 -17.913 609 HA3 GLY 68 2HA GLY 68 2.464 2.557 -18.209 610 H LEU 69 H LEU 69 2.967 5.244 -17.641 611 HA LEU 69 HA LEU 69 3.326 5.178 -14.857 612 HB2 LEU 69 1HB LEU 69 3.469 7.480 -16.805 613 HB3 LEU 69 2HB LEU 69 3.960 7.593 -15.125 614 HG LEU 69 HG LEU 69 5.209 5.542 -16.925 615 HD11 LEU 69 1HD1 LEU 69 7.047 7.262 -17.242 616 HD12 LEU 69 2HD1 LEU 69 5.857 8.469 -16.749 617 HD13 LEU 69 3HD1 LEU 69 5.577 7.489 -18.188 618 HD21 LEU 69 3HD2 LEU 69 7.099 5.848 -15.377 619 HD22 LEU 69 1HD2 LEU 69 5.629 5.339 -14.545 620 HD23 LEU 69 2HD2 LEU 69 6.146 7.023 -14.469 621 H VAL 70 H VAL 70 0.942 6.890 -16.860 622 HA VAL 70 HA VAL 70 -0.244 8.373 -14.801 623 HB VAL 70 HB VAL 70 -2.233 8.557 -16.285 624 HG11 VAL 70 1HG1 VAL 70 0.523 9.078 -17.358 625 HG12 VAL 70 2HG1 VAL 70 -0.600 10.207 -16.596 626 HG13 VAL 70 3HG1 VAL 70 -0.927 9.600 -18.219 627 HG21 VAL 70 3HG2 VAL 70 -2.187 6.348 -17.311 628 HG22 VAL 70 1HG2 VAL 70 -0.656 6.728 -18.100 629 HG23 VAL 70 2HG2 VAL 70 -2.120 7.602 -18.548 630 H GLY 71 H GLY 71 -0.906 5.128 -15.958 631 HA2 GLY 71 1HA GLY 71 -3.258 4.694 -14.419 632 HA3 GLY 71 2HA GLY 71 -2.268 3.446 -15.159 633 H ALA 72 H ALA 72 0.132 3.722 -13.893 634 HA ALA 72 HA ALA 72 -0.442 2.504 -11.373 635 HB1 ALA 72 3HB ALA 72 1.461 1.918 -12.943 636 HB2 ALA 72 1HB ALA 72 1.854 2.019 -11.227 637 HB3 ALA 72 2HB ALA 72 2.285 3.343 -12.311 638 H LEU 73 H LEU 73 0.936 5.631 -12.311 639 HA LEU 73 HA LEU 73 1.583 6.438 -9.674 640 HB2 LEU 73 1HB LEU 73 1.301 7.822 -12.301 641 HB3 LEU 73 2HB LEU 73 1.368 8.797 -10.846 642 HG LEU 73 HG LEU 73 3.545 7.685 -10.280 643 HD11 LEU 73 1HD1 LEU 73 3.342 6.619 -13.097 644 HD12 LEU 73 2HD1 LEU 73 3.268 5.655 -11.624 645 HD13 LEU 73 3HD1 LEU 73 4.752 6.511 -12.042 646 HD21 LEU 73 3HD2 LEU 73 3.422 9.163 -12.906 647 HD22 LEU 73 1HD2 LEU 73 4.852 8.979 -11.889 648 HD23 LEU 73 2HD2 LEU 73 3.464 9.895 -11.301 649 H LEU 74 H LEU 74 -1.306 6.878 -11.693 650 HA LEU 74 HA LEU 74 -2.658 8.529 -9.812 651 HB2 LEU 74 1HB LEU 74 -3.308 7.221 -12.358 652 HB3 LEU 74 2HB LEU 74 -4.669 7.393 -11.268 653 HG LEU 74 HG LEU 74 -3.975 9.876 -11.112 654 HD11 LEU 74 1HD1 LEU 74 -1.778 9.305 -12.355 655 HD12 LEU 74 2HD1 LEU 74 -2.633 10.795 -12.760 656 HD13 LEU 74 3HD1 LEU 74 -2.776 9.383 -13.808 657 HD21 LEU 74 3HD2 LEU 74 -5.098 8.746 -13.672 658 HD22 LEU 74 1HD2 LEU 74 -5.276 10.410 -13.113 659 HD23 LEU 74 2HD2 LEU 74 -6.007 9.090 -12.199 660 H LEU 75 H LEU 75 -2.604 5.061 -10.442 661 HA LEU 75 HA LEU 75 -4.678 4.411 -8.597 662 HB2 LEU 75 1HB LEU 75 -2.869 2.987 -10.348 663 HB3 LEU 75 2HB LEU 75 -2.981 2.186 -8.791 664 HG LEU 75 HG LEU 75 -5.617 2.654 -9.353 665 HD11 LEU 75 1HD1 LEU 75 -5.991 1.972 -11.664 666 HD12 LEU 75 2HD1 LEU 75 -4.252 1.985 -11.955 667 HD13 LEU 75 3HD1 LEU 75 -5.095 3.490 -11.583 668 HD21 LEU 75 3HD2 LEU 75 -5.728 0.274 -9.878 669 HD22 LEU 75 1HD2 LEU 75 -4.646 0.576 -8.519 670 HD23 LEU 75 2HD2 LEU 75 -3.981 0.238 -10.117 671 H LEU 76 H LEU 76 -1.158 4.585 -8.386 672 HA LEU 76 HA LEU 76 -0.953 3.609 -5.723 673 HB2 LEU 76 1HB LEU 76 0.852 3.930 -7.627 674 HB3 LEU 76 2HB LEU 76 1.058 5.497 -6.870 675 HG LEU 76 HG LEU 76 1.288 4.024 -4.677 676 HD11 LEU 76 1HD1 LEU 76 2.463 1.935 -5.127 677 HD12 LEU 76 2HD1 LEU 76 2.208 2.156 -6.858 678 HD13 LEU 76 3HD1 LEU 76 0.830 1.901 -5.788 679 HD21 LEU 76 3HD2 LEU 76 3.470 4.387 -6.725 680 HD22 LEU 76 1HD2 LEU 76 3.717 4.050 -5.013 681 HD23 LEU 76 2HD2 LEU 76 2.966 5.565 -5.513 682 H LEU 77 H LEU 77 -1.454 6.769 -7.152 683 HA LEU 77 HA LEU 77 -0.973 8.303 -4.812 684 HB2 LEU 77 1HB LEU 77 -1.113 9.023 -7.312 685 HB3 LEU 77 2HB LEU 77 -2.831 9.174 -6.997 686 HG LEU 77 HG LEU 77 -1.971 10.656 -4.970 687 HD11 LEU 77 1HD1 LEU 77 0.395 10.264 -5.384 688 HD12 LEU 77 2HD1 LEU 77 -0.009 11.967 -5.606 689 HD13 LEU 77 3HD1 LEU 77 0.231 10.927 -7.011 690 HD21 LEU 77 3HD2 LEU 77 -2.235 12.627 -6.406 691 HD22 LEU 77 1HD2 LEU 77 -3.473 11.411 -6.723 692 HD23 LEU 77 2HD2 LEU 77 -2.114 11.595 -7.832 693 H VAL 78 H VAL 78 -3.920 6.956 -6.278 694 HA VAL 78 HA VAL 78 -5.718 8.077 -4.377 695 HB VAL 78 HB VAL 78 -6.116 5.638 -6.130 696 HG11 VAL 78 1HG1 VAL 78 -8.514 6.077 -5.843 697 HG12 VAL 78 2HG1 VAL 78 -8.137 7.385 -4.721 698 HG13 VAL 78 3HG1 VAL 78 -7.729 5.721 -4.304 699 HG21 VAL 78 3HG2 VAL 78 -5.582 7.613 -7.449 700 HG22 VAL 78 1HG2 VAL 78 -6.837 8.529 -6.616 701 HG23 VAL 78 2HG2 VAL 78 -7.277 7.171 -7.653 702 H VAL 79 H VAL 79 -4.132 4.901 -4.632 703 HA VAL 79 HA VAL 79 -5.383 3.748 -2.365 704 HB VAL 79 HB VAL 79 -2.743 3.043 -3.669 705 HG11 VAL 79 1HG1 VAL 79 -2.682 2.102 -1.493 706 HG12 VAL 79 2HG1 VAL 79 -3.145 0.800 -2.588 707 HG13 VAL 79 3HG1 VAL 79 -4.367 1.590 -1.592 708 HG21 VAL 79 3HG2 VAL 79 -4.636 2.838 -5.183 709 HG22 VAL 79 1HG2 VAL 79 -5.497 1.857 -3.997 710 HG23 VAL 79 2HG2 VAL 79 -4.021 1.245 -4.743 711 H ALA 80 H ALA 80 -2.298 5.463 -2.781 712 HA ALA 80 HA ALA 80 -1.408 5.157 -0.105 713 HB1 ALA 80 3HB ALA 80 0.111 5.695 -1.949 714 HB2 ALA 80 1HB ALA 80 0.231 6.875 -0.645 715 HB3 ALA 80 2HB ALA 80 -0.654 7.275 -2.116 716 H LEU 81 H LEU 81 -3.322 7.621 -1.756 717 HA LEU 81 HA LEU 81 -3.376 9.479 0.398 718 HB2 LEU 81 1HB LEU 81 -3.975 9.750 -2.149 719 HB3 LEU 81 2HB LEU 81 -5.581 9.301 -1.614 720 HG LEU 81 HG LEU 81 -5.134 11.245 0.150 721 HD11 LEU 81 1HD1 LEU 81 -2.868 11.710 -0.616 722 HD12 LEU 81 2HD1 LEU 81 -3.925 13.094 -0.895 723 HD13 LEU 81 3HD1 LEU 81 -3.474 12.043 -2.238 724 HD21 LEU 81 3HD2 LEU 81 -6.312 12.764 -1.377 725 HD22 LEU 81 1HD2 LEU 81 -7.009 11.144 -1.388 726 HD23 LEU 81 2HD2 LEU 81 -5.973 11.667 -2.715 727 H GLY 82 H GLY 82 -5.403 6.765 -0.564 728 HA2 GLY 82 1HA GLY 82 -7.537 7.248 1.248 729 HA3 GLY 82 2HA GLY 82 -7.173 5.717 0.465 730 H ILE 83 H ILE 83 -4.794 4.962 1.419 731 HA ILE 83 HA ILE 83 -5.375 4.067 4.042 732 HB ILE 83 HB ILE 83 -2.640 4.066 2.751 733 HG12 ILE 83 1HG1 ILE 83 -4.517 1.733 2.602 734 HG13 ILE 83 2HG1 ILE 83 -4.687 3.043 1.439 735 HG21 ILE 83 1HG2 ILE 83 -3.881 2.281 4.847 736 HG22 ILE 83 2HG2 ILE 83 -2.641 3.505 5.121 737 HG23 ILE 83 3HG2 ILE 83 -2.273 2.077 4.150 738 HD11 ILE 83 3HD1 ILE 83 -2.383 2.710 0.721 739 HD12 ILE 83 1HD1 ILE 83 -3.332 1.234 0.552 740 HD13 ILE 83 2HD1 ILE 83 -2.203 1.405 1.894 741 H GLY 84 H GLY 84 -3.357 6.678 2.784 742 HA2 GLY 84 1HA GLY 84 -2.069 7.381 5.196 743 HA3 GLY 84 2HA GLY 84 -2.305 8.441 3.815 744 H LEU 85 H LEU 85 -5.040 8.637 3.694 745 HA LEU 85 HA LEU 85 -5.579 10.478 5.815 746 HB2 LEU 85 1HB LEU 85 -7.248 9.432 3.535 747 HB3 LEU 85 2HB LEU 85 -7.866 10.581 4.706 748 HG LEU 85 HG LEU 85 -5.358 11.213 3.194 749 HD11 LEU 85 1HD1 LEU 85 -6.731 12.308 1.472 750 HD12 LEU 85 2HD1 LEU 85 -8.174 11.587 2.185 751 HD13 LEU 85 3HD1 LEU 85 -6.931 10.556 1.475 752 HD21 LEU 85 3HD2 LEU 85 -7.590 12.895 4.332 753 HD22 LEU 85 1HD2 LEU 85 -6.151 13.507 3.517 754 HD23 LEU 85 2HD2 LEU 85 -5.999 12.654 5.051 755 H PHE 86 H PHE 86 -6.270 7.131 5.251 756 HA PHE 86 HA PHE 86 -8.450 6.919 7.101 757 HB2 PHE 86 1HB PHE 86 -7.768 5.354 5.111 758 HB3 PHE 86 2HB PHE 86 -6.744 4.582 6.317 759 HD1 PHE 86 HD1 PHE 86 -10.177 5.214 5.239 760 HD2 PHE 86 HD2 PHE 86 -7.709 3.345 8.159 761 HE1 PHE 86 HE1 PHE 86 -12.104 3.898 6.021 762 HE2 PHE 86 HE2 PHE 86 -9.631 2.026 8.946 763 HZ PHE 86 HZ PHE 86 -11.833 2.302 7.876 764 H ILE 87 H ILE 87 -4.957 6.374 7.263 765 HA ILE 87 HA ILE 87 -5.079 5.422 9.995 766 HB ILE 87 HB ILE 87 -2.625 6.163 8.395 767 HG12 ILE 87 1HG1 ILE 87 -3.828 4.428 7.194 768 HG13 ILE 87 2HG1 ILE 87 -2.398 3.732 7.941 769 HG21 ILE 87 1HG2 ILE 87 -2.894 4.393 10.822 770 HG22 ILE 87 2HG2 ILE 87 -2.282 6.046 10.825 771 HG23 ILE 87 3HG2 ILE 87 -1.402 4.782 9.965 772 HD11 ILE 87 3HD1 ILE 87 -4.181 2.187 8.197 773 HD12 ILE 87 1HD1 ILE 87 -5.258 3.435 8.825 774 HD13 ILE 87 2HD1 ILE 87 -3.878 2.898 9.781 775 H ARG 88 H ARG 88 -4.379 8.427 8.320 776 HA ARG 88 HA ARG 88 -3.171 9.801 10.480 777 HB2 ARG 88 1HB ARG 88 -4.442 10.619 7.905 778 HB3 ARG 88 2HB ARG 88 -4.102 11.851 9.112 779 HG2 ARG 88 1HG ARG 88 -1.746 11.208 9.112 780 HG3 ARG 88 2HG ARG 88 -2.087 9.970 7.902 781 HD2 ARG 88 1HD ARG 88 -2.832 11.702 6.342 782 HD3 ARG 88 2HD ARG 88 -2.493 12.938 7.552 783 HE ARG 88 HE ARG 88 -0.161 11.449 7.138 784 HH11 ARG 88 1HH1 ARG 88 -2.200 13.698 5.403 785 HH12 ARG 88 2HH1 ARG 88 -0.907 14.302 4.422 786 HH21 ARG 88 1HH2 ARG 88 1.533 12.246 5.847 787 HH22 ARG 88 2HH2 ARG 88 1.210 13.477 4.674 788 H ARG 89 H ARG 89 -6.472 9.098 9.697 789 HA ARG 89 HA ARG 89 -7.596 11.114 11.431 790 HB2 ARG 89 1HB ARG 89 -8.766 8.834 9.852 791 HB3 ARG 89 2HB ARG 89 -9.741 9.777 10.971 792 HG2 ARG 89 1HG ARG 89 -9.225 11.807 9.714 793 HG3 ARG 89 2HG ARG 89 -8.245 10.862 8.591 794 HD2 ARG 89 1HD ARG 89 -10.221 9.560 7.967 795 HD3 ARG 89 2HD ARG 89 -11.200 10.507 9.089 796 HE ARG 89 HE ARG 89 -9.938 12.266 7.315 797 HH11 ARG 89 1HH1 ARG 89 -12.397 9.782 7.268 798 HH12 ARG 89 2HH1 ARG 89 -13.251 10.479 5.932 799 HH21 ARG 89 1HH2 ARG 89 -11.062 13.180 5.562 800 HH22 ARG 89 2HH2 ARG 89 -12.493 12.408 4.964 801 H ARG 90 H ARG 90 -6.369 7.950 11.795 802 HA ARG 90 HA ARG 90 -7.925 7.263 14.131 803 HB2 ARG 90 1HB ARG 90 -5.599 5.964 12.727 804 HB3 ARG 90 2HB ARG 90 -6.223 5.353 14.252 805 HG2 ARG 90 1HG ARG 90 -8.415 5.017 13.225 806 HG3 ARG 90 2HG ARG 90 -7.789 5.632 11.694 807 HD2 ARG 90 1HD ARG 90 -7.706 3.290 11.499 808 HD3 ARG 90 2HD ARG 90 -6.049 3.787 11.837 809 HE ARG 90 HE ARG 90 -7.305 3.192 14.267 810 HH11 ARG 90 1HH1 ARG 90 -6.223 1.543 11.380 811 HH12 ARG 90 2HH1 ARG 90 -5.939 0.041 12.195 812 HH21 ARG 90 1HH2 ARG 90 -6.931 1.217 15.333 813 HH22 ARG 90 2HH2 ARG 90 -6.342 -0.143 14.437 814 H HIS 91 H HIS 91 -5.003 8.957 13.471 815 HA HIS 91 HA HIS 91 -3.673 8.535 15.947 816 HB2 HIS 91 1HB HIS 91 -3.406 10.583 13.765 817 HB3 HIS 91 2HB HIS 91 -2.465 10.706 15.247 818 HD1 HIS 91 HD1 HIS 91 -2.489 9.111 11.975 819 HD2 HIS 91 HD2 HIS 91 -0.720 8.395 15.666 820 HE1 HIS 91 HE1 HIS 91 -0.613 7.499 11.520 821 HE2 HIS 91 HE2 HIS 91 0.496 7.147 13.755 822 H ILE 92 H ILE 92 -6.396 10.408 15.118 823 HA ILE 92 HA ILE 92 -6.047 12.406 17.184 824 HB ILE 92 HB ILE 92 -8.632 11.861 15.734 825 HG12 ILE 92 1HG1 ILE 92 -6.759 13.907 14.658 826 HG13 ILE 92 2HG1 ILE 92 -6.379 12.223 14.312 827 HG21 ILE 92 1HG2 ILE 92 -7.418 14.369 16.897 828 HG22 ILE 92 2HG2 ILE 92 -8.729 13.422 17.599 829 HG23 ILE 92 3HG2 ILE 92 -8.974 14.270 16.073 830 HD11 ILE 92 3HD1 ILE 92 -7.656 13.175 12.507 831 HD12 ILE 92 1HD1 ILE 92 -8.933 13.658 13.625 832 HD13 ILE 92 2HD1 ILE 92 -8.618 11.948 13.333 833 H VAL 93 H VAL 93 -7.327 9.236 16.956 834 HA VAL 93 HA VAL 93 -8.964 9.542 19.365 835 HB VAL 93 HB VAL 93 -8.626 6.977 17.820 836 HG11 VAL 93 1HG1 VAL 93 -10.864 8.055 19.532 837 HG12 VAL 93 2HG1 VAL 93 -9.703 6.809 19.995 838 HG13 VAL 93 3HG1 VAL 93 -10.863 6.497 18.705 839 HG21 VAL 93 3HG2 VAL 93 -9.275 8.672 16.194 840 HG22 VAL 93 1HG2 VAL 93 -10.607 9.178 17.234 841 HG23 VAL 93 2HG2 VAL 93 -10.615 7.570 16.511 842 H ARG 94 H ARG 94 -6.232 7.624 18.140 843 HA ARG 94 HA ARG 94 -5.549 6.932 20.922 844 HB2 ARG 94 1HB ARG 94 -5.013 5.477 18.333 845 HB3 ARG 94 2HB ARG 94 -4.184 5.078 19.831 846 HG2 ARG 94 1HG ARG 94 -6.311 4.543 20.886 847 HG3 ARG 94 2HG ARG 94 -7.165 4.984 19.405 848 HD2 ARG 94 1HD ARG 94 -5.915 3.213 18.208 849 HD3 ARG 94 2HD ARG 94 -5.176 2.740 19.737 850 HE ARG 94 HE ARG 94 -7.866 2.646 20.212 851 HH11 ARG 94 1HH1 ARG 94 -5.723 1.146 17.893 852 HH12 ARG 94 2HH1 ARG 94 -6.694 -0.280 17.732 853 HH21 ARG 94 1HH2 ARG 94 -9.139 0.771 19.998 854 HH22 ARG 94 2HH2 ARG 94 -8.632 -0.491 18.927 855 H LYS 95 H LYS 95 -3.768 7.800 21.747 856 HA LYS 95 HA LYS 95 -1.632 8.678 19.928 857 HB2 LYS 95 1HB LYS 95 -2.921 10.262 22.144 858 HB3 LYS 95 2HB LYS 95 -1.316 10.644 21.539 859 HG2 LYS 95 1HG LYS 95 -2.238 10.996 19.304 860 HG3 LYS 95 2HG LYS 95 -3.850 10.611 19.911 861 HD2 LYS 95 1HD LYS 95 -3.725 12.519 21.441 862 HD3 LYS 95 2HD LYS 95 -2.113 12.901 20.836 863 HE2 LYS 95 1HE LYS 95 -4.532 12.768 19.054 864 HE3 LYS 95 2HE LYS 95 -4.037 14.246 19.875 865 HZ1 LYS 95 3HZ LYS 95 -3.171 14.155 17.624 866 HZ2 LYS 95 1HZ LYS 95 -2.379 12.697 17.957 867 HZ3 LYS 95 2HZ LYS 95 -1.904 14.116 18.745 868 H ARG 96 H ARG 96 0.054 7.446 20.386 869 HA ARG 96 HA ARG 96 1.666 6.285 21.480 870 HB2 ARG 96 1HB ARG 96 1.120 8.552 23.363 871 HB3 ARG 96 2HB ARG 96 2.288 7.309 23.792 872 HG2 ARG 96 1HG ARG 96 3.556 7.801 21.761 873 HG3 ARG 96 2HG ARG 96 2.383 9.048 21.334 874 HD2 ARG 96 1HD ARG 96 2.932 10.262 23.387 875 HD3 ARG 96 2HD ARG 96 4.104 9.015 23.811 876 HE ARG 96 HE ARG 96 4.740 9.999 21.270 877 HH11 ARG 96 1HH1 ARG 96 4.706 11.088 24.591 878 HH12 ARG 96 2HH1 ARG 96 5.996 12.220 24.362 879 HH21 ARG 96 1HH2 ARG 96 6.434 11.488 20.972 880 HH22 ARG 96 2HH2 ARG 96 6.974 12.448 22.308 881 H THR 97 H THR 97 -1.149 5.449 21.863 882 HA THR 97 HA THR 97 -1.289 4.396 24.555 883 HB THR 97 HB THR 97 -3.356 3.212 23.648 884 HG1 THR 97 HG1 THR 97 -2.665 4.816 21.400 885 HG21 THR 97 3HG2 THR 97 -4.700 5.267 23.639 886 HG22 THR 97 1HG2 THR 97 -3.230 6.225 23.451 887 HG23 THR 97 2HG2 THR 97 -3.493 5.293 24.924 888 H LEU 98 H LEU 98 -0.496 3.220 21.350 889 HA LEU 98 HA LEU 98 -0.302 0.470 22.256 890 HB2 LEU 98 1HB LEU 98 -1.238 1.223 19.980 891 HB3 LEU 98 2HB LEU 98 0.435 1.476 19.522 892 HG LEU 98 HG LEU 98 0.898 -0.918 19.956 893 HD11 LEU 98 1HD1 LEU 98 -1.301 -2.338 20.004 894 HD12 LEU 98 2HD1 LEU 98 -1.976 -0.894 20.758 895 HD13 LEU 98 3HD1 LEU 98 -0.606 -1.719 21.502 896 HD21 LEU 98 3HD2 LEU 98 0.515 -0.458 17.714 897 HD22 LEU 98 1HD2 LEU 98 -1.191 -0.097 17.978 898 HD23 LEU 98 2HD2 LEU 98 -0.622 -1.762 18.055 899 H ARG 99 H ARG 99 1.707 3.131 21.307 900 HA ARG 99 HA ARG 99 4.201 1.832 21.226 901 HB2 ARG 99 1HB ARG 99 3.412 4.725 21.588 902 HB3 ARG 99 2HB ARG 99 5.090 4.202 21.546 903 HG2 ARG 99 1HG ARG 99 4.859 3.416 19.298 904 HG3 ARG 99 2HG ARG 99 3.118 3.705 19.329 905 HD2 ARG 99 1HD ARG 99 3.521 6.104 19.585 906 HD3 ARG 99 2HD ARG 99 5.260 5.816 19.564 907 HE ARG 99 HE ARG 99 4.155 4.722 17.237 908 HH11 ARG 99 1HH1 ARG 99 4.694 7.859 18.683 909 HH12 ARG 99 2HH1 ARG 99 4.810 8.677 17.162 910 HH21 ARG 99 1HH2 ARG 99 4.309 5.801 15.240 911 HH22 ARG 99 2HH2 ARG 99 4.591 7.509 15.209 912 H ARG 100 H ARG 100 2.181 3.209 23.697 913 HA ARG 100 HA ARG 100 4.133 3.209 25.793 914 HB2 ARG 100 1HB ARG 100 1.201 3.553 25.576 915 HB3 ARG 100 2HB ARG 100 1.748 2.851 27.093 916 HG2 ARG 100 1HG ARG 100 3.228 4.761 27.447 917 HG3 ARG 100 2HG ARG 100 2.682 5.465 25.924 918 HD2 ARG 100 1HD ARG 100 0.397 5.572 26.796 919 HD3 ARG 100 2HD ARG 100 0.945 4.864 28.317 920 HE ARG 100 HE ARG 100 2.466 7.159 27.811 921 HH11 ARG 100 1HH1 ARG 100 -0.829 6.295 28.597 922 HH12 ARG 100 2HH1 ARG 100 -1.157 7.790 29.410 923 HH21 ARG 100 1HH2 ARG 100 2.033 9.120 28.878 924 HH22 ARG 100 2HH2 ARG 100 0.467 9.393 29.568 925 H LEU 101 H LEU 101 2.365 0.951 24.070 926 HA LEU 101 HA LEU 101 2.999 -1.230 25.911 927 HB2 LEU 101 1HB LEU 101 0.969 -1.142 23.673 928 HB3 LEU 101 2HB LEU 101 1.288 -2.527 24.696 929 HG LEU 101 HG LEU 101 0.423 0.046 25.956 930 HD11 LEU 101 1HD1 LEU 101 -1.348 -1.915 24.518 931 HD12 LEU 101 2HD1 LEU 101 -1.223 -0.174 24.267 932 HD13 LEU 101 3HD1 LEU 101 -1.934 -0.801 25.753 933 HD21 LEU 101 3HD2 LEU 101 -0.291 -1.303 27.714 934 HD22 LEU 101 1HD2 LEU 101 1.198 -2.084 27.183 935 HD23 LEU 101 2HD2 LEU 101 -0.365 -2.748 26.704 936 H LEU 102 H LEU 102 3.467 0.136 22.702 937 HA LEU 102 HA LEU 102 4.732 -2.307 21.725 938 HB2 LEU 102 1HB LEU 102 3.332 -0.402 20.438 939 HB3 LEU 102 2HB LEU 102 4.958 0.190 20.162 940 HG LEU 102 HG LEU 102 4.260 -2.657 19.523 941 HD11 LEU 102 1HD1 LEU 102 3.894 -0.299 17.682 942 HD12 LEU 102 2HD1 LEU 102 2.591 -1.237 18.411 943 HD13 LEU 102 3HD1 LEU 102 3.692 -2.000 17.263 944 HD21 LEU 102 3HD2 LEU 102 6.069 -2.389 17.899 945 HD22 LEU 102 1HD2 LEU 102 6.616 -2.020 19.535 946 HD23 LEU 102 2HD2 LEU 102 6.277 -0.711 18.404 947 H GLN 103 H GLN 103 5.788 1.098 22.001 948 HA GLN 103 HA GLN 103 8.540 0.467 21.671 949 HB2 GLN 103 1HB GLN 103 7.057 2.927 22.548 950 HB3 GLN 103 2HB GLN 103 8.812 2.864 22.608 951 HG2 GLN 103 1HG GLN 103 8.769 2.257 20.172 952 HG3 GLN 103 2HG GLN 103 7.045 2.624 20.191 953 HE21 GLN 103 2HE2 GLN 103 6.372 4.753 20.453 954 HE22 GLN 103 1HE2 GLN 103 7.443 6.091 20.229 955 H GLU 104 H GLU 104 6.432 0.457 24.401 956 HA GLU 104 HA GLU 104 8.562 0.676 26.355 957 HB2 GLU 104 1HB GLU 104 5.601 0.195 26.550 958 HB3 GLU 104 2HB GLU 104 6.650 0.038 27.953 959 HG2 GLU 104 1HG GLU 104 6.662 2.535 26.304 960 HG3 GLU 104 2HG GLU 104 5.435 2.269 27.542 961 H ARG 105 H ARG 105 7.062 -1.825 24.557 962 HA ARG 105 HA ARG 105 7.799 -3.928 26.420 963 HB2 ARG 105 1HB ARG 105 5.715 -3.775 24.792 964 HB3 ARG 105 2HB ARG 105 6.841 -4.492 23.648 965 HG2 ARG 105 1HG ARG 105 6.612 -5.774 26.312 966 HG3 ARG 105 2HG ARG 105 5.255 -5.951 25.198 967 HD2 ARG 105 1HD ARG 105 6.766 -6.832 23.493 968 HD3 ARG 105 2HD ARG 105 8.130 -6.640 24.594 969 HE ARG 105 HE ARG 105 6.200 -8.231 25.847 970 HH11 ARG 105 1HH1 ARG 105 8.409 -8.398 23.144 971 HH12 ARG 105 2HH1 ARG 105 8.581 -10.119 23.234 972 HH21 ARG 105 1HH2 ARG 105 6.427 -10.491 25.961 973 HH22 ARG 105 2HH2 ARG 105 7.456 -11.306 24.831 974 H GLU 106 H GLU 106 9.304 -2.204 23.933 975 HA GLU 106 HA GLU 106 11.226 -4.390 23.479 976 HB2 GLU 106 1HB GLU 106 10.253 -2.205 21.668 977 HB3 GLU 106 2HB GLU 106 11.812 -2.966 21.389 978 HG2 GLU 106 1HG GLU 106 10.424 -4.193 20.029 979 HG3 GLU 106 2HG GLU 106 10.467 -5.180 21.489 980 H LEU 107 H LEU 107 10.905 -0.907 24.069 981 HA LEU 107 HA LEU 107 13.784 -0.622 24.298 982 HB2 LEU 107 1HB LEU 107 11.485 1.294 24.335 983 HB3 LEU 107 2HB LEU 107 13.049 1.802 24.937 984 HG LEU 107 HG LEU 107 12.794 2.553 22.667 985 HD11 LEU 107 1HD1 LEU 107 14.645 0.227 22.373 986 HD12 LEU 107 2HD1 LEU 107 15.006 1.515 23.522 987 HD13 LEU 107 3HD1 LEU 107 14.827 1.887 21.807 988 HD21 LEU 107 3HD2 LEU 107 11.122 0.962 21.906 989 HD22 LEU 107 1HD2 LEU 107 12.319 -0.333 21.931 990 HD23 LEU 107 2HD2 LEU 107 12.492 1.005 20.796 991 H VAL 108 H VAL 108 11.780 -1.982 26.248 992 HA VAL 108 HA VAL 108 13.145 -1.028 28.663 993 HB VAL 108 HB VAL 108 10.238 -1.768 28.851 994 HG11 VAL 108 1HG1 VAL 108 11.530 -1.653 30.910 995 HG12 VAL 108 2HG1 VAL 108 10.336 -0.357 30.855 996 HG13 VAL 108 3HG1 VAL 108 12.032 -0.008 30.521 997 HG21 VAL 108 3HG2 VAL 108 11.119 1.087 28.548 998 HG22 VAL 108 1HG2 VAL 108 9.487 0.418 28.477 999 HG23 VAL 108 2HG2 VAL 108 10.624 0.115 27.160 1000 H GLU 109 H GLU 109 13.780 -3.275 27.118 1001 HA GLU 109 HA GLU 109 12.742 -5.561 28.631 1002 HB2 GLU 109 1HB GLU 109 14.249 -5.340 26.033 1003 HB3 GLU 109 2HB GLU 109 14.050 -6.876 26.865 1004 HG2 GLU 109 1HG GLU 109 11.624 -6.646 26.713 1005 HG3 GLU 109 2HG GLU 109 11.823 -5.107 25.881 1006 HA PRO 110 HA PRO 110 16.463 -5.832 31.032 1007 HB2 PRO 110 1HB PRO 110 16.376 -8.466 31.722 1008 HB3 PRO 110 2HB PRO 110 15.305 -7.247 32.436 1009 HG2 PRO 110 1HG PRO 110 14.742 -9.217 30.277 1010 HG3 PRO 110 2HG PRO 110 13.719 -8.703 31.634 1011 HD2 PRO 110 1HD PRO 110 13.394 -7.759 29.112 1012 HD3 PRO 110 2HD PRO 110 13.007 -6.809 30.560 1013 H LEU 111 H LEU 111 18.568 -6.841 31.094 1014 HA LEU 111 HA LEU 111 19.305 -8.500 28.830 1015 HB2 LEU 111 1HB LEU 111 20.544 -5.812 29.423 1016 HB3 LEU 111 2HB LEU 111 21.298 -7.014 28.395 1017 HG LEU 111 HG LEU 111 18.870 -6.820 27.208 1018 HD11 LEU 111 1HD1 LEU 111 19.511 -4.065 28.250 1019 HD12 LEU 111 2HD1 LEU 111 18.125 -5.051 28.715 1020 HD13 LEU 111 3HD1 LEU 111 18.273 -4.461 27.059 1021 HD21 LEU 111 3HD2 LEU 111 19.984 -5.394 25.551 1022 HD22 LEU 111 1HD2 LEU 111 21.023 -6.714 26.086 1023 HD23 LEU 111 2HD2 LEU 111 21.283 -5.083 26.703 1024 H THR 112 H THR 112 19.606 -10.107 30.366 1025 HA THR 112 HA THR 112 21.881 -9.727 32.198 1026 HB THR 112 HB THR 112 20.964 -11.813 33.344 1027 HG1 THR 112 HG1 THR 112 18.468 -11.169 32.245 1028 HG21 THR 112 3HG2 THR 112 20.716 -9.578 34.303 1029 HG22 THR 112 1HG2 THR 112 19.276 -10.552 34.602 1030 HG23 THR 112 2HG2 THR 112 19.260 -9.317 33.342 1031 HA PRO 113 HA PRO 113 24.240 -12.626 29.812 1032 HB2 PRO 113 1HB PRO 113 25.911 -13.592 31.742 1033 HB3 PRO 113 2HB PRO 113 26.082 -11.975 31.034 1034 HG2 PRO 113 1HG PRO 113 24.867 -12.776 33.631 1035 HG3 PRO 113 2HG PRO 113 25.905 -11.387 33.248 1036 HD2 PRO 113 1HD PRO 113 23.217 -11.173 33.508 1037 HD3 PRO 113 2HD PRO 113 24.167 -10.140 32.423 1038 H SER 114 H SER 114 23.506 -14.489 29.077 1039 HA SER 114 HA SER 114 22.831 -16.624 30.992 1040 HB2 SER 114 1HB SER 114 21.393 -15.975 28.405 1041 HB3 SER 114 2HB SER 114 21.048 -17.357 29.445 1042 HG SER 114 HG SER 114 20.769 -15.615 31.129 1043 H GLY 115 H GLY 115 24.730 -15.637 28.411 1044 HA2 GLY 115 1HA GLY 115 25.592 -18.410 27.940 1045 HA3 GLY 115 2HA GLY 115 25.223 -17.386 26.561 1046 H GLU 116 H GLU 116 27.036 -16.980 29.606 1047 HA GLU 116 HA GLU 116 29.190 -15.705 28.070 1048 HB2 GLU 116 1HB GLU 116 28.435 -15.615 30.987 1049 HB3 GLU 116 2HB GLU 116 29.984 -15.022 30.406 1050 HG2 GLU 116 1HG GLU 116 27.421 -14.027 29.226 1051 HG3 GLU 116 2HG GLU 116 28.052 -13.356 30.730 1052 H LYS 117 H LYS 117 31.178 -16.569 27.930 1053 HA LYS 117 HA LYS 117 31.569 -19.260 28.906 1054 HB2 LYS 117 1HB LYS 117 33.153 -17.464 27.081 1055 HB3 LYS 117 2HB LYS 117 33.778 -19.011 27.633 1056 HG2 LYS 117 1HG LYS 117 31.869 -20.148 26.617 1057 HG3 LYS 117 2HG LYS 117 31.239 -18.594 26.065 1058 HD2 LYS 117 1HD LYS 117 33.256 -18.259 24.718 1059 HD3 LYS 117 2HD LYS 117 33.885 -19.811 25.272 1060 HE2 LYS 117 1HE LYS 117 31.978 -20.948 24.243 1061 HE3 LYS 117 2HE LYS 117 31.350 -19.396 23.691 1062 HZ1 LYS 117 3HZ LYS 117 33.341 -19.110 22.349 1063 HZ2 LYS 117 1HZ LYS 117 32.540 -20.542 21.932 1064 HZ3 LYS 117 2HZ LYS 117 33.941 -20.600 22.878 1065 H LEU 118 H LEU 118 33.038 -16.072 29.366 1066 HA LEU 118 HA LEU 118 34.881 -17.114 31.350 1067 HB2 LEU 118 1HB LEU 118 34.477 -14.363 30.192 1068 HB3 LEU 118 2HB LEU 118 35.629 -14.706 31.469 1069 HG LEU 118 HG LEU 118 36.487 -16.511 29.714 1070 HD11 LEU 118 1HD1 LEU 118 35.276 -14.357 27.984 1071 HD12 LEU 118 2HD1 LEU 118 34.764 -16.044 28.056 1072 HD13 LEU 118 3HD1 LEU 118 36.364 -15.633 27.436 1073 HD21 LEU 118 3HD2 LEU 118 37.114 -13.562 29.599 1074 HD22 LEU 118 1HD2 LEU 118 38.128 -14.852 28.953 1075 HD23 LEU 118 2HD2 LEU 118 37.838 -14.744 30.690 1076 H TRP 119 H TRP 119 31.735 -16.044 31.312 1077 HA TRP 119 HA TRP 119 30.204 -15.482 32.889 1078 HB2 TRP 119 1HB TRP 119 32.375 -16.490 34.733 1079 HB3 TRP 119 2HB TRP 119 30.783 -15.994 35.300 1080 HD1 TRP 119 HD1 TRP 119 32.552 -18.786 33.398 1081 HE1 TRP 119 HE1 TRP 119 30.953 -20.792 33.187 1082 HE3 TRP 119 HE3 TRP 119 28.275 -16.618 35.186 1083 HZ2 TRP 119 HZ2 TRP 119 28.243 -21.380 33.707 1084 HZ3 TRP 119 HZ3 TRP 119 26.225 -17.973 35.297 1085 HH2 TRP 119 HH2 TRP 119 26.212 -20.303 34.572 1086 H SER 120 H SER 120 29.576 -13.496 33.321 1087 HA SER 120 HA SER 120 31.499 -11.622 34.532 1088 HB2 SER 120 1HB SER 120 31.113 -11.182 32.087 1089 HB3 SER 120 2HB SER 120 29.419 -10.873 32.467 1090 HG SER 120 HG SER 120 31.540 -9.491 33.731 Start of MODEL 7 1 H1 LYS 1 1H LYS 1 -0.448 0.263 -34.048 2 H2 LYS 1 2H LYS 1 -0.597 0.469 -32.375 3 H3 LYS 1 3H LYS 1 -1.828 -0.298 -33.245 4 HA LYS 1 HA LYS 1 -0.380 -2.127 -33.783 5 HB2 LYS 1 1HB LYS 1 1.611 -0.488 -32.218 6 HB3 LYS 1 2HB LYS 1 1.823 -2.212 -32.489 7 HG2 LYS 1 1HG LYS 1 1.813 -1.835 -34.905 8 HG3 LYS 1 2HG LYS 1 1.604 -0.104 -34.631 9 HD2 LYS 1 1HD LYS 1 3.742 -0.039 -33.438 10 HD3 LYS 1 2HD LYS 1 3.950 -1.769 -33.716 11 HE2 LYS 1 1HE LYS 1 5.240 -0.702 -35.373 12 HE3 LYS 1 2HE LYS 1 3.778 -1.249 -36.190 13 HZ1 LYS 1 3HZ LYS 1 4.359 1.003 -36.833 14 HZ2 LYS 1 1HZ LYS 1 4.288 1.513 -35.221 15 HZ3 LYS 1 2HZ LYS 1 2.884 0.992 -36.005 16 H ILE 2 H ILE 2 -0.602 -0.381 -30.713 17 HA ILE 2 HA ILE 2 -1.736 -2.796 -29.496 18 HB ILE 2 HB ILE 2 -0.538 -2.088 -27.327 19 HG12 ILE 2 1HG1 ILE 2 1.872 -1.225 -28.181 20 HG13 ILE 2 2HG1 ILE 2 0.841 -0.408 -29.350 21 HG21 ILE 2 1HG2 ILE 2 1.008 -3.329 -29.596 22 HG22 ILE 2 2HG2 ILE 2 -0.088 -4.162 -28.493 23 HG23 ILE 2 3HG2 ILE 2 1.412 -3.465 -27.884 24 HD11 ILE 2 3HD1 ILE 2 -0.399 0.631 -27.526 25 HD12 ILE 2 1HD1 ILE 2 1.320 1.014 -27.445 26 HD13 ILE 2 2HD1 ILE 2 0.633 -0.191 -26.356 27 HA PRO 3 HA PRO 3 -4.872 -0.020 -28.062 28 HB2 PRO 3 1HB PRO 3 -5.759 -1.381 -25.866 29 HB3 PRO 3 2HB PRO 3 -6.137 -1.869 -27.529 30 HG2 PRO 3 1HG PRO 3 -4.090 -2.961 -25.666 31 HG3 PRO 3 2HG PRO 3 -5.163 -3.813 -26.794 32 HD2 PRO 3 1HD PRO 3 -2.556 -3.327 -27.346 33 HD3 PRO 3 2HD PRO 3 -3.807 -3.411 -28.601 34 H SER 4 H SER 4 -5.124 1.680 -26.689 35 HA SER 4 HA SER 4 -2.951 2.288 -24.898 36 HB2 SER 4 1HB SER 4 -5.454 3.854 -25.567 37 HB3 SER 4 2HB SER 4 -4.092 4.466 -24.631 38 HG SER 4 HG SER 4 -3.729 3.418 -27.224 39 H ILE 5 H ILE 5 -5.823 0.624 -24.554 40 HA ILE 5 HA ILE 5 -6.474 1.494 -21.873 41 HB ILE 5 HB ILE 5 -7.549 -0.977 -23.230 42 HG12 ILE 5 1HG1 ILE 5 -9.495 0.878 -23.634 43 HG13 ILE 5 2HG1 ILE 5 -8.057 1.874 -23.833 44 HG21 ILE 5 1HG2 ILE 5 -9.514 -0.545 -21.824 45 HG22 ILE 5 2HG2 ILE 5 -8.701 0.856 -21.128 46 HG23 ILE 5 3HG2 ILE 5 -8.052 -0.763 -20.861 47 HD11 ILE 5 3HD1 ILE 5 -8.874 0.972 -25.954 48 HD12 ILE 5 1HD1 ILE 5 -8.632 -0.664 -25.342 49 HD13 ILE 5 2HD1 ILE 5 -7.249 0.403 -25.576 50 H ALA 6 H ALA 6 -4.705 -1.119 -23.396 51 HA ALA 6 HA ALA 6 -4.413 -2.626 -20.944 52 HB1 ALA 6 3HB ALA 6 -4.585 -3.736 -23.147 53 HB2 ALA 6 1HB ALA 6 -3.131 -4.186 -22.257 54 HB3 ALA 6 2HB ALA 6 -3.029 -3.035 -23.589 55 H THR 7 H THR 7 -2.634 -0.224 -22.716 56 HA THR 7 HA THR 7 -0.053 -0.672 -21.676 57 HB THR 7 HB THR 7 -0.992 2.092 -22.348 58 HG1 THR 7 HG1 THR 7 -0.622 1.451 -24.601 59 HG21 THR 7 3HG2 THR 7 1.339 1.809 -21.729 60 HG22 THR 7 1HG2 THR 7 1.226 2.186 -23.449 61 HG23 THR 7 2HG2 THR 7 1.528 0.529 -22.926 62 H GLY 8 H GLY 8 -2.832 1.068 -20.411 63 HA2 GLY 8 1HA GLY 8 -1.351 2.296 -18.249 64 HA3 GLY 8 2HA GLY 8 -3.090 2.345 -18.484 65 H LEU 9 H LEU 9 -3.603 -0.398 -18.622 66 HA LEU 9 HA LEU 9 -3.873 -1.060 -15.907 67 HB2 LEU 9 1HB LEU 9 -4.107 -2.772 -18.384 68 HB3 LEU 9 2HB LEU 9 -4.542 -3.320 -16.776 69 HG LEU 9 HG LEU 9 -5.825 -0.865 -17.933 70 HD11 LEU 9 1HD1 LEU 9 -6.504 -3.735 -18.501 71 HD12 LEU 9 2HD1 LEU 9 -6.260 -2.417 -19.645 72 HD13 LEU 9 3HD1 LEU 9 -7.694 -2.439 -18.620 73 HD21 LEU 9 3HD2 LEU 9 -7.667 -1.560 -16.452 74 HD22 LEU 9 1HD2 LEU 9 -6.165 -1.289 -15.569 75 HD23 LEU 9 2HD2 LEU 9 -6.699 -2.933 -15.917 76 H VAL 10 H VAL 10 -1.577 -2.198 -18.369 77 HA VAL 10 HA VAL 10 -0.342 -4.170 -16.811 78 HB VAL 10 HB VAL 10 1.596 -3.967 -18.360 79 HG11 VAL 10 1HG1 VAL 10 -1.201 -4.180 -19.436 80 HG12 VAL 10 2HG1 VAL 10 -0.067 -5.473 -19.032 81 HG13 VAL 10 3HG1 VAL 10 0.215 -4.465 -20.453 82 HG21 VAL 10 3HG2 VAL 10 1.542 -1.565 -18.772 83 HG22 VAL 10 1HG2 VAL 10 -0.018 -1.722 -19.579 84 HG23 VAL 10 2HG2 VAL 10 1.421 -2.453 -20.291 85 H GLY 11 H GLY 11 0.328 -0.739 -17.110 86 HA2 GLY 11 1HA GLY 11 2.732 -0.731 -15.588 87 HA3 GLY 11 2HA GLY 11 1.735 0.671 -15.944 88 H ALA 12 H ALA 12 -0.628 0.080 -14.713 89 HA ALA 12 HA ALA 12 0.043 0.602 -11.984 90 HB1 ALA 12 3HB ALA 12 -1.906 1.579 -13.286 91 HB2 ALA 12 1HB ALA 12 -2.240 1.043 -11.640 92 HB3 ALA 12 2HB ALA 12 -2.724 0.041 -13.009 93 H LEU 13 H LEU 13 -1.411 -2.169 -13.650 94 HA LEU 13 HA LEU 13 -1.978 -3.629 -11.292 95 HB2 LEU 13 1HB LEU 13 -1.799 -4.289 -14.196 96 HB3 LEU 13 2HB LEU 13 -1.833 -5.606 -13.038 97 HG LEU 13 HG LEU 13 -3.976 -4.666 -12.133 98 HD11 LEU 13 1HD1 LEU 13 -3.710 -2.359 -12.918 99 HD12 LEU 13 2HD1 LEU 13 -5.220 -3.069 -13.489 100 HD13 LEU 13 3HD1 LEU 13 -3.849 -2.912 -14.586 101 HD21 LEU 13 3HD2 LEU 13 -3.957 -6.538 -13.690 102 HD22 LEU 13 1HD2 LEU 13 -3.955 -5.418 -15.052 103 HD23 LEU 13 2HD2 LEU 13 -5.350 -5.495 -13.975 104 H LEU 14 H LEU 14 0.839 -3.543 -13.455 105 HA LEU 14 HA LEU 14 2.230 -5.630 -12.112 106 HB2 LEU 14 1HB LEU 14 2.814 -3.710 -14.254 107 HB3 LEU 14 2HB LEU 14 4.207 -4.168 -13.295 108 HG LEU 14 HG LEU 14 3.480 -6.601 -13.765 109 HD11 LEU 14 1HD1 LEU 14 1.252 -5.721 -14.733 110 HD12 LEU 14 2HD1 LEU 14 2.074 -7.050 -15.552 111 HD13 LEU 14 3HD1 LEU 14 2.195 -5.411 -16.191 112 HD21 LEU 14 3HD2 LEU 14 5.487 -5.574 -14.684 113 HD22 LEU 14 1HD2 LEU 14 4.536 -4.851 -15.982 114 HD23 LEU 14 2HD2 LEU 14 4.703 -6.603 -15.883 115 H LEU 15 H LEU 15 2.206 -2.115 -11.828 116 HA LEU 15 HA LEU 15 4.346 -1.976 -9.948 117 HB2 LEU 15 1HB LEU 15 2.505 -0.135 -11.212 118 HB3 LEU 15 2HB LEU 15 2.684 0.238 -9.508 119 HG LEU 15 HG LEU 15 5.291 -0.084 -10.256 120 HD11 LEU 15 1HD1 LEU 15 3.862 1.212 -12.571 121 HD12 LEU 15 2HD1 LEU 15 4.693 -0.343 -12.605 122 HD13 LEU 15 3HD1 LEU 15 5.609 1.140 -12.338 123 HD21 LEU 15 3HD2 LEU 15 5.419 2.349 -10.182 124 HD22 LEU 15 1HD2 LEU 15 4.369 1.729 -8.907 125 HD23 LEU 15 2HD2 LEU 15 3.668 2.454 -10.353 126 H LEU 16 H LEU 16 0.834 -2.183 -9.671 127 HA LEU 16 HA LEU 16 0.725 -1.914 -6.843 128 HB2 LEU 16 1HB LEU 16 -1.144 -1.729 -8.700 129 HB3 LEU 16 2HB LEU 16 -1.345 -3.437 -8.368 130 HG LEU 16 HG LEU 16 -1.491 -2.587 -5.862 131 HD11 LEU 16 1HD1 LEU 16 -1.029 -0.248 -6.407 132 HD12 LEU 16 2HD1 LEU 16 -2.632 -0.443 -5.703 133 HD13 LEU 16 3HD1 LEU 16 -2.456 -0.207 -7.440 134 HD21 LEU 16 3HD2 LEU 16 -3.738 -2.381 -7.863 135 HD22 LEU 16 1HD2 LEU 16 -3.930 -2.505 -6.114 136 HD23 LEU 16 2HD2 LEU 16 -3.219 -3.841 -7.020 137 H LEU 17 H LEU 17 1.131 -4.614 -9.045 138 HA LEU 17 HA LEU 17 0.705 -6.687 -7.154 139 HB2 LEU 17 1HB LEU 17 0.753 -6.748 -9.759 140 HB3 LEU 17 2HB LEU 17 2.478 -6.987 -9.552 141 HG LEU 17 HG LEU 17 1.664 -8.929 -7.938 142 HD11 LEU 17 1HD1 LEU 17 -0.710 -8.429 -8.156 143 HD12 LEU 17 2HD1 LEU 17 -0.338 -10.021 -8.817 144 HD13 LEU 17 3HD1 LEU 17 -0.608 -8.659 -9.903 145 HD21 LEU 17 3HD2 LEU 17 1.699 -9.111 -10.948 146 HD22 LEU 17 1HD2 LEU 17 1.850 -10.471 -9.836 147 HD23 LEU 17 2HD2 LEU 17 3.096 -9.223 -9.878 148 H VAL 18 H VAL 18 3.627 -5.038 -8.339 149 HA VAL 18 HA VAL 18 5.464 -6.616 -6.843 150 HB VAL 18 HB VAL 18 5.855 -3.820 -7.940 151 HG11 VAL 18 1HG1 VAL 18 8.248 -4.348 -7.864 152 HG12 VAL 18 2HG1 VAL 18 7.881 -5.893 -7.098 153 HG13 VAL 18 3HG1 VAL 18 7.525 -4.383 -6.257 154 HG21 VAL 18 3HG2 VAL 18 6.930 -4.931 -9.844 155 HG22 VAL 18 1HG2 VAL 18 5.232 -5.387 -9.695 156 HG23 VAL 18 2HG2 VAL 18 6.494 -6.502 -9.167 157 H VAL 19 H VAL 19 3.935 -3.459 -6.241 158 HA VAL 19 HA VAL 19 5.280 -2.924 -3.804 159 HB VAL 19 HB VAL 19 2.620 -1.881 -4.807 160 HG11 VAL 19 1HG1 VAL 19 2.640 -1.527 -2.457 161 HG12 VAL 19 2HG1 VAL 19 3.076 0.008 -3.206 162 HG13 VAL 19 3HG1 VAL 19 4.324 -1.006 -2.482 163 HG21 VAL 19 3HG2 VAL 19 3.909 0.116 -5.423 164 HG22 VAL 19 1HG2 VAL 19 4.478 -1.321 -6.272 165 HG23 VAL 19 2HG2 VAL 19 5.389 -0.687 -4.901 166 H ALA 20 H ALA 20 2.154 -4.450 -4.527 167 HA ALA 20 HA ALA 20 1.351 -4.807 -1.828 168 HB1 ALA 20 3HB ALA 20 -0.236 -4.856 -3.694 169 HB2 ALA 20 1HB ALA 20 -0.336 -6.321 -2.718 170 HB3 ALA 20 2HB ALA 20 0.494 -6.353 -4.274 171 H LEU 21 H LEU 21 3.166 -6.805 -4.104 172 HA LEU 21 HA LEU 21 3.252 -9.140 -2.484 173 HB2 LEU 21 1HB LEU 21 3.770 -8.776 -5.034 174 HB3 LEU 21 2HB LEU 21 5.401 -8.478 -4.460 175 HG LEU 21 HG LEU 21 4.989 -10.798 -3.219 176 HD11 LEU 21 1HD1 LEU 21 2.694 -11.052 -3.991 177 HD12 LEU 21 2HD1 LEU 21 3.723 -12.327 -4.643 178 HD13 LEU 21 3HD1 LEU 21 3.238 -10.973 -5.666 179 HD21 LEU 21 3HD2 LEU 21 6.096 -11.895 -5.113 180 HD22 LEU 21 1HD2 LEU 21 6.812 -10.324 -4.754 181 HD23 LEU 21 2HD2 LEU 21 5.722 -10.502 -6.129 182 H GLY 22 H GLY 22 5.301 -6.293 -2.805 183 HA2 GLY 22 1HA GLY 22 7.473 -7.233 -1.234 184 HA3 GLY 22 2HA GLY 22 7.117 -5.552 -1.604 185 H ILE 23 H ILE 23 4.782 -5.024 -0.420 186 HA ILE 23 HA ILE 23 5.451 -4.819 2.324 187 HB ILE 23 HB ILE 23 2.685 -4.448 1.158 188 HG12 ILE 23 1HG1 ILE 23 4.626 -2.191 1.532 189 HG13 ILE 23 2HG1 ILE 23 4.713 -3.169 0.071 190 HG21 ILE 23 1HG2 ILE 23 4.024 -3.263 3.592 191 HG22 ILE 23 2HG2 ILE 23 2.760 -4.494 3.592 192 HG23 ILE 23 3HG2 ILE 23 2.404 -2.865 3.017 193 HD11 ILE 23 3HD1 ILE 23 2.316 -1.620 1.030 194 HD12 ILE 23 1HD1 ILE 23 2.383 -2.611 -0.428 195 HD13 ILE 23 2HD1 ILE 23 3.394 -1.171 -0.293 196 H GLY 24 H GLY 24 3.381 -7.022 0.509 197 HA2 GLY 24 1HA GLY 24 2.116 -8.272 2.707 198 HA3 GLY 24 2HA GLY 24 2.304 -8.964 1.102 199 H LEU 25 H LEU 25 5.036 -9.153 0.875 200 HA LEU 25 HA LEU 25 5.580 -11.466 2.470 201 HB2 LEU 25 1HB LEU 25 7.224 -9.925 0.470 202 HB3 LEU 25 2HB LEU 25 7.834 -11.340 1.305 203 HG LEU 25 HG LEU 25 5.277 -11.532 -0.242 204 HD11 LEU 25 1HD1 LEU 25 8.055 -11.685 -1.403 205 HD12 LEU 25 2HD1 LEU 25 6.817 -10.491 -1.791 206 HD13 LEU 25 3HD1 LEU 25 6.578 -12.185 -2.224 207 HD21 LEU 25 3HD2 LEU 25 6.021 -13.848 -0.523 208 HD22 LEU 25 1HD2 LEU 25 5.943 -13.400 1.181 209 HD23 LEU 25 2HD2 LEU 25 7.503 -13.481 0.361 210 H PHE 26 H PHE 26 6.326 -8.093 2.715 211 HA PHE 26 HA PHE 26 8.549 -8.380 4.509 212 HB2 PHE 26 1HB PHE 26 7.887 -6.374 2.952 213 HB3 PHE 26 2HB PHE 26 6.912 -5.876 4.329 214 HD1 PHE 26 HD2 PHE 26 7.949 -5.135 6.385 215 HD2 PHE 26 HD1 PHE 26 10.301 -6.339 3.050 216 HE1 PHE 26 HE2 PHE 26 9.928 -4.093 7.411 217 HE2 PHE 26 HE1 PHE 26 12.285 -5.300 4.069 218 HZ PHE 26 HZ PHE 26 12.100 -4.175 6.253 219 H ILE 27 H ILE 27 5.076 -7.816 4.862 220 HA ILE 27 HA ILE 27 5.261 -7.507 7.735 221 HB ILE 27 HB ILE 27 2.790 -7.794 6.017 222 HG12 ILE 27 1HG1 ILE 27 4.024 -5.813 5.338 223 HG13 ILE 27 2HG1 ILE 27 2.592 -5.328 6.234 224 HG21 ILE 27 1HG2 ILE 27 1.602 -6.794 7.920 225 HG22 ILE 27 2HG2 ILE 27 3.096 -6.824 8.857 226 HG23 ILE 27 3HG2 ILE 27 2.349 -8.337 8.339 227 HD11 ILE 27 3HD1 ILE 27 4.352 -3.924 6.937 228 HD12 ILE 27 1HD1 ILE 27 5.451 -5.287 7.156 229 HD13 ILE 27 2HD1 ILE 27 4.084 -5.073 8.248 230 H ARG 28 H ARG 28 4.419 -10.037 5.438 231 HA ARG 28 HA ARG 28 3.218 -11.843 7.243 232 HB2 ARG 28 1HB ARG 28 4.470 -12.079 4.543 233 HB3 ARG 28 2HB ARG 28 4.129 -13.550 5.445 234 HG2 ARG 28 1HG ARG 28 1.778 -12.911 5.609 235 HG3 ARG 28 2HG ARG 28 2.118 -11.430 4.711 236 HD2 ARG 28 1HD ARG 28 2.719 -14.160 3.606 237 HD3 ARG 28 2HD ARG 28 1.151 -13.384 3.398 238 HE ARG 28 HE ARG 28 3.140 -11.595 2.575 239 HH11 ARG 28 1HH1 ARG 28 1.750 -14.645 1.579 240 HH12 ARG 28 2HH1 ARG 28 2.096 -14.394 -0.099 241 HH21 ARG 28 1HH2 ARG 28 3.590 -11.270 0.369 242 HH22 ARG 28 2HH2 ARG 28 3.140 -12.479 -0.785 243 H ARG 29 H ARG 29 6.538 -11.049 6.630 244 HA ARG 29 HA ARG 29 7.632 -13.423 7.836 245 HB2 ARG 29 1HB ARG 29 8.656 -11.687 6.086 246 HB3 ARG 29 2HB ARG 29 9.261 -10.947 7.562 247 HG2 ARG 29 1HG ARG 29 10.370 -13.025 8.171 248 HG3 ARG 29 2HG ARG 29 9.729 -13.803 6.723 249 HD2 ARG 29 1HD ARG 29 11.927 -13.200 6.164 250 HD3 ARG 29 2HD ARG 29 10.911 -11.972 5.410 251 HE ARG 29 HE ARG 29 11.664 -11.054 7.943 252 HH11 ARG 29 1HH1 ARG 29 13.131 -11.761 4.850 253 HH12 ARG 29 2HH1 ARG 29 14.399 -10.597 5.046 254 HH21 ARG 29 1HH2 ARG 29 13.331 -9.526 8.198 255 HH22 ARG 29 2HH2 ARG 29 14.512 -9.329 6.946 256 H ARG 30 H ARG 30 6.401 -10.447 8.973 257 HA ARG 30 HA ARG 30 7.907 -10.439 11.453 258 HB2 ARG 30 1HB ARG 30 5.724 -8.687 10.342 259 HB3 ARG 30 2HB ARG 30 6.299 -8.521 11.995 260 HG2 ARG 30 1HG ARG 30 8.554 -8.071 11.169 261 HG3 ARG 30 2HG ARG 30 7.976 -8.240 9.509 262 HD2 ARG 30 1HD ARG 30 6.450 -6.357 9.854 263 HD3 ARG 30 2HD ARG 30 7.030 -6.189 11.510 264 HE ARG 30 HE ARG 30 9.229 -6.044 9.788 265 HH11 ARG 30 1HH1 ARG 30 6.380 -4.187 10.594 266 HH12 ARG 30 2HH1 ARG 30 7.105 -2.667 10.186 267 HH21 ARG 30 1HH2 ARG 30 10.178 -4.047 9.253 268 HH22 ARG 30 2HH2 ARG 30 9.260 -2.589 9.425 269 H HIS 31 H HIS 31 4.941 -11.726 10.273 270 HA HIS 31 HA HIS 31 3.510 -11.864 12.723 271 HB2 HIS 31 1HB HIS 31 3.245 -13.216 10.059 272 HB3 HIS 31 2HB HIS 31 2.260 -13.740 11.420 273 HD1 HIS 31 HD1 HIS 31 0.301 -12.271 12.085 274 HD2 HIS 31 HD2 HIS 31 2.693 -10.573 9.142 275 HE1 HIS 31 HE1 HIS 31 -0.976 -10.272 11.252 276 HE2 HIS 31 HE2 HIS 31 0.529 -9.209 9.535 277 H ILE 32 H ILE 32 6.172 -13.634 11.540 278 HA ILE 32 HA ILE 32 5.613 -16.069 13.000 279 HB ILE 32 HB ILE 32 8.306 -15.334 11.870 280 HG12 ILE 32 1HG1 ILE 32 6.395 -16.878 10.189 281 HG13 ILE 32 2HG1 ILE 32 6.139 -15.138 10.293 282 HG21 ILE 32 1HG2 ILE 32 8.193 -17.340 13.243 283 HG22 ILE 32 2HG2 ILE 32 8.493 -17.765 11.557 284 HG23 ILE 32 3HG2 ILE 32 6.882 -17.970 12.246 285 HD11 ILE 32 3HD1 ILE 32 7.479 -15.680 8.362 286 HD12 ILE 32 1HD1 ILE 32 8.649 -16.521 9.377 287 HD13 ILE 32 2HD1 ILE 32 8.444 -14.776 9.529 288 H VAL 33 H VAL 33 6.966 -13.024 13.708 289 HA VAL 33 HA VAL 33 8.513 -14.027 15.984 290 HB VAL 33 HB VAL 33 8.250 -11.124 15.217 291 HG11 VAL 33 1HG1 VAL 33 9.252 -11.598 17.383 292 HG12 VAL 33 2HG1 VAL 33 10.460 -10.955 16.271 293 HG13 VAL 33 3HG1 VAL 33 10.418 -12.682 16.624 294 HG21 VAL 33 3HG2 VAL 33 10.280 -11.358 13.858 295 HG22 VAL 33 1HG2 VAL 33 8.943 -12.300 13.200 296 HG23 VAL 33 2HG2 VAL 33 10.232 -13.106 14.094 297 H ARG 34 H ARG 34 5.844 -11.792 15.265 298 HA ARG 34 HA ARG 34 5.009 -11.998 18.086 299 HB2 ARG 34 1HB ARG 34 4.854 -9.678 16.172 300 HB3 ARG 34 2HB ARG 34 3.840 -9.762 17.605 301 HG2 ARG 34 1HG ARG 34 5.867 -9.902 19.000 302 HG3 ARG 34 2HG ARG 34 6.851 -9.731 17.543 303 HD2 ARG 34 1HD ARG 34 5.818 -7.552 17.109 304 HD3 ARG 34 2HD ARG 34 4.842 -7.725 18.566 305 HE ARG 34 HE ARG 34 7.443 -8.001 19.400 306 HH11 ARG 34 1HH1 ARG 34 5.608 -5.530 17.743 307 HH12 ARG 34 2HH1 ARG 34 6.561 -4.227 18.372 308 HH21 ARG 34 1HH2 ARG 34 8.693 -6.288 20.224 309 HH22 ARG 34 2HH2 ARG 34 8.312 -4.658 19.778 310 H LYS 35 H LYS 35 3.039 -12.789 18.476 311 HA LYS 35 HA LYS 35 1.096 -12.902 16.270 312 HB2 LYS 35 1HB LYS 35 1.944 -15.139 18.102 313 HB3 LYS 35 2HB LYS 35 0.410 -15.169 17.245 314 HG2 LYS 35 1HG LYS 35 1.600 -15.027 15.112 315 HG3 LYS 35 2HG LYS 35 3.138 -15.004 15.977 316 HD2 LYS 35 1HD LYS 35 3.067 -17.236 15.612 317 HD3 LYS 35 2HD LYS 35 2.023 -17.224 17.035 318 HE2 LYS 35 1HE LYS 35 0.890 -18.514 15.418 319 HE3 LYS 35 2HE LYS 35 0.077 -16.950 15.434 320 HZ1 LYS 35 3HZ LYS 35 2.116 -17.820 13.454 321 HZ2 LYS 35 1HZ LYS 35 1.337 -16.317 13.470 322 HZ3 LYS 35 2HZ LYS 35 0.449 -17.727 13.181 323 H ARG 36 H ARG 36 1.578 -13.169 19.781 324 HA ARG 36 HA ARG 36 -0.965 -11.786 20.175 325 HB2 ARG 36 1HB ARG 36 -0.153 -14.396 21.441 326 HB3 ARG 36 2HB ARG 36 -1.354 -13.344 22.177 327 HG2 ARG 36 1HG ARG 36 -2.738 -13.514 20.170 328 HG3 ARG 36 2HG ARG 36 -1.531 -14.569 19.430 329 HD2 ARG 36 1HD ARG 36 -1.857 -16.198 21.228 330 HD3 ARG 36 2HD ARG 36 -3.063 -15.144 21.965 331 HE ARG 36 HE ARG 36 -3.828 -15.651 19.321 332 HH11 ARG 36 1HH1 ARG 36 -3.493 -17.362 22.350 333 HH12 ARG 36 2HH1 ARG 36 -4.733 -18.515 21.977 334 HH21 ARG 36 1HH2 ARG 36 -5.454 -17.166 18.834 335 HH22 ARG 36 2HH2 ARG 36 -5.844 -18.402 19.983 336 H THR 37 H THR 37 1.802 -10.903 20.318 337 HA THR 37 HA THR 37 2.445 -10.623 23.125 338 HB THR 37 HB THR 37 4.270 -9.086 22.232 339 HG1 THR 37 HG1 THR 37 3.424 -10.181 19.739 340 HG21 THR 37 3HG2 THR 37 4.167 -11.928 21.210 341 HG22 THR 37 1HG2 THR 37 4.697 -11.421 22.815 342 HG23 THR 37 2HG2 THR 37 5.625 -10.952 21.391 343 H LEU 38 H LEU 38 1.126 -8.610 20.554 344 HA LEU 38 HA LEU 38 0.985 -6.292 22.295 345 HB2 LEU 38 1HB LEU 38 0.840 -6.754 19.402 346 HB3 LEU 38 2HB LEU 38 -0.307 -5.568 19.989 347 HG LEU 38 HG LEU 38 1.619 -4.372 19.287 348 HD11 LEU 38 1HD1 LEU 38 0.607 -4.043 21.743 349 HD12 LEU 38 2HD1 LEU 38 1.901 -3.041 21.090 350 HD13 LEU 38 3HD1 LEU 38 2.285 -4.385 22.165 351 HD21 LEU 38 3HD2 LEU 38 3.164 -6.299 19.288 352 HD22 LEU 38 1HD2 LEU 38 3.301 -6.154 21.041 353 HD23 LEU 38 2HD2 LEU 38 3.868 -4.847 19.999 354 H ARG 39 H ARG 39 -1.084 -8.617 20.745 355 HA ARG 39 HA ARG 39 -3.589 -7.530 21.361 356 HB2 ARG 39 1HB ARG 39 -2.685 -10.351 20.775 357 HB3 ARG 39 2HB ARG 39 -4.368 -9.944 21.076 358 HG2 ARG 39 1HG ARG 39 -4.443 -8.535 19.143 359 HG3 ARG 39 2HG ARG 39 -2.705 -8.707 18.894 360 HD2 ARG 39 1HD ARG 39 -3.001 -11.101 18.485 361 HD3 ARG 39 2HD ARG 39 -4.737 -10.930 18.736 362 HE ARG 39 HE ARG 39 -3.957 -9.149 16.726 363 HH11 ARG 39 1HH1 ARG 39 -4.224 -12.595 17.243 364 HH12 ARG 39 2HH1 ARG 39 -4.501 -12.950 15.569 365 HH21 ARG 39 1HH2 ARG 39 -4.321 -9.618 14.529 366 HH22 ARG 39 2HH2 ARG 39 -4.555 -11.259 14.031 367 H ARG 40 H ARG 40 -1.252 -9.427 23.106 368 HA ARG 40 HA ARG 40 -2.942 -10.168 25.290 369 HB2 ARG 40 1HB ARG 40 -0.060 -10.232 24.682 370 HB3 ARG 40 2HB ARG 40 -0.417 -9.961 26.382 371 HG2 ARG 40 1HG ARG 40 -1.776 -11.992 26.423 372 HG3 ARG 40 2HG ARG 40 -1.414 -12.265 24.717 373 HD2 ARG 40 1HD ARG 40 0.967 -12.433 25.249 374 HD3 ARG 40 2HD ARG 40 0.608 -12.153 26.953 375 HE ARG 40 HE ARG 40 -0.894 -14.347 26.089 376 HH11 ARG 40 1HH1 ARG 40 2.452 -13.494 26.632 377 HH12 ARG 40 2HH1 ARG 40 2.936 -15.117 26.995 378 HH21 ARG 40 1HH2 ARG 40 -0.255 -16.478 26.566 379 HH22 ARG 40 2HH2 ARG 40 1.399 -16.810 26.957 380 H LEU 41 H LEU 41 -1.433 -7.380 24.171 381 HA LEU 41 HA LEU 41 -2.022 -5.869 26.604 382 HB2 LEU 41 1HB LEU 41 -0.171 -5.159 24.322 383 HB3 LEU 41 2HB LEU 41 -0.453 -4.181 25.748 384 HG LEU 41 HG LEU 41 0.560 -6.955 26.149 385 HD11 LEU 41 1HD1 LEU 41 1.999 -6.238 24.380 386 HD12 LEU 41 2HD1 LEU 41 2.887 -6.102 25.899 387 HD13 LEU 41 3HD1 LEU 41 2.223 -4.659 25.132 388 HD21 LEU 41 3HD2 LEU 41 1.368 -4.390 27.492 389 HD22 LEU 41 1HD2 LEU 41 1.548 -6.042 28.083 390 HD23 LEU 41 2HD2 LEU 41 -0.054 -5.310 27.983 391 H LEU 42 H LEU 42 -2.698 -6.299 23.185 392 HA LEU 42 HA LEU 42 -4.090 -3.743 23.000 393 HB2 LEU 42 1HB LEU 42 -2.810 -5.344 21.159 394 HB3 LEU 42 2HB LEU 42 -4.504 -5.631 20.810 395 HG LEU 42 HG LEU 42 -3.487 -2.821 21.033 396 HD11 LEU 42 1HD1 LEU 42 -3.012 -2.817 18.645 397 HD12 LEU 42 2HD1 LEU 42 -3.340 -4.548 18.567 398 HD13 LEU 42 3HD1 LEU 42 -1.963 -3.952 19.493 399 HD21 LEU 42 3HD2 LEU 42 -5.695 -4.121 19.439 400 HD22 LEU 42 1HD2 LEU 42 -5.310 -2.399 19.452 401 HD23 LEU 42 2HD2 LEU 42 -5.895 -3.184 20.921 402 H GLN 43 H GLN 43 -5.031 -7.158 22.521 403 HA GLN 43 HA GLN 43 -7.822 -6.565 22.546 404 HB2 GLN 43 1HB GLN 43 -6.224 -9.106 22.610 405 HB3 GLN 43 2HB GLN 43 -7.968 -9.136 22.829 406 HG2 GLN 43 1HG GLN 43 -8.142 -7.886 20.646 407 HG3 GLN 43 2HG GLN 43 -6.424 -8.211 20.425 408 HE21 GLN 43 2HE2 GLN 43 -5.737 -10.318 20.054 409 HE22 GLN 43 1HE2 GLN 43 -6.826 -11.569 19.572 410 H GLU 44 H GLU 44 -5.487 -7.185 25.003 411 HA GLU 44 HA GLU 44 -7.432 -8.005 26.990 412 HB2 GLU 44 1HB GLU 44 -4.474 -7.482 27.055 413 HB3 GLU 44 2HB GLU 44 -5.387 -7.705 28.540 414 HG2 GLU 44 1HG GLU 44 -5.540 -9.722 26.337 415 HG3 GLU 44 2HG GLU 44 -4.201 -9.729 27.484 416 H ARG 45 H ARG 45 -6.150 -5.056 25.810 417 HA ARG 45 HA ARG 45 -6.770 -3.551 28.215 418 HB2 ARG 45 1HB ARG 45 -4.833 -3.174 26.447 419 HB3 ARG 45 2HB ARG 45 -6.072 -2.239 25.624 420 HG2 ARG 45 1HG ARG 45 -5.646 -1.684 28.504 421 HG3 ARG 45 2HG ARG 45 -4.394 -1.162 27.377 422 HD2 ARG 45 1HD ARG 45 -6.066 0.061 26.083 423 HD3 ARG 45 2HD ARG 45 -7.324 -0.471 27.196 424 HE ARG 45 HE ARG 45 -5.329 0.826 28.669 425 HH11 ARG 45 1HH1 ARG 45 -7.776 1.586 26.292 426 HH12 ARG 45 2HH1 ARG 45 -7.982 3.215 26.842 427 HH21 ARG 45 1HH2 ARG 45 -5.603 2.967 29.391 428 HH22 ARG 45 2HH2 ARG 45 -6.748 3.998 28.600 429 H GLU 46 H GLU 46 -8.446 -4.634 25.491 430 HA GLU 46 HA GLU 46 -10.449 -2.491 25.775 431 HB2 GLU 46 1HB GLU 46 -9.650 -4.130 23.382 432 HB3 GLU 46 2HB GLU 46 -11.184 -3.275 23.446 433 HG2 GLU 46 1HG GLU 46 -9.996 -1.162 23.759 434 HG3 GLU 46 2HG GLU 46 -8.457 -2.023 23.689 435 H LEU 47 H LEU 47 -9.995 -5.991 25.437 436 HA LEU 47 HA LEU 47 -12.841 -6.448 25.796 437 HB2 LEU 47 1HB LEU 47 -11.236 -7.744 24.216 438 HB3 LEU 47 2HB LEU 47 -10.781 -8.618 25.664 439 HG LEU 47 HG LEU 47 -13.664 -8.527 25.354 440 HD11 LEU 47 1HD1 LEU 47 -12.072 -9.797 23.133 441 HD12 LEU 47 2HD1 LEU 47 -13.146 -8.409 22.978 442 HD13 LEU 47 3HD1 LEU 47 -13.804 -9.990 23.403 443 HD21 LEU 47 3HD2 LEU 47 -12.475 -10.048 26.841 444 HD22 LEU 47 1HD2 LEU 47 -11.668 -10.784 25.458 445 HD23 LEU 47 2HD2 LEU 47 -13.414 -10.940 25.646 446 H VAL 48 H VAL 48 -10.685 -5.569 27.865 447 HA VAL 48 HA VAL 48 -11.805 -7.183 30.045 448 HB VAL 48 HB VAL 48 -8.912 -6.372 30.168 449 HG11 VAL 48 1HG1 VAL 48 -9.995 -7.054 32.239 450 HG12 VAL 48 2HG1 VAL 48 -8.782 -8.240 31.753 451 HG13 VAL 48 3HG1 VAL 48 -10.495 -8.573 31.494 452 HG21 VAL 48 3HG2 VAL 48 -9.423 -7.792 28.100 453 HG22 VAL 48 1HG2 VAL 48 -9.753 -9.100 29.236 454 HG23 VAL 48 2HG2 VAL 48 -8.153 -8.358 29.186 455 H GLU 49 H GLU 49 -12.822 -4.774 29.390 456 HA GLU 49 HA GLU 49 -11.597 -2.775 31.144 457 HB2 GLU 49 1HB GLU 49 -13.746 -2.626 29.037 458 HB3 GLU 49 2HB GLU 49 -13.437 -1.298 30.146 459 HG2 GLU 49 1HG GLU 49 -11.137 -1.154 29.337 460 HG3 GLU 49 2HG GLU 49 -11.447 -2.486 28.226 461 HA PRO 50 HA PRO 50 -14.502 -3.493 34.413 462 HB2 PRO 50 1HB PRO 50 -14.539 -1.023 35.573 463 HB3 PRO 50 2HB PRO 50 -13.183 -2.152 35.742 464 HG2 PRO 50 1HG PRO 50 -13.456 0.207 33.949 465 HG3 PRO 50 2HG PRO 50 -12.051 -0.350 34.879 466 HD2 PRO 50 1HD PRO 50 -12.315 -0.803 32.221 467 HD3 PRO 50 2HD PRO 50 -11.458 -1.914 33.309 468 H LEU 51 H LEU 51 -16.661 -3.288 34.868 469 HA LEU 51 HA LEU 51 -18.207 -1.180 33.605 470 HB2 LEU 51 1HB LEU 51 -18.684 -4.125 33.148 471 HB3 LEU 51 2HB LEU 51 -19.882 -2.892 32.809 472 HG LEU 51 HG LEU 51 -17.195 -2.623 31.542 473 HD11 LEU 51 1HD1 LEU 51 -17.724 -4.966 31.181 474 HD12 LEU 51 2HD1 LEU 51 -17.900 -4.054 29.682 475 HD13 LEU 51 3HD1 LEU 51 -19.330 -4.532 30.598 476 HD21 LEU 51 3HD2 LEU 51 -18.872 -0.874 31.257 477 HD22 LEU 51 1HD2 LEU 51 -20.012 -2.060 30.617 478 HD23 LEU 51 2HD2 LEU 51 -18.537 -1.682 29.727 479 H THR 52 H THR 52 -18.502 -0.427 35.697 480 HA THR 52 HA THR 52 -20.010 -2.121 37.553 481 HB THR 52 HB THR 52 -19.634 -0.174 39.156 482 HG1 THR 52 HG1 THR 52 -17.896 0.593 37.033 483 HG21 THR 52 3HG2 THR 52 -17.322 -0.837 39.643 484 HG22 THR 52 1HG2 THR 52 -17.213 -1.612 38.063 485 HG23 THR 52 2HG2 THR 52 -18.329 -2.237 39.278 486 HA PRO 53 HA PRO 53 -23.802 0.010 36.673 487 HB2 PRO 53 1HB PRO 53 -25.179 -0.467 38.961 488 HB3 PRO 53 2HB PRO 53 -24.838 -1.739 37.772 489 HG2 PRO 53 1HG PRO 53 -23.469 -1.155 40.350 490 HG3 PRO 53 2HG PRO 53 -23.909 -2.717 39.631 491 HD2 PRO 53 1HD PRO 53 -21.391 -1.679 39.527 492 HD3 PRO 53 2HD PRO 53 -22.049 -2.783 38.305 493 H SER 54 H SER 54 -21.566 1.180 38.816 494 HA SER 54 HA SER 54 -23.189 3.285 39.974 495 HB2 SER 54 1HB SER 54 -21.005 4.027 40.972 496 HB3 SER 54 2HB SER 54 -21.457 2.372 41.378 497 HG SER 54 HG SER 54 -19.333 2.329 40.768 498 H GLY 55 H GLY 55 -22.056 2.831 36.981 499 HA2 GLY 55 1HA GLY 55 -21.624 5.722 36.554 500 HA3 GLY 55 2HA GLY 55 -20.627 4.524 35.744 501 H GLU 56 H GLU 56 -24.126 4.931 36.297 502 HA GLU 56 HA GLU 56 -24.553 4.380 33.438 503 HB2 GLU 56 1HB GLU 56 -26.314 3.977 35.850 504 HB3 GLU 56 2HB GLU 56 -26.948 3.927 34.211 505 HG2 GLU 56 1HG GLU 56 -24.649 2.192 35.020 506 HG3 GLU 56 2HG GLU 56 -26.311 1.723 35.372 507 H LYS 57 H LYS 57 -26.008 5.646 32.243 508 HA LYS 57 HA LYS 57 -26.130 8.406 33.092 509 HB2 LYS 57 1HB LYS 57 -26.784 6.996 30.513 510 HB3 LYS 57 2HB LYS 57 -27.163 8.694 30.763 511 HG2 LYS 57 1HG LYS 57 -24.796 9.164 31.160 512 HG3 LYS 57 2HG LYS 57 -24.419 7.459 30.899 513 HD2 LYS 57 1HD LYS 57 -25.280 7.619 28.615 514 HD3 LYS 57 2HD LYS 57 -25.665 9.321 28.876 515 HE2 LYS 57 1HE LYS 57 -23.292 9.793 29.258 516 HE3 LYS 57 2HE LYS 57 -22.912 8.093 28.992 517 HZ1 LYS 57 3HZ LYS 57 -24.113 9.931 26.990 518 HZ2 LYS 57 1HZ LYS 57 -23.746 8.300 26.732 519 HZ3 LYS 57 2HZ LYS 57 -22.504 9.412 27.011 520 H LEU 58 H LEU 58 -28.411 5.821 32.276 521 HA LEU 58 HA LEU 58 -30.678 7.498 32.951 522 HB2 LEU 58 1HB LEU 58 -30.474 4.669 31.936 523 HB3 LEU 58 2HB LEU 58 -31.997 5.435 32.345 524 HG LEU 58 HG LEU 58 -30.225 6.810 30.383 525 HD11 LEU 58 1HD1 LEU 58 -31.933 4.416 29.727 526 HD12 LEU 58 2HD1 LEU 58 -30.175 4.506 29.618 527 HD13 LEU 58 3HD1 LEU 58 -31.178 5.491 28.551 528 HD21 LEU 58 3HD2 LEU 58 -33.211 6.452 30.613 529 HD22 LEU 58 1HD2 LEU 58 -32.379 7.451 29.421 530 HD23 LEU 58 2HD2 LEU 58 -32.294 7.865 31.133 531 H TRP 59 H TRP 59 -28.558 5.511 34.584 532 HA TRP 59 HA TRP 59 -30.452 5.207 36.813 533 HB2 TRP 59 1HB TRP 59 -28.506 3.146 35.774 534 HB3 TRP 59 2HB TRP 59 -29.231 3.052 37.375 535 HD1 TRP 59 HD1 TRP 59 -31.816 2.414 37.520 536 HE1 TRP 59 HE1 TRP 59 -33.429 1.338 35.827 537 HE3 TRP 59 HE3 TRP 59 -29.061 3.037 33.254 538 HZ2 TRP 59 HZ2 TRP 59 -33.522 0.822 33.056 539 HZ3 TRP 59 HZ3 TRP 59 -29.985 2.223 31.125 540 HH2 TRP 59 HH2 TRP 59 -32.171 1.138 31.029 541 H SER 60 H SER 60 -29.614 5.484 38.867 542 HA SER 60 HA SER 60 -26.970 6.756 38.957 543 HB2 SER 60 1HB SER 60 -29.264 6.883 40.930 544 HB3 SER 60 2HB SER 60 -27.733 7.741 41.094 545 HG SER 60 HG SER 60 -29.765 8.738 40.005 546 H1 LYS 61 1H LYS 61 -0.692 8.648 -32.928 547 H2 LYS 61 2H LYS 61 -0.487 8.013 -31.373 548 H3 LYS 61 3H LYS 61 0.717 8.986 -32.054 549 HA LYS 61 HA LYS 61 -0.740 10.884 -32.045 550 HB2 LYS 61 1HB LYS 61 -2.685 8.885 -30.899 551 HB3 LYS 61 2HB LYS 61 -2.899 10.618 -30.702 552 HG2 LYS 61 1HG LYS 61 -2.970 10.886 -33.131 553 HG3 LYS 61 2HG LYS 61 -2.759 9.146 -33.326 554 HD2 LYS 61 1HD LYS 61 -4.857 8.761 -32.121 555 HD3 LYS 61 2HD LYS 61 -5.066 10.503 -31.930 556 HE2 LYS 61 1HE LYS 61 -6.416 9.900 -33.763 557 HE3 LYS 61 2HE LYS 61 -4.979 10.648 -34.458 558 HZ1 LYS 61 3HZ LYS 61 -5.591 8.640 -35.648 559 HZ2 LYS 61 1HZ LYS 61 -5.470 7.727 -34.229 560 HZ3 LYS 61 2HZ LYS 61 -4.089 8.442 -34.894 561 H ILE 62 H ILE 62 -0.424 8.398 -29.548 562 HA ILE 62 HA ILE 62 0.762 10.417 -27.781 563 HB ILE 62 HB ILE 62 -0.365 9.160 -25.834 564 HG12 ILE 62 1HG1 ILE 62 -2.808 8.541 -26.803 565 HG13 ILE 62 2HG1 ILE 62 -1.820 8.061 -28.179 566 HG21 ILE 62 1HG2 ILE 62 -1.981 10.944 -27.645 567 HG22 ILE 62 2HG2 ILE 62 -0.845 11.465 -26.401 568 HG23 ILE 62 3HG2 ILE 62 -2.328 10.627 -25.947 569 HD11 ILE 62 3HD1 ILE 62 -0.524 6.587 -26.731 570 HD12 ILE 62 1HD1 ILE 62 -2.241 6.188 -26.696 571 HD13 ILE 62 2HD1 ILE 62 -1.512 7.071 -25.354 572 HA PRO 63 HA PRO 63 3.932 7.375 -27.229 573 HB2 PRO 63 1HB PRO 63 4.898 8.120 -24.783 574 HB3 PRO 63 2HB PRO 63 5.222 9.026 -26.272 575 HG2 PRO 63 1HG PRO 63 3.244 9.584 -24.122 576 HG3 PRO 63 2HG PRO 63 4.281 10.707 -25.024 577 HD2 PRO 63 1HD PRO 63 1.656 10.369 -25.594 578 HD3 PRO 63 2HD PRO 63 2.864 10.785 -26.825 579 H SER 64 H SER 64 4.223 5.376 -26.358 580 HA SER 64 HA SER 64 2.107 4.311 -24.715 581 HB2 SER 64 1HB SER 64 4.579 2.988 -25.853 582 HB3 SER 64 2HB SER 64 3.247 2.145 -25.064 583 HG SER 64 HG SER 64 2.802 3.833 -27.279 584 H ILE 65 H ILE 65 4.997 5.842 -24.043 585 HA ILE 65 HA ILE 65 5.733 4.304 -21.707 586 HB ILE 65 HB ILE 65 6.773 7.048 -22.405 587 HG12 ILE 65 1HG1 ILE 65 8.696 5.372 -23.345 588 HG13 ILE 65 2HG1 ILE 65 7.248 4.456 -23.749 589 HG21 ILE 65 1HG2 ILE 65 8.782 6.273 -21.228 590 HG22 ILE 65 2HG2 ILE 65 7.985 4.735 -20.895 591 HG23 ILE 65 3HG2 ILE 65 7.354 6.224 -20.193 592 HD11 ILE 65 3HD1 ILE 65 7.998 5.886 -25.587 593 HD12 ILE 65 1HD1 ILE 65 7.783 7.304 -24.561 594 HD13 ILE 65 2HD1 ILE 65 6.387 6.328 -25.019 595 H ALA 66 H ALA 66 3.925 7.216 -22.434 596 HA ALA 66 HA ALA 66 3.721 8.028 -19.665 597 HB1 ALA 66 3HB ALA 66 3.826 9.677 -21.506 598 HB2 ALA 66 1HB ALA 66 2.405 9.872 -20.480 599 HB3 ALA 66 2HB ALA 66 2.252 9.109 -22.062 600 H THR 67 H THR 67 1.875 6.166 -21.943 601 HA THR 67 HA THR 67 -0.668 6.314 -20.735 602 HB THR 67 HB THR 67 0.235 3.826 -22.138 603 HG1 THR 67 HG1 THR 67 -0.206 5.032 -24.132 604 HG21 THR 67 3HG2 THR 67 -2.071 3.928 -21.389 605 HG22 THR 67 1HG2 THR 67 -2.018 4.015 -23.150 606 HG23 THR 67 2HG2 THR 67 -2.295 5.476 -22.203 607 H GLY 68 H GLY 68 2.143 4.317 -20.063 608 HA2 GLY 68 1HA GLY 68 0.730 2.561 -18.250 609 HA3 GLY 68 2HA GLY 68 2.460 2.582 -18.547 610 H LEU 69 H LEU 69 2.980 5.268 -17.980 611 HA LEU 69 HA LEU 69 3.344 5.199 -15.198 612 HB2 LEU 69 1HB LEU 69 3.503 7.499 -17.146 613 HB3 LEU 69 2HB LEU 69 3.993 7.610 -15.467 614 HG LEU 69 HG LEU 69 5.228 5.548 -17.267 615 HD11 LEU 69 1HD1 LEU 69 5.899 8.471 -17.088 616 HD12 LEU 69 2HD1 LEU 69 5.611 7.495 -18.529 617 HD13 LEU 69 3HD1 LEU 69 7.078 7.256 -17.582 618 HD21 LEU 69 3HD2 LEU 69 7.120 5.842 -15.720 619 HD22 LEU 69 1HD2 LEU 69 5.647 5.341 -14.888 620 HD23 LEU 69 2HD2 LEU 69 6.176 7.021 -14.811 621 H VAL 70 H VAL 70 0.972 6.929 -17.199 622 HA VAL 70 HA VAL 70 -0.202 8.421 -15.139 623 HB VAL 70 HB VAL 70 -2.190 8.621 -16.621 624 HG11 VAL 70 1HG1 VAL 70 0.568 9.120 -17.696 625 HG12 VAL 70 2HG1 VAL 70 -0.545 10.257 -16.931 626 HG13 VAL 70 3HG1 VAL 70 -0.878 9.654 -18.555 627 HG21 VAL 70 3HG2 VAL 70 -2.161 6.410 -17.648 628 HG22 VAL 70 1HG2 VAL 70 -0.628 6.779 -18.438 629 HG23 VAL 70 2HG2 VAL 70 -2.086 7.666 -18.884 630 H GLY 71 H GLY 71 -0.897 5.184 -16.300 631 HA2 GLY 71 1HA GLY 71 -3.248 4.767 -14.756 632 HA3 GLY 71 2HA GLY 71 -2.269 3.512 -15.498 633 H ALA 72 H ALA 72 0.137 3.771 -14.235 634 HA ALA 72 HA ALA 72 -0.446 2.551 -11.717 635 HB1 ALA 72 3HB ALA 72 1.454 1.958 -13.292 636 HB2 ALA 72 1HB ALA 72 1.845 2.046 -11.577 637 HB3 ALA 72 2HB ALA 72 2.287 3.373 -12.651 638 H LEU 73 H LEU 73 0.964 5.669 -12.648 639 HA LEU 73 HA LEU 73 1.615 6.463 -10.010 640 HB2 LEU 73 1HB LEU 73 1.341 7.859 -12.633 641 HB3 LEU 73 2HB LEU 73 1.421 8.827 -11.174 642 HG LEU 73 HG LEU 73 3.589 7.692 -10.617 643 HD11 LEU 73 1HD1 LEU 73 3.287 5.670 -11.969 644 HD12 LEU 73 2HD1 LEU 73 4.780 6.511 -12.385 645 HD13 LEU 73 3HD1 LEU 73 3.372 6.642 -13.438 646 HD21 LEU 73 3HD2 LEU 73 3.527 9.907 -11.629 647 HD22 LEU 73 1HD2 LEU 73 3.474 9.181 -13.237 648 HD23 LEU 73 2HD2 LEU 73 4.904 8.980 -12.224 649 H LEU 74 H LEU 74 -1.272 6.933 -12.026 650 HA LEU 74 HA LEU 74 -2.609 8.590 -10.138 651 HB2 LEU 74 1HB LEU 74 -3.272 7.294 -12.688 652 HB3 LEU 74 2HB LEU 74 -4.631 7.479 -11.595 653 HG LEU 74 HG LEU 74 -3.910 9.955 -11.437 654 HD11 LEU 74 1HD1 LEU 74 -1.718 9.367 -12.676 655 HD12 LEU 74 2HD1 LEU 74 -2.561 10.860 -13.091 656 HD13 LEU 74 3HD1 LEU 74 -2.712 9.445 -14.131 657 HD21 LEU 74 3HD2 LEU 74 -5.950 9.194 -12.525 658 HD22 LEU 74 1HD2 LEU 74 -5.046 8.839 -13.998 659 HD23 LEU 74 2HD2 LEU 74 -5.203 10.505 -13.439 660 H LEU 75 H LEU 75 -2.591 5.123 -10.782 661 HA LEU 75 HA LEU 75 -4.666 4.488 -8.935 662 HB2 LEU 75 1HB LEU 75 -2.878 3.051 -10.697 663 HB3 LEU 75 2HB LEU 75 -3.002 2.244 -9.145 664 HG LEU 75 HG LEU 75 -5.629 2.739 -9.695 665 HD11 LEU 75 1HD1 LEU 75 -4.286 2.099 -12.315 666 HD12 LEU 75 2HD1 LEU 75 -5.111 3.606 -11.914 667 HD13 LEU 75 3HD1 LEU 75 -6.023 2.100 -12.013 668 HD21 LEU 75 3HD2 LEU 75 -5.767 0.370 -10.255 669 HD22 LEU 75 1HD2 LEU 75 -4.671 0.639 -8.898 670 HD23 LEU 75 2HD2 LEU 75 -4.022 0.321 -10.506 671 H LEU 76 H LEU 76 -1.148 4.632 -8.732 672 HA LEU 76 HA LEU 76 -0.944 3.633 -6.076 673 HB2 LEU 76 1HB LEU 76 0.860 3.949 -7.979 674 HB3 LEU 76 2HB LEU 76 1.080 5.511 -7.218 675 HG LEU 76 HG LEU 76 1.305 4.036 -5.029 676 HD11 LEU 76 1HD1 LEU 76 0.814 1.919 -6.150 677 HD12 LEU 76 2HD1 LEU 76 2.442 1.931 -5.474 678 HD13 LEU 76 3HD1 LEU 76 2.206 2.156 -7.206 679 HD21 LEU 76 3HD2 LEU 76 3.483 4.370 -7.088 680 HD22 LEU 76 1HD2 LEU 76 3.734 4.033 -5.375 681 HD23 LEU 76 2HD2 LEU 76 3.000 5.557 -5.876 682 H LEU 77 H LEU 77 -1.411 6.812 -7.481 683 HA LEU 77 HA LEU 77 -0.914 8.321 -5.129 684 HB2 LEU 77 1HB LEU 77 -1.050 9.062 -7.625 685 HB3 LEU 77 2HB LEU 77 -2.764 9.229 -7.306 686 HG LEU 77 HG LEU 77 -1.888 10.686 -5.267 687 HD11 LEU 77 1HD1 LEU 77 0.474 10.271 -5.688 688 HD12 LEU 77 2HD1 LEU 77 0.088 11.979 -5.897 689 HD13 LEU 77 3HD1 LEU 77 0.315 10.948 -7.310 690 HD21 LEU 77 3HD2 LEU 77 -2.023 11.648 -8.123 691 HD22 LEU 77 1HD2 LEU 77 -2.133 12.670 -6.689 692 HD23 LEU 77 2HD2 LEU 77 -3.383 11.471 -7.014 693 H VAL 78 H VAL 78 -3.881 7.026 -6.605 694 HA VAL 78 HA VAL 78 -5.660 8.150 -4.690 695 HB VAL 78 HB VAL 78 -6.099 5.736 -6.464 696 HG11 VAL 78 1HG1 VAL 78 -8.488 6.215 -6.174 697 HG12 VAL 78 2HG1 VAL 78 -8.089 7.507 -5.042 698 HG13 VAL 78 3HG1 VAL 78 -7.710 5.833 -4.638 699 HG21 VAL 78 3HG2 VAL 78 -7.233 7.303 -7.975 700 HG22 VAL 78 1HG2 VAL 78 -5.529 7.711 -7.769 701 HG23 VAL 78 2HG2 VAL 78 -6.768 8.643 -6.926 702 H VAL 79 H VAL 79 -4.126 4.952 -4.985 703 HA VAL 79 HA VAL 79 -5.391 3.794 -2.729 704 HB VAL 79 HB VAL 79 -2.770 3.060 -4.058 705 HG11 VAL 79 1HG1 VAL 79 -2.712 2.105 -1.882 706 HG12 VAL 79 2HG1 VAL 79 -3.181 0.816 -2.992 707 HG13 VAL 79 3HG1 VAL 79 -4.400 1.601 -1.987 708 HG21 VAL 79 3HG2 VAL 79 -4.088 1.288 -5.131 709 HG22 VAL 79 1HG2 VAL 79 -4.679 2.895 -5.555 710 HG23 VAL 79 2HG2 VAL 79 -5.547 1.920 -4.368 711 H ALA 80 H ALA 80 -2.284 5.470 -3.131 712 HA ALA 80 HA ALA 80 -1.390 5.112 -0.462 713 HB1 ALA 80 3HB ALA 80 0.134 5.653 -2.302 714 HB2 ALA 80 1HB ALA 80 0.274 6.814 -0.980 715 HB3 ALA 80 2HB ALA 80 -0.609 7.246 -2.446 716 H LEU 81 H LEU 81 -3.271 7.626 -2.074 717 HA LEU 81 HA LEU 81 -3.293 9.457 0.101 718 HB2 LEU 81 1HB LEU 81 -3.898 9.770 -2.436 719 HB3 LEU 81 2HB LEU 81 -5.508 9.325 -1.905 720 HG LEU 81 HG LEU 81 -5.047 11.242 -0.116 721 HD11 LEU 81 1HD1 LEU 81 -2.776 11.699 -0.871 722 HD12 LEU 81 2HD1 LEU 81 -3.821 13.094 -1.133 723 HD13 LEU 81 3HD1 LEU 81 -3.377 12.058 -2.489 724 HD21 LEU 81 3HD2 LEU 81 -6.211 12.791 -1.620 725 HD22 LEU 81 1HD2 LEU 81 -6.921 11.176 -1.659 726 HD23 LEU 81 2HD2 LEU 81 -5.878 11.714 -2.976 727 H GLY 82 H GLY 82 -5.363 6.783 -0.884 728 HA2 GLY 82 1HA GLY 82 -7.477 7.271 0.950 729 HA3 GLY 82 2HA GLY 82 -7.142 5.746 0.142 730 H ILE 83 H ILE 83 -4.771 4.939 1.068 731 HA ILE 83 HA ILE 83 -5.348 4.020 3.685 732 HB ILE 83 HB ILE 83 -2.626 3.978 2.369 733 HG12 ILE 83 1HG1 ILE 83 -4.564 1.695 2.207 734 HG13 ILE 83 2HG1 ILE 83 -4.694 3.019 1.054 735 HG21 ILE 83 1HG2 ILE 83 -3.887 2.192 4.453 736 HG22 ILE 83 2HG2 ILE 83 -2.618 3.386 4.731 737 HG23 ILE 83 3HG2 ILE 83 -2.289 1.966 3.740 738 HD11 ILE 83 3HD1 ILE 83 -2.274 1.284 1.494 739 HD12 ILE 83 1HD1 ILE 83 -2.385 2.621 0.350 740 HD13 ILE 83 2HD1 ILE 83 -3.396 1.191 0.137 741 H GLY 84 H GLY 84 -3.330 6.630 2.439 742 HA2 GLY 84 1HA GLY 84 -1.988 7.267 4.844 743 HA3 GLY 84 2HA GLY 84 -2.226 8.354 3.483 744 H LEU 85 H LEU 85 -4.963 8.584 3.406 745 HA LEU 85 HA LEU 85 -5.443 10.397 5.566 746 HB2 LEU 85 1HB LEU 85 -7.160 9.424 3.288 747 HB3 LEU 85 2HB LEU 85 -7.737 10.569 4.485 748 HG LEU 85 HG LEU 85 -5.232 11.171 2.958 749 HD11 LEU 85 1HD1 LEU 85 -8.047 11.609 1.971 750 HD12 LEU 85 2HD1 LEU 85 -6.826 10.564 1.241 751 HD13 LEU 85 3HD1 LEU 85 -6.594 12.312 1.259 752 HD21 LEU 85 3HD2 LEU 85 -5.974 13.475 3.317 753 HD22 LEU 85 1HD2 LEU 85 -5.842 12.599 4.840 754 HD23 LEU 85 2HD2 LEU 85 -7.426 12.884 4.123 755 H PHE 86 H PHE 86 -6.197 7.074 4.945 756 HA PHE 86 HA PHE 86 -8.356 6.872 6.825 757 HB2 PHE 86 1HB PHE 86 -7.756 5.347 4.778 758 HB3 PHE 86 2HB PHE 86 -6.737 4.509 5.944 759 HD1 PHE 86 HD2 PHE 86 -7.708 3.251 7.767 760 HD2 PHE 86 HD1 PHE 86 -10.165 5.275 4.943 761 HE1 PHE 86 HE2 PHE 86 -9.657 1.970 8.550 762 HE2 PHE 86 HE1 PHE 86 -12.119 3.998 5.722 763 HZ PHE 86 HZ PHE 86 -11.866 2.342 7.527 764 H ILE 87 H ILE 87 -4.877 6.251 6.904 765 HA ILE 87 HA ILE 87 -4.966 5.202 9.601 766 HB ILE 87 HB ILE 87 -2.552 5.937 7.935 767 HG12 ILE 87 1HG1 ILE 87 -3.817 4.198 6.804 768 HG13 ILE 87 2HG1 ILE 87 -2.359 3.503 7.493 769 HG21 ILE 87 1HG2 ILE 87 -1.306 4.480 9.470 770 HG22 ILE 87 2HG2 ILE 87 -2.767 4.258 10.432 771 HG23 ILE 87 3HG2 ILE 87 -2.031 5.856 10.301 772 HD11 ILE 87 3HD1 ILE 87 -4.100 1.956 7.864 773 HD12 ILE 87 1HD1 ILE 87 -5.186 3.207 8.466 774 HD13 ILE 87 2HD1 ILE 87 -3.783 2.722 9.420 775 H ARG 88 H ARG 88 -4.190 8.246 8.017 776 HA ARG 88 HA ARG 88 -2.922 9.523 10.189 777 HB2 ARG 88 1HB ARG 88 -4.262 10.452 7.688 778 HB3 ARG 88 2HB ARG 88 -3.884 11.637 8.931 779 HG2 ARG 88 1HG ARG 88 -1.533 10.988 8.844 780 HG3 ARG 88 2HG ARG 88 -1.908 9.791 7.603 781 HD2 ARG 88 1HD ARG 88 -2.534 12.714 7.271 782 HD3 ARG 88 2HD ARG 88 -0.976 12.025 6.815 783 HE ARG 88 HE ARG 88 -3.001 10.506 5.620 784 HH11 ARG 88 1HH1 ARG 88 -1.632 13.715 5.410 785 HH12 ARG 88 2HH1 ARG 88 -2.033 13.910 3.736 786 HH21 ARG 88 1HH2 ARG 88 -3.526 10.766 3.421 787 HH22 ARG 88 2HH2 ARG 88 -3.108 12.237 2.609 788 H ARG 89 H ARG 89 -6.264 8.902 9.503 789 HA ARG 89 HA ARG 89 -7.307 10.874 11.323 790 HB2 ARG 89 1HB ARG 89 -8.396 9.652 9.215 791 HB3 ARG 89 2HB ARG 89 -8.954 8.549 10.466 792 HG2 ARG 89 1HG ARG 89 -10.034 10.390 11.634 793 HG3 ARG 89 2HG ARG 89 -9.437 11.522 10.419 794 HD2 ARG 89 1HD ARG 89 -11.656 11.077 9.795 795 HD3 ARG 89 2HD ARG 89 -10.671 10.093 8.713 796 HE ARG 89 HE ARG 89 -11.343 8.541 10.941 797 HH11 ARG 89 1HH1 ARG 89 -12.911 10.026 8.191 798 HH12 ARG 89 2HH1 ARG 89 -14.175 8.845 8.120 799 HH21 ARG 89 1HH2 ARG 89 -13.007 6.992 10.843 800 HH22 ARG 89 2HH2 ARG 89 -14.230 7.124 9.625 801 H ARG 90 H ARG 90 -6.051 7.710 11.602 802 HA ARG 90 HA ARG 90 -7.474 7.048 14.041 803 HB2 ARG 90 1HB ARG 90 -5.337 5.656 12.439 804 HB3 ARG 90 2HB ARG 90 -5.857 5.062 14.009 805 HG2 ARG 90 1HG ARG 90 -8.140 4.832 13.169 806 HG3 ARG 90 2HG ARG 90 -7.618 5.431 11.594 807 HD2 ARG 90 1HD ARG 90 -6.089 3.532 11.383 808 HD3 ARG 90 2HD ARG 90 -6.612 2.935 12.956 809 HE ARG 90 HE ARG 90 -8.869 3.234 11.330 810 HH11 ARG 90 1HH1 ARG 90 -6.004 1.243 11.527 811 HH12 ARG 90 2HH1 ARG 90 -6.749 -0.121 10.760 812 HH21 ARG 90 1HH2 ARG 90 -9.845 1.442 10.325 813 HH22 ARG 90 2HH2 ARG 90 -8.927 -0.006 10.078 814 H HIS 91 H HIS 91 -4.543 8.612 13.139 815 HA HIS 91 HA HIS 91 -3.030 8.110 15.492 816 HB2 HIS 91 1HB HIS 91 -2.848 10.112 13.266 817 HB3 HIS 91 2HB HIS 91 -1.815 10.267 14.684 818 HD1 HIS 91 HD1 HIS 91 0.158 8.684 14.875 819 HD2 HIS 91 HD2 HIS 91 -2.339 7.804 11.673 820 HE1 HIS 91 HE1 HIS 91 1.397 6.977 13.508 821 HE2 HIS 91 HE2 HIS 91 -0.170 6.394 11.623 822 H ILE 92 H ILE 92 -5.721 10.116 14.902 823 HA ILE 92 HA ILE 92 -5.104 12.087 16.928 824 HB ILE 92 HB ILE 92 -7.837 11.662 15.736 825 HG12 ILE 92 1HG1 ILE 92 -5.976 13.599 14.453 826 HG13 ILE 92 2HG1 ILE 92 -5.724 11.895 14.091 827 HG21 ILE 92 1HG2 ILE 92 -7.670 13.239 17.581 828 HG22 ILE 92 2HG2 ILE 92 -8.023 14.087 16.077 829 HG23 ILE 92 3HG2 ILE 92 -6.389 14.113 16.740 830 HD11 ILE 92 3HD1 ILE 92 -7.126 12.915 12.415 831 HD12 ILE 92 1HD1 ILE 92 -8.258 13.457 13.653 832 HD13 ILE 92 2HD1 ILE 92 -8.056 11.734 13.336 833 H VAL 93 H VAL 93 -6.447 8.957 16.861 834 HA VAL 93 HA VAL 93 -7.912 9.323 19.370 835 HB VAL 93 HB VAL 93 -7.688 6.723 17.863 836 HG11 VAL 93 1HG1 VAL 93 -8.614 6.609 20.110 837 HG12 VAL 93 2HG1 VAL 93 -9.862 6.274 18.909 838 HG13 VAL 93 3HG1 VAL 93 -9.801 7.849 19.699 839 HG21 VAL 93 3HG2 VAL 93 -9.762 7.296 16.681 840 HG22 VAL 93 1HG2 VAL 93 -8.442 8.382 16.247 841 HG23 VAL 93 2HG2 VAL 93 -9.697 8.920 17.364 842 H ARG 94 H ARG 94 -5.277 7.366 18.003 843 HA ARG 94 HA ARG 94 -4.348 6.832 20.750 844 HB2 ARG 94 1HB ARG 94 -4.268 5.092 18.292 845 HB3 ARG 94 2HB ARG 94 -3.206 4.804 19.663 846 HG2 ARG 94 1HG ARG 94 -5.184 4.565 21.112 847 HG3 ARG 94 2HG ARG 94 -6.217 4.776 19.696 848 HD2 ARG 94 1HD ARG 94 -5.210 2.792 18.672 849 HD3 ARG 94 2HD ARG 94 -4.184 2.582 20.091 850 HE ARG 94 HE ARG 94 -6.755 2.618 21.054 851 HH11 ARG 94 1HH1 ARG 94 -4.987 0.675 18.750 852 HH12 ARG 94 2HH1 ARG 94 -5.926 -0.751 19.046 853 HH21 ARG 94 1HH2 ARG 94 -7.983 0.745 21.443 854 HH22 ARG 94 2HH2 ARG 94 -7.625 -0.711 20.575 855 H LYS 95 H LYS 95 -2.363 7.501 21.267 856 HA LYS 95 HA LYS 95 -0.495 8.196 19.104 857 HB2 LYS 95 1HB LYS 95 -1.271 9.873 21.485 858 HB3 LYS 95 2HB LYS 95 0.235 10.132 20.614 859 HG2 LYS 95 1HG LYS 95 -1.027 10.546 18.559 860 HG3 LYS 95 2HG LYS 95 -2.537 10.293 19.439 861 HD2 LYS 95 1HD LYS 95 -2.468 12.541 19.668 862 HD3 LYS 95 2HD LYS 95 -1.376 12.164 21.001 863 HE2 LYS 95 1HE LYS 95 -0.292 13.836 19.742 864 HE3 LYS 95 2HE LYS 95 0.514 12.326 19.322 865 HZ1 LYS 95 3HZ LYS 95 -1.586 13.674 17.708 866 HZ2 LYS 95 1HZ LYS 95 -0.814 12.223 17.305 867 HZ3 LYS 95 2HZ LYS 95 0.070 13.664 17.363 868 H ARG 96 H ARG 96 -0.858 7.534 22.577 869 HA ARG 96 HA ARG 96 1.691 6.107 22.511 870 HB2 ARG 96 1HB ARG 96 0.933 8.292 24.441 871 HB3 ARG 96 2HB ARG 96 2.154 7.089 24.835 872 HG2 ARG 96 1HG ARG 96 3.470 7.784 22.899 873 HG3 ARG 96 2HG ARG 96 2.244 8.991 22.501 874 HD2 ARG 96 1HD ARG 96 2.638 10.095 24.649 875 HD3 ARG 96 2HD ARG 96 3.862 8.890 25.044 876 HE ARG 96 HE ARG 96 4.541 10.074 22.600 877 HH11 ARG 96 1HH1 ARG 96 4.316 10.932 25.981 878 HH12 ARG 96 2HH1 ARG 96 5.546 12.146 25.882 879 HH21 ARG 96 1HH2 ARG 96 6.157 11.669 22.473 880 HH22 ARG 96 2HH2 ARG 96 6.590 12.565 23.891 881 H THR 97 H THR 97 -1.074 5.204 22.509 882 HA THR 97 HA THR 97 -1.624 4.199 25.165 883 HB THR 97 HB THR 97 -3.485 2.940 23.964 884 HG1 THR 97 HG1 THR 97 -2.717 4.652 21.817 885 HG21 THR 97 3HG2 THR 97 -3.404 5.950 23.718 886 HG22 THR 97 1HG2 THR 97 -3.881 5.038 25.151 887 HG23 THR 97 2HG2 THR 97 -4.858 4.954 23.686 888 H LEU 98 H LEU 98 -0.399 2.933 22.115 889 HA LEU 98 HA LEU 98 -0.212 0.241 23.184 890 HB2 LEU 98 1HB LEU 98 -0.161 1.443 20.509 891 HB3 LEU 98 2HB LEU 98 1.000 0.150 20.727 892 HG LEU 98 HG LEU 98 -0.953 -0.829 19.801 893 HD11 LEU 98 1HD1 LEU 98 0.138 -1.784 22.052 894 HD12 LEU 98 2HD1 LEU 98 -1.181 -2.586 21.203 895 HD13 LEU 98 3HD1 LEU 98 -1.524 -1.572 22.604 896 HD21 LEU 98 3HD2 LEU 98 -2.489 1.025 20.358 897 HD22 LEU 98 1HD2 LEU 98 -2.567 0.426 22.015 898 HD23 LEU 98 2HD2 LEU 98 -3.176 -0.565 20.690 899 H ARG 99 H ARG 99 1.816 2.899 22.228 900 HA ARG 99 HA ARG 99 4.333 1.700 22.454 901 HB2 ARG 99 1HB ARG 99 3.423 4.573 22.655 902 HB3 ARG 99 2HB ARG 99 5.113 4.108 22.785 903 HG2 ARG 99 1HG ARG 99 5.118 3.255 20.550 904 HG3 ARG 99 2HG ARG 99 3.373 3.477 20.413 905 HD2 ARG 99 1HD ARG 99 3.665 5.896 20.633 906 HD3 ARG 99 2HD ARG 99 5.409 5.674 20.773 907 HE ARG 99 HE ARG 99 4.553 4.476 18.392 908 HH11 ARG 99 1HH1 ARG 99 4.854 7.668 19.784 909 HH12 ARG 99 2HH1 ARG 99 5.076 8.448 18.253 910 HH21 ARG 99 1HH2 ARG 99 4.846 5.504 16.385 911 HH22 ARG 99 2HH2 ARG 99 5.072 7.220 16.325 912 H ARG 100 H ARG 100 2.065 3.065 24.710 913 HA ARG 100 HA ARG 100 3.831 3.216 26.956 914 HB2 ARG 100 1HB ARG 100 0.930 3.425 26.482 915 HB3 ARG 100 2HB ARG 100 1.344 2.720 28.039 916 HG2 ARG 100 1HG ARG 100 2.711 4.676 28.564 917 HG3 ARG 100 2HG ARG 100 2.294 5.384 27.002 918 HD2 ARG 100 1HD ARG 100 -0.067 5.397 27.639 919 HD3 ARG 100 2HD ARG 100 0.347 4.682 29.197 920 HE ARG 100 HE ARG 100 1.829 7.033 28.887 921 HH11 ARG 100 1HH1 ARG 100 -1.500 6.052 29.301 922 HH12 ARG 100 2HH1 ARG 100 -1.965 7.522 30.091 923 HH21 ARG 100 1HH2 ARG 100 1.217 8.962 29.927 924 HH22 ARG 100 2HH2 ARG 100 -0.422 9.172 30.445 925 H LEU 101 H LEU 101 2.272 0.812 25.197 926 HA LEU 101 HA LEU 101 2.936 -1.280 27.130 927 HB2 LEU 101 1HB LEU 101 1.005 -1.378 24.805 928 HB3 LEU 101 2HB LEU 101 1.332 -2.693 25.915 929 HG LEU 101 HG LEU 101 0.345 -0.125 27.061 930 HD11 LEU 101 1HD1 LEU 101 -1.155 -0.361 25.216 931 HD12 LEU 101 2HD1 LEU 101 -1.993 -0.894 26.674 932 HD13 LEU 101 3HD1 LEU 101 -1.360 -2.083 25.537 933 HD21 LEU 101 3HD2 LEU 101 -0.429 -2.956 27.714 934 HD22 LEU 101 1HD2 LEU 101 -0.582 -1.516 28.720 935 HD23 LEU 101 2HD2 LEU 101 1.012 -2.189 28.380 936 H LEU 102 H LEU 102 3.499 0.032 23.922 937 HA LEU 102 HA LEU 102 4.872 -2.380 23.030 938 HB2 LEU 102 1HB LEU 102 3.539 -0.360 21.715 939 HB3 LEU 102 2HB LEU 102 5.221 0.015 21.396 940 HG LEU 102 HG LEU 102 4.200 -2.759 20.911 941 HD11 LEU 102 1HD1 LEU 102 3.646 -2.142 18.622 942 HD12 LEU 102 2HD1 LEU 102 3.978 -0.449 18.988 943 HD13 LEU 102 3HD1 LEU 102 2.631 -1.272 19.772 944 HD21 LEU 102 3HD2 LEU 102 6.359 -1.079 19.640 945 HD22 LEU 102 1HD2 LEU 102 5.968 -2.744 19.214 946 HD23 LEU 102 2HD2 LEU 102 6.605 -2.370 20.816 947 H GLN 103 H GLN 103 5.812 1.045 23.428 948 HA GLN 103 HA GLN 103 8.600 0.478 23.204 949 HB2 GLN 103 1HB GLN 103 7.016 2.907 23.982 950 HB3 GLN 103 2HB GLN 103 8.766 2.887 24.143 951 HG2 GLN 103 1HG GLN 103 8.863 2.250 21.706 952 HG3 GLN 103 2HG GLN 103 7.139 2.615 21.635 953 HE21 GLN 103 2HE2 GLN 103 6.450 4.743 21.850 954 HE22 GLN 103 1HE2 GLN 103 7.529 6.081 21.677 955 H GLU 104 H GLU 104 6.351 0.425 25.815 956 HA GLU 104 HA GLU 104 8.365 0.705 27.880 957 HB2 GLU 104 1HB GLU 104 5.409 0.170 27.905 958 HB3 GLU 104 2HB GLU 104 6.372 -0.001 29.365 959 HG2 GLU 104 1HG GLU 104 6.459 2.524 27.762 960 HG3 GLU 104 2HG GLU 104 5.160 2.225 28.916 961 H ARG 105 H ARG 105 7.031 -1.839 26.014 962 HA ARG 105 HA ARG 105 7.724 -3.919 27.920 963 HB2 ARG 105 1HB ARG 105 5.728 -3.828 26.181 964 HB3 ARG 105 2HB ARG 105 6.934 -4.511 25.101 965 HG2 ARG 105 1HG ARG 105 6.602 -5.801 27.748 966 HG3 ARG 105 2HG ARG 105 5.311 -6.015 26.565 967 HD2 ARG 105 1HD ARG 105 6.934 -6.851 24.942 968 HD3 ARG 105 2HD ARG 105 8.232 -6.622 26.113 969 HE ARG 105 HE ARG 105 6.281 -8.267 27.262 970 HH11 ARG 105 1HH1 ARG 105 8.642 -8.368 24.688 971 HH12 ARG 105 2HH1 ARG 105 8.860 -10.084 24.787 972 HH21 ARG 105 1HH2 ARG 105 6.568 -10.521 27.390 973 HH22 ARG 105 2HH2 ARG 105 7.682 -11.305 26.320 974 H GLU 106 H GLU 106 9.314 -2.152 25.520 975 HA GLU 106 HA GLU 106 11.316 -4.287 25.165 976 HB2 GLU 106 1HB GLU 106 10.443 -2.084 23.312 977 HB3 GLU 106 2HB GLU 106 11.977 -2.918 23.099 978 HG2 GLU 106 1HG GLU 106 10.788 -5.043 22.889 979 HG3 GLU 106 2HG GLU 106 9.254 -4.202 23.097 980 H LEU 107 H LEU 107 10.867 -0.822 25.771 981 HA LEU 107 HA LEU 107 13.724 -0.461 26.141 982 HB2 LEU 107 1HB LEU 107 12.073 1.196 25.009 983 HB3 LEU 107 2HB LEU 107 11.672 1.658 26.651 984 HG LEU 107 HG LEU 107 14.542 1.663 26.230 985 HD11 LEU 107 1HD1 LEU 107 12.881 3.464 24.473 986 HD12 LEU 107 2HD1 LEU 107 13.945 2.168 23.924 987 HD13 LEU 107 3HD1 LEU 107 14.622 3.588 24.726 988 HD21 LEU 107 3HD2 LEU 107 13.410 2.738 28.103 989 HD22 LEU 107 1HD2 LEU 107 12.559 3.807 26.986 990 HD23 LEU 107 2HD2 LEU 107 14.312 3.916 27.150 991 H VAL 108 H VAL 108 11.634 -1.862 27.978 992 HA VAL 108 HA VAL 108 12.834 -0.869 30.466 993 HB VAL 108 HB VAL 108 9.943 -1.695 30.470 994 HG11 VAL 108 1HG1 VAL 108 11.097 -1.573 32.608 995 HG12 VAL 108 2HG1 VAL 108 9.875 -0.308 32.492 996 HG13 VAL 108 3HG1 VAL 108 11.579 0.089 32.270 997 HG21 VAL 108 3HG2 VAL 108 10.391 0.217 28.827 998 HG22 VAL 108 1HG2 VAL 108 10.764 1.185 30.255 999 HG23 VAL 108 2HG2 VAL 108 9.161 0.473 30.066 1000 H GLU 109 H GLU 109 13.818 -3.017 29.172 1001 HA GLU 109 HA GLU 109 12.644 -5.411 30.381 1002 HB2 GLU 109 1HB GLU 109 14.719 -4.993 28.238 1003 HB3 GLU 109 2HB GLU 109 14.443 -6.567 28.971 1004 HG2 GLU 109 1HG GLU 109 12.116 -6.505 28.231 1005 HG3 GLU 109 2HG GLU 109 12.394 -4.928 27.496 1006 HA PRO 110 HA PRO 110 15.659 -5.559 33.624 1007 HB2 PRO 110 1HB PRO 110 15.724 -8.247 34.097 1008 HB3 PRO 110 2HB PRO 110 14.380 -7.206 34.601 1009 HG2 PRO 110 1HG PRO 110 14.582 -9.014 32.246 1010 HG3 PRO 110 2HG PRO 110 13.211 -8.725 33.334 1011 HD2 PRO 110 1HD PRO 110 13.388 -7.592 30.881 1012 HD3 PRO 110 2HD PRO 110 12.573 -6.807 32.248 1013 H LEU 111 H LEU 111 17.831 -5.866 33.939 1014 HA LEU 111 HA LEU 111 19.324 -7.563 32.118 1015 HB2 LEU 111 1HB LEU 111 19.799 -4.600 32.431 1016 HB3 LEU 111 2HB LEU 111 20.979 -5.696 31.741 1017 HG LEU 111 HG LEU 111 18.251 -5.637 30.539 1018 HD11 LEU 111 1HD1 LEU 111 18.777 -3.278 30.786 1019 HD12 LEU 111 2HD1 LEU 111 18.899 -3.765 29.096 1020 HD13 LEU 111 3HD1 LEU 111 20.361 -3.538 30.055 1021 HD21 LEU 111 3HD2 LEU 111 19.911 -7.242 29.750 1022 HD22 LEU 111 1HD2 LEU 111 21.033 -5.927 29.405 1023 HD23 LEU 111 2HD2 LEU 111 19.527 -6.065 28.497 1024 H THR 112 H THR 112 19.686 -8.837 33.928 1025 HA THR 112 HA THR 112 21.262 -7.680 36.111 1026 HB THR 112 HB THR 112 20.933 -9.980 37.162 1027 HG1 THR 112 HG1 THR 112 19.122 -10.173 34.972 1028 HG21 THR 112 3HG2 THR 112 18.641 -9.478 37.882 1029 HG22 THR 112 1HG2 THR 112 18.483 -8.316 36.564 1030 HG23 THR 112 2HG2 THR 112 19.643 -8.027 37.862 1031 HA PRO 113 HA PRO 113 25.013 -9.490 34.579 1032 HB2 PRO 113 1HB PRO 113 26.469 -9.621 36.865 1033 HB3 PRO 113 2HB PRO 113 26.094 -8.084 36.062 1034 HG2 PRO 113 1HG PRO 113 24.810 -9.329 38.442 1035 HG3 PRO 113 2HG PRO 113 25.232 -7.630 38.142 1036 HD2 PRO 113 1HD PRO 113 22.707 -8.617 37.855 1037 HD3 PRO 113 2HD PRO 113 23.329 -7.229 36.941 1038 H SER 114 H SER 114 22.846 -11.188 36.415 1039 HA SER 114 HA SER 114 24.497 -13.517 36.928 1040 HB2 SER 114 1HB SER 114 22.345 -14.503 37.770 1041 HB3 SER 114 2HB SER 114 22.819 -13.009 38.579 1042 HG SER 114 HG SER 114 20.673 -12.818 38.073 1043 H GLY 115 H GLY 115 23.266 -12.302 34.197 1044 HA2 GLY 115 1HA GLY 115 22.808 -14.982 33.043 1045 HA3 GLY 115 2HA GLY 115 21.790 -13.618 32.609 1046 H GLU 116 H GLU 116 25.303 -14.139 32.919 1047 HA GLU 116 HA GLU 116 25.637 -12.859 30.291 1048 HB2 GLU 116 1HB GLU 116 27.481 -13.093 32.665 1049 HB3 GLU 116 2HB GLU 116 28.060 -12.614 31.075 1050 HG2 GLU 116 1HG GLU 116 25.795 -11.160 32.385 1051 HG3 GLU 116 2HG GLU 116 27.470 -10.792 32.792 1052 H LYS 117 H LYS 117 27.047 -13.763 28.759 1053 HA LYS 117 HA LYS 117 27.183 -16.647 28.851 1054 HB2 LYS 117 1HB LYS 117 27.757 -14.609 26.712 1055 HB3 LYS 117 2HB LYS 117 28.136 -16.312 26.495 1056 HG2 LYS 117 1HG LYS 117 25.781 -16.879 26.835 1057 HG3 LYS 117 2HG LYS 117 25.404 -15.168 27.041 1058 HD2 LYS 117 1HD LYS 117 26.187 -14.721 24.767 1059 HD3 LYS 117 2HD LYS 117 26.575 -16.431 24.562 1060 HE2 LYS 117 1HE LYS 117 24.214 -16.999 24.886 1061 HE3 LYS 117 2HE LYS 117 23.832 -15.289 25.086 1062 HZ1 LYS 117 3HZ LYS 117 24.958 -16.535 22.635 1063 HZ2 LYS 117 1HZ LYS 117 24.589 -14.893 22.825 1064 HZ3 LYS 117 2HZ LYS 117 23.352 -16.045 22.845 1065 H LEU 118 H LEU 118 29.448 -13.929 28.664 1066 HA LEU 118 HA LEU 118 31.729 -15.714 28.801 1067 HB2 LEU 118 1HB LEU 118 31.503 -12.720 28.569 1068 HB3 LEU 118 2HB LEU 118 33.035 -13.559 28.713 1069 HG LEU 118 HG LEU 118 31.192 -14.381 26.519 1070 HD11 LEU 118 1HD1 LEU 118 32.889 -11.890 26.455 1071 HD12 LEU 118 2HD1 LEU 118 31.129 -11.957 26.386 1072 HD13 LEU 118 3HD1 LEU 118 32.090 -12.625 25.065 1073 HD21 LEU 118 3HD2 LEU 118 34.187 -14.083 26.735 1074 HD22 LEU 118 1HD2 LEU 118 33.311 -14.739 25.351 1075 HD23 LEU 118 2HD2 LEU 118 33.280 -15.587 26.897 1076 H TRP 119 H TRP 119 29.673 -14.231 30.967 1077 HA TRP 119 HA TRP 119 31.642 -14.514 33.133 1078 HB2 TRP 119 1HB TRP 119 29.670 -12.261 32.735 1079 HB3 TRP 119 2HB TRP 119 30.450 -12.586 34.279 1080 HD1 TRP 119 HD1 TRP 119 33.040 -11.995 34.500 1081 HE1 TRP 119 HE1 TRP 119 34.601 -10.508 33.095 1082 HE3 TRP 119 HE3 TRP 119 30.141 -11.495 30.313 1083 HZ2 TRP 119 HZ2 TRP 119 34.604 -9.285 30.552 1084 HZ3 TRP 119 HZ3 TRP 119 31.000 -10.148 28.442 1085 HH2 TRP 119 HH2 TRP 119 33.185 -9.066 28.561 1086 H SER 120 H SER 120 30.872 -15.321 35.071 1087 HA SER 120 HA SER 120 28.228 -16.584 34.913 1088 HB2 SER 120 1HB SER 120 30.585 -17.212 36.707 1089 HB3 SER 120 2HB SER 120 29.056 -18.090 36.691 1090 HG SER 120 HG SER 120 31.046 -18.760 35.312 Start of MODEL 8 1 H1 LYS 1 1H LYS 1 -0.806 0.755 -33.956 2 H2 LYS 1 2H LYS 1 -0.898 0.891 -32.272 3 H3 LYS 1 3H LYS 1 -2.120 0.089 -33.122 4 HA LYS 1 HA LYS 1 -0.597 -1.637 -33.783 5 HB2 LYS 1 1HB LYS 1 1.355 0.155 -33.481 6 HB3 LYS 1 2HB LYS 1 1.473 -0.606 -31.901 7 HG2 LYS 1 1HG LYS 1 1.796 -2.780 -32.970 8 HG3 LYS 1 2HG LYS 1 1.675 -2.017 -34.556 9 HD2 LYS 1 1HD LYS 1 3.646 -0.654 -34.048 10 HD3 LYS 1 2HD LYS 1 3.765 -1.418 -32.462 11 HE2 LYS 1 1HE LYS 1 3.841 -2.980 -35.033 12 HE3 LYS 1 2HE LYS 1 5.291 -2.320 -34.278 13 HZ1 LYS 1 3HZ LYS 1 4.800 -3.609 -32.292 14 HZ2 LYS 1 1HZ LYS 1 4.933 -4.621 -33.642 15 HZ3 LYS 1 2HZ LYS 1 3.408 -4.241 -33.016 16 H ILE 2 H ILE 2 -0.781 -0.013 -30.641 17 HA ILE 2 HA ILE 2 -1.748 -2.524 -29.474 18 HB ILE 2 HB ILE 2 -0.494 -1.838 -27.328 19 HG12 ILE 2 1HG1 ILE 2 1.835 -0.827 -28.245 20 HG13 ILE 2 2HG1 ILE 2 0.718 -0.018 -29.339 21 HG21 ILE 2 1HG2 ILE 2 1.012 -2.916 -29.705 22 HG22 ILE 2 2HG2 ILE 2 0.004 -3.843 -28.592 23 HG23 ILE 2 3HG2 ILE 2 1.495 -3.095 -28.018 24 HD11 ILE 2 3HD1 ILE 2 0.627 0.077 -26.332 25 HD12 ILE 2 1HD1 ILE 2 -0.494 0.888 -27.426 26 HD13 ILE 2 2HD1 ILE 2 1.207 1.355 -27.400 27 HA PRO 3 HA PRO 3 -4.945 0.048 -27.809 28 HB2 PRO 3 1HB PRO 3 -5.684 -1.439 -25.640 29 HB3 PRO 3 2HB PRO 3 -6.102 -1.881 -27.307 30 HG2 PRO 3 1HG PRO 3 -3.936 -2.941 -25.563 31 HG3 PRO 3 2HG PRO 3 -5.010 -3.802 -26.683 32 HD2 PRO 3 1HD PRO 3 -2.452 -3.169 -27.310 33 HD3 PRO 3 2HD PRO 3 -3.744 -3.272 -28.521 34 H SER 4 H SER 4 -5.119 1.741 -26.450 35 HA SER 4 HA SER 4 -2.944 2.300 -24.643 36 HB2 SER 4 1HB SER 4 -5.429 3.901 -25.295 37 HB3 SER 4 2HB SER 4 -4.063 4.486 -24.345 38 HG SER 4 HG SER 4 -3.276 3.438 -26.726 39 H ILE 5 H ILE 5 -5.813 0.638 -24.328 40 HA ILE 5 HA ILE 5 -6.484 1.484 -21.643 41 HB ILE 5 HB ILE 5 -7.544 -0.988 -23.005 42 HG12 ILE 5 1HG1 ILE 5 -9.477 0.869 -23.459 43 HG13 ILE 5 2HG1 ILE 5 -8.032 1.854 -23.657 44 HG21 ILE 5 1HG2 ILE 5 -8.722 0.873 -20.944 45 HG22 ILE 5 2HG2 ILE 5 -8.082 -0.744 -20.647 46 HG23 ILE 5 3HG2 ILE 5 -9.528 -0.535 -21.635 47 HD11 ILE 5 3HD1 ILE 5 -8.632 -0.694 -25.138 48 HD12 ILE 5 1HD1 ILE 5 -7.209 0.323 -25.354 49 HD13 ILE 5 2HD1 ILE 5 -8.805 0.941 -25.775 50 H ALA 6 H ALA 6 -4.714 -1.126 -23.181 51 HA ALA 6 HA ALA 6 -4.423 -2.642 -20.732 52 HB1 ALA 6 3HB ALA 6 -4.604 -3.760 -22.920 53 HB2 ALA 6 1HB ALA 6 -3.126 -4.191 -22.059 54 HB3 ALA 6 2HB ALA 6 -3.065 -3.041 -23.395 55 H THR 7 H THR 7 -2.637 -0.242 -22.503 56 HA THR 7 HA THR 7 -0.058 -0.702 -21.462 57 HB THR 7 HB THR 7 -0.988 2.064 -22.138 58 HG1 THR 7 HG1 THR 7 -0.332 1.137 -24.404 59 HG21 THR 7 3HG2 THR 7 1.532 0.496 -22.705 60 HG22 THR 7 1HG2 THR 7 1.340 1.781 -21.511 61 HG23 THR 7 2HG2 THR 7 1.234 2.153 -23.232 62 H GLY 8 H GLY 8 -2.830 1.050 -20.199 63 HA2 GLY 8 1HA GLY 8 -1.346 2.274 -18.038 64 HA3 GLY 8 2HA GLY 8 -3.085 2.329 -18.274 65 H LEU 9 H LEU 9 -3.608 -0.413 -18.412 66 HA LEU 9 HA LEU 9 -3.881 -1.072 -15.698 67 HB2 LEU 9 1HB LEU 9 -4.119 -2.785 -18.171 68 HB3 LEU 9 2HB LEU 9 -4.556 -3.330 -16.565 69 HG LEU 9 HG LEU 9 -5.833 -0.874 -17.725 70 HD11 LEU 9 1HD1 LEU 9 -7.706 -2.441 -18.409 71 HD12 LEU 9 2HD1 LEU 9 -6.524 -3.745 -18.282 72 HD13 LEU 9 3HD1 LEU 9 -6.269 -2.432 -19.431 73 HD21 LEU 9 3HD2 LEU 9 -6.174 -1.286 -15.361 74 HD22 LEU 9 1HD2 LEU 9 -6.708 -2.933 -15.699 75 HD23 LEU 9 2HD2 LEU 9 -7.676 -1.563 -16.242 76 H VAL 10 H VAL 10 -1.591 -2.227 -18.157 77 HA VAL 10 HA VAL 10 -0.362 -4.200 -16.596 78 HB VAL 10 HB VAL 10 1.576 -4.003 -18.143 79 HG11 VAL 10 1HG1 VAL 10 -1.219 -4.206 -19.222 80 HG12 VAL 10 2HG1 VAL 10 -0.090 -5.503 -18.817 81 HG13 VAL 10 3HG1 VAL 10 0.197 -4.496 -20.236 82 HG21 VAL 10 3HG2 VAL 10 1.532 -1.600 -18.556 83 HG22 VAL 10 1HG2 VAL 10 -0.028 -1.753 -19.365 84 HG23 VAL 10 2HG2 VAL 10 1.410 -2.489 -20.073 85 H GLY 11 H GLY 11 0.312 -0.770 -16.891 86 HA2 GLY 11 1HA GLY 11 2.718 -0.762 -15.374 87 HA3 GLY 11 2HA GLY 11 1.721 0.640 -15.728 88 H ALA 12 H ALA 12 -0.639 0.064 -14.494 89 HA ALA 12 HA ALA 12 0.035 0.576 -11.765 90 HB1 ALA 12 3HB ALA 12 -1.907 1.567 -13.054 91 HB2 ALA 12 1HB ALA 12 -2.250 1.013 -11.417 92 HB3 ALA 12 2HB ALA 12 -2.732 0.029 -12.797 93 H LEU 13 H LEU 13 -1.433 -2.186 -13.433 94 HA LEU 13 HA LEU 13 -2.010 -3.653 -11.088 95 HB2 LEU 13 1HB LEU 13 -1.799 -4.305 -13.990 96 HB3 LEU 13 2HB LEU 13 -1.837 -5.626 -12.838 97 HG LEU 13 HG LEU 13 -3.994 -4.710 -11.951 98 HD11 LEU 13 1HD1 LEU 13 -3.848 -2.922 -14.378 99 HD12 LEU 13 2HD1 LEU 13 -3.737 -2.392 -12.700 100 HD13 LEU 13 3HD1 LEU 13 -5.234 -3.104 -13.304 101 HD21 LEU 13 3HD2 LEU 13 -3.940 -5.425 -14.878 102 HD22 LEU 13 1HD2 LEU 13 -5.346 -5.521 -13.817 103 HD23 LEU 13 2HD2 LEU 13 -3.950 -6.562 -13.530 104 H LEU 14 H LEU 14 0.817 -3.599 -13.249 105 HA LEU 14 HA LEU 14 2.201 -5.669 -11.880 106 HB2 LEU 14 1HB LEU 14 2.800 -3.759 -14.027 107 HB3 LEU 14 2HB LEU 14 4.189 -4.223 -13.062 108 HG LEU 14 HG LEU 14 3.441 -6.654 -13.531 109 HD11 LEU 14 1HD1 LEU 14 1.225 -5.796 -14.503 110 HD12 LEU 14 2HD1 LEU 14 2.071 -7.083 -15.365 111 HD13 LEU 14 3HD1 LEU 14 2.166 -5.419 -15.947 112 HD21 LEU 14 3HD2 LEU 14 5.465 -5.649 -14.433 113 HD22 LEU 14 1HD2 LEU 14 4.534 -4.914 -15.739 114 HD23 LEU 14 2HD2 LEU 14 4.681 -6.670 -15.639 115 H LEU 15 H LEU 15 2.185 -2.154 -11.612 116 HA LEU 15 HA LEU 15 4.322 -2.008 -9.732 117 HB2 LEU 15 1HB LEU 15 2.489 -0.173 -11.009 118 HB3 LEU 15 2HB LEU 15 2.655 0.208 -9.305 119 HG LEU 15 HG LEU 15 5.269 -0.131 -10.058 120 HD11 LEU 15 1HD1 LEU 15 4.659 -0.341 -12.409 121 HD12 LEU 15 2HD1 LEU 15 5.581 1.134 -12.117 122 HD13 LEU 15 3HD1 LEU 15 3.833 1.216 -12.338 123 HD21 LEU 15 3HD2 LEU 15 4.363 1.660 -8.668 124 HD22 LEU 15 1HD2 LEU 15 3.661 2.419 -10.097 125 HD23 LEU 15 2HD2 LEU 15 5.411 2.299 -9.934 126 H LEU 16 H LEU 16 0.823 -2.286 -9.465 127 HA LEU 16 HA LEU 16 0.687 -1.952 -6.641 128 HB2 LEU 16 1HB LEU 16 -1.180 -1.818 -8.470 129 HB3 LEU 16 2HB LEU 16 -1.319 -3.544 -8.199 130 HG LEU 16 HG LEU 16 -1.520 -2.778 -5.667 131 HD11 LEU 16 1HD1 LEU 16 -2.776 -0.693 -5.471 132 HD12 LEU 16 2HD1 LEU 16 -2.553 -0.395 -7.195 133 HD13 LEU 16 3HD1 LEU 16 -1.158 -0.411 -6.117 134 HD21 LEU 16 3HD2 LEU 16 -3.755 -2.614 -7.684 135 HD22 LEU 16 1HD2 LEU 16 -3.957 -2.796 -5.941 136 HD23 LEU 16 2HD2 LEU 16 -3.180 -4.072 -6.876 137 H LEU 17 H LEU 17 1.108 -4.718 -8.781 138 HA LEU 17 HA LEU 17 0.771 -6.725 -6.804 139 HB2 LEU 17 1HB LEU 17 2.008 -6.677 -9.537 140 HB3 LEU 17 2HB LEU 17 2.135 -8.104 -8.526 141 HG LEU 17 HG LEU 17 -0.559 -6.912 -9.084 142 HD11 LEU 17 1HD1 LEU 17 -0.758 -8.373 -11.040 143 HD12 LEU 17 2HD1 LEU 17 0.948 -8.797 -10.892 144 HD13 LEU 17 3HD1 LEU 17 0.482 -7.139 -11.268 145 HD21 LEU 17 3HD2 LEU 17 0.420 -9.717 -8.544 146 HD22 LEU 17 1HD2 LEU 17 -1.260 -9.250 -8.816 147 HD23 LEU 17 2HD2 LEU 17 -0.398 -8.658 -7.396 148 H VAL 18 H VAL 18 3.625 -5.053 -8.100 149 HA VAL 18 HA VAL 18 5.534 -6.563 -6.626 150 HB VAL 18 HB VAL 18 5.824 -3.778 -7.781 151 HG11 VAL 18 1HG1 VAL 18 8.234 -4.228 -7.736 152 HG12 VAL 18 2HG1 VAL 18 7.931 -5.766 -6.930 153 HG13 VAL 18 3HG1 VAL 18 7.541 -4.251 -6.115 154 HG21 VAL 18 3HG2 VAL 18 5.221 -5.409 -9.487 155 HG22 VAL 18 1HG2 VAL 18 6.530 -6.466 -8.959 156 HG23 VAL 18 2HG2 VAL 18 6.898 -4.899 -9.679 157 H VAL 19 H VAL 19 3.973 -3.415 -6.037 158 HA VAL 19 HA VAL 19 5.352 -2.831 -3.635 159 HB VAL 19 HB VAL 19 2.663 -1.839 -4.609 160 HG11 VAL 19 1HG1 VAL 19 2.660 -1.435 -2.286 161 HG12 VAL 19 2HG1 VAL 19 3.153 0.086 -3.030 162 HG13 VAL 19 3HG1 VAL 19 4.360 -0.963 -2.285 163 HG21 VAL 19 3HG2 VAL 19 4.502 -1.263 -6.095 164 HG22 VAL 19 1HG2 VAL 19 5.410 -0.597 -4.738 165 HG23 VAL 19 2HG2 VAL 19 3.912 0.171 -5.258 166 H ALA 20 H ALA 20 2.231 -4.405 -4.272 167 HA ALA 20 HA ALA 20 1.483 -4.736 -1.557 168 HB1 ALA 20 3HB ALA 20 -0.131 -4.847 -3.397 169 HB2 ALA 20 1HB ALA 20 -0.188 -6.297 -2.394 170 HB3 ALA 20 2HB ALA 20 0.619 -6.340 -3.961 171 H LEU 21 H LEU 21 3.295 -6.742 -3.829 172 HA LEU 21 HA LEU 21 3.452 -9.049 -2.175 173 HB2 LEU 21 1HB LEU 21 3.935 -8.708 -4.738 174 HB3 LEU 21 2HB LEU 21 5.565 -8.376 -4.183 175 HG LEU 21 HG LEU 21 5.200 -10.688 -2.908 176 HD11 LEU 21 1HD1 LEU 21 2.904 -10.985 -3.661 177 HD12 LEU 21 2HD1 LEU 21 3.949 -12.253 -4.305 178 HD13 LEU 21 3HD1 LEU 21 3.436 -10.920 -5.341 179 HD21 LEU 21 3HD2 LEU 21 6.311 -11.789 -4.798 180 HD22 LEU 21 1HD2 LEU 21 7.005 -10.204 -4.461 181 HD23 LEU 21 2HD2 LEU 21 5.909 -10.414 -5.826 182 H GLY 22 H GLY 22 5.450 -6.172 -2.565 183 HA2 GLY 22 1HA GLY 22 7.650 -7.054 -0.998 184 HA3 GLY 22 2HA GLY 22 7.269 -5.385 -1.396 185 H ILE 23 H ILE 23 4.881 -4.947 -0.206 186 HA ILE 23 HA ILE 23 5.566 -4.581 2.511 187 HB ILE 23 HB ILE 23 2.790 -4.458 1.310 188 HG12 ILE 23 1HG1 ILE 23 4.524 -2.054 1.756 189 HG13 ILE 23 2HG1 ILE 23 4.752 -3.019 0.303 190 HG21 ILE 23 1HG2 ILE 23 2.503 -4.410 3.622 191 HG22 ILE 23 2HG2 ILE 23 2.555 -2.703 3.184 192 HG23 ILE 23 3HG2 ILE 23 3.976 -3.477 3.884 193 HD11 ILE 23 3HD1 ILE 23 2.176 -1.714 1.150 194 HD12 ILE 23 1HD1 ILE 23 2.435 -2.644 -0.326 195 HD13 ILE 23 2HD1 ILE 23 3.282 -1.116 -0.087 196 H GLY 24 H GLY 24 3.501 -6.947 0.868 197 HA2 GLY 24 1HA GLY 24 2.483 -8.219 3.177 198 HA3 GLY 24 2HA GLY 24 2.576 -8.930 1.573 199 H LEU 25 H LEU 25 5.314 -8.951 1.157 200 HA LEU 25 HA LEU 25 6.089 -11.239 2.678 201 HB2 LEU 25 1HB LEU 25 7.500 -9.560 0.616 202 HB3 LEU 25 2HB LEU 25 8.290 -10.903 1.421 203 HG LEU 25 HG LEU 25 5.692 -11.332 -0.015 204 HD11 LEU 25 1HD1 LEU 25 8.437 -11.296 -1.262 205 HD12 LEU 25 2HD1 LEU 25 7.100 -10.205 -1.629 206 HD13 LEU 25 3HD1 LEU 25 6.976 -11.917 -2.029 207 HD21 LEU 25 3HD2 LEU 25 6.637 -13.588 -0.306 208 HD22 LEU 25 1HD2 LEU 25 6.509 -13.132 1.392 209 HD23 LEU 25 2HD2 LEU 25 8.074 -13.086 0.583 210 H PHE 26 H PHE 26 6.629 -7.830 2.952 211 HA PHE 26 HA PHE 26 8.948 -7.967 4.619 212 HB2 PHE 26 1HB PHE 26 7.251 -5.896 3.487 213 HB3 PHE 26 2HB PHE 26 7.682 -5.537 5.157 214 HD1 PHE 26 HD1 PHE 26 8.938 -5.991 1.756 215 HD2 PHE 26 HD2 PHE 26 9.974 -5.110 5.788 216 HE1 PHE 26 HE1 PHE 26 11.139 -5.186 1.009 217 HE2 PHE 26 HE2 PHE 26 12.177 -4.303 5.049 218 HZ PHE 26 HZ PHE 26 12.762 -4.341 2.657 219 H ILE 27 H ILE 27 5.464 -7.673 5.213 220 HA ILE 27 HA ILE 27 5.823 -7.560 8.087 221 HB ILE 27 HB ILE 27 3.226 -7.967 6.597 222 HG12 ILE 27 1HG1 ILE 27 4.158 -5.293 7.594 223 HG13 ILE 27 2HG1 ILE 27 4.691 -5.867 6.018 224 HG21 ILE 27 1HG2 ILE 27 3.824 -6.892 9.356 225 HG22 ILE 27 2HG2 ILE 27 3.121 -8.465 8.980 226 HG23 ILE 27 3HG2 ILE 27 2.224 -6.990 8.618 227 HD11 ILE 27 3HD1 ILE 27 2.404 -6.017 5.262 228 HD12 ILE 27 1HD1 ILE 27 2.729 -4.400 5.889 229 HD13 ILE 27 2HD1 ILE 27 1.819 -5.557 6.860 230 H ARG 28 H ARG 28 5.195 -9.980 5.660 231 HA ARG 28 HA ARG 28 4.101 -12.005 7.286 232 HB2 ARG 28 1HB ARG 28 4.447 -11.777 4.654 233 HB3 ARG 28 2HB ARG 28 5.867 -12.750 5.007 234 HG2 ARG 28 1HG ARG 28 4.448 -14.451 6.038 235 HG3 ARG 28 2HG ARG 28 3.023 -13.473 5.685 236 HD2 ARG 28 1HD ARG 28 3.506 -13.638 3.291 237 HD3 ARG 28 2HD ARG 28 4.931 -14.613 3.645 238 HE ARG 28 HE ARG 28 2.711 -15.845 4.816 239 HH11 ARG 28 1HH1 ARG 28 3.960 -15.145 1.628 240 HH12 ARG 28 2HH1 ARG 28 3.198 -16.516 0.894 241 HH21 ARG 28 1HH2 ARG 28 1.712 -17.645 3.849 242 HH22 ARG 28 2HH2 ARG 28 1.922 -17.934 2.153 243 H ARG 29 H ARG 29 7.346 -10.859 6.895 244 HA ARG 29 HA ARG 29 8.601 -13.206 8.022 245 HB2 ARG 29 1HB ARG 29 9.616 -10.480 7.238 246 HB3 ARG 29 2HB ARG 29 10.638 -11.655 8.054 247 HG2 ARG 29 1HG ARG 29 10.295 -13.233 6.221 248 HG3 ARG 29 2HG ARG 29 9.267 -12.055 5.402 249 HD2 ARG 29 1HD ARG 29 11.376 -11.846 4.386 250 HD3 ARG 29 2HD ARG 29 11.258 -10.479 5.493 251 HE ARG 29 HE ARG 29 12.500 -12.596 6.838 252 HH11 ARG 29 1HH1 ARG 29 13.151 -10.408 4.190 253 HH12 ARG 29 2HH1 ARG 29 14.867 -10.447 4.417 254 HH21 ARG 29 1HH2 ARG 29 14.755 -12.644 7.133 255 HH22 ARG 29 2HH2 ARG 29 15.777 -11.716 6.086 256 H ARG 30 H ARG 30 7.573 -10.038 9.136 257 HA ARG 30 HA ARG 30 8.760 -10.390 11.758 258 HB2 ARG 30 1HB ARG 30 7.117 -8.205 10.499 259 HB3 ARG 30 2HB ARG 30 7.522 -8.195 12.209 260 HG2 ARG 30 1HG ARG 30 9.899 -8.200 11.650 261 HG3 ARG 30 2HG ARG 30 9.494 -8.212 9.933 262 HD2 ARG 30 1HD ARG 30 8.351 -6.062 10.193 263 HD3 ARG 30 2HD ARG 30 8.758 -6.053 11.908 264 HE ARG 30 HE ARG 30 11.125 -6.328 10.442 265 HH11 ARG 30 1HH1 ARG 30 8.637 -3.940 11.012 266 HH12 ARG 30 2HH1 ARG 30 9.696 -2.595 10.751 267 HH21 ARG 30 1HH2 ARG 30 12.513 -4.559 10.100 268 HH22 ARG 30 2HH2 ARG 30 11.894 -2.947 10.232 269 H HIS 31 H HIS 31 5.755 -11.018 10.210 270 HA HIS 31 HA HIS 31 4.047 -10.906 12.479 271 HB2 HIS 31 1HB HIS 31 3.508 -10.963 9.907 272 HB3 HIS 31 2HB HIS 31 3.474 -12.705 10.159 273 HD1 HIS 31 HD1 HIS 31 1.568 -9.589 10.841 274 HD2 HIS 31 HD2 HIS 31 1.339 -13.632 11.771 275 HE1 HIS 31 HE1 HIS 31 -0.746 -9.936 11.761 276 HE2 HIS 31 HE2 HIS 31 -0.890 -12.407 12.234 277 H ILE 32 H ILE 32 6.415 -13.164 11.519 278 HA ILE 32 HA ILE 32 5.206 -15.468 12.776 279 HB ILE 32 HB ILE 32 8.120 -15.282 12.054 280 HG12 ILE 32 1HG1 ILE 32 6.182 -16.281 10.024 281 HG13 ILE 32 2HG1 ILE 32 6.317 -14.537 10.216 282 HG21 ILE 32 1HG2 ILE 32 7.832 -17.677 11.588 283 HG22 ILE 32 2HG2 ILE 32 6.131 -17.553 12.038 284 HG23 ILE 32 3HG2 ILE 32 7.384 -17.271 13.245 285 HD11 ILE 32 3HD1 ILE 32 7.764 -15.320 8.446 286 HD12 ILE 32 1HD1 ILE 32 8.561 -16.432 9.560 287 HD13 ILE 32 2HD1 ILE 32 8.724 -14.690 9.784 288 H VAL 33 H VAL 33 6.849 -12.748 13.881 289 HA VAL 33 HA VAL 33 8.032 -14.084 16.197 290 HB VAL 33 HB VAL 33 8.068 -11.111 15.711 291 HG11 VAL 33 1HG1 VAL 33 8.793 -11.868 17.906 292 HG12 VAL 33 2HG1 VAL 33 10.157 -11.228 16.990 293 HG13 VAL 33 3HG1 VAL 33 9.950 -12.970 17.159 294 HG21 VAL 33 3HG2 VAL 33 10.208 -11.385 14.544 295 HG22 VAL 33 1HG2 VAL 33 8.884 -12.145 13.662 296 HG23 VAL 33 2HG2 VAL 33 10.008 -13.135 14.594 297 H ARG 34 H ARG 34 5.618 -11.585 15.449 298 HA ARG 34 HA ARG 34 4.397 -12.083 18.082 299 HB2 ARG 34 1HB ARG 34 4.860 -9.450 16.691 300 HB3 ARG 34 2HB ARG 34 3.654 -9.635 17.956 301 HG2 ARG 34 1HG ARG 34 5.397 -10.331 19.520 302 HG3 ARG 34 2HG ARG 34 6.608 -10.147 18.250 303 HD2 ARG 34 1HD ARG 34 4.817 -7.893 19.119 304 HD3 ARG 34 2HD ARG 34 6.365 -8.224 19.896 305 HE ARG 34 HE ARG 34 6.782 -8.053 17.133 306 HH11 ARG 34 1HH1 ARG 34 5.888 -5.980 19.803 307 HH12 ARG 34 2HH1 ARG 34 6.556 -4.556 19.080 308 HH21 ARG 34 1HH2 ARG 34 7.658 -6.179 16.187 309 HH22 ARG 34 2HH2 ARG 34 7.561 -4.668 17.028 310 H LYS 35 H LYS 35 2.321 -12.649 18.017 311 HA LYS 35 HA LYS 35 0.743 -11.986 15.623 312 HB2 LYS 35 1HB LYS 35 0.993 -14.654 17.002 313 HB3 LYS 35 2HB LYS 35 -0.374 -14.262 15.969 314 HG2 LYS 35 1HG LYS 35 1.148 -13.894 14.094 315 HG3 LYS 35 2HG LYS 35 2.519 -14.287 15.132 316 HD2 LYS 35 1HD LYS 35 1.596 -16.532 15.486 317 HD3 LYS 35 2HD LYS 35 0.239 -16.134 14.430 318 HE2 LYS 35 1HE LYS 35 1.790 -15.788 12.570 319 HE3 LYS 35 2HE LYS 35 3.145 -16.182 13.625 320 HZ1 LYS 35 3HZ LYS 35 0.925 -18.019 12.903 321 HZ2 LYS 35 1HZ LYS 35 2.225 -18.399 13.916 322 HZ3 LYS 35 2HZ LYS 35 2.494 -18.076 12.277 323 H ARG 36 H ARG 36 0.664 -12.975 19.029 324 HA ARG 36 HA ARG 36 -1.839 -11.477 19.326 325 HB2 ARG 36 1HB ARG 36 -1.159 -14.199 20.415 326 HB3 ARG 36 2HB ARG 36 -2.414 -13.202 21.136 327 HG2 ARG 36 1HG ARG 36 -3.615 -13.169 19.010 328 HG3 ARG 36 2HG ARG 36 -2.354 -14.166 18.283 329 HD2 ARG 36 1HD ARG 36 -2.848 -15.951 19.883 330 HD3 ARG 36 2HD ARG 36 -4.106 -14.953 20.609 331 HE ARG 36 HE ARG 36 -4.640 -15.200 17.873 332 HH11 ARG 36 1HH1 ARG 36 -4.584 -17.189 20.747 333 HH12 ARG 36 2HH1 ARG 36 -5.794 -18.282 20.162 334 HH21 ARG 36 1HH2 ARG 36 -6.229 -16.638 17.109 335 HH22 ARG 36 2HH2 ARG 36 -6.727 -17.969 18.099 336 H THR 37 H THR 37 1.150 -11.050 19.909 337 HA THR 37 HA THR 37 1.238 -10.785 22.789 338 HB THR 37 HB THR 37 3.293 -9.466 21.082 339 HG1 THR 37 HG1 THR 37 4.269 -11.520 20.693 340 HG21 THR 37 3HG2 THR 37 3.509 -9.486 23.520 341 HG22 THR 37 1HG2 THR 37 4.801 -10.421 22.768 342 HG23 THR 37 2HG2 THR 37 3.436 -11.248 23.520 343 H LEU 38 H LEU 38 0.662 -8.732 20.020 344 HA LEU 38 HA LEU 38 0.747 -6.304 21.607 345 HB2 LEU 38 1HB LEU 38 1.627 -6.524 19.206 346 HB3 LEU 38 2HB LEU 38 -0.055 -6.506 18.716 347 HG LEU 38 HG LEU 38 -0.310 -4.271 19.766 348 HD11 LEU 38 1HD1 LEU 38 2.561 -4.738 20.440 349 HD12 LEU 38 2HD1 LEU 38 1.273 -4.042 21.426 350 HD13 LEU 38 3HD1 LEU 38 1.993 -3.098 20.122 351 HD21 LEU 38 3HD2 LEU 38 1.721 -4.708 17.603 352 HD22 LEU 38 1HD2 LEU 38 1.226 -3.090 18.095 353 HD23 LEU 38 2HD2 LEU 38 0.033 -4.220 17.455 354 H ARG 39 H ARG 39 -1.526 -8.389 20.013 355 HA ARG 39 HA ARG 39 -3.864 -6.861 20.332 356 HB2 ARG 39 1HB ARG 39 -3.390 -9.806 19.874 357 HB3 ARG 39 2HB ARG 39 -5.004 -9.127 20.021 358 HG2 ARG 39 1HG ARG 39 -3.130 -7.939 18.036 359 HG3 ARG 39 2HG ARG 39 -3.891 -9.488 17.674 360 HD2 ARG 39 1HD ARG 39 -6.096 -8.487 18.039 361 HD3 ARG 39 2HD ARG 39 -5.333 -6.939 18.402 362 HE ARG 39 HE ARG 39 -4.465 -7.781 15.879 363 HH11 ARG 39 1HH1 ARG 39 -7.402 -6.697 17.434 364 HH12 ARG 39 2HH1 ARG 39 -8.070 -6.029 15.982 365 HH21 ARG 39 1HH2 ARG 39 -5.345 -6.902 13.975 366 HH22 ARG 39 2HH2 ARG 39 -6.903 -6.146 14.020 367 H ARG 40 H ARG 40 -2.033 -9.056 22.304 368 HA ARG 40 HA ARG 40 -4.002 -9.413 24.352 369 HB2 ARG 40 1HB ARG 40 -1.112 -9.988 24.018 370 HB3 ARG 40 2HB ARG 40 -1.641 -9.724 25.672 371 HG2 ARG 40 1HG ARG 40 -3.309 -11.492 25.424 372 HG3 ARG 40 2HG ARG 40 -2.780 -11.756 23.762 373 HD2 ARG 40 1HD ARG 40 -1.695 -13.414 25.027 374 HD3 ARG 40 2HD ARG 40 -0.469 -12.184 24.727 375 HE ARG 40 HE ARG 40 -1.706 -11.619 27.172 376 HH11 ARG 40 1HH1 ARG 40 0.385 -14.043 25.769 377 HH12 ARG 40 2HH1 ARG 40 1.147 -14.435 27.273 378 HH21 ARG 40 1HH2 ARG 40 -0.702 -12.136 29.148 379 HH22 ARG 40 2HH2 ARG 40 0.529 -13.354 29.191 380 H LEU 41 H LEU 41 -1.943 -6.988 23.292 381 HA LEU 41 HA LEU 41 -2.344 -5.341 25.675 382 HB2 LEU 41 1HB LEU 41 -0.309 -5.061 23.459 383 HB3 LEU 41 2HB LEU 41 -0.484 -3.959 24.808 384 HG LEU 41 HG LEU 41 0.074 -6.854 25.338 385 HD11 LEU 41 1HD1 LEU 41 2.105 -4.775 24.545 386 HD12 LEU 41 2HD1 LEU 41 1.746 -6.285 23.710 387 HD13 LEU 41 3HD1 LEU 41 2.493 -6.315 25.307 388 HD21 LEU 41 3HD2 LEU 41 -0.497 -5.032 27.085 389 HD22 LEU 41 1HD2 LEU 41 1.154 -4.478 26.802 390 HD23 LEU 41 2HD2 LEU 41 0.861 -6.114 27.390 391 H LEU 42 H LEU 42 -2.921 -5.693 22.224 392 HA LEU 42 HA LEU 42 -3.775 -2.950 21.870 393 HB2 LEU 42 1HB LEU 42 -2.900 -4.797 20.132 394 HB3 LEU 42 2HB LEU 42 -4.626 -5.028 19.938 395 HG LEU 42 HG LEU 42 -3.532 -2.257 19.749 396 HD11 LEU 42 1HD1 LEU 42 -3.091 -2.560 17.373 397 HD12 LEU 42 2HD1 LEU 42 -3.428 -4.286 17.522 398 HD13 LEU 42 3HD1 LEU 42 -2.036 -3.584 18.347 399 HD21 LEU 42 3HD2 LEU 42 -5.766 -3.725 18.352 400 HD22 LEU 42 1HD2 LEU 42 -5.371 -2.017 18.157 401 HD23 LEU 42 2HD2 LEU 42 -5.944 -2.618 19.714 402 H GLN 43 H GLN 43 -5.393 -6.094 22.114 403 HA GLN 43 HA GLN 43 -8.022 -4.889 22.090 404 HB2 GLN 43 1HB GLN 43 -7.007 -7.710 22.365 405 HB3 GLN 43 2HB GLN 43 -8.697 -7.320 22.648 406 HG2 GLN 43 1HG GLN 43 -7.400 -6.451 20.109 407 HG3 GLN 43 2HG GLN 43 -7.894 -8.132 20.305 408 HE21 GLN 43 2HE2 GLN 43 -8.964 -4.839 20.037 409 HE22 GLN 43 1HE2 GLN 43 -10.632 -5.188 19.756 410 H GLU 44 H GLU 44 -5.644 -5.141 24.355 411 HA GLU 44 HA GLU 44 -7.287 -5.782 26.651 412 HB2 GLU 44 1HB GLU 44 -4.682 -6.111 26.235 413 HB3 GLU 44 2HB GLU 44 -4.611 -4.506 26.952 414 HG2 GLU 44 1HG GLU 44 -5.788 -5.341 28.928 415 HG3 GLU 44 2HG GLU 44 -5.838 -6.951 28.211 416 H ARG 45 H ARG 45 -5.873 -2.871 25.217 417 HA ARG 45 HA ARG 45 -6.964 -1.183 27.312 418 HB2 ARG 45 1HB ARG 45 -5.026 -0.854 25.105 419 HB3 ARG 45 2HB ARG 45 -5.984 0.568 25.494 420 HG2 ARG 45 1HG ARG 45 -4.591 -0.941 27.665 421 HG3 ARG 45 2HG ARG 45 -3.700 0.199 26.656 422 HD2 ARG 45 1HD ARG 45 -5.278 1.969 27.266 423 HD3 ARG 45 2HD ARG 45 -6.166 0.828 28.276 424 HE ARG 45 HE ARG 45 -3.494 0.846 29.105 425 HH11 ARG 45 1HH1 ARG 45 -6.266 2.977 29.078 426 HH12 ARG 45 2HH1 ARG 45 -5.768 3.843 30.494 427 HH21 ARG 45 1HH2 ARG 45 -2.845 1.985 30.964 428 HH22 ARG 45 2HH2 ARG 45 -3.827 3.280 31.562 429 H GLU 46 H GLU 46 -8.021 -2.467 24.380 430 HA GLU 46 HA GLU 46 -9.696 -0.250 23.593 431 HB2 GLU 46 1HB GLU 46 -9.343 -3.062 22.593 432 HB3 GLU 46 2HB GLU 46 -10.650 -2.046 22.006 433 HG2 GLU 46 1HG GLU 46 -8.955 -0.364 21.322 434 HG3 GLU 46 2HG GLU 46 -7.699 -1.514 21.777 435 H LEU 47 H LEU 47 -9.969 -3.016 25.644 436 HA LEU 47 HA LEU 47 -12.878 -2.742 25.752 437 HB2 LEU 47 1HB LEU 47 -11.041 -4.893 26.786 438 HB3 LEU 47 2HB LEU 47 -12.760 -4.853 27.127 439 HG LEU 47 HG LEU 47 -11.900 -4.787 24.274 440 HD11 LEU 47 1HD1 LEU 47 -10.506 -6.543 25.209 441 HD12 LEU 47 2HD1 LEU 47 -11.790 -7.234 24.220 442 HD13 LEU 47 3HD1 LEU 47 -11.913 -7.273 25.978 443 HD21 LEU 47 3HD2 LEU 47 -14.183 -6.105 25.742 444 HD22 LEU 47 1HD2 LEU 47 -13.952 -6.086 23.993 445 HD23 LEU 47 2HD2 LEU 47 -14.260 -4.579 24.858 446 H VAL 48 H VAL 48 -10.359 -1.388 27.148 447 HA VAL 48 HA VAL 48 -11.768 -0.989 29.705 448 HB VAL 48 HB VAL 48 -8.761 -0.887 29.523 449 HG11 VAL 48 1HG1 VAL 48 -9.781 0.217 31.439 450 HG12 VAL 48 2HG1 VAL 48 -8.901 -1.223 31.949 451 HG13 VAL 48 3HG1 VAL 48 -10.661 -1.259 31.839 452 HG21 VAL 48 3HG2 VAL 48 -9.600 -3.145 28.844 453 HG22 VAL 48 1HG2 VAL 48 -10.343 -3.283 30.437 454 HG23 VAL 48 2HG2 VAL 48 -8.591 -3.141 30.291 455 H GLU 49 H GLU 49 -12.483 0.694 27.889 456 HA GLU 49 HA GLU 49 -10.738 3.050 27.982 457 HB2 GLU 49 1HB GLU 49 -13.079 2.305 26.240 458 HB3 GLU 49 2HB GLU 49 -12.445 3.943 26.292 459 HG2 GLU 49 1HG GLU 49 -10.265 3.124 25.559 460 HG3 GLU 49 2HG GLU 49 -10.901 1.480 25.508 461 HA PRO 50 HA PRO 50 -13.288 5.067 30.987 462 HB2 PRO 50 1HB PRO 50 -12.888 7.682 30.304 463 HB3 PRO 50 2HB PRO 50 -11.668 6.698 31.134 464 HG2 PRO 50 1HG PRO 50 -11.868 7.415 28.252 465 HG3 PRO 50 2HG PRO 50 -10.438 7.333 29.301 466 HD2 PRO 50 1HD PRO 50 -11.073 5.369 27.548 467 HD3 PRO 50 2HD PRO 50 -10.235 5.059 29.081 468 H LEU 51 H LEU 51 -15.399 5.528 31.169 469 HA LEU 51 HA LEU 51 -16.809 6.859 29.011 470 HB2 LEU 51 1HB LEU 51 -16.899 4.264 28.821 471 HB3 LEU 51 2HB LEU 51 -18.001 4.364 30.179 472 HG LEU 51 HG LEU 51 -19.240 6.101 28.601 473 HD11 LEU 51 1HD1 LEU 51 -17.817 4.289 26.655 474 HD12 LEU 51 2HD1 LEU 51 -17.574 6.028 26.825 475 HD13 LEU 51 3HD1 LEU 51 -19.125 5.404 26.261 476 HD21 LEU 51 3HD2 LEU 51 -20.646 4.254 27.809 477 HD22 LEU 51 1HD2 LEU 51 -20.230 4.080 29.514 478 HD23 LEU 51 2HD2 LEU 51 -19.402 3.105 28.300 479 H THR 52 H THR 52 -16.944 8.584 30.440 480 HA THR 52 HA THR 52 -18.495 8.202 32.897 481 HB THR 52 HB THR 52 -17.903 10.651 33.289 482 HG1 THR 52 HG1 THR 52 -15.752 10.922 31.936 483 HG21 THR 52 3HG2 THR 52 -16.747 8.828 34.435 484 HG22 THR 52 1HG2 THR 52 -15.625 10.128 34.036 485 HG23 THR 52 2HG2 THR 52 -15.645 8.654 33.068 486 HA PRO 53 HA PRO 53 -22.194 9.846 31.086 487 HB2 PRO 53 1HB PRO 53 -23.408 10.855 33.315 488 HB3 PRO 53 2HB PRO 53 -23.311 9.118 32.966 489 HG2 PRO 53 1HG PRO 53 -21.652 10.764 34.810 490 HG3 PRO 53 2HG PRO 53 -22.312 9.132 35.034 491 HD2 PRO 53 1HD PRO 53 -19.730 9.580 34.354 492 HD3 PRO 53 2HD PRO 53 -20.623 8.135 33.844 493 H SER 54 H SER 54 -22.184 11.583 29.836 494 HA SER 54 HA SER 54 -21.305 14.161 30.932 495 HB2 SER 54 1HB SER 54 -21.640 13.278 28.054 496 HB3 SER 54 2HB SER 54 -21.065 14.862 28.573 497 HG SER 54 HG SER 54 -19.668 12.882 29.770 498 H GLY 55 H GLY 55 -24.090 12.444 30.150 499 HA2 GLY 55 1HA GLY 55 -25.918 14.339 30.915 500 HA3 GLY 55 2HA GLY 55 -25.710 14.609 29.191 501 H GLU 56 H GLU 56 -25.592 12.246 28.045 502 HA GLU 56 HA GLU 56 -27.949 10.750 28.987 503 HB2 GLU 56 1HB GLU 56 -27.296 11.684 26.198 504 HB3 GLU 56 2HB GLU 56 -28.413 10.359 26.498 505 HG2 GLU 56 1HG GLU 56 -29.830 11.845 27.814 506 HG3 GLU 56 2HG GLU 56 -28.708 13.173 27.527 507 H LYS 57 H LYS 57 -27.845 8.558 28.876 508 HA LYS 57 HA LYS 57 -25.243 7.393 28.406 509 HB2 LYS 57 1HB LYS 57 -27.828 6.296 29.500 510 HB3 LYS 57 2HB LYS 57 -26.428 5.278 29.200 511 HG2 LYS 57 1HG LYS 57 -26.125 5.749 31.412 512 HG3 LYS 57 2HG LYS 57 -25.209 7.071 30.688 513 HD2 LYS 57 1HD LYS 57 -27.149 8.546 30.934 514 HD3 LYS 57 2HD LYS 57 -28.067 7.222 31.651 515 HE2 LYS 57 1HE LYS 57 -25.473 8.217 32.804 516 HE3 LYS 57 2HE LYS 57 -27.036 8.893 33.260 517 HZ1 LYS 57 3HZ LYS 57 -27.727 6.696 33.998 518 HZ2 LYS 57 1HZ LYS 57 -26.327 7.185 34.811 519 HZ3 LYS 57 2HZ LYS 57 -26.227 6.049 33.561 520 H LEU 58 H LEU 58 -28.493 7.177 27.031 521 HA LEU 58 HA LEU 58 -27.617 5.271 25.027 522 HB2 LEU 58 1HB LEU 58 -29.906 5.331 26.268 523 HB3 LEU 58 2HB LEU 58 -30.324 6.552 25.082 524 HG LEU 58 HG LEU 58 -29.492 4.688 23.385 525 HD11 LEU 58 1HD1 LEU 58 -30.427 3.093 25.767 526 HD12 LEU 58 2HD1 LEU 58 -28.793 3.110 25.103 527 HD13 LEU 58 3HD1 LEU 58 -30.125 2.456 24.150 528 HD21 LEU 58 3HD2 LEU 58 -31.822 3.948 23.188 529 HD22 LEU 58 1HD2 LEU 58 -31.703 5.696 23.393 530 HD23 LEU 58 2HD2 LEU 58 -32.180 4.680 24.753 531 H TRP 59 H TRP 59 -27.597 8.581 25.380 532 HA TRP 59 HA TRP 59 -27.428 8.966 22.468 533 HB2 TRP 59 1HB TRP 59 -29.547 9.906 23.709 534 HB3 TRP 59 2HB TRP 59 -28.441 11.175 24.222 535 HD1 TRP 59 HD1 TRP 59 -27.576 12.880 22.364 536 HE1 TRP 59 HE1 TRP 59 -28.424 13.441 20.001 537 HE3 TRP 59 HE3 TRP 59 -30.639 8.849 21.614 538 HZ2 TRP 59 HZ2 TRP 59 -30.158 12.327 18.074 539 HZ3 TRP 59 HZ3 TRP 59 -31.855 8.674 19.484 540 HH2 TRP 59 HH2 TRP 59 -31.619 10.379 17.752 541 H SER 60 H SER 60 -25.844 10.359 21.746 542 HA SER 60 HA SER 60 -23.824 11.091 23.746 543 HB2 SER 60 1HB SER 60 -23.172 9.597 21.831 544 HB3 SER 60 2HB SER 60 -23.493 10.947 20.740 545 HG SER 60 HG SER 60 -21.567 10.844 22.822 546 H1 LYS 61 1H LYS 61 -0.334 8.151 -32.979 547 H2 LYS 61 2H LYS 61 -0.185 7.578 -31.395 548 H3 LYS 61 3H LYS 61 1.011 8.582 -32.047 549 HA LYS 61 HA LYS 61 -0.525 10.413 -32.182 550 HB2 LYS 61 1HB LYS 61 -2.473 8.596 -32.294 551 HB3 LYS 61 2HB LYS 61 -2.536 8.917 -30.567 552 HG2 LYS 61 1HG LYS 61 -2.885 11.294 -31.018 553 HG3 LYS 61 2HG LYS 61 -2.819 10.971 -32.751 554 HD2 LYS 61 1HD LYS 61 -4.779 9.514 -32.553 555 HD3 LYS 61 2HD LYS 61 -4.842 9.837 -30.818 556 HE2 LYS 61 1HE LYS 61 -4.995 12.016 -32.887 557 HE3 LYS 61 2HE LYS 61 -6.423 11.176 -32.283 558 HZ1 LYS 61 3HZ LYS 61 -5.861 11.902 -30.048 559 HZ2 LYS 61 1HZ LYS 61 -6.033 13.231 -31.081 560 HZ3 LYS 61 2HZ LYS 61 -4.490 12.707 -30.627 561 H ILE 62 H ILE 62 -0.243 8.026 -29.581 562 HA ILE 62 HA ILE 62 0.774 10.148 -27.830 563 HB ILE 62 HB ILE 62 -0.410 8.920 -25.898 564 HG12 ILE 62 1HG1 ILE 62 -2.775 8.174 -26.970 565 HG13 ILE 62 2HG1 ILE 62 -1.698 7.684 -28.274 566 HG21 ILE 62 1HG2 ILE 62 -1.991 10.575 -27.859 567 HG22 ILE 62 2HG2 ILE 62 -0.943 11.183 -26.576 568 HG23 ILE 62 3HG2 ILE 62 -2.417 10.305 -26.169 569 HD11 ILE 62 3HD1 ILE 62 -1.508 6.806 -25.401 570 HD12 ILE 62 1HD1 ILE 62 -0.427 6.313 -26.705 571 HD13 ILE 62 2HD1 ILE 62 -2.128 5.849 -26.747 572 HA PRO 63 HA PRO 63 4.013 7.245 -27.004 573 HB2 PRO 63 1HB PRO 63 4.831 8.115 -24.548 574 HB3 PRO 63 2HB PRO 63 5.194 8.981 -26.054 575 HG2 PRO 63 1HG PRO 63 3.093 9.538 -24.021 576 HG3 PRO 63 2HG PRO 63 4.132 10.667 -24.914 577 HD2 PRO 63 1HD PRO 63 1.552 10.210 -25.597 578 HD3 PRO 63 2HD PRO 63 2.804 10.629 -26.783 579 H SER 64 H SER 64 4.224 5.255 -26.142 580 HA SER 64 HA SER 64 2.108 4.234 -24.471 581 HB2 SER 64 1HB SER 64 4.564 2.871 -25.602 582 HB3 SER 64 2HB SER 64 3.226 2.053 -24.793 583 HG SER 64 HG SER 64 2.366 3.681 -26.789 584 H ILE 65 H ILE 65 4.995 5.769 -23.829 585 HA ILE 65 HA ILE 65 5.750 4.253 -21.483 586 HB ILE 65 HB ILE 65 6.775 7.001 -22.186 587 HG12 ILE 65 1HG1 ILE 65 8.685 5.334 -23.174 588 HG13 ILE 65 2HG1 ILE 65 7.228 4.429 -23.573 589 HG21 ILE 65 1HG2 ILE 65 8.014 4.671 -20.724 590 HG22 ILE 65 2HG2 ILE 65 7.390 6.150 -19.993 591 HG23 ILE 65 3HG2 ILE 65 8.802 6.214 -21.048 592 HD11 ILE 65 3HD1 ILE 65 7.789 7.280 -24.357 593 HD12 ILE 65 1HD1 ILE 65 6.356 6.347 -24.784 594 HD13 ILE 65 2HD1 ILE 65 7.936 5.869 -25.405 595 H ALA 66 H ALA 66 3.941 7.167 -22.224 596 HA ALA 66 HA ALA 66 3.739 7.988 -19.457 597 HB1 ALA 66 3HB ALA 66 3.852 9.641 -21.280 598 HB2 ALA 66 1HB ALA 66 2.406 9.825 -20.288 599 HB3 ALA 66 2HB ALA 66 2.296 9.064 -21.875 600 H THR 67 H THR 67 1.885 6.128 -21.732 601 HA THR 67 HA THR 67 -0.656 6.288 -20.521 602 HB THR 67 HB THR 67 0.238 3.798 -21.929 603 HG1 THR 67 HG1 THR 67 -0.489 5.283 -23.851 604 HG21 THR 67 3HG2 THR 67 -2.292 5.449 -21.982 605 HG22 THR 67 1HG2 THR 67 -2.066 3.898 -21.172 606 HG23 THR 67 2HG2 THR 67 -2.019 3.989 -22.932 607 H GLY 68 H GLY 68 2.149 4.279 -19.855 608 HA2 GLY 68 1HA GLY 68 0.732 2.527 -18.040 609 HA3 GLY 68 2HA GLY 68 2.462 2.542 -18.341 610 H LEU 69 H LEU 69 2.992 5.227 -17.773 611 HA LEU 69 HA LEU 69 3.359 5.155 -14.991 612 HB2 LEU 69 1HB LEU 69 3.522 7.456 -16.939 613 HB3 LEU 69 2HB LEU 69 4.015 7.564 -15.260 614 HG LEU 69 HG LEU 69 5.242 5.502 -17.065 615 HD11 LEU 69 1HD1 LEU 69 7.097 7.203 -17.379 616 HD12 LEU 69 2HD1 LEU 69 5.926 8.421 -16.875 617 HD13 LEU 69 3HD1 LEU 69 5.627 7.455 -18.319 618 HD21 LEU 69 3HD2 LEU 69 5.663 5.284 -14.688 619 HD22 LEU 69 1HD2 LEU 69 6.192 6.964 -14.602 620 HD23 LEU 69 2HD2 LEU 69 7.136 5.788 -15.516 621 H VAL 70 H VAL 70 0.994 6.903 -16.986 622 HA VAL 70 HA VAL 70 -0.174 8.393 -14.924 623 HB VAL 70 HB VAL 70 -2.165 8.599 -16.402 624 HG11 VAL 70 1HG1 VAL 70 0.593 9.089 -17.484 625 HG12 VAL 70 2HG1 VAL 70 -0.514 10.231 -16.716 626 HG13 VAL 70 3HG1 VAL 70 -0.853 9.629 -18.340 627 HG21 VAL 70 3HG2 VAL 70 -2.145 6.387 -17.430 628 HG22 VAL 70 1HG2 VAL 70 -0.612 6.754 -18.223 629 HG23 VAL 70 2HG2 VAL 70 -2.069 7.644 -18.666 630 H GLY 71 H GLY 71 -0.874 5.157 -16.083 631 HA2 GLY 71 1HA GLY 71 -3.227 4.742 -14.541 632 HA3 GLY 71 2HA GLY 71 -2.248 3.486 -15.281 633 H ALA 72 H ALA 72 0.154 3.730 -14.020 634 HA ALA 72 HA ALA 72 -0.432 2.520 -11.498 635 HB1 ALA 72 3HB ALA 72 1.463 1.908 -13.066 636 HB2 ALA 72 1HB ALA 72 1.863 2.016 -11.351 637 HB3 ALA 72 2HB ALA 72 2.302 3.330 -12.443 638 H LEU 73 H LEU 73 0.993 5.627 -12.435 639 HA LEU 73 HA LEU 73 1.655 6.433 -9.808 640 HB2 LEU 73 1HB LEU 73 1.350 7.820 -12.432 641 HB3 LEU 73 2HB LEU 73 1.431 8.795 -10.976 642 HG LEU 73 HG LEU 73 3.613 7.687 -10.431 643 HD11 LEU 73 1HD1 LEU 73 3.377 6.597 -13.235 644 HD12 LEU 73 2HD1 LEU 73 3.322 5.645 -11.752 645 HD13 LEU 73 3HD1 LEU 73 4.800 6.498 -12.197 646 HD21 LEU 73 3HD2 LEU 73 3.466 9.143 -13.066 647 HD22 LEU 73 1HD2 LEU 73 4.906 8.965 -12.064 648 HD23 LEU 73 2HD2 LEU 73 3.526 9.888 -11.469 649 H LEU 74 H LEU 74 -1.243 6.934 -11.812 650 HA LEU 74 HA LEU 74 -2.572 8.568 -9.904 651 HB2 LEU 74 1HB LEU 74 -3.251 7.281 -12.455 652 HB3 LEU 74 2HB LEU 74 -4.603 7.472 -11.356 653 HG LEU 74 HG LEU 74 -3.861 9.943 -11.199 654 HD11 LEU 74 1HD1 LEU 74 -1.684 9.380 -12.434 655 HD12 LEU 74 2HD1 LEU 74 -2.552 10.843 -12.903 656 HD13 LEU 74 3HD1 LEU 74 -2.673 9.389 -13.894 657 HD21 LEU 74 3HD2 LEU 74 -5.919 9.201 -12.263 658 HD22 LEU 74 1HD2 LEU 74 -5.036 8.838 -13.746 659 HD23 LEU 74 2HD2 LEU 74 -5.172 10.504 -13.186 660 H LEU 75 H LEU 75 -2.562 5.104 -10.566 661 HA LEU 75 HA LEU 75 -4.635 4.463 -8.719 662 HB2 LEU 75 1HB LEU 75 -2.856 3.034 -10.491 663 HB3 LEU 75 2HB LEU 75 -2.966 2.221 -8.942 664 HG LEU 75 HG LEU 75 -5.602 2.732 -9.492 665 HD11 LEU 75 1HD1 LEU 75 -5.069 3.551 -11.725 666 HD12 LEU 75 2HD1 LEU 75 -5.987 2.048 -11.799 667 HD13 LEU 75 3HD1 LEU 75 -4.248 2.034 -12.092 668 HD21 LEU 75 3HD2 LEU 75 -4.658 0.644 -8.650 669 HD22 LEU 75 1HD2 LEU 75 -4.007 0.288 -10.250 670 HD23 LEU 75 2HD2 LEU 75 -5.751 0.353 -10.002 671 H LEU 76 H LEU 76 -1.129 4.676 -8.504 672 HA LEU 76 HA LEU 76 -0.899 3.618 -5.874 673 HB2 LEU 76 1HB LEU 76 0.904 3.974 -7.734 674 HB3 LEU 76 2HB LEU 76 1.061 5.570 -7.026 675 HG LEU 76 HG LEU 76 1.342 4.170 -4.791 676 HD11 LEU 76 1HD1 LEU 76 2.593 2.111 -5.189 677 HD12 LEU 76 2HD1 LEU 76 2.314 2.272 -6.922 678 HD13 LEU 76 3HD1 LEU 76 0.955 2.000 -5.831 679 HD21 LEU 76 3HD2 LEU 76 3.508 4.547 -6.854 680 HD22 LEU 76 1HD2 LEU 76 3.769 4.269 -5.132 681 HD23 LEU 76 2HD2 LEU 76 2.967 5.742 -5.676 682 H LEU 77 H LEU 77 -1.381 6.844 -7.199 683 HA LEU 77 HA LEU 77 -0.967 8.267 -4.779 684 HB2 LEU 77 1HB LEU 77 -2.295 8.928 -7.387 685 HB3 LEU 77 2HB LEU 77 -2.383 10.041 -6.035 686 HG LEU 77 HG LEU 77 0.285 9.049 -6.974 687 HD11 LEU 77 1HD1 LEU 77 0.426 10.972 -8.488 688 HD12 LEU 77 2HD1 LEU 77 -1.272 11.335 -8.176 689 HD13 LEU 77 3HD1 LEU 77 -0.825 9.834 -8.987 690 HD21 LEU 77 3HD2 LEU 77 -0.662 11.610 -5.689 691 HD22 LEU 77 1HD2 LEU 77 1.005 11.239 -6.129 692 HD23 LEU 77 2HD2 LEU 77 0.188 10.291 -4.885 693 H VAL 78 H VAL 78 -3.872 6.978 -6.371 694 HA VAL 78 HA VAL 78 -5.723 8.042 -4.491 695 HB VAL 78 HB VAL 78 -6.064 5.655 -6.323 696 HG11 VAL 78 1HG1 VAL 78 -8.470 6.066 -6.083 697 HG12 VAL 78 2HG1 VAL 78 -8.132 7.341 -4.911 698 HG13 VAL 78 3HG1 VAL 78 -7.721 5.668 -4.536 699 HG21 VAL 78 3HG2 VAL 78 -5.511 7.678 -7.563 700 HG22 VAL 78 1HG2 VAL 78 -6.797 8.553 -6.733 701 HG23 VAL 78 2HG2 VAL 78 -7.197 7.228 -7.826 702 H VAL 79 H VAL 79 -4.158 4.857 -4.799 703 HA VAL 79 HA VAL 79 -5.458 3.659 -2.587 704 HB VAL 79 HB VAL 79 -2.807 2.969 -3.877 705 HG11 VAL 79 1HG1 VAL 79 -2.728 1.970 -1.741 706 HG12 VAL 79 2HG1 VAL 79 -3.252 0.695 -2.839 707 HG13 VAL 79 3HG1 VAL 79 -4.429 1.507 -1.807 708 HG21 VAL 79 3HG2 VAL 79 -4.698 2.793 -5.399 709 HG22 VAL 79 1HG2 VAL 79 -5.563 1.791 -4.233 710 HG23 VAL 79 2HG2 VAL 79 -4.085 1.191 -4.987 711 H ALA 80 H ALA 80 -2.353 5.359 -2.895 712 HA ALA 80 HA ALA 80 -1.513 4.972 -0.215 713 HB1 ALA 80 3HB ALA 80 0.038 5.567 -2.014 714 HB2 ALA 80 1HB ALA 80 0.136 6.704 -0.669 715 HB3 ALA 80 2HB ALA 80 -0.723 7.153 -2.143 716 H LEU 81 H LEU 81 -3.390 7.493 -1.820 717 HA LEU 81 HA LEU 81 -3.483 9.287 0.382 718 HB2 LEU 81 1HB LEU 81 -4.053 9.626 -2.162 719 HB3 LEU 81 2HB LEU 81 -5.665 9.154 -1.660 720 HG LEU 81 HG LEU 81 -5.247 11.053 0.162 721 HD11 LEU 81 1HD1 LEU 81 -2.976 11.548 -0.562 722 HD12 LEU 81 2HD1 LEU 81 -4.035 12.934 -0.818 723 HD13 LEU 81 3HD1 LEU 81 -3.563 11.922 -2.184 724 HD21 LEU 81 3HD2 LEU 81 -6.414 12.606 -1.336 725 HD22 LEU 81 1HD2 LEU 81 -7.105 10.984 -1.401 726 HD23 LEU 81 2HD2 LEU 81 -6.055 11.548 -2.701 727 H GLY 82 H GLY 82 -5.505 6.603 -0.680 728 HA2 GLY 82 1HA GLY 82 -7.647 7.035 1.136 729 HA3 GLY 82 2HA GLY 82 -7.287 5.530 0.303 730 H ILE 83 H ILE 83 -4.863 4.806 1.257 731 HA ILE 83 HA ILE 83 -5.459 3.741 3.806 732 HB ILE 83 HB ILE 83 -2.725 3.948 2.523 733 HG12 ILE 83 1HG1 ILE 83 -4.454 1.503 2.382 734 HG13 ILE 83 2HG1 ILE 83 -4.727 2.813 1.240 735 HG21 ILE 83 1HG2 ILE 83 -2.362 3.300 4.730 736 HG22 ILE 83 2HG2 ILE 83 -2.435 1.765 3.863 737 HG23 ILE 83 3HG2 ILE 83 -3.829 2.324 4.788 738 HD11 ILE 83 3HD1 ILE 83 -2.128 1.344 1.629 739 HD12 ILE 83 1HD1 ILE 83 -2.434 2.626 0.458 740 HD13 ILE 83 2HD1 ILE 83 -3.278 1.085 0.317 741 H GLY 84 H GLY 84 -3.439 6.464 2.771 742 HA2 GLY 84 1HA GLY 84 -2.339 7.092 5.296 743 HA3 GLY 84 2HA GLY 84 -2.481 8.197 3.937 744 H LEU 85 H LEU 85 -5.232 8.314 3.633 745 HA LEU 85 HA LEU 85 -5.946 10.122 5.725 746 HB2 LEU 85 1HB LEU 85 -7.432 9.033 3.345 747 HB3 LEU 85 2HB LEU 85 -8.189 10.114 4.497 748 HG LEU 85 HG LEU 85 -5.639 10.917 3.138 749 HD11 LEU 85 1HD1 LEU 85 -8.424 11.195 2.017 750 HD12 LEU 85 2HD1 LEU 85 -7.105 10.244 1.333 751 HD13 LEU 85 3HD1 LEU 85 -6.987 12.003 1.391 752 HD21 LEU 85 3HD2 LEU 85 -6.582 13.166 3.477 753 HD22 LEU 85 1HD2 LEU 85 -6.401 12.283 4.994 754 HD23 LEU 85 2HD2 LEU 85 -7.992 12.442 4.252 755 H PHE 86 H PHE 86 -6.492 6.757 5.116 756 HA PHE 86 HA PHE 86 -8.752 6.441 6.837 757 HB2 PHE 86 1HB PHE 86 -7.104 4.748 5.148 758 HB3 PHE 86 2HB PHE 86 -7.481 3.963 6.679 759 HD1 PHE 86 HD1 PHE 86 -8.847 5.286 3.559 760 HD2 PHE 86 HD2 PHE 86 -9.753 3.375 7.252 761 HE1 PHE 86 HE1 PHE 86 -11.076 4.693 2.702 762 HE2 PHE 86 HE2 PHE 86 -11.983 2.779 6.402 763 HZ PHE 86 HZ PHE 86 -12.647 3.438 4.124 764 H ILE 87 H ILE 87 -5.253 6.020 7.218 765 HA ILE 87 HA ILE 87 -5.516 5.157 9.972 766 HB ILE 87 HB ILE 87 -2.969 5.952 8.554 767 HG12 ILE 87 1HG1 ILE 87 -3.878 3.106 8.848 768 HG13 ILE 87 2HG1 ILE 87 -4.462 4.069 7.496 769 HG21 ILE 87 1HG2 ILE 87 -3.478 4.190 10.954 770 HG22 ILE 87 2HG2 ILE 87 -2.782 5.809 10.979 771 HG23 ILE 87 3HG2 ILE 87 -1.904 4.485 10.214 772 HD11 ILE 87 3HD1 ILE 87 -2.200 4.421 6.729 773 HD12 ILE 87 1HD1 ILE 87 -2.511 2.696 6.923 774 HD13 ILE 87 2HD1 ILE 87 -1.563 3.564 8.131 775 H ARG 88 H ARG 88 -4.959 8.131 8.242 776 HA ARG 88 HA ARG 88 -3.801 9.664 10.303 777 HB2 ARG 88 1HB ARG 88 -4.237 10.131 7.716 778 HB3 ARG 88 2HB ARG 88 -5.641 10.972 8.359 779 HG2 ARG 88 1HG ARG 88 -4.179 12.351 9.750 780 HG3 ARG 88 2HG ARG 88 -2.771 11.505 9.107 781 HD2 ARG 88 1HD ARG 88 -3.333 12.287 6.857 782 HD3 ARG 88 2HD ARG 88 -4.741 13.130 7.501 783 HE ARG 88 HE ARG 88 -2.477 14.023 8.878 784 HH11 ARG 88 1HH1 ARG 88 -3.837 14.175 5.661 785 HH12 ARG 88 2HH1 ARG 88 -3.093 15.693 5.286 786 HH21 ARG 88 1HH2 ARG 88 -1.503 16.018 8.381 787 HH22 ARG 88 2HH2 ARG 88 -1.769 16.740 6.828 788 H ARG 89 H ARG 89 -7.064 8.646 9.735 789 HA ARG 89 HA ARG 89 -8.268 10.611 11.477 790 HB2 ARG 89 1HB ARG 89 -9.322 8.181 10.043 791 HB3 ARG 89 2HB ARG 89 -10.312 9.097 11.172 792 HG2 ARG 89 1HG ARG 89 -10.022 11.101 9.804 793 HG3 ARG 89 2HG ARG 89 -9.027 10.183 8.673 794 HD2 ARG 89 1HD ARG 89 -11.171 10.237 7.708 795 HD3 ARG 89 2HD ARG 89 -11.021 8.629 8.415 796 HE ARG 89 HE ARG 89 -12.209 10.314 10.305 797 HH11 ARG 89 1HH1 ARG 89 -12.956 8.892 7.202 798 HH12 ARG 89 2HH1 ARG 89 -14.664 8.863 7.488 799 HH21 ARG 89 1HH2 ARG 89 -14.452 10.274 10.678 800 HH22 ARG 89 2HH2 ARG 89 -15.513 9.648 9.461 801 H ARG 90 H ARG 90 -7.219 7.267 11.690 802 HA ARG 90 HA ARG 90 -8.315 6.917 14.352 803 HB2 ARG 90 1HB ARG 90 -6.725 5.143 12.510 804 HB3 ARG 90 2HB ARG 90 -7.072 4.685 14.172 805 HG2 ARG 90 1HG ARG 90 -9.468 4.826 13.713 806 HG3 ARG 90 2HG ARG 90 -9.119 5.288 12.046 807 HD2 ARG 90 1HD ARG 90 -7.979 3.150 11.696 808 HD3 ARG 90 2HD ARG 90 -8.328 2.692 13.362 809 HE ARG 90 HE ARG 90 -10.741 3.329 12.099 810 HH11 ARG 90 1HH1 ARG 90 -8.246 0.886 11.942 811 HH12 ARG 90 2HH1 ARG 90 -9.319 -0.349 11.373 812 HH21 ARG 90 1HH2 ARG 90 -12.148 1.704 11.352 813 HH22 ARG 90 2HH2 ARG 90 -11.532 0.117 11.038 814 H HIS 91 H HIS 91 -5.362 7.940 12.922 815 HA HIS 91 HA HIS 91 -3.579 7.246 15.025 816 HB2 HIS 91 1HB HIS 91 -3.127 7.977 12.538 817 HB3 HIS 91 2HB HIS 91 -3.076 9.592 13.237 818 HD1 HIS 91 HD1 HIS 91 -1.163 6.415 13.016 819 HD2 HIS 91 HD2 HIS 91 -0.885 10.076 14.963 820 HE1 HIS 91 HE1 HIS 91 1.183 6.520 13.916 821 HE2 HIS 91 HE2 HIS 91 1.355 8.782 15.015 822 H ILE 92 H ILE 92 -5.968 9.665 14.767 823 HA ILE 92 HA ILE 92 -4.707 11.568 16.543 824 HB ILE 92 HB ILE 92 -7.645 11.563 15.894 825 HG12 ILE 92 1HG1 ILE 92 -5.772 13.067 14.133 826 HG13 ILE 92 2HG1 ILE 92 -5.907 11.333 13.866 827 HG21 ILE 92 1HG2 ILE 92 -7.362 13.999 16.061 828 HG22 ILE 92 2HG2 ILE 92 -5.647 13.768 16.405 829 HG23 ILE 92 3HG2 ILE 92 -6.861 13.176 17.538 830 HD11 ILE 92 3HD1 ILE 92 -7.409 12.546 12.411 831 HD12 ILE 92 1HD1 ILE 92 -8.164 13.323 13.803 832 HD13 ILE 92 2HD1 ILE 92 -8.325 11.583 13.570 833 H VAL 93 H VAL 93 -6.325 8.645 16.951 834 HA VAL 93 HA VAL 93 -7.423 9.326 19.574 835 HB VAL 93 HB VAL 93 -7.488 6.581 18.329 836 HG11 VAL 93 1HG1 VAL 93 -8.136 6.736 20.669 837 HG12 VAL 93 2HG1 VAL 93 -9.535 6.351 19.664 838 HG13 VAL 93 3HG1 VAL 93 -9.313 7.990 20.276 839 HG21 VAL 93 3HG2 VAL 93 -9.666 7.142 17.347 840 HG22 VAL 93 1HG2 VAL 93 -8.368 8.112 16.651 841 HG23 VAL 93 2HG2 VAL 93 -9.455 8.820 17.846 842 H ARG 94 H ARG 94 -5.047 7.119 18.119 843 HA ARG 94 HA ARG 94 -3.737 6.917 20.749 844 HB2 ARG 94 1HB ARG 94 -4.258 4.737 18.733 845 HB3 ARG 94 2HB ARG 94 -3.008 4.591 19.961 846 HG2 ARG 94 1HG ARG 94 -4.696 4.846 21.712 847 HG3 ARG 94 2HG ARG 94 -5.949 4.994 20.479 848 HD2 ARG 94 1HD ARG 94 -4.140 2.600 20.667 849 HD3 ARG 94 2HD ARG 94 -5.659 2.709 21.555 850 HE ARG 94 HE ARG 94 -6.169 3.266 18.860 851 HH11 ARG 94 1HH1 ARG 94 -5.198 0.570 20.862 852 HH12 ARG 94 2HH1 ARG 94 -5.895 -0.620 19.814 853 HH21 ARG 94 1HH2 ARG 94 -7.086 1.700 17.486 854 HH22 ARG 94 2HH2 ARG 94 -6.965 0.023 17.900 855 H LYS 95 H LYS 95 -1.662 7.490 20.765 856 HA LYS 95 HA LYS 95 -0.167 7.482 18.230 857 HB2 LYS 95 1HB LYS 95 -0.358 9.697 20.265 858 HB3 LYS 95 2HB LYS 95 0.971 9.595 19.119 859 HG2 LYS 95 1HG LYS 95 -0.615 9.721 17.266 860 HG3 LYS 95 2HG LYS 95 -1.948 9.823 18.416 861 HD2 LYS 95 1HD LYS 95 -1.004 11.903 19.312 862 HD3 LYS 95 2HD LYS 95 0.316 11.801 18.145 863 HE2 LYS 95 1HE LYS 95 -1.299 11.946 16.312 864 HE3 LYS 95 2HE LYS 95 -2.616 12.045 17.479 865 HZ1 LYS 95 3HZ LYS 95 -0.412 14.016 17.187 866 HZ2 LYS 95 1HZ LYS 95 -1.678 14.112 18.308 867 HZ3 LYS 95 2HZ LYS 95 -2.003 14.227 16.652 868 H ARG 96 H ARG 96 0.029 7.547 21.770 869 HA ARG 96 HA ARG 96 2.534 6.035 21.581 870 HB2 ARG 96 1HB ARG 96 1.904 8.374 23.367 871 HB3 ARG 96 2HB ARG 96 3.179 7.229 23.759 872 HG2 ARG 96 1HG ARG 96 4.307 7.758 21.658 873 HG3 ARG 96 2HG ARG 96 3.026 8.905 21.262 874 HD2 ARG 96 1HD ARG 96 3.582 10.212 23.254 875 HD3 ARG 96 2HD ARG 96 4.859 9.065 23.653 876 HE ARG 96 HE ARG 96 5.302 10.020 21.059 877 HH11 ARG 96 1HH1 ARG 96 5.351 11.189 24.353 878 HH12 ARG 96 2HH1 ARG 96 6.546 12.402 24.036 879 HH21 ARG 96 1HH2 ARG 96 6.871 11.615 20.645 880 HH22 ARG 96 2HH2 ARG 96 7.408 12.643 21.932 881 H THR 97 H THR 97 -0.434 5.458 22.133 882 HA THR 97 HA THR 97 -0.427 4.448 24.844 883 HB THR 97 HB THR 97 -2.545 3.610 22.922 884 HG1 THR 97 HG1 THR 97 -3.524 5.691 23.116 885 HG21 THR 97 3HG2 THR 97 -2.678 2.993 25.287 886 HG22 THR 97 1HG2 THR 97 -3.991 4.087 24.848 887 HG23 THR 97 2HG2 THR 97 -2.599 4.694 25.743 888 H LEU 98 H LEU 98 0.047 3.193 21.617 889 HA LEU 98 HA LEU 98 0.004 0.433 22.515 890 HB2 LEU 98 1HB LEU 98 -0.955 1.270 20.287 891 HB3 LEU 98 2HB LEU 98 0.709 1.388 19.753 892 HG LEU 98 HG LEU 98 0.989 -1.042 20.172 893 HD11 LEU 98 1HD1 LEU 98 -1.856 -0.781 21.041 894 HD12 LEU 98 2HD1 LEU 98 -0.538 -1.705 21.768 895 HD13 LEU 98 3HD1 LEU 98 -1.306 -2.279 20.288 896 HD21 LEU 98 3HD2 LEU 98 -1.111 -0.065 18.270 897 HD22 LEU 98 1HD2 LEU 98 -0.607 -1.753 18.304 898 HD23 LEU 98 2HD2 LEU 98 0.568 -0.490 17.943 899 H ARG 99 H ARG 99 2.232 2.873 21.448 900 HA ARG 99 HA ARG 99 4.572 1.324 21.278 901 HB2 ARG 99 1HB ARG 99 4.097 4.287 21.621 902 HB3 ARG 99 2HB ARG 99 5.711 3.598 21.532 903 HG2 ARG 99 1HG ARG 99 3.767 2.961 19.370 904 HG3 ARG 99 2HG ARG 99 4.523 4.557 19.399 905 HD2 ARG 99 1HD ARG 99 6.734 3.503 19.416 906 HD3 ARG 99 2HD ARG 99 5.976 1.912 19.386 907 HE ARG 99 HE ARG 99 5.028 3.381 17.202 908 HH11 ARG 99 1HH1 ARG 99 8.010 1.941 18.321 909 HH12 ARG 99 2HH1 ARG 99 8.626 1.678 16.724 910 HH21 ARG 99 1HH2 ARG 99 5.840 3.033 15.106 911 HH22 ARG 99 2HH2 ARG 99 7.394 2.298 14.900 912 H ARG 100 H ARG 100 2.817 2.921 23.814 913 HA ARG 100 HA ARG 100 4.857 2.739 25.818 914 HB2 ARG 100 1HB ARG 100 1.958 3.368 25.741 915 HB3 ARG 100 2HB ARG 100 2.542 2.683 27.253 916 HG2 ARG 100 1HG ARG 100 4.208 4.461 27.418 917 HG3 ARG 100 2HG ARG 100 3.624 5.148 25.902 918 HD2 ARG 100 1HD ARG 100 2.591 6.413 27.593 919 HD3 ARG 100 2HD ARG 100 1.349 5.300 27.022 920 HE ARG 100 HE ARG 100 2.664 4.120 29.192 921 HH11 ARG 100 1HH1 ARG 100 0.539 6.818 28.541 922 HH12 ARG 100 2HH1 ARG 100 -0.170 6.799 30.121 923 HH21 ARG 100 1HH2 ARG 100 1.730 4.098 31.267 924 HH22 ARG 100 2HH2 ARG 100 0.507 5.256 31.667 925 H LEU 101 H LEU 101 2.751 0.665 24.230 926 HA LEU 101 HA LEU 101 3.225 -1.546 26.087 927 HB2 LEU 101 1HB LEU 101 1.115 -1.245 23.942 928 HB3 LEU 101 2HB LEU 101 1.330 -2.660 24.951 929 HG LEU 101 HG LEU 101 0.803 -0.007 26.237 930 HD11 LEU 101 1HD1 LEU 101 -1.263 -1.817 24.996 931 HD12 LEU 101 2HD1 LEU 101 -0.925 -0.139 24.573 932 HD13 LEU 101 3HD1 LEU 101 -1.617 -0.530 26.146 933 HD21 LEU 101 3HD2 LEU 101 1.424 -2.220 27.427 934 HD22 LEU 101 1HD2 LEU 101 -0.237 -2.689 27.065 935 HD23 LEU 101 2HD2 LEU 101 0.082 -1.260 28.050 936 H LEU 102 H LEU 102 3.687 -0.301 22.828 937 HA LEU 102 HA LEU 102 4.517 -2.853 21.742 938 HB2 LEU 102 1HB LEU 102 3.591 -0.618 20.577 939 HB3 LEU 102 2HB LEU 102 5.313 -0.337 20.393 940 HG LEU 102 HG LEU 102 4.200 -2.967 19.524 941 HD11 LEU 102 1HD1 LEU 102 3.682 -2.055 17.325 942 HD12 LEU 102 2HD1 LEU 102 4.030 -0.428 17.909 943 HD13 LEU 102 3HD1 LEU 102 2.664 -1.327 18.568 944 HD21 LEU 102 3HD2 LEU 102 6.393 -1.176 18.484 945 HD22 LEU 102 1HD2 LEU 102 5.985 -2.776 17.864 946 HD23 LEU 102 2HD2 LEU 102 6.612 -2.599 19.502 947 H GLN 103 H GLN 103 6.157 0.126 22.746 948 HA GLN 103 HA GLN 103 8.777 -1.019 22.318 949 HB2 GLN 103 1HB GLN 103 7.784 1.626 23.357 950 HB3 GLN 103 2HB GLN 103 9.482 1.184 23.469 951 HG2 GLN 103 1HG GLN 103 8.097 1.004 20.837 952 HG3 GLN 103 2HG GLN 103 8.605 2.577 21.449 953 HE21 GLN 103 2HE2 GLN 103 9.650 -0.528 20.294 954 HE22 GLN 103 1HE2 GLN 103 11.309 -0.109 20.058 955 H GLU 104 H GLU 104 6.477 -1.378 24.650 956 HA GLU 104 HA GLU 104 8.199 -1.353 26.978 957 HB2 GLU 104 1HB GLU 104 5.583 -0.939 26.748 958 HB3 GLU 104 2HB GLU 104 5.529 -2.674 27.022 959 HG2 GLU 104 1HG GLU 104 6.774 -2.380 29.108 960 HG3 GLU 104 2HG GLU 104 6.808 -0.638 28.835 961 H ARG 105 H ARG 105 6.725 -3.793 24.880 962 HA ARG 105 HA ARG 105 7.878 -5.966 26.422 963 HB2 ARG 105 1HB ARG 105 5.865 -5.715 24.273 964 HB3 ARG 105 2HB ARG 105 6.829 -7.186 24.244 965 HG2 ARG 105 1HG ARG 105 5.518 -6.303 26.780 966 HG3 ARG 105 2HG ARG 105 4.587 -7.143 25.538 967 HD2 ARG 105 1HD ARG 105 6.178 -9.004 25.612 968 HD3 ARG 105 2HD ARG 105 7.104 -8.163 26.853 969 HE ARG 105 HE ARG 105 4.460 -8.410 27.738 970 HH11 ARG 105 1HH1 ARG 105 7.221 -10.446 27.062 971 HH12 ARG 105 2HH1 ARG 105 6.767 -11.654 28.219 972 HH21 ARG 105 1HH2 ARG 105 3.869 -9.997 29.255 973 HH22 ARG 105 2HH2 ARG 105 4.865 -11.398 29.462 974 H GLU 106 H GLU 106 8.843 -3.956 23.896 975 HA GLU 106 HA GLU 106 10.479 -5.882 22.499 976 HB2 GLU 106 1HB GLU 106 10.106 -2.908 22.282 977 HB3 GLU 106 2HB GLU 106 11.389 -3.730 21.407 978 HG2 GLU 106 1HG GLU 106 9.665 -5.183 20.364 979 HG3 GLU 106 2HG GLU 106 8.429 -4.195 21.145 980 H LEU 107 H LEU 107 10.834 -3.747 25.193 981 HA LEU 107 HA LEU 107 13.744 -4.026 25.127 982 HB2 LEU 107 1HB LEU 107 11.951 -2.229 26.749 983 HB3 LEU 107 2HB LEU 107 13.680 -2.349 27.010 984 HG LEU 107 HG LEU 107 12.726 -1.671 24.269 985 HD11 LEU 107 1HD1 LEU 107 11.370 -0.228 25.677 986 HD12 LEU 107 2HD1 LEU 107 12.625 0.705 24.861 987 HD13 LEU 107 3HD1 LEU 107 12.808 0.282 26.564 988 HD21 LEU 107 3HD2 LEU 107 15.063 -0.774 25.954 989 HD22 LEU 107 1HD2 LEU 107 14.774 -0.335 24.270 990 HD23 LEU 107 2HD2 LEU 107 15.103 -2.013 24.700 991 H VAL 108 H VAL 108 11.267 -5.711 26.204 992 HA VAL 108 HA VAL 108 12.759 -6.757 28.520 993 HB VAL 108 HB VAL 108 9.745 -6.822 28.419 994 HG11 VAL 108 1HG1 VAL 108 10.825 -8.383 29.944 995 HG12 VAL 108 2HG1 VAL 108 9.969 -7.132 30.843 996 HG13 VAL 108 3HG1 VAL 108 11.724 -7.060 30.687 997 HG21 VAL 108 3HG2 VAL 108 10.573 -4.461 28.325 998 HG22 VAL 108 1HG2 VAL 108 11.369 -4.741 29.875 999 HG23 VAL 108 2HG2 VAL 108 9.613 -4.849 29.755 1000 H GLU 109 H GLU 109 13.405 -7.904 26.304 1001 HA GLU 109 HA GLU 109 11.652 -10.210 25.837 1002 HB2 GLU 109 1HB GLU 109 13.940 -9.026 24.273 1003 HB3 GLU 109 2HB GLU 109 13.298 -10.623 23.916 1004 HG2 GLU 109 1HG GLU 109 11.099 -9.650 23.496 1005 HG3 GLU 109 2HG GLU 109 11.741 -8.048 23.855 1006 HA PRO 110 HA PRO 110 14.293 -12.931 28.123 1007 HB2 PRO 110 1HB PRO 110 13.860 -15.279 26.794 1008 HB3 PRO 110 2HB PRO 110 12.672 -14.551 27.893 1009 HG2 PRO 110 1HG PRO 110 12.773 -14.488 24.920 1010 HG3 PRO 110 2HG PRO 110 11.379 -14.690 26.001 1011 HD2 PRO 110 1HD PRO 110 11.964 -12.334 24.802 1012 HD3 PRO 110 2HD PRO 110 11.179 -12.439 26.388 1013 H LEU 111 H LEU 111 16.407 -13.413 28.107 1014 HA LEU 111 HA LEU 111 17.738 -14.128 25.630 1015 HB2 LEU 111 1HB LEU 111 17.834 -11.574 26.123 1016 HB3 LEU 111 2HB LEU 111 18.980 -12.021 27.370 1017 HG LEU 111 HG LEU 111 20.157 -13.279 25.352 1018 HD11 LEU 111 1HD1 LEU 111 18.678 -11.028 23.997 1019 HD12 LEU 111 2HD1 LEU 111 18.434 -12.751 23.715 1020 HD13 LEU 111 3HD1 LEU 111 19.967 -11.995 23.282 1021 HD21 LEU 111 3HD2 LEU 111 21.544 -11.283 25.025 1022 HD22 LEU 111 1HD2 LEU 111 21.187 -11.563 26.728 1023 HD23 LEU 111 2HD2 LEU 111 20.322 -10.307 25.840 1024 H THR 112 H THR 112 17.913 -16.167 26.554 1025 HA THR 112 HA THR 112 19.547 -16.435 28.972 1026 HB THR 112 HB THR 112 18.958 -18.902 28.729 1027 HG1 THR 112 HG1 THR 112 16.762 -18.820 27.426 1028 HG21 THR 112 3HG2 THR 112 17.849 -17.447 30.350 1029 HG22 THR 112 1HG2 THR 112 16.708 -18.603 29.664 1030 HG23 THR 112 2HG2 THR 112 16.704 -16.927 29.114 1031 HA PRO 113 HA PRO 113 23.177 -17.530 26.673 1032 HB2 PRO 113 1HB PRO 113 24.458 -19.081 28.517 1033 HB3 PRO 113 2HB PRO 113 24.359 -17.314 28.638 1034 HG2 PRO 113 1HG PRO 113 22.755 -19.392 30.042 1035 HG3 PRO 113 2HG PRO 113 23.430 -17.872 30.663 1036 HD2 PRO 113 1HD PRO 113 20.823 -18.138 29.977 1037 HD3 PRO 113 2HD PRO 113 21.708 -16.607 29.832 1038 H SER 114 H SER 114 23.117 -18.879 25.013 1039 HA SER 114 HA SER 114 22.265 -21.660 25.426 1040 HB2 SER 114 1HB SER 114 22.506 -20.053 22.868 1041 HB3 SER 114 2HB SER 114 21.941 -21.720 22.975 1042 HG SER 114 HG SER 114 20.595 -20.128 24.693 1043 H GLY 115 H GLY 115 25.028 -19.786 25.027 1044 HA2 GLY 115 1HA GLY 115 26.873 -21.805 25.208 1045 HA3 GLY 115 2HA GLY 115 26.606 -21.616 23.481 1046 H GLU 116 H GLU 116 26.460 -19.036 22.997 1047 HA GLU 116 HA GLU 116 28.853 -17.827 24.219 1048 HB2 GLU 116 1HB GLU 116 28.105 -18.005 21.306 1049 HB3 GLU 116 2HB GLU 116 29.237 -16.799 21.903 1050 HG2 GLU 116 1HG GLU 116 30.691 -18.571 22.739 1051 HG3 GLU 116 2HG GLU 116 29.553 -19.783 22.152 1052 H LYS 117 H LYS 117 28.757 -15.684 24.689 1053 HA LYS 117 HA LYS 117 26.144 -14.448 24.627 1054 HB2 LYS 117 1HB LYS 117 28.770 -13.664 25.881 1055 HB3 LYS 117 2HB LYS 117 27.366 -12.609 25.905 1056 HG2 LYS 117 1HG LYS 117 27.135 -13.643 27.925 1057 HG3 LYS 117 2HG LYS 117 26.189 -14.734 26.913 1058 HD2 LYS 117 1HD LYS 117 28.129 -16.214 26.699 1059 HD3 LYS 117 2HD LYS 117 29.077 -15.120 27.707 1060 HE2 LYS 117 1HE LYS 117 26.518 -16.393 28.645 1061 HE3 LYS 117 2HE LYS 117 28.092 -17.156 28.856 1062 HZ1 LYS 117 3HZ LYS 117 28.817 -15.227 30.119 1063 HZ2 LYS 117 1HZ LYS 117 27.442 -15.917 30.822 1064 HZ3 LYS 117 2HZ LYS 117 27.306 -14.494 29.917 1065 H LEU 118 H LEU 118 29.347 -13.866 23.247 1066 HA LEU 118 HA LEU 118 28.415 -11.507 21.842 1067 HB2 LEU 118 1HB LEU 118 30.743 -11.878 22.946 1068 HB3 LEU 118 2HB LEU 118 31.115 -12.746 21.470 1069 HG LEU 118 HG LEU 118 30.235 -10.508 20.347 1070 HD11 LEU 118 1HD1 LEU 118 31.257 -9.586 23.030 1071 HD12 LEU 118 2HD1 LEU 118 29.602 -9.436 22.440 1072 HD13 LEU 118 3HD1 LEU 118 30.905 -8.549 21.647 1073 HD21 LEU 118 3HD2 LEU 118 32.562 -9.730 20.273 1074 HD22 LEU 118 1HD2 LEU 118 32.441 -11.471 20.018 1075 HD23 LEU 118 2HD2 LEU 118 32.968 -10.843 21.579 1076 H TRP 119 H TRP 119 28.392 -14.793 21.318 1077 HA TRP 119 HA TRP 119 28.123 -14.405 18.414 1078 HB2 TRP 119 1HB TRP 119 30.279 -15.627 19.293 1079 HB3 TRP 119 2HB TRP 119 29.185 -16.992 19.494 1080 HD1 TRP 119 HD1 TRP 119 28.250 -18.155 17.286 1081 HE1 TRP 119 HE1 TRP 119 29.017 -18.075 14.831 1082 HE3 TRP 119 HE3 TRP 119 31.305 -14.055 17.514 1083 HZ2 TRP 119 HZ2 TRP 119 30.691 -16.488 13.206 1084 HZ3 TRP 119 HZ3 TRP 119 32.450 -13.324 15.463 1085 HH2 TRP 119 HH2 TRP 119 32.148 -14.516 13.354 1086 H SER 120 H SER 120 26.509 -15.569 17.406 1087 HA SER 120 HA SER 120 24.555 -16.807 19.211 1088 HB2 SER 120 1HB SER 120 23.845 -14.867 17.776 1089 HB3 SER 120 2HB SER 120 24.125 -15.883 16.362 1090 HG SER 120 HG SER 120 22.270 -16.336 18.461 Start of MODEL 9 1 H1 LYS 1 1H LYS 1 1.081 -1.594 -34.410 2 H2 LYS 1 2H LYS 1 0.501 -3.047 -33.764 3 H3 LYS 1 3H LYS 1 1.614 -2.118 -32.891 4 HA LYS 1 HA LYS 1 0.022 -0.346 -32.646 5 HB2 LYS 1 1HB LYS 1 -1.702 -2.215 -34.269 6 HB3 LYS 1 2HB LYS 1 -2.383 -0.927 -33.285 7 HG2 LYS 1 1HG LYS 1 -1.125 0.726 -34.570 8 HG3 LYS 1 2HG LYS 1 -0.438 -0.567 -35.557 9 HD2 LYS 1 1HD LYS 1 -2.685 -1.178 -36.314 10 HD3 LYS 1 2HD LYS 1 -3.371 0.113 -35.326 11 HE2 LYS 1 1HE LYS 1 -2.118 1.767 -36.625 12 HE3 LYS 1 2HE LYS 1 -1.432 0.476 -37.611 13 HZ1 LYS 1 3HZ LYS 1 -4.318 1.157 -37.415 14 HZ2 LYS 1 1HZ LYS 1 -3.662 -0.082 -38.361 15 HZ3 LYS 1 2HZ LYS 1 -3.301 1.532 -38.715 16 H ILE 2 H ILE 2 -0.758 -0.281 -30.630 17 HA ILE 2 HA ILE 2 -1.759 -2.750 -29.403 18 HB ILE 2 HB ILE 2 -0.522 -2.048 -27.269 19 HG12 ILE 2 1HG1 ILE 2 1.640 -0.909 -28.928 20 HG13 ILE 2 2HG1 ILE 2 0.235 0.134 -28.731 21 HG21 ILE 2 1HG2 ILE 2 1.491 -3.288 -27.931 22 HG22 ILE 2 2HG2 ILE 2 1.028 -3.117 -29.624 23 HG23 ILE 2 3HG2 ILE 2 0.015 -4.052 -28.523 24 HD11 ILE 2 3HD1 ILE 2 0.451 -0.033 -26.308 25 HD12 ILE 2 1HD1 ILE 2 1.920 0.596 -27.051 26 HD13 ILE 2 2HD1 ILE 2 1.857 -1.080 -26.507 27 HA PRO 3 HA PRO 3 -4.950 -0.106 -27.842 28 HB2 PRO 3 1HB PRO 3 -5.718 -1.522 -25.636 29 HB3 PRO 3 2HB PRO 3 -6.128 -2.007 -27.291 30 HG2 PRO 3 1HG PRO 3 -3.984 -3.038 -25.504 31 HG3 PRO 3 2HG PRO 3 -5.059 -3.920 -26.607 32 HD2 PRO 3 1HD PRO 3 -2.490 -3.331 -27.233 33 HD3 PRO 3 2HD PRO 3 -3.776 -3.451 -28.450 34 H SER 4 H SER 4 -5.147 1.615 -26.513 35 HA SER 4 HA SER 4 -2.970 2.229 -24.724 36 HB2 SER 4 1HB SER 4 -4.037 3.910 -26.258 37 HB3 SER 4 2HB SER 4 -5.475 3.848 -25.238 38 HG SER 4 HG SER 4 -3.123 5.154 -24.842 39 H ILE 5 H ILE 5 -5.844 0.570 -24.369 40 HA ILE 5 HA ILE 5 -6.501 1.468 -21.698 41 HB ILE 5 HB ILE 5 -7.574 -1.026 -23.010 42 HG12 ILE 5 1HG1 ILE 5 -9.504 0.829 -23.490 43 HG13 ILE 5 2HG1 ILE 5 -8.056 1.806 -23.711 44 HG21 ILE 5 1HG2 ILE 5 -8.101 -0.735 -20.655 45 HG22 ILE 5 2HG2 ILE 5 -9.552 -0.541 -21.639 46 HG23 ILE 5 3HG2 ILE 5 -8.738 0.876 -20.979 47 HD11 ILE 5 3HD1 ILE 5 -7.244 0.243 -25.385 48 HD12 ILE 5 1HD1 ILE 5 -8.842 0.856 -25.810 49 HD13 ILE 5 2HD1 ILE 5 -8.669 -0.768 -25.144 50 H ALA 6 H ALA 6 -4.736 -1.168 -23.192 51 HA ALA 6 HA ALA 6 -4.447 -2.646 -20.721 52 HB1 ALA 6 3HB ALA 6 -4.626 -3.779 -22.912 53 HB2 ALA 6 1HB ALA 6 -3.174 -4.226 -22.014 54 HB3 ALA 6 2HB ALA 6 -3.065 -3.094 -23.361 55 H THR 7 H THR 7 -2.673 -0.255 -22.506 56 HA THR 7 HA THR 7 -0.086 -0.703 -21.480 57 HB THR 7 HB THR 7 -1.013 2.066 -22.134 58 HG1 THR 7 HG1 THR 7 -0.849 1.522 -24.363 59 HG21 THR 7 3HG2 THR 7 1.477 0.477 -22.771 60 HG22 THR 7 1HG2 THR 7 1.325 1.748 -21.558 61 HG23 THR 7 2HG2 THR 7 1.185 2.143 -23.271 62 H GLY 8 H GLY 8 -2.851 1.051 -20.204 63 HA2 GLY 8 1HA GLY 8 -1.353 2.265 -18.047 64 HA3 GLY 8 2HA GLY 8 -3.094 2.329 -18.275 65 H LEU 9 H LEU 9 -3.621 -0.417 -18.417 66 HA LEU 9 HA LEU 9 -3.893 -1.077 -15.701 67 HB2 LEU 9 1HB LEU 9 -4.136 -2.786 -18.178 68 HB3 LEU 9 2HB LEU 9 -4.570 -3.335 -16.570 69 HG LEU 9 HG LEU 9 -5.848 -0.874 -17.714 70 HD11 LEU 9 1HD1 LEU 9 -6.518 -3.738 -18.313 71 HD12 LEU 9 2HD1 LEU 9 -6.300 -2.397 -19.439 72 HD13 LEU 9 3HD1 LEU 9 -7.723 -2.453 -18.400 73 HD21 LEU 9 3HD2 LEU 9 -6.185 -1.316 -15.352 74 HD22 LEU 9 1HD2 LEU 9 -6.729 -2.954 -15.714 75 HD23 LEU 9 2HD2 LEU 9 -7.689 -1.570 -16.237 76 H VAL 10 H VAL 10 -1.604 -2.228 -18.163 77 HA VAL 10 HA VAL 10 -0.376 -4.203 -16.601 78 HB VAL 10 HB VAL 10 1.560 -4.014 -18.154 79 HG11 VAL 10 1HG1 VAL 10 -1.239 -4.215 -19.225 80 HG12 VAL 10 2HG1 VAL 10 -0.112 -5.512 -18.819 81 HG13 VAL 10 3HG1 VAL 10 0.174 -4.511 -20.243 82 HG21 VAL 10 3HG2 VAL 10 1.399 -2.504 -20.083 83 HG22 VAL 10 1HG2 VAL 10 1.510 -1.608 -18.568 84 HG23 VAL 10 2HG2 VAL 10 -0.044 -1.769 -19.385 85 H GLY 11 H GLY 11 0.316 -0.777 -16.918 86 HA2 GLY 11 1HA GLY 11 2.720 -0.772 -15.400 87 HA3 GLY 11 2HA GLY 11 1.728 0.631 -15.757 88 H ALA 12 H ALA 12 -0.635 0.049 -14.518 89 HA ALA 12 HA ALA 12 0.044 0.579 -11.792 90 HB1 ALA 12 3HB ALA 12 -1.903 1.560 -13.089 91 HB2 ALA 12 1HB ALA 12 -2.238 1.024 -11.443 92 HB3 ALA 12 2HB ALA 12 -2.726 0.024 -12.811 93 H LEU 13 H LEU 13 -1.446 -2.188 -13.436 94 HA LEU 13 HA LEU 13 -2.001 -3.635 -11.071 95 HB2 LEU 13 1HB LEU 13 -1.836 -4.314 -13.971 96 HB3 LEU 13 2HB LEU 13 -1.881 -5.621 -12.805 97 HG LEU 13 HG LEU 13 -4.012 -4.650 -11.902 98 HD11 LEU 13 1HD1 LEU 13 -3.883 -2.930 -14.378 99 HD12 LEU 13 2HD1 LEU 13 -3.718 -2.353 -12.720 100 HD13 LEU 13 3HD1 LEU 13 -5.244 -3.052 -13.263 101 HD21 LEU 13 3HD2 LEU 13 -5.399 -5.485 -13.731 102 HD22 LEU 13 1HD2 LEU 13 -4.015 -6.538 -13.438 103 HD23 LEU 13 2HD2 LEU 13 -4.006 -5.434 -14.811 104 H LEU 14 H LEU 14 0.807 -3.575 -13.246 105 HA LEU 14 HA LEU 14 2.189 -5.666 -11.896 106 HB2 LEU 14 1HB LEU 14 2.777 -3.765 -14.057 107 HB3 LEU 14 2HB LEU 14 4.172 -4.242 -13.108 108 HG LEU 14 HG LEU 14 3.400 -6.667 -13.560 109 HD11 LEU 14 1HD1 LEU 14 1.176 -5.774 -14.506 110 HD12 LEU 14 2HD1 LEU 14 1.983 -7.096 -15.351 111 HD13 LEU 14 3HD1 LEU 14 2.104 -5.449 -15.969 112 HD21 LEU 14 3HD2 LEU 14 4.604 -6.699 -15.687 113 HD22 LEU 14 1HD2 LEU 14 5.416 -5.677 -14.501 114 HD23 LEU 14 2HD2 LEU 14 4.465 -4.945 -15.794 115 H LEU 15 H LEU 15 2.196 -2.149 -11.642 116 HA LEU 15 HA LEU 15 4.355 -2.017 -9.782 117 HB2 LEU 15 1HB LEU 15 2.534 -0.165 -11.055 118 HB3 LEU 15 2HB LEU 15 2.729 0.225 -9.357 119 HG LEU 15 HG LEU 15 5.326 -0.137 -10.105 120 HD11 LEU 15 1HD1 LEU 15 5.658 1.035 -12.215 121 HD12 LEU 15 2HD1 LEU 15 3.911 1.119 -12.452 122 HD13 LEU 15 3HD1 LEU 15 4.725 -0.445 -12.448 123 HD21 LEU 15 3HD2 LEU 15 4.416 1.721 -8.802 124 HD22 LEU 15 1HD2 LEU 15 3.740 2.422 -10.271 125 HD23 LEU 15 2HD2 LEU 15 5.486 2.292 -10.081 126 H LEU 16 H LEU 16 0.846 -2.193 -9.479 127 HA LEU 16 HA LEU 16 0.761 -1.877 -6.653 128 HB2 LEU 16 1HB LEU 16 -1.119 -1.713 -8.509 129 HB3 LEU 16 2HB LEU 16 -1.338 -3.408 -8.122 130 HG LEU 16 HG LEU 16 -1.448 -2.475 -5.643 131 HD11 LEU 16 1HD1 LEU 16 -2.571 -0.316 -5.546 132 HD12 LEU 16 2HD1 LEU 16 -2.401 -0.138 -7.293 133 HD13 LEU 16 3HD1 LEU 16 -0.968 -0.161 -6.266 134 HD21 LEU 16 3HD2 LEU 16 -3.713 -2.312 -7.628 135 HD22 LEU 16 1HD2 LEU 16 -3.888 -2.376 -5.875 136 HD23 LEU 16 2HD2 LEU 16 -3.202 -3.749 -6.741 137 H LEU 17 H LEU 17 1.095 -4.620 -8.817 138 HA LEU 17 HA LEU 17 0.677 -6.652 -6.880 139 HB2 LEU 17 1HB LEU 17 0.673 -6.760 -9.484 140 HB3 LEU 17 2HB LEU 17 2.397 -7.023 -9.307 141 HG LEU 17 HG LEU 17 1.583 -8.921 -7.641 142 HD11 LEU 17 1HD1 LEU 17 -0.786 -8.388 -7.825 143 HD12 LEU 17 2HD1 LEU 17 -0.452 -9.998 -8.462 144 HD13 LEU 17 3HD1 LEU 17 -0.720 -8.651 -9.567 145 HD21 LEU 17 3HD2 LEU 17 2.974 -9.275 -9.601 146 HD22 LEU 17 1HD2 LEU 17 1.559 -9.159 -10.647 147 HD23 LEU 17 2HD2 LEU 17 1.710 -10.502 -9.514 148 H VAL 18 H VAL 18 3.603 -5.072 -8.150 149 HA VAL 18 HA VAL 18 5.438 -6.657 -6.657 150 HB VAL 18 HB VAL 18 5.856 -3.899 -7.839 151 HG11 VAL 18 1HG1 VAL 18 7.868 -5.971 -6.959 152 HG12 VAL 18 2HG1 VAL 18 7.544 -4.432 -6.162 153 HG13 VAL 18 3HG1 VAL 18 8.244 -4.457 -7.781 154 HG21 VAL 18 3HG2 VAL 18 6.443 -6.629 -8.988 155 HG22 VAL 18 1HG2 VAL 18 6.887 -5.087 -9.721 156 HG23 VAL 18 2HG2 VAL 18 5.186 -5.516 -9.532 157 H VAL 19 H VAL 19 3.976 -3.462 -6.091 158 HA VAL 19 HA VAL 19 5.391 -2.900 -3.699 159 HB VAL 19 HB VAL 19 2.742 -1.817 -4.690 160 HG11 VAL 19 1HG1 VAL 19 3.206 0.074 -3.115 161 HG12 VAL 19 2HG1 VAL 19 4.478 -0.915 -2.396 162 HG13 VAL 19 3HG1 VAL 19 2.799 -1.451 -2.330 163 HG21 VAL 19 3HG2 VAL 19 5.536 -0.684 -4.806 164 HG22 VAL 19 1HG2 VAL 19 4.072 0.145 -5.333 165 HG23 VAL 19 2HG2 VAL 19 4.606 -1.314 -6.167 166 H ALA 20 H ALA 20 2.211 -4.367 -4.314 167 HA ALA 20 HA ALA 20 1.462 -4.638 -1.593 168 HB1 ALA 20 3HB ALA 20 -0.165 -4.703 -3.423 169 HB2 ALA 20 1HB ALA 20 -0.275 -6.139 -2.405 170 HB3 ALA 20 2HB ALA 20 0.521 -6.231 -3.976 171 H LEU 21 H LEU 21 3.139 -6.770 -3.865 172 HA LEU 21 HA LEU 21 3.229 -9.039 -2.154 173 HB2 LEU 21 1HB LEU 21 3.655 -8.783 -4.739 174 HB3 LEU 21 2HB LEU 21 5.315 -8.530 -4.236 175 HG LEU 21 HG LEU 21 4.857 -10.787 -2.894 176 HD11 LEU 21 1HD1 LEU 21 3.487 -12.312 -4.222 177 HD12 LEU 21 2HD1 LEU 21 3.022 -10.979 -5.278 178 HD13 LEU 21 3HD1 LEU 21 2.529 -10.976 -3.585 179 HD21 LEU 21 3HD2 LEU 21 5.858 -11.991 -4.782 180 HD22 LEU 21 1HD2 LEU 21 6.646 -10.439 -4.498 181 HD23 LEU 21 2HD2 LEU 21 5.508 -10.620 -5.833 182 H GLY 22 H GLY 22 5.329 -6.260 -2.657 183 HA2 GLY 22 1HA GLY 22 7.551 -7.203 -1.160 184 HA3 GLY 22 2HA GLY 22 7.212 -5.526 -1.560 185 H ILE 23 H ILE 23 4.936 -4.930 -0.283 186 HA ILE 23 HA ILE 23 5.742 -4.657 2.419 187 HB ILE 23 HB ILE 23 2.932 -4.271 1.369 188 HG12 ILE 23 1HG1 ILE 23 4.915 -2.034 1.612 189 HG13 ILE 23 2HG1 ILE 23 4.938 -3.049 0.174 190 HG21 ILE 23 1HG2 ILE 23 3.108 -4.263 3.797 191 HG22 ILE 23 2HG2 ILE 23 2.754 -2.641 3.202 192 HG23 ILE 23 3HG2 ILE 23 4.389 -3.052 3.717 193 HD11 ILE 23 3HD1 ILE 23 3.628 -1.047 -0.196 194 HD12 ILE 23 1HD1 ILE 23 2.594 -1.448 1.175 195 HD13 ILE 23 2HD1 ILE 23 2.599 -2.478 -0.257 196 H GLY 24 H GLY 24 3.530 -6.863 0.778 197 HA2 GLY 24 1HA GLY 24 2.366 -8.031 3.071 198 HA3 GLY 24 2HA GLY 24 2.456 -8.771 1.481 199 H LEU 25 H LEU 25 5.170 -9.021 1.118 200 HA LEU 25 HA LEU 25 5.753 -11.300 2.746 201 HB2 LEU 25 1HB LEU 25 7.317 -9.849 0.619 202 HB3 LEU 25 2HB LEU 25 7.943 -11.253 1.462 203 HG LEU 25 HG LEU 25 5.305 -11.431 0.055 204 HD11 LEU 25 1HD1 LEU 25 8.015 -11.674 -1.241 205 HD12 LEU 25 2HD1 LEU 25 6.781 -10.469 -1.603 206 HD13 LEU 25 3HD1 LEU 25 6.489 -12.169 -1.972 207 HD21 LEU 25 3HD2 LEU 25 6.005 -13.273 1.495 208 HD22 LEU 25 1HD2 LEU 25 7.515 -13.412 0.597 209 HD23 LEU 25 2HD2 LEU 25 5.982 -13.769 -0.197 210 H PHE 26 H PHE 26 6.594 -7.937 2.846 211 HA PHE 26 HA PHE 26 8.900 -8.222 4.523 212 HB2 PHE 26 1HB PHE 26 8.169 -6.238 2.964 213 HB3 PHE 26 2HB PHE 26 7.299 -5.694 4.394 214 HD1 PHE 26 HD1 PHE 26 10.586 -6.251 2.900 215 HD2 PHE 26 HD2 PHE 26 8.483 -4.927 6.356 216 HE1 PHE 26 HE1 PHE 26 12.652 -5.231 3.763 217 HE2 PHE 26 HE2 PHE 26 10.546 -3.903 7.224 218 HZ PHE 26 HZ PHE 26 12.634 -4.055 5.927 219 H ILE 27 H ILE 27 5.468 -7.553 5.066 220 HA ILE 27 HA ILE 27 5.828 -7.223 7.921 221 HB ILE 27 HB ILE 27 3.238 -7.469 6.384 222 HG12 ILE 27 1HG1 ILE 27 4.478 -5.568 5.515 223 HG13 ILE 27 2HG1 ILE 27 3.141 -4.991 6.497 224 HG21 ILE 27 1HG2 ILE 27 3.769 -6.319 9.121 225 HG22 ILE 27 2HG2 ILE 27 3.032 -7.887 8.790 226 HG23 ILE 27 3HG2 ILE 27 2.206 -6.405 8.308 227 HD11 ILE 27 3HD1 ILE 27 6.062 -5.035 7.212 228 HD12 ILE 27 1HD1 ILE 27 4.779 -4.673 8.367 229 HD13 ILE 27 2HD1 ILE 27 5.025 -3.630 6.967 230 H ARG 28 H ARG 28 4.868 -9.760 5.702 231 HA ARG 28 HA ARG 28 3.665 -11.514 7.562 232 HB2 ARG 28 1HB ARG 28 3.839 -11.533 4.902 233 HB3 ARG 28 2HB ARG 28 5.169 -12.630 5.246 234 HG2 ARG 28 1HG ARG 28 3.656 -14.073 6.509 235 HG3 ARG 28 2HG ARG 28 2.322 -12.971 6.166 236 HD2 ARG 28 1HD ARG 28 2.606 -13.376 3.768 237 HD3 ARG 28 2HD ARG 28 3.940 -14.478 4.113 238 HE ARG 28 HE ARG 28 1.687 -15.349 5.526 239 HH11 ARG 28 1HH1 ARG 28 2.782 -15.060 2.219 240 HH12 ARG 28 2HH1 ARG 28 1.827 -16.392 1.657 241 HH21 ARG 28 1HH2 ARG 28 0.435 -17.097 4.784 242 HH22 ARG 28 2HH2 ARG 28 0.495 -17.546 3.112 243 H ARG 29 H ARG 29 6.979 -10.785 6.847 244 HA ARG 29 HA ARG 29 8.053 -13.150 8.111 245 HB2 ARG 29 1HB ARG 29 9.294 -10.644 6.992 246 HB3 ARG 29 2HB ARG 29 10.244 -11.849 7.850 247 HG2 ARG 29 1HG ARG 29 9.589 -13.539 6.212 248 HG3 ARG 29 2HG ARG 29 8.633 -12.330 5.351 249 HD2 ARG 29 1HD ARG 29 10.661 -11.021 4.944 250 HD3 ARG 29 2HD ARG 29 11.613 -12.230 5.805 251 HE ARG 29 HE ARG 29 10.215 -13.510 3.748 252 HH11 ARG 29 1HH1 ARG 29 12.804 -11.194 4.138 253 HH12 ARG 29 2HH1 ARG 29 13.585 -11.633 2.655 254 HH21 ARG 29 1HH2 ARG 29 11.246 -14.085 1.802 255 HH22 ARG 29 2HH2 ARG 29 12.701 -13.273 1.331 256 H ARG 30 H ARG 30 6.975 -10.074 9.130 257 HA ARG 30 HA ARG 30 8.619 -9.925 11.502 258 HB2 ARG 30 1HB ARG 30 6.329 -8.284 10.442 259 HB3 ARG 30 2HB ARG 30 6.985 -8.017 12.051 260 HG2 ARG 30 1HG ARG 30 9.182 -7.564 11.083 261 HG3 ARG 30 2HG ARG 30 8.522 -7.829 9.468 262 HD2 ARG 30 1HD ARG 30 6.992 -5.960 9.769 263 HD3 ARG 30 2HD ARG 30 7.596 -5.710 11.406 264 HE ARG 30 HE ARG 30 9.780 -5.575 9.692 265 HH11 ARG 30 1HH1 ARG 30 6.831 -3.790 10.270 266 HH12 ARG 30 2HH1 ARG 30 7.497 -2.280 9.743 267 HH21 ARG 30 1HH2 ARG 30 10.650 -3.590 8.999 268 HH22 ARG 30 2HH2 ARG 30 9.662 -2.168 9.021 269 H HIS 31 H HIS 31 5.602 -11.338 10.624 270 HA HIS 31 HA HIS 31 4.353 -11.358 13.173 271 HB2 HIS 31 1HB HIS 31 3.967 -12.966 10.661 272 HB3 HIS 31 2HB HIS 31 3.049 -13.317 12.121 273 HD1 HIS 31 HD1 HIS 31 3.118 -11.123 9.203 274 HD2 HIS 31 HD2 HIS 31 1.364 -11.101 12.970 275 HE1 HIS 31 HE1 HIS 31 1.290 -9.400 9.083 276 HE2 HIS 31 HE2 HIS 31 0.188 -9.465 11.347 277 H ILE 32 H ILE 32 6.893 -13.240 11.807 278 HA ILE 32 HA ILE 32 6.563 -15.489 13.601 279 HB ILE 32 HB ILE 32 9.071 -14.973 12.028 280 HG12 ILE 32 1HG1 ILE 32 6.918 -16.547 10.725 281 HG13 ILE 32 2HG1 ILE 32 6.694 -14.800 10.752 282 HG21 ILE 32 1HG2 ILE 32 7.593 -17.490 12.800 283 HG22 ILE 32 2HG2 ILE 32 9.055 -16.861 13.561 284 HG23 ILE 32 3HG2 ILE 32 9.104 -17.426 11.893 285 HD11 ILE 32 3HD1 ILE 32 8.992 -16.323 9.552 286 HD12 ILE 32 1HD1 ILE 32 8.942 -14.568 9.711 287 HD13 ILE 32 2HD1 ILE 32 7.754 -15.396 8.705 288 H VAL 33 H VAL 33 7.867 -12.398 13.844 289 HA VAL 33 HA VAL 33 9.883 -13.139 15.834 290 HB VAL 33 HB VAL 33 9.253 -10.319 14.983 291 HG11 VAL 33 1HG1 VAL 33 11.604 -9.936 15.571 292 HG12 VAL 33 2HG1 VAL 33 11.764 -11.635 16.015 293 HG13 VAL 33 3HG1 VAL 33 10.687 -10.583 16.932 294 HG21 VAL 33 3HG2 VAL 33 10.994 -10.506 13.266 295 HG22 VAL 33 1HG2 VAL 33 9.633 -11.576 12.932 296 HG23 VAL 33 2HG2 VAL 33 11.129 -12.234 13.595 297 H ARG 34 H ARG 34 6.667 -11.925 15.599 298 HA ARG 34 HA ARG 34 6.657 -10.886 18.323 299 HB2 ARG 34 1HB ARG 34 4.830 -10.738 15.987 300 HB3 ARG 34 2HB ARG 34 4.090 -10.665 17.580 301 HG2 ARG 34 1HG ARG 34 5.520 -8.763 18.153 302 HG3 ARG 34 2HG ARG 34 6.247 -8.833 16.547 303 HD2 ARG 34 1HD ARG 34 4.584 -7.123 16.516 304 HD3 ARG 34 2HD ARG 34 3.966 -8.489 15.586 305 HE ARG 34 HE ARG 34 3.143 -8.516 18.337 306 HH11 ARG 34 1HH1 ARG 34 2.403 -7.255 15.163 307 HH12 ARG 34 2HH1 ARG 34 0.724 -7.017 15.513 308 HH21 ARG 34 1HH2 ARG 34 0.936 -8.205 18.794 309 HH22 ARG 34 2HH2 ARG 34 -0.108 -7.555 17.573 310 H LYS 35 H LYS 35 5.456 -11.737 20.000 311 HA LYS 35 HA LYS 35 4.587 -14.524 19.632 312 HB2 LYS 35 1HB LYS 35 5.698 -13.058 22.018 313 HB3 LYS 35 2HB LYS 35 4.868 -14.599 22.181 314 HG2 LYS 35 1HG LYS 35 6.512 -15.645 20.708 315 HG3 LYS 35 2HG LYS 35 7.345 -14.097 20.544 316 HD2 LYS 35 1HD LYS 35 7.777 -14.075 22.953 317 HD3 LYS 35 2HD LYS 35 6.941 -15.621 23.118 318 HE2 LYS 35 1HE LYS 35 8.599 -16.668 21.651 319 HE3 LYS 35 2HE LYS 35 9.431 -15.123 21.488 320 HZ1 LYS 35 3HZ LYS 35 10.500 -16.530 23.129 321 HZ2 LYS 35 1HZ LYS 35 9.066 -16.629 24.022 322 HZ3 LYS 35 2HZ LYS 35 9.865 -15.147 23.866 323 H ARG 36 H ARG 36 3.001 -12.072 19.125 324 HA ARG 36 HA ARG 36 0.903 -11.260 19.414 325 HB2 ARG 36 1HB ARG 36 0.639 -14.056 20.457 326 HB3 ARG 36 2HB ARG 36 -0.727 -12.953 20.556 327 HG2 ARG 36 1HG ARG 36 -0.646 -12.637 18.133 328 HG3 ARG 36 2HG ARG 36 0.721 -13.749 18.038 329 HD2 ARG 36 1HD ARG 36 -0.676 -15.541 18.944 330 HD3 ARG 36 2HD ARG 36 -2.041 -14.428 19.045 331 HE ARG 36 HE ARG 36 -1.104 -14.445 16.408 332 HH11 ARG 36 1HH1 ARG 36 -2.696 -16.595 18.657 333 HH12 ARG 36 2HH1 ARG 36 -3.513 -17.486 17.418 334 HH21 ARG 36 1HH2 ARG 36 -2.180 -15.618 14.782 335 HH22 ARG 36 2HH2 ARG 36 -3.220 -16.932 15.220 336 H THR 37 H THR 37 2.898 -10.689 21.454 337 HA THR 37 HA THR 37 1.508 -10.649 23.991 338 HB THR 37 HB THR 37 3.517 -9.260 24.714 339 HG1 THR 37 HG1 THR 37 4.872 -10.191 22.457 340 HG21 THR 37 3HG2 THR 37 5.016 -11.203 24.774 341 HG22 THR 37 1HG2 THR 37 4.018 -12.009 23.562 342 HG23 THR 37 2HG2 THR 37 3.356 -11.657 25.160 343 H LEU 38 H LEU 38 1.572 -8.682 21.243 344 HA LEU 38 HA LEU 38 1.018 -6.207 22.651 345 HB2 LEU 38 1HB LEU 38 2.423 -6.401 20.514 346 HB3 LEU 38 2HB LEU 38 0.902 -6.628 19.675 347 HG LEU 38 HG LEU 38 0.181 -4.391 20.671 348 HD11 LEU 38 1HD1 LEU 38 1.757 -4.062 22.407 349 HD12 LEU 38 2HD1 LEU 38 2.138 -2.874 21.160 350 HD13 LEU 38 3HD1 LEU 38 3.118 -4.332 21.317 351 HD21 LEU 38 3HD2 LEU 38 1.314 -3.134 18.923 352 HD22 LEU 38 1HD2 LEU 38 0.793 -4.710 18.325 353 HD23 LEU 38 2HD2 LEU 38 2.487 -4.436 18.730 354 H ARG 39 H ARG 39 -0.595 -8.541 20.616 355 HA ARG 39 HA ARG 39 -3.107 -7.303 20.414 356 HB2 ARG 39 1HB ARG 39 -2.198 -10.160 20.075 357 HB3 ARG 39 2HB ARG 39 -3.877 -9.681 19.871 358 HG2 ARG 39 1HG ARG 39 -3.226 -8.155 18.076 359 HG3 ARG 39 2HG ARG 39 -1.540 -8.637 18.281 360 HD2 ARG 39 1HD ARG 39 -2.330 -9.905 16.466 361 HD3 ARG 39 2HD ARG 39 -2.322 -11.012 17.838 362 HE ARG 39 HE ARG 39 -4.855 -9.835 17.667 363 HH11 ARG 39 1HH1 ARG 39 -2.851 -12.055 15.860 364 HH12 ARG 39 2HH1 ARG 39 -4.195 -12.906 15.177 365 HH21 ARG 39 1HH2 ARG 39 -6.620 -10.956 16.769 366 HH22 ARG 39 2HH2 ARG 39 -6.333 -12.282 15.693 367 H ARG 40 H ARG 40 -1.543 -9.399 22.711 368 HA ARG 40 HA ARG 40 -3.859 -9.994 24.279 369 HB2 ARG 40 1HB ARG 40 -0.891 -10.060 24.855 370 HB3 ARG 40 2HB ARG 40 -2.083 -10.437 26.091 371 HG2 ARG 40 1HG ARG 40 -2.219 -11.882 23.493 372 HG3 ARG 40 2HG ARG 40 -0.968 -12.328 24.655 373 HD2 ARG 40 1HD ARG 40 -2.688 -12.694 26.360 374 HD3 ARG 40 2HD ARG 40 -3.935 -12.246 25.197 375 HE ARG 40 HE ARG 40 -2.425 -14.339 24.116 376 HH11 ARG 40 1HH1 ARG 40 -4.679 -13.783 26.728 377 HH12 ARG 40 2HH1 ARG 40 -5.268 -15.412 26.730 378 HH21 ARG 40 1HH2 ARG 40 -3.201 -16.478 24.122 379 HH22 ARG 40 2HH2 ARG 40 -4.429 -16.940 25.251 380 H LEU 41 H LEU 41 -1.832 -7.355 23.772 381 HA LEU 41 HA LEU 41 -2.909 -5.872 26.052 382 HB2 LEU 41 1HB LEU 41 -0.403 -5.475 24.423 383 HB3 LEU 41 2HB LEU 41 -1.016 -4.263 25.530 384 HG LEU 41 HG LEU 41 -0.408 -7.044 26.492 385 HD11 LEU 41 1HD1 LEU 41 1.548 -4.757 26.304 386 HD12 LEU 41 2HD1 LEU 41 1.604 -6.241 25.353 387 HD13 LEU 41 3HD1 LEU 41 1.828 -6.305 27.101 388 HD21 LEU 41 3HD2 LEU 41 -0.021 -5.827 28.614 389 HD22 LEU 41 1HD2 LEU 41 -1.667 -5.651 28.005 390 HD23 LEU 41 2HD2 LEU 41 -0.508 -4.334 27.814 391 H LEU 42 H LEU 42 -2.703 -6.107 22.561 392 HA LEU 42 HA LEU 42 -3.522 -3.417 22.003 393 HB2 LEU 42 1HB LEU 42 -2.443 -5.272 20.465 394 HB3 LEU 42 2HB LEU 42 -4.120 -5.647 20.115 395 HG LEU 42 HG LEU 42 -3.264 -2.809 19.844 396 HD11 LEU 42 1HD1 LEU 42 -2.617 -4.927 17.796 397 HD12 LEU 42 2HD1 LEU 42 -1.438 -4.069 18.788 398 HD13 LEU 42 3HD1 LEU 42 -2.405 -3.186 17.608 399 HD21 LEU 42 3HD2 LEU 42 -5.590 -3.468 19.483 400 HD22 LEU 42 1HD2 LEU 42 -5.078 -4.610 18.241 401 HD23 LEU 42 2HD2 LEU 42 -4.853 -2.879 17.993 402 H GLN 43 H GLN 43 -5.253 -6.493 22.256 403 HA GLN 43 HA GLN 43 -7.817 -5.195 21.838 404 HB2 GLN 43 1HB GLN 43 -6.987 -8.053 22.315 405 HB3 GLN 43 2HB GLN 43 -8.676 -7.562 22.304 406 HG2 GLN 43 1HG GLN 43 -8.427 -6.753 20.015 407 HG3 GLN 43 2HG GLN 43 -6.734 -7.244 20.026 408 HE21 GLN 43 2HE2 GLN 43 -10.035 -8.320 19.933 409 HE22 GLN 43 1HE2 GLN 43 -9.705 -9.951 19.472 410 H GLU 44 H GLU 44 -5.723 -5.849 24.412 411 HA GLU 44 HA GLU 44 -7.779 -6.117 26.443 412 HB2 GLU 44 1HB GLU 44 -5.277 -7.033 26.370 413 HB3 GLU 44 2HB GLU 44 -4.962 -5.500 27.172 414 HG2 GLU 44 1HG GLU 44 -6.567 -6.082 28.919 415 HG3 GLU 44 2HG GLU 44 -6.883 -7.619 28.113 416 H ARG 45 H ARG 45 -5.553 -3.615 25.308 417 HA ARG 45 HA ARG 45 -6.481 -1.732 27.315 418 HB2 ARG 45 1HB ARG 45 -4.359 -1.663 25.193 419 HB3 ARG 45 2HB ARG 45 -4.882 -0.180 25.977 420 HG2 ARG 45 1HG ARG 45 -4.128 -2.470 27.707 421 HG3 ARG 45 2HG ARG 45 -2.843 -1.596 26.873 422 HD2 ARG 45 1HD ARG 45 -3.639 0.503 27.848 423 HD3 ARG 45 2HD ARG 45 -4.929 -0.370 28.675 424 HE ARG 45 HE ARG 45 -2.485 -1.523 29.394 425 HH11 ARG 45 1HH1 ARG 45 -4.218 1.479 29.841 426 HH12 ARG 45 2HH1 ARG 45 -3.470 1.827 31.364 427 HH21 ARG 45 1HH2 ARG 45 -1.506 -1.064 31.396 428 HH22 ARG 45 2HH2 ARG 45 -1.932 0.384 32.245 429 H GLU 46 H GLU 46 -7.435 -2.681 24.217 430 HA GLU 46 HA GLU 46 -8.643 -0.078 23.609 431 HB2 GLU 46 1HB GLU 46 -8.136 -2.545 21.965 432 HB3 GLU 46 2HB GLU 46 -9.260 -1.306 21.424 433 HG2 GLU 46 1HG GLU 46 -7.262 0.306 21.843 434 HG3 GLU 46 2HG GLU 46 -6.298 -1.167 21.741 435 H LEU 47 H LEU 47 -9.482 -2.358 25.574 436 HA LEU 47 HA LEU 47 -11.396 -3.221 26.429 437 HB2 LEU 47 1HB LEU 47 -11.970 -0.706 26.088 438 HB3 LEU 47 2HB LEU 47 -12.987 -1.282 24.782 439 HG LEU 47 HG LEU 47 -13.933 -2.873 26.683 440 HD11 LEU 47 1HD1 LEU 47 -12.371 -2.136 28.400 441 HD12 LEU 47 2HD1 LEU 47 -14.029 -1.717 28.835 442 HD13 LEU 47 3HD1 LEU 47 -12.938 -0.476 28.218 443 HD21 LEU 47 3HD2 LEU 47 -15.251 -1.297 25.388 444 HD22 LEU 47 1HD2 LEU 47 -14.661 0.037 26.377 445 HD23 LEU 47 2HD2 LEU 47 -15.684 -1.206 27.096 446 H VAL 48 H VAL 48 -10.354 -4.417 24.065 447 HA VAL 48 HA VAL 48 -10.829 -5.940 22.444 448 HB VAL 48 HB VAL 48 -13.487 -6.422 23.779 449 HG11 VAL 48 1HG1 VAL 48 -13.019 -7.702 21.762 450 HG12 VAL 48 2HG1 VAL 48 -13.024 -8.755 23.176 451 HG13 VAL 48 3HG1 VAL 48 -11.494 -8.260 22.453 452 HG21 VAL 48 3HG2 VAL 48 -12.478 -7.724 25.483 453 HG22 VAL 48 1HG2 VAL 48 -11.634 -6.174 25.480 454 HG23 VAL 48 2HG2 VAL 48 -10.885 -7.590 24.742 455 H GLU 49 H GLU 49 -11.227 -3.544 21.433 456 HA GLU 49 HA GLU 49 -13.873 -3.503 20.168 457 HB2 GLU 49 1HB GLU 49 -11.715 -1.426 20.476 458 HB3 GLU 49 2HB GLU 49 -13.035 -1.220 19.332 459 HG2 GLU 49 1HG GLU 49 -14.646 -1.385 21.160 460 HG3 GLU 49 2HG GLU 49 -13.323 -1.592 22.306 461 HA PRO 50 HA PRO 50 -12.168 -5.082 16.383 462 HB2 PRO 50 1HB PRO 50 -14.083 -4.232 14.643 463 HB3 PRO 50 2HB PRO 50 -14.333 -5.580 15.768 464 HG2 PRO 50 1HG PRO 50 -15.237 -2.754 15.988 465 HG3 PRO 50 2HG PRO 50 -16.097 -4.252 16.397 466 HD2 PRO 50 1HD PRO 50 -14.909 -2.680 18.263 467 HD3 PRO 50 2HD PRO 50 -15.084 -4.437 18.443 468 H LEU 51 H LEU 51 -10.696 -4.380 14.950 469 HA LEU 51 HA LEU 51 -10.820 -1.671 13.917 470 HB2 LEU 51 1HB LEU 51 -9.349 -1.881 16.064 471 HB3 LEU 51 2HB LEU 51 -8.202 -2.664 14.996 472 HG LEU 51 HG LEU 51 -9.254 -0.017 14.145 473 HD11 LEU 51 1HD1 LEU 51 -8.833 0.362 16.505 474 HD12 LEU 51 2HD1 LEU 51 -7.602 1.153 15.523 475 HD13 LEU 51 3HD1 LEU 51 -7.230 -0.358 16.353 476 HD21 LEU 51 3HD2 LEU 51 -6.965 0.232 13.332 477 HD22 LEU 51 1HD2 LEU 51 -7.685 -1.268 12.750 478 HD23 LEU 51 2HD2 LEU 51 -6.526 -1.303 14.079 479 H THR 52 H THR 52 -11.332 -2.663 11.969 480 HA THR 52 HA THR 52 -9.015 -3.753 10.545 481 HB THR 52 HB THR 52 -10.291 -5.725 11.130 482 HG1 THR 52 HG1 THR 52 -10.699 -6.478 8.992 483 HG21 THR 52 3HG2 THR 52 -12.481 -4.715 11.521 484 HG22 THR 52 1HG2 THR 52 -12.609 -6.051 10.376 485 HG23 THR 52 2HG2 THR 52 -12.651 -4.386 9.797 486 HA PRO 53 HA PRO 53 -10.320 -0.764 7.523 487 HB2 PRO 53 1HB PRO 53 -8.798 -1.568 5.425 488 HB3 PRO 53 2HB PRO 53 -8.111 -0.754 6.844 489 HG2 PRO 53 1HG PRO 53 -8.131 -3.651 6.161 490 HG3 PRO 53 2HG PRO 53 -6.834 -2.663 6.862 491 HD2 PRO 53 1HD PRO 53 -8.425 -4.306 8.343 492 HD3 PRO 53 2HD PRO 53 -7.662 -2.839 8.985 493 H SER 54 H SER 54 -11.207 -3.959 7.466 494 HA SER 54 HA SER 54 -12.380 -3.982 4.810 495 HB2 SER 54 1HB SER 54 -12.533 -6.004 7.060 496 HB3 SER 54 2HB SER 54 -13.156 -6.248 5.430 497 HG SER 54 HG SER 54 -11.007 -7.113 5.843 498 H GLY 55 H GLY 55 -13.210 -2.440 7.522 499 HA2 GLY 55 1HA GLY 55 -15.272 -1.245 7.682 500 HA3 GLY 55 2HA GLY 55 -16.075 -2.584 6.877 501 H GLU 56 H GLU 56 -17.145 -4.005 8.091 502 HA GLU 56 HA GLU 56 -16.547 -4.114 10.974 503 HB2 GLU 56 1HB GLU 56 -19.225 -3.926 9.606 504 HB3 GLU 56 2HB GLU 56 -19.061 -4.541 11.244 505 HG2 GLU 56 1HG GLU 56 -18.067 -2.424 11.943 506 HG3 GLU 56 2HG GLU 56 -18.225 -1.808 10.299 507 H LYS 57 H LYS 57 -16.630 -6.101 11.946 508 HA LYS 57 HA LYS 57 -16.527 -8.387 10.181 509 HB2 LYS 57 1HB LYS 57 -15.955 -8.000 13.111 510 HB3 LYS 57 2HB LYS 57 -15.974 -9.595 12.370 511 HG2 LYS 57 1HG LYS 57 -14.202 -8.906 10.836 512 HG3 LYS 57 2HG LYS 57 -14.183 -7.306 11.581 513 HD2 LYS 57 1HD LYS 57 -13.554 -8.313 13.722 514 HD3 LYS 57 2HD LYS 57 -13.576 -9.912 12.976 515 HE2 LYS 57 1HE LYS 57 -11.791 -9.223 11.452 516 HE3 LYS 57 2HE LYS 57 -11.771 -7.624 12.196 517 HZ1 LYS 57 3HZ LYS 57 -11.124 -8.649 14.288 518 HZ2 LYS 57 1HZ LYS 57 -10.012 -9.026 13.069 519 HZ3 LYS 57 2HZ LYS 57 -11.141 -10.180 13.571 520 H LEU 58 H LEU 58 -18.530 -7.247 12.868 521 HA LEU 58 HA LEU 58 -20.280 -9.549 12.652 522 HB2 LEU 58 1HB LEU 58 -20.264 -7.171 14.500 523 HB3 LEU 58 2HB LEU 58 -21.513 -8.399 14.532 524 HG LEU 58 HG LEU 58 -19.416 -10.010 14.812 525 HD11 LEU 58 1HD1 LEU 58 -17.714 -8.981 16.230 526 HD12 LEU 58 2HD1 LEU 58 -18.474 -7.405 16.003 527 HD13 LEU 58 3HD1 LEU 58 -17.752 -8.242 14.629 528 HD21 LEU 58 3HD2 LEU 58 -21.288 -9.855 16.353 529 HD22 LEU 58 1HD2 LEU 58 -20.631 -8.363 17.027 530 HD23 LEU 58 2HD2 LEU 58 -19.763 -9.882 17.239 531 H TRP 59 H TRP 59 -20.002 -6.578 11.173 532 HA TRP 59 HA TRP 59 -22.825 -6.643 10.348 533 HB2 TRP 59 1HB TRP 59 -22.065 -4.724 11.980 534 HB3 TRP 59 2HB TRP 59 -21.372 -4.028 10.520 535 HD1 TRP 59 HD1 TRP 59 -23.055 -3.104 8.674 536 HE1 TRP 59 HE1 TRP 59 -25.556 -2.506 8.756 537 HE3 TRP 59 HE3 TRP 59 -24.312 -5.433 13.055 538 HZ2 TRP 59 HZ2 TRP 59 -27.768 -2.960 10.446 539 HZ3 TRP 59 HZ3 TRP 59 -26.643 -5.301 13.831 540 HH2 TRP 59 HH2 TRP 59 -28.333 -4.088 12.554 541 H SER 60 H SER 60 -23.226 -6.290 8.204 542 HA SER 60 HA SER 60 -20.870 -6.228 6.457 543 HB2 SER 60 1HB SER 60 -23.715 -7.086 5.866 544 HB3 SER 60 2HB SER 60 -22.374 -7.141 4.720 545 HG SER 60 HG SER 60 -23.059 -9.030 6.333 546 H1 LYS 61 1H LYS 61 -2.223 10.529 -32.741 547 H2 LYS 61 2H LYS 61 -1.616 11.764 -31.758 548 H3 LYS 61 3H LYS 61 -2.704 10.635 -31.121 549 HA LYS 61 HA LYS 61 -1.113 8.868 -31.401 550 HB2 LYS 61 1HB LYS 61 0.565 11.103 -32.536 551 HB3 LYS 61 2HB LYS 61 1.274 9.606 -31.945 552 HG2 LYS 61 1HG LYS 61 -0.035 8.341 -33.576 553 HG3 LYS 61 2HG LYS 61 -0.748 9.843 -34.167 554 HD2 LYS 61 1HD LYS 61 1.475 10.642 -34.813 555 HD3 LYS 61 2HD LYS 61 2.188 9.140 -34.220 556 HE2 LYS 61 1HE LYS 61 0.885 7.877 -35.863 557 HE3 LYS 61 2HE LYS 61 0.173 9.379 -36.454 558 HZ1 LYS 61 3HZ LYS 61 3.060 8.683 -36.539 559 HZ2 LYS 61 1HZ LYS 61 2.378 10.124 -37.106 560 HZ3 LYS 61 2HZ LYS 61 1.998 8.655 -37.856 561 H ILE 62 H ILE 62 -0.265 8.282 -29.500 562 HA ILE 62 HA ILE 62 0.788 10.349 -27.704 563 HB ILE 62 HB ILE 62 -0.381 9.107 -25.788 564 HG12 ILE 62 1HG1 ILE 62 -2.601 8.432 -27.613 565 HG13 ILE 62 2HG1 ILE 62 -1.195 7.380 -27.743 566 HG21 ILE 62 1HG2 ILE 62 -2.408 10.468 -26.034 567 HG22 ILE 62 2HG2 ILE 62 -2.003 10.748 -27.728 568 HG23 ILE 62 3HG2 ILE 62 -0.951 11.367 -26.456 569 HD11 ILE 62 3HD1 ILE 62 -1.330 6.906 -25.354 570 HD12 ILE 62 1HD1 ILE 62 -2.827 6.486 -26.186 571 HD13 ILE 62 2HD1 ILE 62 -2.737 7.962 -25.224 572 HA PRO 63 HA PRO 63 4.017 7.402 -26.996 573 HB2 PRO 63 1HB PRO 63 4.864 8.196 -24.523 574 HB3 PRO 63 2HB PRO 63 5.221 9.098 -26.006 575 HG2 PRO 63 1HG PRO 63 3.143 9.616 -23.940 576 HG3 PRO 63 2HG PRO 63 4.185 10.761 -24.811 577 HD2 PRO 63 1HD PRO 63 1.594 10.344 -25.482 578 HD3 PRO 63 2HD PRO 63 2.838 10.785 -26.669 579 H SER 64 H SER 64 4.250 5.395 -26.170 580 HA SER 64 HA SER 64 2.133 4.324 -24.533 581 HB2 SER 64 1HB SER 64 3.140 3.108 -26.488 582 HB3 SER 64 2HB SER 64 4.611 2.908 -25.534 583 HG SER 64 HG SER 64 2.267 1.533 -25.416 584 H ILE 65 H ILE 65 5.023 5.845 -23.853 585 HA ILE 65 HA ILE 65 5.765 4.283 -21.532 586 HB ILE 65 HB ILE 65 6.805 7.038 -22.181 587 HG12 ILE 65 1HG1 ILE 65 8.711 5.383 -23.195 588 HG13 ILE 65 2HG1 ILE 65 7.251 4.491 -23.614 589 HG21 ILE 65 1HG2 ILE 65 7.410 6.145 -20.003 590 HG22 ILE 65 2HG2 ILE 65 8.826 6.222 -21.052 591 HG23 ILE 65 3HG2 ILE 65 8.028 4.676 -20.758 592 HD11 ILE 65 3HD1 ILE 65 6.391 6.433 -24.793 593 HD12 ILE 65 1HD1 ILE 65 7.970 5.961 -25.417 594 HD13 ILE 65 2HD1 ILE 65 7.827 7.353 -24.345 595 H ALA 66 H ALA 66 3.964 7.210 -22.225 596 HA ALA 66 HA ALA 66 3.763 7.989 -19.445 597 HB1 ALA 66 3HB ALA 66 3.874 9.658 -21.268 598 HB2 ALA 66 1HB ALA 66 2.455 9.848 -20.237 599 HB3 ALA 66 2HB ALA 66 2.296 9.105 -21.829 600 H THR 67 H THR 67 1.920 6.141 -21.734 601 HA THR 67 HA THR 67 -0.630 6.294 -20.541 602 HB THR 67 HB THR 67 0.264 3.796 -21.926 603 HG1 THR 67 HG1 THR 67 0.028 4.904 -23.927 604 HG21 THR 67 3HG2 THR 67 -2.240 5.484 -22.041 605 HG22 THR 67 1HG2 THR 67 -2.052 3.941 -21.208 606 HG23 THR 67 2HG2 THR 67 -1.971 4.008 -22.969 607 H GLY 68 H GLY 68 2.170 4.278 -19.859 608 HA2 GLY 68 1HA GLY 68 0.740 2.537 -18.045 609 HA3 GLY 68 2HA GLY 68 2.471 2.543 -18.341 610 H LEU 69 H LEU 69 3.005 5.232 -17.778 611 HA LEU 69 HA LEU 69 3.370 5.161 -14.995 612 HB2 LEU 69 1HB LEU 69 3.538 7.459 -16.945 613 HB3 LEU 69 2HB LEU 69 4.028 7.571 -15.266 614 HG LEU 69 HG LEU 69 5.257 5.499 -17.056 615 HD11 LEU 69 1HD1 LEU 69 5.919 8.424 -16.907 616 HD12 LEU 69 2HD1 LEU 69 5.658 7.423 -18.336 617 HD13 LEU 69 3HD1 LEU 69 7.115 7.212 -17.365 618 HD21 LEU 69 3HD2 LEU 69 5.674 5.309 -14.672 619 HD22 LEU 69 1HD2 LEU 69 6.214 6.988 -14.611 620 HD23 LEU 69 2HD2 LEU 69 7.149 5.794 -15.510 621 H VAL 70 H VAL 70 1.005 6.906 -16.992 622 HA VAL 70 HA VAL 70 -0.160 8.399 -14.928 623 HB VAL 70 HB VAL 70 -2.148 8.612 -16.411 624 HG11 VAL 70 1HG1 VAL 70 0.615 9.100 -17.487 625 HG12 VAL 70 2HG1 VAL 70 -0.492 10.240 -16.718 626 HG13 VAL 70 3HG1 VAL 70 -0.831 9.644 -18.342 627 HG21 VAL 70 3HG2 VAL 70 -2.058 7.660 -18.671 628 HG22 VAL 70 1HG2 VAL 70 -2.123 6.399 -17.441 629 HG23 VAL 70 2HG2 VAL 70 -0.596 6.774 -18.239 630 H GLY 71 H GLY 71 -0.878 5.171 -16.106 631 HA2 GLY 71 1HA GLY 71 -3.230 4.760 -14.563 632 HA3 GLY 71 2HA GLY 71 -2.255 3.501 -15.308 633 H ALA 72 H ALA 72 0.150 3.751 -14.039 634 HA ALA 72 HA ALA 72 -0.441 2.523 -11.526 635 HB1 ALA 72 3HB ALA 72 1.457 1.924 -13.097 636 HB2 ALA 72 1HB ALA 72 1.850 2.013 -11.381 637 HB3 ALA 72 2HB ALA 72 2.296 3.337 -12.457 638 H LEU 73 H LEU 73 1.006 5.630 -12.437 639 HA LEU 73 HA LEU 73 1.647 6.412 -9.795 640 HB2 LEU 73 1HB LEU 73 1.387 7.823 -12.411 641 HB3 LEU 73 2HB LEU 73 1.478 8.782 -10.946 642 HG LEU 73 HG LEU 73 3.635 7.617 -10.399 643 HD11 LEU 73 1HD1 LEU 73 3.414 6.603 -13.233 644 HD12 LEU 73 2HD1 LEU 73 3.301 5.613 -11.780 645 HD13 LEU 73 3HD1 LEU 73 4.812 6.437 -12.171 646 HD21 LEU 73 3HD2 LEU 73 4.961 8.909 -11.992 647 HD22 LEU 73 1HD2 LEU 73 3.593 9.843 -11.387 648 HD23 LEU 73 2HD2 LEU 73 3.533 9.136 -13.002 649 H LEU 74 H LEU 74 -1.233 6.909 -11.817 650 HA LEU 74 HA LEU 74 -2.559 8.568 -9.921 651 HB2 LEU 74 1HB LEU 74 -3.229 7.298 -12.483 652 HB3 LEU 74 2HB LEU 74 -4.588 7.503 -11.396 653 HG LEU 74 HG LEU 74 -3.821 9.964 -11.225 654 HD11 LEU 74 1HD1 LEU 74 -1.634 9.359 -12.444 655 HD12 LEU 74 2HD1 LEU 74 -2.463 10.853 -12.887 656 HD13 LEU 74 3HD1 LEU 74 -2.612 9.425 -13.911 657 HD21 LEU 74 3HD2 LEU 74 -5.097 10.547 -13.229 658 HD22 LEU 74 1HD2 LEU 74 -5.872 9.247 -12.323 659 HD23 LEU 74 2HD2 LEU 74 -4.968 8.881 -13.794 660 H LEU 75 H LEU 75 -2.574 5.107 -10.596 661 HA LEU 75 HA LEU 75 -4.670 4.484 -8.763 662 HB2 LEU 75 1HB LEU 75 -2.901 3.036 -10.536 663 HB3 LEU 75 2HB LEU 75 -3.041 2.216 -8.994 664 HG LEU 75 HG LEU 75 -5.659 2.749 -9.535 665 HD11 LEU 75 1HD1 LEU 75 -6.067 2.169 -11.865 666 HD12 LEU 75 2HD1 LEU 75 -4.330 2.156 -12.173 667 HD13 LEU 75 3HD1 LEU 75 -5.138 3.662 -11.734 668 HD21 LEU 75 3HD2 LEU 75 -4.715 0.620 -8.793 669 HD22 LEU 75 1HD2 LEU 75 -4.092 0.329 -10.417 670 HD23 LEU 75 2HD2 LEU 75 -5.831 0.398 -10.141 671 H LEU 76 H LEU 76 -1.153 4.592 -8.543 672 HA LEU 76 HA LEU 76 -0.973 3.547 -5.902 673 HB2 LEU 76 1HB LEU 76 0.842 3.882 -7.798 674 HB3 LEU 76 2HB LEU 76 1.082 5.419 -6.989 675 HG LEU 76 HG LEU 76 1.270 3.870 -4.845 676 HD11 LEU 76 1HD1 LEU 76 2.386 1.766 -5.354 677 HD12 LEU 76 2HD1 LEU 76 2.157 2.051 -7.080 678 HD13 LEU 76 3HD1 LEU 76 0.759 1.798 -6.033 679 HD21 LEU 76 3HD2 LEU 76 3.467 4.243 -6.878 680 HD22 LEU 76 1HD2 LEU 76 3.701 3.846 -5.175 681 HD23 LEU 76 2HD2 LEU 76 2.991 5.395 -5.631 682 H LEU 77 H LEU 77 -1.368 6.759 -7.261 683 HA LEU 77 HA LEU 77 -0.877 8.216 -4.876 684 HB2 LEU 77 1HB LEU 77 -0.960 9.001 -7.360 685 HB3 LEU 77 2HB LEU 77 -2.676 9.201 -7.061 686 HG LEU 77 HG LEU 77 -1.799 10.602 -4.987 687 HD11 LEU 77 1HD1 LEU 77 0.561 10.145 -5.383 688 HD12 LEU 77 2HD1 LEU 77 0.214 11.865 -5.563 689 HD13 LEU 77 3HD1 LEU 77 0.439 10.854 -6.992 690 HD21 LEU 77 3HD2 LEU 77 -3.252 11.449 -6.738 691 HD22 LEU 77 1HD2 LEU 77 -1.873 11.617 -7.824 692 HD23 LEU 77 2HD2 LEU 77 -1.980 12.616 -6.375 693 H VAL 78 H VAL 78 -3.850 7.010 -6.416 694 HA VAL 78 HA VAL 78 -5.628 8.141 -4.500 695 HB VAL 78 HB VAL 78 -6.098 5.786 -6.346 696 HG11 VAL 78 1HG1 VAL 78 -8.069 7.548 -4.889 697 HG12 VAL 78 2HG1 VAL 78 -7.726 5.855 -4.534 698 HG13 VAL 78 3HG1 VAL 78 -8.480 6.300 -6.066 699 HG21 VAL 78 3HG2 VAL 78 -6.710 8.718 -6.722 700 HG22 VAL 78 1HG2 VAL 78 -7.185 7.421 -7.818 701 HG23 VAL 78 2HG2 VAL 78 -5.478 7.793 -7.580 702 H VAL 79 H VAL 79 -4.163 4.916 -4.839 703 HA VAL 79 HA VAL 79 -5.497 3.742 -2.630 704 HB VAL 79 HB VAL 79 -2.889 2.968 -3.957 705 HG11 VAL 79 1HG1 VAL 79 -3.308 0.729 -2.917 706 HG12 VAL 79 2HG1 VAL 79 -4.551 1.489 -1.923 707 HG13 VAL 79 3HG1 VAL 79 -2.868 1.998 -1.775 708 HG21 VAL 79 3HG2 VAL 79 -5.690 1.892 -4.273 709 HG22 VAL 79 1HG2 VAL 79 -4.248 1.236 -5.046 710 HG23 VAL 79 2HG2 VAL 79 -4.804 2.861 -5.451 711 H ALA 80 H ALA 80 -2.334 5.334 -2.947 712 HA ALA 80 HA ALA 80 -1.494 4.887 -0.276 713 HB1 ALA 80 3HB ALA 80 0.071 5.435 -2.078 714 HB2 ALA 80 1HB ALA 80 0.222 6.554 -0.725 715 HB3 ALA 80 2HB ALA 80 -0.626 7.051 -2.190 716 H LEU 81 H LEU 81 -3.236 7.530 -1.853 717 HA LEU 81 HA LEU 81 -3.258 9.273 0.393 718 HB2 LEU 81 1HB LEU 81 -3.772 9.700 -2.153 719 HB3 LEU 81 2HB LEU 81 -5.415 9.317 -1.679 720 HG LEU 81 HG LEU 81 -4.903 11.147 0.191 721 HD11 LEU 81 1HD1 LEU 81 -3.572 12.971 -0.737 722 HD12 LEU 81 2HD1 LEU 81 -3.149 11.963 -2.121 723 HD13 LEU 81 3HD1 LEU 81 -2.598 11.520 -0.505 724 HD21 LEU 81 3HD2 LEU 81 -5.961 12.798 -1.283 725 HD22 LEU 81 1HD2 LEU 81 -6.746 11.224 -1.389 726 HD23 LEU 81 2HD2 LEU 81 -5.653 11.751 -2.667 727 H GLY 82 H GLY 82 -5.386 6.713 -0.748 728 HA2 GLY 82 1HA GLY 82 -7.553 7.223 1.015 729 HA3 GLY 82 2HA GLY 82 -7.235 5.709 0.180 730 H ILE 83 H ILE 83 -4.921 4.809 1.181 731 HA ILE 83 HA ILE 83 -5.637 3.837 3.743 732 HB ILE 83 HB ILE 83 -2.865 3.751 2.535 733 HG12 ILE 83 1HG1 ILE 83 -4.849 1.520 2.251 734 HG13 ILE 83 2HG1 ILE 83 -4.916 2.875 1.130 735 HG21 ILE 83 1HG2 ILE 83 -2.960 3.108 4.882 736 HG22 ILE 83 2HG2 ILE 83 -2.634 1.700 3.870 737 HG23 ILE 83 3HG2 ILE 83 -4.249 1.955 4.530 738 HD11 ILE 83 3HD1 ILE 83 -3.627 1.045 0.206 739 HD12 ILE 83 1HD1 ILE 83 -2.547 1.079 1.599 740 HD13 ILE 83 2HD1 ILE 83 -2.595 2.447 0.488 741 H GLY 84 H GLY 84 -3.472 6.407 2.663 742 HA2 GLY 84 1HA GLY 84 -2.226 6.938 5.142 743 HA3 GLY 84 2HA GLY 84 -2.365 8.068 3.803 744 H LEU 85 H LEU 85 -5.089 8.391 3.608 745 HA LEU 85 HA LEU 85 -5.606 10.164 5.795 746 HB2 LEU 85 1HB LEU 85 -7.248 9.311 3.417 747 HB3 LEU 85 2HB LEU 85 -7.839 10.444 4.617 748 HG LEU 85 HG LEU 85 -5.249 10.995 3.218 749 HD11 LEU 85 1HD1 LEU 85 -8.001 11.557 2.123 750 HD12 LEU 85 2HD1 LEU 85 -6.784 10.494 1.417 751 HD13 LEU 85 3HD1 LEU 85 -6.497 12.232 1.495 752 HD21 LEU 85 3HD2 LEU 85 -5.892 12.394 5.112 753 HD22 LEU 85 1HD2 LEU 85 -7.432 12.756 4.334 754 HD23 LEU 85 2HD2 LEU 85 -5.924 13.315 3.609 755 H PHE 86 H PHE 86 -6.460 6.888 5.041 756 HA PHE 86 HA PHE 86 -8.708 6.714 6.809 757 HB2 PHE 86 1HB PHE 86 -8.037 5.210 4.763 758 HB3 PHE 86 2HB PHE 86 -7.121 4.315 5.971 759 HD1 PHE 86 HD1 PHE 86 -10.456 5.227 4.785 760 HD2 PHE 86 HD2 PHE 86 -8.244 3.057 7.703 761 HE1 PHE 86 HE1 PHE 86 -12.496 4.009 5.419 762 HE2 PHE 86 HE2 PHE 86 -10.281 1.833 8.341 763 HZ PHE 86 HZ PHE 86 -12.410 2.308 7.199 764 H ILE 87 H ILE 87 -5.262 5.943 7.044 765 HA ILE 87 HA ILE 87 -5.529 4.876 9.724 766 HB ILE 87 HB ILE 87 -2.990 5.526 8.218 767 HG12 ILE 87 1HG1 ILE 87 -4.266 3.914 6.924 768 HG13 ILE 87 2HG1 ILE 87 -2.900 3.105 7.676 769 HG21 ILE 87 1HG2 ILE 87 -3.434 3.699 10.576 770 HG22 ILE 87 2HG2 ILE 87 -2.702 5.302 10.642 771 HG23 ILE 87 3HG2 ILE 87 -1.898 4.002 9.762 772 HD11 ILE 87 3HD1 ILE 87 -5.795 2.948 8.477 773 HD12 ILE 87 1HD1 ILE 87 -4.475 2.302 9.452 774 HD13 ILE 87 2HD1 ILE 87 -4.773 1.661 7.837 775 H ARG 88 H ARG 88 -4.632 7.909 8.214 776 HA ARG 88 HA ARG 88 -3.360 9.120 10.426 777 HB2 ARG 88 1HB ARG 88 -3.622 9.833 7.872 778 HB3 ARG 88 2HB ARG 88 -4.935 10.797 8.534 779 HG2 ARG 88 1HG ARG 88 -3.374 11.867 10.081 780 HG3 ARG 88 2HG ARG 88 -2.056 10.898 9.416 781 HD2 ARG 88 1HD ARG 88 -2.420 11.914 7.219 782 HD3 ARG 88 2HD ARG 88 -3.736 12.881 7.884 783 HE ARG 88 HE ARG 88 -1.434 13.364 9.399 784 HH11 ARG 88 1HH1 ARG 88 -2.639 13.945 6.170 785 HH12 ARG 88 2HH1 ARG 88 -1.698 15.381 5.944 786 HH21 ARG 88 1HH2 ARG 88 -0.198 15.250 9.098 787 HH22 ARG 88 2HH2 ARG 88 -0.312 16.121 7.605 788 H ARG 89 H ARG 89 -6.698 8.589 9.658 789 HA ARG 89 HA ARG 89 -7.719 10.537 11.529 790 HB2 ARG 89 1HB ARG 89 -9.008 8.406 9.838 791 HB3 ARG 89 2HB ARG 89 -9.923 9.340 11.012 792 HG2 ARG 89 1HG ARG 89 -9.315 11.402 9.852 793 HG3 ARG 89 2HG ARG 89 -8.394 10.465 8.674 794 HD2 ARG 89 1HD ARG 89 -10.441 9.299 8.006 795 HD3 ARG 89 2HD ARG 89 -11.358 10.235 9.185 796 HE ARG 89 HE ARG 89 -10.024 12.016 7.488 797 HH11 ARG 89 1HH1 ARG 89 -12.609 9.667 7.345 798 HH12 ARG 89 2HH1 ARG 89 -13.437 10.474 6.056 799 HH21 ARG 89 1HH2 ARG 89 -11.116 13.074 5.796 800 HH22 ARG 89 2HH2 ARG 89 -12.590 12.407 5.178 801 H ARG 90 H ARG 90 -6.622 7.306 11.674 802 HA ARG 90 HA ARG 90 -8.184 6.535 13.978 803 HB2 ARG 90 1HB ARG 90 -5.940 5.239 12.450 804 HB3 ARG 90 2HB ARG 90 -6.543 4.558 13.954 805 HG2 ARG 90 1HG ARG 90 -8.773 4.362 12.975 806 HG3 ARG 90 2HG ARG 90 -8.166 5.045 11.465 807 HD2 ARG 90 1HD ARG 90 -6.634 3.167 11.216 808 HD3 ARG 90 2HD ARG 90 -7.186 2.498 12.750 809 HE ARG 90 HE ARG 90 -9.425 2.805 11.134 810 HH11 ARG 90 1HH1 ARG 90 -6.468 0.942 11.128 811 HH12 ARG 90 2HH1 ARG 90 -7.157 -0.380 10.245 812 HH21 ARG 90 1HH2 ARG 90 -10.327 1.066 9.977 813 HH22 ARG 90 2HH2 ARG 90 -9.346 -0.309 9.592 814 H HIS 91 H HIS 91 -5.193 8.141 13.400 815 HA HIS 91 HA HIS 91 -3.859 7.500 15.821 816 HB2 HIS 91 1HB HIS 91 -3.551 9.711 13.806 817 HB3 HIS 91 2HB HIS 91 -2.582 9.673 15.276 818 HD1 HIS 91 HD1 HIS 91 -2.759 8.316 11.887 819 HD2 HIS 91 HD2 HIS 91 -0.880 7.319 15.458 820 HE1 HIS 91 HE1 HIS 91 -0.944 6.693 11.262 821 HE2 HIS 91 HE2 HIS 91 0.233 6.170 13.427 822 H ILE 92 H ILE 92 -6.436 9.663 15.081 823 HA ILE 92 HA ILE 92 -6.037 11.365 17.389 824 HB ILE 92 HB ILE 92 -8.598 11.269 15.819 825 HG12 ILE 92 1HG1 ILE 92 -6.481 13.136 14.901 826 HG13 ILE 92 2HG1 ILE 92 -6.265 11.445 14.465 827 HG21 ILE 92 1HG2 ILE 92 -7.084 13.502 17.173 828 HG22 ILE 92 2HG2 ILE 92 -8.522 12.689 17.792 829 HG23 ILE 92 3HG2 ILE 92 -8.624 13.671 16.331 830 HD11 ILE 92 3HD1 ILE 92 -8.594 13.219 13.782 831 HD12 ILE 92 1HD1 ILE 92 -8.547 11.483 13.475 832 HD13 ILE 92 2HD1 ILE 92 -7.390 12.552 12.680 833 H VAL 93 H VAL 93 -7.346 8.313 16.858 834 HA VAL 93 HA VAL 93 -9.289 8.500 19.039 835 HB VAL 93 HB VAL 93 -8.701 6.003 17.460 836 HG11 VAL 93 1HG1 VAL 93 -11.033 5.469 18.005 837 HG12 VAL 93 2HG1 VAL 93 -11.171 6.991 18.883 838 HG13 VAL 93 3HG1 VAL 93 -10.067 5.741 19.456 839 HG21 VAL 93 3HG2 VAL 93 -10.499 6.624 15.910 840 HG22 VAL 93 1HG2 VAL 93 -9.143 7.750 15.822 841 HG23 VAL 93 2HG2 VAL 93 -10.614 8.205 16.684 842 H ARG 94 H ARG 94 -6.087 7.403 18.386 843 HA ARG 94 HA ARG 94 -5.991 5.689 20.744 844 HB2 ARG 94 1HB ARG 94 -4.244 6.165 18.389 845 HB3 ARG 94 2HB ARG 94 -3.453 5.680 19.884 846 HG2 ARG 94 1HG ARG 94 -4.871 3.689 19.986 847 HG3 ARG 94 2HG ARG 94 -5.651 4.173 18.481 848 HD2 ARG 94 1HD ARG 94 -3.997 2.538 17.947 849 HD3 ARG 94 2HD ARG 94 -3.406 4.102 17.387 850 HE ARG 94 HE ARG 94 -2.491 3.413 20.020 851 HH11 ARG 94 1HH1 ARG 94 -1.862 3.029 16.603 852 HH12 ARG 94 2HH1 ARG 94 -0.174 2.714 16.824 853 HH21 ARG 94 1HH2 ARG 94 -0.271 3.003 20.305 854 HH22 ARG 94 2HH2 ARG 94 0.729 2.699 18.924 855 H LYS 95 H LYS 95 -4.732 6.077 22.543 856 HA LYS 95 HA LYS 95 -3.863 8.868 22.887 857 HB2 LYS 95 1HB LYS 95 -4.901 6.823 24.843 858 HB3 LYS 95 2HB LYS 95 -4.059 8.273 25.376 859 HG2 LYS 95 1HG LYS 95 -5.748 9.659 24.284 860 HG3 LYS 95 2HG LYS 95 -6.592 8.204 23.747 861 HD2 LYS 95 1HD LYS 95 -6.942 7.551 26.081 862 HD3 LYS 95 2HD LYS 95 -6.095 9.004 26.615 863 HE2 LYS 95 1HE LYS 95 -7.795 10.390 25.531 864 HE3 LYS 95 2HE LYS 95 -8.641 8.937 24.996 865 HZ1 LYS 95 3HZ LYS 95 -9.648 9.863 26.983 866 HZ2 LYS 95 1HZ LYS 95 -8.184 9.732 27.822 867 HZ3 LYS 95 2HZ LYS 95 -8.995 8.337 27.312 868 H ARG 96 H ARG 96 -2.306 6.639 21.704 869 HA ARG 96 HA ARG 96 -0.203 5.789 21.701 870 HB2 ARG 96 1HB ARG 96 0.108 8.216 23.429 871 HB3 ARG 96 2HB ARG 96 1.471 7.132 23.191 872 HG2 ARG 96 1HG ARG 96 1.308 7.461 20.774 873 HG3 ARG 96 2HG ARG 96 -0.056 8.553 21.018 874 HD2 ARG 96 1HD ARG 96 1.377 10.052 22.315 875 HD3 ARG 96 2HD ARG 96 2.740 8.958 22.074 876 HE ARG 96 HE ARG 96 1.716 9.658 19.567 877 HH11 ARG 96 1HH1 ARG 96 3.392 11.152 22.246 878 HH12 ARG 96 2HH1 ARG 96 4.172 12.341 21.255 879 HH21 ARG 96 1HH2 ARG 96 2.742 11.221 18.270 880 HH22 ARG 96 2HH2 ARG 96 3.801 12.379 19.000 881 H THR 97 H THR 97 -2.131 4.696 23.587 882 HA THR 97 HA THR 97 -0.658 4.001 25.978 883 HB THR 97 HB THR 97 -2.649 2.463 26.378 884 HG1 THR 97 HG1 THR 97 -4.073 3.944 24.490 885 HG21 THR 97 3HG2 THR 97 -4.135 4.316 26.993 886 HG22 THR 97 1HG2 THR 97 -3.175 5.414 26.003 887 HG23 THR 97 2HG2 THR 97 -2.462 4.661 27.429 888 H LEU 98 H LEU 98 -0.821 2.821 22.813 889 HA LEU 98 HA LEU 98 -0.234 0.066 23.507 890 HB2 LEU 98 1HB LEU 98 -1.706 0.805 21.544 891 HB3 LEU 98 2HB LEU 98 -0.214 1.251 20.742 892 HG LEU 98 HG LEU 98 0.530 -1.165 21.094 893 HD11 LEU 98 1HD1 LEU 98 -0.990 -1.943 22.735 894 HD12 LEU 98 2HD1 LEU 98 -1.417 -2.766 21.235 895 HD13 LEU 98 3HD1 LEU 98 -2.385 -1.404 21.801 896 HD21 LEU 98 3HD2 LEU 98 -0.667 -1.926 19.117 897 HD22 LEU 98 1HD2 LEU 98 -0.159 -0.247 18.935 898 HD23 LEU 98 2HD2 LEU 98 -1.841 -0.625 19.312 899 H ARG 99 H ARG 99 1.321 2.858 22.099 900 HA ARG 99 HA ARG 99 3.819 1.727 21.497 901 HB2 ARG 99 1HB ARG 99 2.913 4.570 21.948 902 HB3 ARG 99 2HB ARG 99 4.582 4.166 21.569 903 HG2 ARG 99 1HG ARG 99 3.863 3.161 19.460 904 HG3 ARG 99 2HG ARG 99 2.189 3.565 19.841 905 HD2 ARG 99 1HD ARG 99 2.923 5.267 18.396 906 HD3 ARG 99 2HD ARG 99 2.967 5.976 20.008 907 HE ARG 99 HE ARG 99 5.487 4.896 19.452 908 HH11 ARG 99 1HH1 ARG 99 3.432 7.504 18.354 909 HH12 ARG 99 2HH1 ARG 99 4.758 8.510 17.874 910 HH21 ARG 99 1HH2 ARG 99 7.225 6.222 18.819 911 HH22 ARG 99 2HH2 ARG 99 6.908 7.782 18.137 912 H ARG 100 H ARG 100 2.343 3.142 24.314 913 HA ARG 100 HA ARG 100 4.712 3.318 25.904 914 HB2 ARG 100 1HB ARG 100 1.766 3.217 26.576 915 HB3 ARG 100 2HB ARG 100 3.000 3.264 27.829 916 HG2 ARG 100 1HG ARG 100 3.056 5.338 25.694 917 HG3 ARG 100 2HG ARG 100 1.847 5.459 26.974 918 HD2 ARG 100 1HD ARG 100 3.624 5.373 28.656 919 HD3 ARG 100 2HD ARG 100 4.830 5.252 27.376 920 HE ARG 100 HE ARG 100 3.293 7.548 26.930 921 HH11 ARG 100 1HH1 ARG 100 5.632 6.337 29.229 922 HH12 ARG 100 2HH1 ARG 100 6.227 7.912 29.638 923 HH21 ARG 100 1HH2 ARG 100 4.078 9.614 27.469 924 HH22 ARG 100 2HH2 ARG 100 5.345 9.770 28.639 925 H LEU 101 H LEU 101 2.658 0.892 24.793 926 HA LEU 101 HA LEU 101 3.804 -1.130 26.570 927 HB2 LEU 101 1HB LEU 101 1.243 -1.097 24.978 928 HB3 LEU 101 2HB LEU 101 1.887 -2.553 25.708 929 HG LEU 101 HG LEU 101 1.325 -0.123 27.383 930 HD11 LEU 101 1HD1 LEU 101 -0.646 -2.291 26.670 931 HD12 LEU 101 2HD1 LEU 101 -0.727 -0.611 26.142 932 HD13 LEU 101 3HD1 LEU 101 -0.894 -1.006 27.852 933 HD21 LEU 101 3HD2 LEU 101 1.003 -1.856 29.125 934 HD22 LEU 101 1HD2 LEU 101 2.627 -1.858 28.437 935 HD23 LEU 101 2HD2 LEU 101 1.459 -3.085 27.946 936 H LEU 102 H LEU 102 3.481 0.008 23.270 937 HA LEU 102 HA LEU 102 4.272 -2.437 22.001 938 HB2 LEU 102 1HB LEU 102 3.148 -0.249 21.038 939 HB3 LEU 102 2HB LEU 102 4.815 0.211 20.742 940 HG LEU 102 HG LEU 102 3.938 -2.460 19.767 941 HD11 LEU 102 1HD1 LEU 102 3.232 0.115 18.368 942 HD12 LEU 102 2HD1 LEU 102 2.083 -0.976 19.140 943 HD13 LEU 102 3HD1 LEU 102 3.007 -1.517 17.738 944 HD21 LEU 102 3HD2 LEU 102 6.253 -1.720 19.515 945 HD22 LEU 102 1HD2 LEU 102 5.704 -0.294 18.632 946 HD23 LEU 102 2HD2 LEU 102 5.465 -1.902 17.948 947 H GLN 103 H GLN 103 6.023 0.475 22.989 948 HA GLN 103 HA GLN 103 8.565 -0.658 22.163 949 HB2 GLN 103 1HB GLN 103 7.765 1.972 23.399 950 HB3 GLN 103 2HB GLN 103 9.450 1.509 23.203 951 HG2 GLN 103 1HG GLN 103 9.121 1.323 20.791 952 HG3 GLN 103 2HG GLN 103 7.431 1.787 20.987 953 HE21 GLN 103 2HE2 GLN 103 10.732 2.864 21.068 954 HE22 GLN 103 1HE2 GLN 103 10.395 4.558 21.062 955 H GLU 104 H GLU 104 6.562 -0.709 24.888 956 HA GLU 104 HA GLU 104 8.685 -0.973 26.848 957 HB2 GLU 104 1HB GLU 104 6.186 -0.082 27.099 958 HB3 GLU 104 2HB GLU 104 5.891 -1.771 27.484 959 HG2 GLU 104 1HG GLU 104 7.556 -1.658 29.267 960 HG3 GLU 104 2HG GLU 104 7.853 0.035 28.881 961 H ARG 105 H ARG 105 6.412 -3.101 25.172 962 HA ARG 105 HA ARG 105 7.397 -5.439 26.585 963 HB2 ARG 105 1HB ARG 105 5.205 -4.960 24.591 964 HB3 ARG 105 2HB ARG 105 5.748 -6.596 24.943 965 HG2 ARG 105 1HG ARG 105 5.063 -4.840 27.235 966 HG3 ARG 105 2HG ARG 105 3.747 -5.471 26.246 967 HD2 ARG 105 1HD ARG 105 4.566 -7.749 26.610 968 HD3 ARG 105 2HD ARG 105 5.886 -7.117 27.594 969 HE ARG 105 HE ARG 105 3.472 -6.202 28.671 970 HH11 ARG 105 1HH1 ARG 105 5.206 -9.210 28.259 971 HH12 ARG 105 2HH1 ARG 105 4.509 -9.947 29.663 972 HH21 ARG 105 1HH2 ARG 105 2.559 -7.173 30.514 973 HH22 ARG 105 2HH2 ARG 105 3.007 -8.791 30.941 974 H GLU 106 H GLU 106 8.251 -3.709 23.813 975 HA GLU 106 HA GLU 106 9.426 -6.057 22.507 976 HB2 GLU 106 1HB GLU 106 8.876 -3.247 21.582 977 HB3 GLU 106 2HB GLU 106 9.976 -4.298 20.698 978 HG2 GLU 106 1HG GLU 106 7.986 -5.972 20.747 979 HG3 GLU 106 2HG GLU 106 7.027 -4.529 21.066 980 H LEU 107 H LEU 107 10.342 -4.366 24.970 981 HA LEU 107 HA LEU 107 12.288 -3.750 25.957 982 HB2 LEU 107 1HB LEU 107 12.839 -6.085 24.949 983 HB3 LEU 107 2HB LEU 107 13.815 -5.182 23.807 984 HG LEU 107 HG LEU 107 14.829 -4.140 26.026 985 HD11 LEU 107 1HD1 LEU 107 13.322 -5.307 27.541 986 HD12 LEU 107 2HD1 LEU 107 14.992 -5.817 27.797 987 HD13 LEU 107 3HD1 LEU 107 13.876 -6.859 26.912 988 HD21 LEU 107 3HD2 LEU 107 16.096 -5.316 24.320 989 HD22 LEU 107 1HD2 LEU 107 15.534 -6.866 24.945 990 HD23 LEU 107 2HD2 LEU 107 16.586 -5.849 25.929 991 H VAL 108 H VAL 108 11.172 -1.981 24.023 992 HA VAL 108 HA VAL 108 11.599 -0.085 22.840 993 HB VAL 108 HB VAL 108 14.302 0.042 24.167 994 HG11 VAL 108 1HG1 VAL 108 13.773 1.803 22.570 995 HG12 VAL 108 2HG1 VAL 108 13.831 2.451 24.210 996 HG13 VAL 108 3HG1 VAL 108 12.276 2.156 23.433 997 HG21 VAL 108 3HG2 VAL 108 13.358 0.849 26.185 998 HG22 VAL 108 1HG2 VAL 108 12.507 -0.648 25.805 999 HG23 VAL 108 2HG2 VAL 108 11.740 0.908 25.488 1000 H GLU 109 H GLU 109 11.953 -2.132 21.226 1001 HA GLU 109 HA GLU 109 14.555 -1.829 19.907 1002 HB2 GLU 109 1HB GLU 109 12.399 -3.923 19.733 1003 HB3 GLU 109 2HB GLU 109 13.678 -3.817 18.533 1004 HG2 GLU 109 1HG GLU 109 15.352 -4.129 20.284 1005 HG3 GLU 109 2HG GLU 109 14.068 -4.234 21.488 1006 HA PRO 110 HA PRO 110 12.730 0.676 16.726 1007 HB2 PRO 110 1HB PRO 110 14.584 0.320 14.761 1008 HB3 PRO 110 2HB PRO 110 14.877 1.330 16.190 1009 HG2 PRO 110 1HG PRO 110 15.776 -1.453 15.632 1010 HG3 PRO 110 2HG PRO 110 16.655 -0.110 16.391 1011 HD2 PRO 110 1HD PRO 110 15.523 -2.122 17.821 1012 HD3 PRO 110 2HD PRO 110 15.711 -0.471 18.447 1013 H LEU 111 H LEU 111 11.209 0.366 15.210 1014 HA LEU 111 HA LEU 111 11.286 -1.977 13.500 1015 HB2 LEU 111 1HB LEU 111 9.890 -2.341 15.676 1016 HB3 LEU 111 2HB LEU 111 8.711 -1.312 14.888 1017 HG LEU 111 HG LEU 111 9.722 -3.639 13.339 1018 HD11 LEU 111 1HD1 LEU 111 9.378 -4.623 15.533 1019 HD12 LEU 111 2HD1 LEU 111 8.109 -5.137 14.419 1020 HD13 LEU 111 3HD1 LEU 111 7.775 -3.896 15.626 1021 HD21 LEU 111 3HD2 LEU 111 7.406 -3.678 12.567 1022 HD22 LEU 111 1HD2 LEU 111 8.113 -2.074 12.374 1023 HD23 LEU 111 2HD2 LEU 111 6.999 -2.393 13.704 1024 H THR 112 H THR 112 11.737 -0.509 11.863 1025 HA THR 112 HA THR 112 9.379 0.906 10.853 1026 HB THR 112 HB THR 112 10.683 2.663 11.890 1027 HG1 THR 112 HG1 THR 112 11.024 3.950 10.010 1028 HG21 THR 112 3HG2 THR 112 12.879 1.595 11.929 1029 HG22 THR 112 1HG2 THR 112 12.976 3.184 11.170 1030 HG23 THR 112 2HG2 THR 112 12.990 1.729 10.175 1031 HA PRO 113 HA PRO 113 10.570 -1.184 7.112 1032 HB2 PRO 113 1HB PRO 113 8.982 0.134 5.350 1033 HB3 PRO 113 2HB PRO 113 8.338 -1.026 6.527 1034 HG2 PRO 113 1HG PRO 113 8.348 1.951 6.626 1035 HG3 PRO 113 2HG PRO 113 7.071 0.807 7.087 1036 HD2 PRO 113 1HD PRO 113 8.718 2.013 8.893 1037 HD3 PRO 113 2HD PRO 113 7.971 0.426 9.153 1038 H SER 114 H SER 114 11.468 1.918 7.863 1039 HA SER 114 HA SER 114 12.552 2.642 5.268 1040 HB2 SER 114 1HB SER 114 12.788 4.006 7.961 1041 HB3 SER 114 2HB SER 114 13.358 4.671 6.431 1042 HG SER 114 HG SER 114 11.228 5.387 7.128 1043 H GLY 115 H GLY 115 13.464 0.449 7.452 1044 HA2 GLY 115 1HA GLY 115 15.525 -0.739 7.225 1045 HA3 GLY 115 2HA GLY 115 16.308 0.769 6.772 1046 H GLU 116 H GLU 116 17.425 1.827 8.280 1047 HA GLU 116 HA GLU 116 16.922 1.177 11.108 1048 HB2 GLU 116 1HB GLU 116 19.552 1.364 9.649 1049 HB3 GLU 116 2HB GLU 116 19.445 1.529 11.397 1050 HG2 GLU 116 1HG GLU 116 18.466 -0.701 11.551 1051 HG3 GLU 116 2HG GLU 116 18.567 -0.866 9.798 1052 H LYS 117 H LYS 117 17.048 2.841 12.562 1053 HA LYS 117 HA LYS 117 16.895 5.507 11.461 1054 HB2 LYS 117 1HB LYS 117 16.420 4.366 14.205 1055 HB3 LYS 117 2HB LYS 117 16.421 6.099 13.907 1056 HG2 LYS 117 1HG LYS 117 14.596 5.826 12.306 1057 HG3 LYS 117 2HG LYS 117 14.594 4.088 12.607 1058 HD2 LYS 117 1HD LYS 117 14.043 4.497 14.957 1059 HD3 LYS 117 2HD LYS 117 14.047 6.236 14.655 1060 HE2 LYS 117 1HE LYS 117 12.208 5.961 13.063 1061 HE3 LYS 117 2HE LYS 117 12.206 4.224 13.363 1062 HZ1 LYS 117 3HZ LYS 117 11.633 4.662 15.671 1063 HZ2 LYS 117 1HZ LYS 117 10.484 5.341 14.632 1064 HZ3 LYS 117 2HZ LYS 117 11.634 6.328 15.381 1065 H LEU 118 H LEU 118 18.981 3.714 13.687 1066 HA LEU 118 HA LEU 118 20.734 5.999 14.024 1067 HB2 LEU 118 1HB LEU 118 20.768 3.221 15.185 1068 HB3 LEU 118 2HB LEU 118 22.024 4.404 15.494 1069 HG LEU 118 HG LEU 118 19.945 5.876 16.257 1070 HD11 LEU 118 1HD1 LEU 118 18.286 4.505 17.411 1071 HD12 LEU 118 2HD1 LEU 118 19.031 3.047 16.756 1072 HD13 LEU 118 3HD1 LEU 118 18.268 4.211 15.674 1073 HD21 LEU 118 3HD2 LEU 118 21.866 5.332 17.639 1074 HD22 LEU 118 1HD2 LEU 118 21.227 3.713 17.921 1075 HD23 LEU 118 2HD2 LEU 118 20.372 5.121 18.552 1076 H TRP 119 H TRP 119 20.392 3.517 11.829 1077 HA TRP 119 HA TRP 119 23.187 3.808 10.956 1078 HB2 TRP 119 1HB TRP 119 22.475 1.526 12.054 1079 HB3 TRP 119 2HB TRP 119 21.729 1.234 10.486 1080 HD1 TRP 119 HD1 TRP 119 23.345 0.830 8.409 1081 HE1 TRP 119 HE1 TRP 119 25.845 0.244 8.247 1082 HE3 TRP 119 HE3 TRP 119 24.758 1.940 13.201 1083 HZ2 TRP 119 HZ2 TRP 119 28.115 0.249 9.924 1084 HZ3 TRP 119 HZ3 TRP 119 27.114 1.620 13.837 1085 HH2 TRP 119 HH2 TRP 119 28.756 0.791 12.232 1086 H SER 120 H SER 120 23.515 4.031 8.782 1087 HA SER 120 HA SER 120 21.101 4.418 7.159 1088 HB2 SER 120 1HB SER 120 23.928 5.411 6.719 1089 HB3 SER 120 2HB SER 120 22.552 5.759 5.672 1090 HG SER 120 HG SER 120 23.299 7.164 7.700 Start of MODEL 10 1 H1 LYS 1 1H LYS 1 0.836 -1.681 -34.614 2 H2 LYS 1 2H LYS 1 0.160 -3.089 -33.964 3 H3 LYS 1 3H LYS 1 1.313 -2.221 -33.083 4 HA LYS 1 HA LYS 1 -0.174 -0.354 -32.880 5 HB2 LYS 1 1HB LYS 1 -1.982 -2.133 -34.512 6 HB3 LYS 1 2HB LYS 1 -2.599 -0.796 -33.553 7 HG2 LYS 1 1HG LYS 1 -1.224 0.764 -34.835 8 HG3 LYS 1 2HG LYS 1 -0.601 -0.579 -35.797 9 HD2 LYS 1 1HD LYS 1 -2.870 -1.062 -36.584 10 HD3 LYS 1 2HD LYS 1 -3.488 0.281 -35.622 11 HE2 LYS 1 1HE LYS 1 -2.116 1.839 -36.919 12 HE3 LYS 1 2HE LYS 1 -1.497 0.495 -37.878 13 HZ1 LYS 1 3HZ LYS 1 -3.278 1.650 -39.023 14 HZ2 LYS 1 1HZ LYS 1 -4.337 1.356 -37.737 15 HZ3 LYS 1 2HZ LYS 1 -3.746 0.067 -38.657 16 H ILE 2 H ILE 2 -0.937 -0.231 -30.866 17 HA ILE 2 HA ILE 2 -2.140 -2.608 -29.639 18 HB ILE 2 HB ILE 2 -0.855 -1.973 -27.498 19 HG12 ILE 2 1HG1 ILE 2 1.568 -1.208 -28.410 20 HG13 ILE 2 2HG1 ILE 2 0.543 -0.334 -29.543 21 HG21 ILE 2 1HG2 ILE 2 0.575 -3.257 -29.819 22 HG22 ILE 2 2HG2 ILE 2 -0.527 -4.052 -28.693 23 HG23 ILE 2 3HG2 ILE 2 1.019 -3.428 -28.120 24 HD11 ILE 2 3HD1 ILE 2 1.133 1.047 -27.639 25 HD12 ILE 2 1HD1 ILE 2 0.424 -0.138 -26.542 26 HD13 ILE 2 2HD1 ILE 2 -0.604 0.739 -27.676 27 HA PRO 3 HA PRO 3 -5.111 0.294 -28.102 28 HB2 PRO 3 1HB PRO 3 -6.011 -1.054 -25.903 29 HB3 PRO 3 2HB PRO 3 -6.446 -1.503 -27.562 30 HG2 PRO 3 1HG PRO 3 -4.411 -2.710 -25.758 31 HG3 PRO 3 2HG PRO 3 -5.546 -3.498 -26.872 32 HD2 PRO 3 1HD PRO 3 -2.933 -3.125 -27.478 33 HD3 PRO 3 2HD PRO 3 -4.214 -3.137 -28.704 34 H SER 4 H SER 4 -5.192 2.015 -26.755 35 HA SER 4 HA SER 4 -2.977 2.456 -24.963 36 HB2 SER 4 1HB SER 4 -5.350 4.211 -25.636 37 HB3 SER 4 2HB SER 4 -3.944 4.717 -24.701 38 HG SER 4 HG SER 4 -3.347 3.569 -27.129 39 H ILE 5 H ILE 5 -5.960 1.007 -24.613 40 HA ILE 5 HA ILE 5 -6.553 1.939 -21.939 41 HB ILE 5 HB ILE 5 -7.796 -0.464 -23.271 42 HG12 ILE 5 1HG1 ILE 5 -9.599 1.522 -23.719 43 HG13 ILE 5 2HG1 ILE 5 -8.090 2.403 -23.930 44 HG21 ILE 5 1HG2 ILE 5 -9.731 0.135 -21.886 45 HG22 ILE 5 2HG2 ILE 5 -8.823 1.486 -21.209 46 HG23 ILE 5 3HG2 ILE 5 -8.296 -0.170 -20.909 47 HD11 ILE 5 3HD1 ILE 5 -8.949 1.532 -26.040 48 HD12 ILE 5 1HD1 ILE 5 -8.863 -0.109 -25.396 49 HD13 ILE 5 2HD1 ILE 5 -7.386 0.825 -25.633 50 H ALA 6 H ALA 6 -4.984 -0.813 -23.445 51 HA ALA 6 HA ALA 6 -4.792 -2.312 -20.977 52 HB1 ALA 6 3HB ALA 6 -5.060 -3.435 -23.159 53 HB2 ALA 6 1HB ALA 6 -3.629 -3.973 -22.281 54 HB3 ALA 6 2HB ALA 6 -3.465 -2.848 -23.628 55 H THR 7 H THR 7 -2.858 -0.053 -22.766 56 HA THR 7 HA THR 7 -0.306 -0.685 -21.749 57 HB THR 7 HB THR 7 -1.057 2.140 -22.413 58 HG1 THR 7 HG1 THR 7 -0.371 0.832 -24.641 59 HG21 THR 7 3HG2 THR 7 1.156 2.081 -23.530 60 HG22 THR 7 1HG2 THR 7 1.348 0.408 -23.005 61 HG23 THR 7 2HG2 THR 7 1.253 1.701 -21.810 62 H GLY 8 H GLY 8 -2.937 1.263 -20.466 63 HA2 GLY 8 1HA GLY 8 -1.351 2.369 -18.313 64 HA3 GLY 8 2HA GLY 8 -3.082 2.555 -18.537 65 H LEU 9 H LEU 9 -3.801 -0.147 -18.675 66 HA LEU 9 HA LEU 9 -4.112 -0.781 -15.958 67 HB2 LEU 9 1HB LEU 9 -4.485 -2.471 -18.432 68 HB3 LEU 9 2HB LEU 9 -4.951 -2.986 -16.821 69 HG LEU 9 HG LEU 9 -6.055 -0.441 -17.964 70 HD11 LEU 9 1HD1 LEU 9 -6.617 -1.936 -19.683 71 HD12 LEU 9 2HD1 LEU 9 -8.039 -1.879 -18.643 72 HD13 LEU 9 3HD1 LEU 9 -6.935 -3.251 -18.552 73 HD21 LEU 9 3HD2 LEU 9 -7.074 -2.448 -15.956 74 HD22 LEU 9 1HD2 LEU 9 -7.935 -1.000 -16.479 75 HD23 LEU 9 2HD2 LEU 9 -6.414 -0.851 -15.600 76 H VAL 10 H VAL 10 -1.925 -2.105 -18.425 77 HA VAL 10 HA VAL 10 -0.837 -4.160 -16.866 78 HB VAL 10 HB VAL 10 1.104 -4.111 -18.423 79 HG11 VAL 10 1HG1 VAL 10 -1.704 -4.109 -19.487 80 HG12 VAL 10 2HG1 VAL 10 -0.674 -5.485 -19.083 81 HG13 VAL 10 3HG1 VAL 10 -0.319 -4.507 -20.508 82 HG21 VAL 10 3HG2 VAL 10 1.227 -1.708 -18.839 83 HG22 VAL 10 1HG2 VAL 10 -0.338 -1.757 -19.651 84 HG23 VAL 10 2HG2 VAL 10 1.046 -2.594 -20.352 85 H GLY 11 H GLY 11 0.116 -0.797 -17.196 86 HA2 GLY 11 1HA GLY 11 2.513 -0.970 -15.679 87 HA3 GLY 11 2HA GLY 11 1.630 0.505 -16.041 88 H ALA 12 H ALA 12 -0.767 0.118 -14.795 89 HA ALA 12 HA ALA 12 -0.041 0.605 -12.074 90 HB1 ALA 12 3HB ALA 12 -1.911 1.726 -13.368 91 HB2 ALA 12 1HB ALA 12 -2.282 1.222 -11.719 92 HB3 ALA 12 2HB ALA 12 -2.848 0.260 -13.085 93 H LEU 13 H LEU 13 -1.757 -2.044 -13.697 94 HA LEU 13 HA LEU 13 -2.420 -3.437 -11.331 95 HB2 LEU 13 1HB LEU 13 -2.284 -4.141 -14.227 96 HB3 LEU 13 2HB LEU 13 -2.423 -5.437 -13.056 97 HG LEU 13 HG LEU 13 -4.489 -4.328 -12.168 98 HD11 LEU 13 1HD1 LEU 13 -5.600 -2.645 -13.526 99 HD12 LEU 13 2HD1 LEU 13 -4.232 -2.612 -14.636 100 HD13 LEU 13 3HD1 LEU 13 -4.033 -2.053 -12.975 101 HD21 LEU 13 3HD2 LEU 13 -4.612 -6.207 -13.713 102 HD22 LEU 13 1HD2 LEU 13 -4.520 -5.099 -15.082 103 HD23 LEU 13 2HD2 LEU 13 -5.919 -5.061 -14.008 104 H LEU 14 H LEU 14 0.386 -3.636 -13.511 105 HA LEU 14 HA LEU 14 1.608 -5.797 -12.126 106 HB2 LEU 14 1HB LEU 14 2.347 -3.963 -14.300 107 HB3 LEU 14 2HB LEU 14 3.697 -4.544 -13.345 108 HG LEU 14 HG LEU 14 2.730 -6.901 -13.784 109 HD11 LEU 14 1HD1 LEU 14 0.588 -5.882 -14.734 110 HD12 LEU 14 2HD1 LEU 14 1.323 -7.215 -15.625 111 HD13 LEU 14 3HD1 LEU 14 1.535 -5.557 -16.187 112 HD21 LEU 14 3HD2 LEU 14 4.827 -6.087 -14.716 113 HD22 LEU 14 1HD2 LEU 14 3.951 -5.287 -16.019 114 HD23 LEU 14 2HD2 LEU 14 3.943 -7.046 -15.902 115 H LEU 15 H LEU 15 1.893 -2.286 -11.914 116 HA LEU 15 HA LEU 15 4.049 -2.303 -10.047 117 HB2 LEU 15 1HB LEU 15 2.380 -0.330 -11.346 118 HB3 LEU 15 2HB LEU 15 2.601 0.064 -9.652 119 HG LEU 15 HG LEU 15 5.163 -0.513 -10.396 120 HD11 LEU 15 1HD1 LEU 15 3.851 0.841 -12.747 121 HD12 LEU 15 2HD1 LEU 15 4.539 -0.783 -12.737 122 HD13 LEU 15 3HD1 LEU 15 5.585 0.619 -12.512 123 HD21 LEU 15 3HD2 LEU 15 4.409 1.417 -9.099 124 HD22 LEU 15 1HD2 LEU 15 3.786 2.164 -10.570 125 HD23 LEU 15 2HD2 LEU 15 5.518 1.896 -10.384 126 H LEU 16 H LEU 16 0.545 -2.290 -9.761 127 HA LEU 16 HA LEU 16 0.446 -1.868 -6.951 128 HB2 LEU 16 1HB LEU 16 -1.416 -1.625 -8.756 129 HB3 LEU 16 2HB LEU 16 -1.674 -3.338 -8.481 130 HG LEU 16 HG LEU 16 -1.830 -2.573 -5.954 131 HD11 LEU 16 1HD1 LEU 16 -2.859 -0.393 -5.708 132 HD12 LEU 16 2HD1 LEU 16 -2.697 -0.095 -7.437 133 HD13 LEU 16 3HD1 LEU 16 -1.258 -0.231 -6.429 134 HD21 LEU 16 3HD2 LEU 16 -3.592 -3.704 -7.185 135 HD22 LEU 16 1HD2 LEU 16 -4.036 -2.190 -7.975 136 HD23 LEU 16 2HD2 LEU 16 -4.259 -2.376 -6.234 137 H LEU 17 H LEU 17 0.597 -4.730 -9.008 138 HA LEU 17 HA LEU 17 0.135 -6.635 -6.961 139 HB2 LEU 17 1HB LEU 17 1.367 -6.797 -9.696 140 HB3 LEU 17 2HB LEU 17 1.323 -8.192 -8.637 141 HG LEU 17 HG LEU 17 -1.214 -6.725 -9.265 142 HD11 LEU 17 1HD1 LEU 17 -0.181 -7.143 -11.427 143 HD12 LEU 17 2HD1 LEU 17 -1.562 -8.211 -11.178 144 HD13 LEU 17 3HD1 LEU 17 0.078 -8.832 -10.992 145 HD21 LEU 17 3HD2 LEU 17 -0.563 -9.601 -8.625 146 HD22 LEU 17 1HD2 LEU 17 -2.176 -8.958 -8.929 147 HD23 LEU 17 2HD2 LEU 17 -1.264 -8.418 -7.520 148 H VAL 18 H VAL 18 3.117 -5.302 -8.378 149 HA VAL 18 HA VAL 18 4.900 -6.906 -6.859 150 HB VAL 18 HB VAL 18 5.431 -4.204 -8.120 151 HG11 VAL 18 1HG1 VAL 18 7.786 -4.892 -8.108 152 HG12 VAL 18 2HG1 VAL 18 7.347 -6.365 -7.242 153 HG13 VAL 18 3HG1 VAL 18 7.129 -4.793 -6.475 154 HG21 VAL 18 3HG2 VAL 18 4.632 -5.817 -9.762 155 HG22 VAL 18 1HG2 VAL 18 5.838 -6.985 -9.222 156 HG23 VAL 18 2HG2 VAL 18 6.348 -5.486 -10.000 157 H VAL 19 H VAL 19 3.642 -3.610 -6.378 158 HA VAL 19 HA VAL 19 5.114 -3.076 -4.012 159 HB VAL 19 HB VAL 19 2.548 -1.834 -5.033 160 HG11 VAL 19 1HG1 VAL 19 2.656 -1.426 -2.669 161 HG12 VAL 19 2HG1 VAL 19 3.113 0.055 -3.511 162 HG13 VAL 19 3HG1 VAL 19 4.354 -0.963 -2.780 163 HG21 VAL 19 3HG2 VAL 19 4.456 -1.519 -6.514 164 HG22 VAL 19 1HG2 VAL 19 5.414 -0.900 -5.170 165 HG23 VAL 19 2HG2 VAL 19 4.009 0.001 -5.741 166 H ALA 20 H ALA 20 1.900 -4.452 -4.588 167 HA ALA 20 HA ALA 20 1.079 -4.522 -1.874 168 HB1 ALA 20 3HB ALA 20 -0.507 -4.671 -3.734 169 HB2 ALA 20 1HB ALA 20 -0.674 -6.035 -2.628 170 HB3 ALA 20 2HB ALA 20 0.154 -6.247 -4.170 171 H LEU 21 H LEU 21 2.701 -6.872 -3.974 172 HA LEU 21 HA LEU 21 2.730 -8.991 -2.079 173 HB2 LEU 21 1HB LEU 21 4.343 -8.444 -4.564 174 HB3 LEU 21 2HB LEU 21 4.596 -9.874 -3.581 175 HG LEU 21 HG LEU 21 1.864 -9.261 -4.654 176 HD11 LEU 21 1HD1 LEU 21 3.348 -9.125 -6.578 177 HD12 LEU 21 2HD1 LEU 21 2.380 -10.599 -6.636 178 HD13 LEU 21 3HD1 LEU 21 4.071 -10.674 -6.144 179 HD21 LEU 21 3HD2 LEU 21 1.667 -11.710 -4.577 180 HD22 LEU 21 1HD2 LEU 21 2.067 -11.029 -3.000 181 HD23 LEU 21 2HD2 LEU 21 3.318 -11.814 -3.965 182 H GLY 22 H GLY 22 4.896 -6.322 -2.807 183 HA2 GLY 22 1HA GLY 22 7.115 -7.207 -1.278 184 HA3 GLY 22 2HA GLY 22 6.800 -5.551 -1.774 185 H ILE 23 H ILE 23 4.596 -4.789 -0.504 186 HA ILE 23 HA ILE 23 5.442 -4.424 2.176 187 HB ILE 23 HB ILE 23 2.650 -3.923 1.129 188 HG12 ILE 23 1HG1 ILE 23 4.811 -1.834 1.216 189 HG13 ILE 23 2HG1 ILE 23 4.661 -2.892 -0.184 190 HG21 ILE 23 1HG2 ILE 23 2.859 -3.797 3.551 191 HG22 ILE 23 2HG2 ILE 23 2.597 -2.190 2.873 192 HG23 ILE 23 3HG2 ILE 23 4.210 -2.674 3.393 193 HD11 ILE 23 3HD1 ILE 23 3.516 -0.813 -0.588 194 HD12 ILE 23 1HD1 ILE 23 2.558 -1.019 0.878 195 HD13 ILE 23 2HD1 ILE 23 2.342 -2.126 -0.479 196 H GLY 24 H GLY 24 3.127 -6.602 0.652 197 HA2 GLY 24 1HA GLY 24 1.887 -7.564 3.004 198 HA3 GLY 24 2HA GLY 24 1.944 -8.398 1.460 199 H LEU 25 H LEU 25 4.643 -8.812 1.135 200 HA LEU 25 HA LEU 25 5.091 -11.016 2.910 201 HB2 LEU 25 1HB LEU 25 6.719 -9.819 0.675 202 HB3 LEU 25 2HB LEU 25 7.269 -11.193 1.614 203 HG LEU 25 HG LEU 25 4.606 -11.323 0.254 204 HD11 LEU 25 1HD1 LEU 25 6.126 -10.543 -1.476 205 HD12 LEU 25 2HD1 LEU 25 5.689 -12.230 -1.746 206 HD13 LEU 25 3HD1 LEU 25 7.267 -11.826 -1.072 207 HD21 LEU 25 3HD2 LEU 25 6.726 -13.375 0.895 208 HD22 LEU 25 1HD2 LEU 25 5.162 -13.705 0.148 209 HD23 LEU 25 2HD2 LEU 25 5.239 -13.100 1.804 210 H PHE 26 H PHE 26 6.134 -7.711 2.775 211 HA PHE 26 HA PHE 26 8.425 -8.043 4.479 212 HB2 PHE 26 1HB PHE 26 7.877 -6.148 2.748 213 HB3 PHE 26 2HB PHE 26 7.034 -5.415 4.107 214 HD1 PHE 26 HD1 PHE 26 8.250 -4.577 6.023 215 HD2 PHE 26 HD2 PHE 26 10.285 -6.354 2.734 216 HE1 PHE 26 HE1 PHE 26 10.375 -3.645 6.840 217 HE2 PHE 26 HE2 PHE 26 12.415 -5.425 3.546 218 HZ PHE 26 HZ PHE 26 12.462 -4.070 5.603 219 H ILE 27 H ILE 27 5.044 -7.132 4.931 220 HA ILE 27 HA ILE 27 5.415 -6.512 7.735 221 HB ILE 27 HB ILE 27 2.863 -6.749 6.133 222 HG12 ILE 27 1HG1 ILE 27 4.233 -4.926 5.291 223 HG13 ILE 27 2HG1 ILE 27 2.863 -4.269 6.175 224 HG21 ILE 27 1HG2 ILE 27 1.813 -5.511 7.987 225 HG22 ILE 27 2HG2 ILE 27 3.318 -5.637 8.898 226 HG23 ILE 27 3HG2 ILE 27 2.416 -7.094 8.481 227 HD11 ILE 27 3HD1 ILE 27 4.708 -2.952 6.775 228 HD12 ILE 27 1HD1 ILE 27 5.744 -4.360 7.009 229 HD13 ILE 27 2HD1 ILE 27 4.440 -4.027 8.148 230 H ARG 28 H ARG 28 4.139 -9.183 5.802 231 HA ARG 28 HA ARG 28 3.010 -10.643 7.956 232 HB2 ARG 28 1HB ARG 28 3.831 -11.346 5.159 233 HB3 ARG 28 2HB ARG 28 3.329 -12.607 6.276 234 HG2 ARG 28 1HG ARG 28 1.571 -10.233 5.926 235 HG3 ARG 28 2HG ARG 28 1.613 -11.459 4.657 236 HD2 ARG 28 1HD ARG 28 1.050 -13.179 6.307 237 HD3 ARG 28 2HD ARG 28 1.009 -11.952 7.573 238 HE ARG 28 HE ARG 28 -0.756 -11.185 5.540 239 HH11 ARG 28 1HH1 ARG 28 -0.451 -13.677 7.973 240 HH12 ARG 28 2HH1 ARG 28 -2.162 -13.900 8.135 241 HH21 ARG 28 1HH2 ARG 28 -3.002 -11.480 5.756 242 HH22 ARG 28 2HH2 ARG 28 -3.608 -12.653 6.876 243 H ARG 29 H ARG 29 6.244 -10.407 6.678 244 HA ARG 29 HA ARG 29 7.221 -12.739 8.076 245 HB2 ARG 29 1HB ARG 29 8.503 -10.602 6.401 246 HB3 ARG 29 2HB ARG 29 9.486 -11.719 7.338 247 HG2 ARG 29 1HG ARG 29 8.489 -13.603 6.158 248 HG3 ARG 29 2HG ARG 29 7.478 -12.494 5.230 249 HD2 ARG 29 1HD ARG 29 9.487 -11.458 4.289 250 HD3 ARG 29 2HD ARG 29 10.493 -12.570 5.215 251 HE ARG 29 HE ARG 29 8.754 -14.115 3.702 252 HH11 ARG 29 1HH1 ARG 29 11.344 -11.839 3.127 253 HH12 ARG 29 2HH1 ARG 29 11.816 -12.567 1.627 254 HH21 ARG 29 1HH2 ARG 29 9.377 -15.068 1.733 255 HH22 ARG 29 2HH2 ARG 29 10.698 -14.398 0.837 256 H ARG 30 H ARG 30 6.706 -9.445 8.825 257 HA ARG 30 HA ARG 30 8.710 -9.307 10.913 258 HB2 ARG 30 1HB ARG 30 6.600 -7.409 9.919 259 HB3 ARG 30 2HB ARG 30 7.505 -7.085 11.390 260 HG2 ARG 30 1HG ARG 30 9.593 -7.149 10.124 261 HG3 ARG 30 2HG ARG 30 8.685 -7.478 8.647 262 HD2 ARG 30 1HD ARG 30 9.119 -5.168 8.604 263 HD3 ARG 30 2HD ARG 30 7.437 -5.317 9.110 264 HE ARG 30 HE ARG 30 9.043 -5.221 11.401 265 HH11 ARG 30 1HH1 ARG 30 8.064 -3.135 8.773 266 HH12 ARG 30 2HH1 ARG 30 8.216 -1.684 9.705 267 HH21 ARG 30 1HH2 ARG 30 9.241 -3.312 12.623 268 HH22 ARG 30 2HH2 ARG 30 8.885 -1.785 11.889 269 H HIS 31 H HIS 31 5.403 -10.226 10.615 270 HA HIS 31 HA HIS 31 4.743 -9.835 13.398 271 HB2 HIS 31 1HB HIS 31 3.318 -10.954 11.017 272 HB3 HIS 31 2HB HIS 31 2.703 -11.294 12.631 273 HD1 HIS 31 HD1 HIS 31 2.826 -8.684 10.042 274 HD2 HIS 31 HD2 HIS 31 1.863 -8.950 14.076 275 HE1 HIS 31 HE1 HIS 31 1.573 -6.569 10.576 276 HE2 HIS 31 HE2 HIS 31 0.925 -6.794 13.001 277 H ILE 32 H ILE 32 6.316 -12.243 11.577 278 HA ILE 32 HA ILE 32 5.617 -14.460 13.302 279 HB ILE 32 HB ILE 32 7.906 -14.498 11.354 280 HG12 ILE 32 1HG1 ILE 32 6.072 -13.549 10.073 281 HG13 ILE 32 2HG1 ILE 32 6.321 -15.219 9.581 282 HG21 ILE 32 1HG2 ILE 32 5.971 -16.616 12.281 283 HG22 ILE 32 2HG2 ILE 32 7.650 -16.434 12.787 284 HG23 ILE 32 3HG2 ILE 32 7.274 -16.858 11.117 285 HD11 ILE 32 3HD1 ILE 32 4.392 -15.897 10.924 286 HD12 ILE 32 1HD1 ILE 32 3.958 -14.679 9.724 287 HD13 ILE 32 2HD1 ILE 32 4.148 -14.220 11.416 288 H VAL 33 H VAL 33 7.789 -11.887 13.445 289 HA VAL 33 HA VAL 33 9.761 -13.326 15.057 290 HB VAL 33 HB VAL 33 9.865 -10.382 14.424 291 HG11 VAL 33 1HG1 VAL 33 11.424 -11.200 16.104 292 HG12 VAL 33 2HG1 VAL 33 12.285 -10.727 14.639 293 HG13 VAL 33 3HG1 VAL 33 12.006 -12.434 14.987 294 HG21 VAL 33 3HG2 VAL 33 10.881 -12.630 12.682 295 HG22 VAL 33 1HG2 VAL 33 11.210 -10.914 12.442 296 HG23 VAL 33 2HG2 VAL 33 9.563 -11.523 12.293 297 H ARG 34 H ARG 34 6.993 -11.340 15.416 298 HA ARG 34 HA ARG 34 7.697 -10.493 18.116 299 HB2 ARG 34 1HB ARG 34 5.460 -9.840 16.230 300 HB3 ARG 34 2HB ARG 34 5.298 -9.488 17.944 301 HG2 ARG 34 1HG ARG 34 7.451 -8.194 17.766 302 HG3 ARG 34 2HG ARG 34 7.318 -8.380 16.015 303 HD2 ARG 34 1HD ARG 34 5.143 -7.266 16.060 304 HD3 ARG 34 2HD ARG 34 5.263 -7.091 17.811 305 HE ARG 34 HE ARG 34 7.522 -5.918 16.647 306 HH11 ARG 34 1HH1 ARG 34 4.072 -5.389 16.837 307 HH12 ARG 34 2HH1 ARG 34 4.202 -3.671 16.656 308 HH21 ARG 34 1HH2 ARG 34 7.688 -3.661 16.410 309 HH22 ARG 34 2HH2 ARG 34 6.252 -2.691 16.414 310 H LYS 35 H LYS 35 6.428 -10.990 19.944 311 HA LYS 35 HA LYS 35 5.137 -13.615 19.778 312 HB2 LYS 35 1HB LYS 35 7.058 -12.832 21.457 313 HB3 LYS 35 2HB LYS 35 5.674 -12.288 22.393 314 HG2 LYS 35 1HG LYS 35 4.759 -14.549 22.371 315 HG3 LYS 35 2HG LYS 35 6.134 -15.099 21.412 316 HD2 LYS 35 1HD LYS 35 7.650 -14.474 23.231 317 HD3 LYS 35 2HD LYS 35 6.272 -13.923 24.189 318 HE2 LYS 35 1HE LYS 35 5.355 -16.193 24.169 319 HE3 LYS 35 2HE LYS 35 6.731 -16.741 23.212 320 HZ1 LYS 35 3HZ LYS 35 6.874 -15.615 25.957 321 HZ2 LYS 35 1HZ LYS 35 8.195 -16.140 25.039 322 HZ3 LYS 35 2HZ LYS 35 7.025 -17.250 25.552 323 H ARG 36 H ARG 36 3.326 -13.880 21.520 324 HA ARG 36 HA ARG 36 1.283 -11.940 20.874 325 HB2 ARG 36 1HB ARG 36 1.259 -14.601 22.284 326 HB3 ARG 36 2HB ARG 36 -0.164 -13.570 22.229 327 HG2 ARG 36 1HG ARG 36 -0.132 -13.649 19.788 328 HG3 ARG 36 2HG ARG 36 1.298 -14.683 19.842 329 HD2 ARG 36 1HD ARG 36 0.020 -16.381 21.058 330 HD3 ARG 36 2HD ARG 36 -1.407 -15.346 21.002 331 HE ARG 36 HE ARG 36 -0.498 -15.739 18.386 332 HH11 ARG 36 1HH1 ARG 36 -1.936 -17.580 20.986 333 HH12 ARG 36 2HH1 ARG 36 -2.711 -18.708 19.924 334 HH21 ARG 36 1HH2 ARG 36 -1.518 -17.221 16.993 335 HH22 ARG 36 2HH2 ARG 36 -2.473 -18.504 17.658 336 H THR 37 H THR 37 3.479 -11.164 22.682 337 HA THR 37 HA THR 37 2.295 -10.935 25.311 338 HB THR 37 HB THR 37 4.701 -11.237 25.175 339 HG1 THR 37 HG1 THR 37 4.975 -8.752 26.097 340 HG21 THR 37 3HG2 THR 37 6.191 -9.551 24.251 341 HG22 THR 37 1HG2 THR 37 4.811 -8.560 23.775 342 HG23 THR 37 2HG2 THR 37 5.082 -10.121 23.002 343 H LEU 38 H LEU 38 2.143 -9.170 22.420 344 HA LEU 38 HA LEU 38 1.627 -6.617 23.700 345 HB2 LEU 38 1HB LEU 38 2.597 -7.374 21.173 346 HB3 LEU 38 2HB LEU 38 1.021 -6.666 20.877 347 HG LEU 38 HG LEU 38 2.630 -4.929 20.637 348 HD11 LEU 38 1HD1 LEU 38 1.723 -3.311 21.980 349 HD12 LEU 38 2HD1 LEU 38 1.703 -4.343 23.408 350 HD13 LEU 38 3HD1 LEU 38 0.508 -4.578 22.134 351 HD21 LEU 38 3HD2 LEU 38 4.277 -4.352 22.307 352 HD22 LEU 38 1HD2 LEU 38 4.464 -6.044 21.847 353 HD23 LEU 38 2HD2 LEU 38 3.686 -5.626 23.375 354 H ARG 39 H ARG 39 -0.055 -9.123 21.954 355 HA ARG 39 HA ARG 39 -2.597 -7.932 21.807 356 HB2 ARG 39 1HB ARG 39 -1.664 -10.799 21.644 357 HB3 ARG 39 2HB ARG 39 -3.360 -10.355 21.506 358 HG2 ARG 39 1HG ARG 39 -2.844 -8.976 19.556 359 HG3 ARG 39 2HG ARG 39 -1.142 -9.419 19.695 360 HD2 ARG 39 1HD ARG 39 -1.729 -11.771 19.351 361 HD3 ARG 39 2HD ARG 39 -3.428 -11.326 19.213 362 HE ARG 39 HE ARG 39 -1.971 -9.850 17.333 363 HH11 ARG 39 1HH1 ARG 39 -2.897 -13.164 17.948 364 HH12 ARG 39 2HH1 ARG 39 -2.878 -13.611 16.275 365 HH21 ARG 39 1HH2 ARG 39 -1.947 -10.439 15.135 366 HH22 ARG 39 2HH2 ARG 39 -2.339 -12.064 14.679 367 H ARG 40 H ARG 40 -0.837 -9.754 24.188 368 HA ARG 40 HA ARG 40 -3.045 -10.260 25.941 369 HB2 ARG 40 1HB ARG 40 -0.049 -10.180 26.349 370 HB3 ARG 40 2HB ARG 40 -1.160 -10.466 27.681 371 HG2 ARG 40 1HG ARG 40 -2.017 -12.452 26.545 372 HG3 ARG 40 2HG ARG 40 -0.904 -12.164 25.206 373 HD2 ARG 40 1HD ARG 40 0.992 -12.410 26.735 374 HD3 ARG 40 2HD ARG 40 -0.122 -12.697 28.071 375 HE ARG 40 HE ARG 40 -0.671 -14.551 26.048 376 HH11 ARG 40 1HH1 ARG 40 1.868 -13.808 28.332 377 HH12 ARG 40 2HH1 ARG 40 2.421 -15.447 28.440 378 HH21 ARG 40 1HH2 ARG 40 0.055 -16.703 26.193 379 HH22 ARG 40 2HH2 ARG 40 1.392 -17.088 27.225 380 H LEU 41 H LEU 41 -1.167 -7.644 25.014 381 HA LEU 41 HA LEU 41 -2.136 -5.938 27.182 382 HB2 LEU 41 1HB LEU 41 0.201 -5.563 25.307 383 HB3 LEU 41 2HB LEU 41 -0.333 -4.372 26.472 384 HG LEU 41 HG LEU 41 0.549 -7.130 27.306 385 HD11 LEU 41 1HD1 LEU 41 2.358 -6.045 26.030 386 HD12 LEU 41 2HD1 LEU 41 2.752 -6.247 27.738 387 HD13 LEU 41 3HD1 LEU 41 2.274 -4.664 27.125 388 HD21 LEU 41 3HD2 LEU 41 1.184 -5.399 29.304 389 HD22 LEU 41 1HD2 LEU 41 -0.309 -6.335 29.224 390 HD23 LEU 41 2HD2 LEU 41 -0.284 -4.664 28.661 391 H LEU 42 H LEU 42 -2.123 -6.549 23.716 392 HA LEU 42 HA LEU 42 -3.343 -3.952 23.156 393 HB2 LEU 42 1HB LEU 42 -1.648 -5.354 21.681 394 HB3 LEU 42 2HB LEU 42 -3.127 -6.078 21.083 395 HG LEU 42 HG LEU 42 -2.937 -3.103 21.102 396 HD11 LEU 42 1HD1 LEU 42 -1.620 -4.867 19.043 397 HD12 LEU 42 2HD1 LEU 42 -0.792 -3.797 20.173 398 HD13 LEU 42 3HD1 LEU 42 -1.836 -3.121 18.924 399 HD21 LEU 42 3HD2 LEU 42 -4.290 -3.359 19.082 400 HD22 LEU 42 1HD2 LEU 42 -5.016 -4.205 20.447 401 HD23 LEU 42 2HD2 LEU 42 -4.152 -5.112 19.206 402 H GLN 43 H GLN 43 -4.236 -7.375 22.719 403 HA GLN 43 HA GLN 43 -6.946 -6.744 22.032 404 HB2 GLN 43 1HB GLN 43 -5.390 -8.881 21.550 405 HB3 GLN 43 2HB GLN 43 -6.259 -9.477 22.957 406 HG2 GLN 43 1HG GLN 43 -7.574 -10.218 21.223 407 HG3 GLN 43 2HG GLN 43 -8.372 -8.711 21.671 408 HE21 GLN 43 2HE2 GLN 43 -6.419 -10.330 19.298 409 HE22 GLN 43 1HE2 GLN 43 -6.610 -9.158 18.044 410 H GLU 44 H GLU 44 -5.237 -7.342 24.987 411 HA GLU 44 HA GLU 44 -7.626 -7.977 26.501 412 HB2 GLU 44 1HB GLU 44 -4.729 -7.657 27.196 413 HB3 GLU 44 2HB GLU 44 -5.947 -7.699 28.463 414 HG2 GLU 44 1HG GLU 44 -6.725 -9.885 27.490 415 HG3 GLU 44 2HG GLU 44 -5.287 -9.847 26.470 416 H ARG 45 H ARG 45 -5.934 -5.140 25.577 417 HA ARG 45 HA ARG 45 -6.987 -3.527 27.754 418 HB2 ARG 45 1HB ARG 45 -4.690 -3.288 26.451 419 HB3 ARG 45 2HB ARG 45 -5.670 -2.323 25.357 420 HG2 ARG 45 1HG ARG 45 -5.765 -1.743 28.280 421 HG3 ARG 45 2HG ARG 45 -4.377 -1.207 27.334 422 HD2 ARG 45 1HD ARG 45 -5.846 0.012 25.830 423 HD3 ARG 45 2HD ARG 45 -7.258 -0.572 26.705 424 HE ARG 45 HE ARG 45 -5.411 0.841 28.378 425 HH11 ARG 45 1HH1 ARG 45 -8.066 1.229 26.140 426 HH12 ARG 45 2HH1 ARG 45 -8.550 2.761 26.787 427 HH21 ARG 45 1HH2 ARG 45 -6.049 2.853 29.227 428 HH22 ARG 45 2HH2 ARG 45 -7.405 3.681 28.539 429 H GLU 46 H GLU 46 -7.647 -4.200 24.386 430 HA GLU 46 HA GLU 46 -9.678 -2.112 24.239 431 HB2 GLU 46 1HB GLU 46 -8.526 -4.029 22.220 432 HB3 GLU 46 2HB GLU 46 -9.946 -3.055 21.869 433 HG2 GLU 46 1HG GLU 46 -8.653 -1.022 22.278 434 HG3 GLU 46 2HG GLU 46 -7.229 -2.001 22.625 435 H LEU 47 H LEU 47 -9.570 -5.105 25.505 436 HA LEU 47 HA LEU 47 -11.061 -6.721 26.061 437 HB2 LEU 47 1HB LEU 47 -12.855 -4.364 25.601 438 HB3 LEU 47 2HB LEU 47 -13.524 -5.920 26.054 439 HG LEU 47 HG LEU 47 -11.754 -5.722 28.017 440 HD11 LEU 47 1HD1 LEU 47 -11.538 -3.413 28.787 441 HD12 LEU 47 2HD1 LEU 47 -12.325 -2.846 27.315 442 HD13 LEU 47 3HD1 LEU 47 -10.757 -3.646 27.225 443 HD21 LEU 47 3HD2 LEU 47 -13.515 -4.732 29.404 444 HD22 LEU 47 1HD2 LEU 47 -14.153 -5.961 28.312 445 HD23 LEU 47 2HD2 LEU 47 -14.385 -4.252 27.947 446 H VAL 48 H VAL 48 -10.162 -6.711 23.368 447 HA VAL 48 HA VAL 48 -10.531 -7.649 21.328 448 HB VAL 48 HB VAL 48 -12.808 -9.216 22.528 449 HG11 VAL 48 1HG1 VAL 48 -11.938 -11.000 21.085 450 HG12 VAL 48 2HG1 VAL 48 -10.667 -9.917 20.520 451 HG13 VAL 48 3HG1 VAL 48 -12.355 -9.556 20.161 452 HG21 VAL 48 3HG2 VAL 48 -10.812 -9.106 24.095 453 HG22 VAL 48 1HG2 VAL 48 -9.917 -9.983 22.854 454 HG23 VAL 48 2HG2 VAL 48 -11.335 -10.716 23.601 455 H GLU 49 H GLU 49 -11.589 -5.225 21.342 456 HA GLU 49 HA GLU 49 -14.275 -5.486 20.164 457 HB2 GLU 49 1HB GLU 49 -12.915 -3.180 21.544 458 HB3 GLU 49 2HB GLU 49 -14.347 -2.955 20.551 459 HG2 GLU 49 1HG GLU 49 -15.591 -4.479 21.997 460 HG3 GLU 49 2HG GLU 49 -14.154 -4.707 22.991 461 HA PRO 50 HA PRO 50 -12.535 -4.445 16.217 462 HB2 PRO 50 1HB PRO 50 -14.768 -3.509 14.966 463 HB3 PRO 50 2HB PRO 50 -14.496 -5.231 15.290 464 HG2 PRO 50 1HG PRO 50 -16.185 -3.280 16.773 465 HG3 PRO 50 2HG PRO 50 -16.516 -4.973 16.353 466 HD2 PRO 50 1HD PRO 50 -15.694 -4.205 18.823 467 HD3 PRO 50 2HD PRO 50 -15.310 -5.790 18.122 468 H LEU 51 H LEU 51 -12.203 -2.625 14.739 469 HA LEU 51 HA LEU 51 -12.807 0.012 15.788 470 HB2 LEU 51 1HB LEU 51 -10.378 -1.106 16.366 471 HB3 LEU 51 2HB LEU 51 -10.021 -0.272 14.868 472 HG LEU 51 HG LEU 51 -9.434 1.128 16.746 473 HD11 LEU 51 1HD1 LEU 51 -11.922 2.149 15.388 474 HD12 LEU 51 2HD1 LEU 51 -10.273 2.265 14.772 475 HD13 LEU 51 3HD1 LEU 51 -10.731 3.134 16.238 476 HD21 LEU 51 3HD2 LEU 51 -12.298 1.225 17.623 477 HD22 LEU 51 1HD2 LEU 51 -10.853 1.746 18.488 478 HD23 LEU 51 2HD2 LEU 51 -11.178 0.026 18.268 479 H THR 52 H THR 52 -14.170 0.178 14.014 480 HA THR 52 HA THR 52 -12.792 0.811 11.502 481 HB THR 52 HB THR 52 -14.786 -0.187 10.266 482 HG1 THR 52 HG1 THR 52 -15.456 -0.788 12.829 483 HG21 THR 52 3HG2 THR 52 -12.936 -2.063 11.746 484 HG22 THR 52 1HG2 THR 52 -12.576 -1.229 10.234 485 HG23 THR 52 2HG2 THR 52 -13.844 -2.454 10.285 486 HA PRO 53 HA PRO 53 -15.294 4.466 11.658 487 HB2 PRO 53 1HB PRO 53 -15.351 5.127 9.009 488 HB3 PRO 53 2HB PRO 53 -13.922 5.356 10.035 489 HG2 PRO 53 1HG PRO 53 -14.515 3.184 8.088 490 HG3 PRO 53 2HG PRO 53 -12.991 4.038 8.400 491 HD2 PRO 53 1HD PRO 53 -13.506 1.565 9.378 492 HD3 PRO 53 2HD PRO 53 -12.478 2.740 10.221 493 H SER 54 H SER 54 -17.392 4.408 12.079 494 HA SER 54 HA SER 54 -19.204 3.063 10.190 495 HB2 SER 54 1HB SER 54 -20.799 2.988 12.131 496 HB3 SER 54 2HB SER 54 -19.322 2.056 12.376 497 HG SER 54 HG SER 54 -19.991 4.586 13.452 498 H GLY 55 H GLY 55 -18.199 6.084 11.252 499 HA2 GLY 55 1HA GLY 55 -20.783 7.365 10.678 500 HA3 GLY 55 2HA GLY 55 -19.410 8.131 11.461 501 H GLU 56 H GLU 56 -21.012 7.503 8.512 502 HA GLU 56 HA GLU 56 -20.765 8.264 6.389 503 HB2 GLU 56 1HB GLU 56 -18.873 10.168 7.766 504 HB3 GLU 56 2HB GLU 56 -19.213 10.253 6.043 505 HG2 GLU 56 1HG GLU 56 -21.431 10.311 8.051 506 HG3 GLU 56 2HG GLU 56 -20.528 11.770 7.649 507 H LYS 57 H LYS 57 -19.822 7.319 4.717 508 HA LYS 57 HA LYS 57 -17.307 5.947 5.087 509 HB2 LYS 57 1HB LYS 57 -19.357 5.961 2.885 510 HB3 LYS 57 2HB LYS 57 -17.814 5.137 2.711 511 HG2 LYS 57 1HG LYS 57 -18.336 3.744 4.649 512 HG3 LYS 57 2HG LYS 57 -19.885 4.571 4.824 513 HD2 LYS 57 1HD LYS 57 -20.551 3.788 2.601 514 HD3 LYS 57 2HD LYS 57 -19.003 2.961 2.428 515 HE2 LYS 57 1HE LYS 57 -20.913 2.387 4.679 516 HE3 LYS 57 2HE LYS 57 -20.980 1.537 3.137 517 HZ1 LYS 57 3HZ LYS 57 -18.704 0.798 3.489 518 HZ2 LYS 57 1HZ LYS 57 -19.697 0.306 4.767 519 HZ3 LYS 57 2HZ LYS 57 -18.643 1.613 4.969 520 H LEU 58 H LEU 58 -18.580 8.598 3.140 521 HA LEU 58 HA LEU 58 -16.034 8.979 1.806 522 HB2 LEU 58 1HB LEU 58 -18.686 10.386 1.567 523 HB3 LEU 58 2HB LEU 58 -17.255 10.884 0.686 524 HG LEU 58 HG LEU 58 -17.297 8.344 -0.099 525 HD11 LEU 58 1HD1 LEU 58 -20.193 8.958 0.470 526 HD12 LEU 58 2HD1 LEU 58 -19.219 7.722 1.264 527 HD13 LEU 58 3HD1 LEU 58 -19.592 7.582 -0.455 528 HD21 LEU 58 3HD2 LEU 58 -17.341 10.272 -1.573 529 HD22 LEU 58 1HD2 LEU 58 -19.052 10.522 -1.224 530 HD23 LEU 58 2HD2 LEU 58 -18.531 9.076 -2.090 531 H TRP 59 H TRP 59 -17.435 9.940 4.674 532 HA TRP 59 HA TRP 59 -15.571 12.202 4.905 533 HB2 TRP 59 1HB TRP 59 -18.151 12.733 4.668 534 HB3 TRP 59 2HB TRP 59 -18.175 12.297 6.374 535 HD1 TRP 59 HD1 TRP 59 -16.980 13.950 8.086 536 HE1 TRP 59 HE1 TRP 59 -16.210 16.396 7.881 537 HE3 TRP 59 HE3 TRP 59 -17.158 14.440 2.995 538 HZ2 TRP 59 HZ2 TRP 59 -15.742 18.284 5.837 539 HZ3 TRP 59 HZ3 TRP 59 -16.532 16.599 1.997 540 HH2 TRP 59 HH2 TRP 59 -15.840 18.482 3.390 541 H SER 60 H SER 60 -14.592 12.474 6.901 542 HA SER 60 HA SER 60 -15.116 10.381 8.905 543 HB2 SER 60 1HB SER 60 -12.409 11.430 8.042 544 HB3 SER 60 2HB SER 60 -12.686 10.288 9.357 545 HG SER 60 HG SER 60 -13.289 9.886 6.612 546 H1 LYS 61 1H LYS 61 -1.985 10.668 -32.923 547 H2 LYS 61 2H LYS 61 -1.282 11.859 -31.951 548 H3 LYS 61 3H LYS 61 -2.407 10.784 -31.290 549 HA LYS 61 HA LYS 61 -0.924 8.938 -31.632 550 HB2 LYS 61 1HB LYS 61 0.837 11.089 -32.801 551 HB3 LYS 61 2HB LYS 61 1.480 9.550 -32.247 552 HG2 LYS 61 1HG LYS 61 0.054 8.374 -33.844 553 HG3 LYS 61 2HG LYS 61 -0.593 9.919 -34.400 554 HD2 LYS 61 1HD LYS 61 1.649 10.602 -35.108 555 HD3 LYS 61 2HD LYS 61 2.295 9.055 -34.553 556 HE2 LYS 61 1HE LYS 61 0.873 7.885 -36.165 557 HE3 LYS 61 2HE LYS 61 0.228 9.430 -36.719 558 HZ1 LYS 61 3HZ LYS 61 1.965 8.623 -38.186 559 HZ2 LYS 61 1HZ LYS 61 3.068 8.575 -36.903 560 HZ3 LYS 61 2HZ LYS 61 2.451 10.058 -37.435 561 H ILE 62 H ILE 62 -0.094 8.294 -29.747 562 HA ILE 62 HA ILE 62 1.160 10.274 -27.982 563 HB ILE 62 HB ILE 62 -0.056 9.095 -26.038 564 HG12 ILE 62 1HG1 ILE 62 -2.511 8.585 -27.037 565 HG13 ILE 62 2HG1 ILE 62 -1.529 8.042 -28.393 566 HG21 ILE 62 1HG2 ILE 62 -1.556 10.935 -27.894 567 HG22 ILE 62 2HG2 ILE 62 -0.414 11.414 -26.637 568 HG23 ILE 62 3HG2 ILE 62 -1.943 10.654 -26.196 569 HD11 ILE 62 3HD1 ILE 62 -2.060 6.208 -26.898 570 HD12 ILE 62 1HD1 ILE 62 -1.311 7.069 -25.554 571 HD13 ILE 62 2HD1 ILE 62 -0.325 6.523 -26.911 572 HA PRO 63 HA PRO 63 4.167 7.084 -27.357 573 HB2 PRO 63 1HB PRO 63 5.147 7.815 -24.913 574 HB3 PRO 63 2HB PRO 63 5.528 8.684 -26.411 575 HG2 PRO 63 1HG PRO 63 3.559 9.368 -24.287 576 HG3 PRO 63 2HG PRO 63 4.660 10.426 -25.193 577 HD2 PRO 63 1HD PRO 63 2.027 10.210 -25.788 578 HD3 PRO 63 2HD PRO 63 3.267 10.551 -27.011 579 H SER 64 H SER 64 4.286 5.071 -26.509 580 HA SER 64 HA SER 64 2.130 4.168 -24.822 581 HB2 SER 64 1HB SER 64 4.472 2.661 -26.010 582 HB3 SER 64 2HB SER 64 3.095 1.921 -25.193 583 HG SER 64 HG SER 64 2.423 3.661 -27.215 584 H ILE 65 H ILE 65 5.129 5.487 -24.206 585 HA ILE 65 HA ILE 65 5.807 3.892 -21.889 586 HB ILE 65 HB ILE 65 7.016 6.565 -22.587 587 HG12 ILE 65 1HG1 ILE 65 8.793 4.773 -23.600 588 HG13 ILE 65 2HG1 ILE 65 7.273 3.972 -23.984 589 HG21 ILE 65 1HG2 ILE 65 8.995 5.634 -21.472 590 HG22 ILE 65 2HG2 ILE 65 8.101 4.150 -21.144 591 HG23 ILE 65 3HG2 ILE 65 7.593 5.667 -20.403 592 HD11 ILE 65 3HD1 ILE 65 8.067 5.368 -25.818 593 HD12 ILE 65 1HD1 ILE 65 8.010 6.782 -24.765 594 HD13 ILE 65 2HD1 ILE 65 6.522 5.937 -25.189 595 H ALA 66 H ALA 66 4.200 6.934 -22.570 596 HA ALA 66 HA ALA 66 4.098 7.735 -19.791 597 HB1 ALA 66 3HB ALA 66 4.298 9.391 -21.612 598 HB2 ALA 66 1HB ALA 66 2.901 9.676 -20.575 599 HB3 ALA 66 2HB ALA 66 2.686 8.941 -22.164 600 H THR 67 H THR 67 2.096 6.014 -22.043 601 HA THR 67 HA THR 67 -0.418 6.347 -20.811 602 HB THR 67 HB THR 67 0.297 3.798 -22.216 603 HG1 THR 67 HG1 THR 67 -0.457 5.640 -23.999 604 HG21 THR 67 3HG2 THR 67 -1.951 4.137 -23.204 605 HG22 THR 67 1HG2 THR 67 -2.118 5.613 -22.253 606 HG23 THR 67 2HG2 THR 67 -1.988 4.053 -21.442 607 H GLY 68 H GLY 68 2.246 4.142 -20.170 608 HA2 GLY 68 1HA GLY 68 0.727 2.505 -18.330 609 HA3 GLY 68 2HA GLY 68 2.450 2.392 -18.653 610 H LEU 69 H LEU 69 3.175 5.040 -18.104 611 HA LEU 69 HA LEU 69 3.580 4.943 -15.328 612 HB2 LEU 69 1HB LEU 69 3.878 7.223 -17.283 613 HB3 LEU 69 2HB LEU 69 4.400 7.301 -15.611 614 HG LEU 69 HG LEU 69 5.452 5.148 -17.418 615 HD11 LEU 69 1HD1 LEU 69 5.965 7.043 -18.704 616 HD12 LEU 69 2HD1 LEU 69 7.421 6.723 -17.761 617 HD13 LEU 69 3HD1 LEU 69 6.324 8.017 -17.279 618 HD21 LEU 69 3HD2 LEU 69 6.547 6.565 -14.988 619 HD22 LEU 69 1HD2 LEU 69 7.384 5.309 -15.900 620 HD23 LEU 69 2HD2 LEU 69 5.893 4.928 -15.040 621 H VAL 70 H VAL 70 1.317 6.857 -17.288 622 HA VAL 70 HA VAL 70 0.291 8.427 -15.211 623 HB VAL 70 HB VAL 70 -1.700 8.778 -16.660 624 HG11 VAL 70 1HG1 VAL 70 1.071 9.068 -17.782 625 HG12 VAL 70 2HG1 VAL 70 0.060 10.285 -16.998 626 HG13 VAL 70 3HG1 VAL 70 -0.346 9.712 -18.616 627 HG21 VAL 70 3HG2 VAL 70 -1.848 6.568 -17.685 628 HG22 VAL 70 1HG2 VAL 70 -0.312 6.834 -18.509 629 HG23 VAL 70 2HG2 VAL 70 -1.715 7.819 -18.921 630 H GLY 71 H GLY 71 -0.688 5.263 -16.376 631 HA2 GLY 71 1HA GLY 71 -3.031 5.023 -14.788 632 HA3 GLY 71 2HA GLY 71 -2.167 3.697 -15.552 633 H ALA 72 H ALA 72 0.271 3.756 -14.327 634 HA ALA 72 HA ALA 72 -0.365 2.572 -11.807 635 HB1 ALA 72 3HB ALA 72 1.454 1.837 -13.411 636 HB2 ALA 72 1HB ALA 72 1.884 1.893 -11.701 637 HB3 ALA 72 2HB ALA 72 2.408 3.182 -12.786 638 H LEU 73 H LEU 73 1.307 5.561 -12.738 639 HA LEU 73 HA LEU 73 2.055 6.289 -10.114 640 HB2 LEU 73 1HB LEU 73 1.825 7.725 -12.718 641 HB3 LEU 73 2HB LEU 73 2.010 8.672 -11.254 642 HG LEU 73 HG LEU 73 4.099 7.378 -10.756 643 HD11 LEU 73 1HD1 LEU 73 5.157 6.113 -12.543 644 HD12 LEU 73 2HD1 LEU 73 3.752 6.365 -13.577 645 HD13 LEU 73 3HD1 LEU 73 3.605 5.392 -12.115 646 HD21 LEU 73 3HD2 LEU 73 4.178 9.595 -11.760 647 HD22 LEU 73 1HD2 LEU 73 4.036 8.884 -13.368 648 HD23 LEU 73 2HD2 LEU 73 5.470 8.572 -12.389 649 H LEU 74 H LEU 74 -0.820 7.040 -12.070 650 HA LEU 74 HA LEU 74 -1.986 8.757 -10.129 651 HB2 LEU 74 1HB LEU 74 -2.805 7.553 -12.681 652 HB3 LEU 74 2HB LEU 74 -4.120 7.857 -11.561 653 HG LEU 74 HG LEU 74 -3.158 10.252 -11.402 654 HD11 LEU 74 1HD1 LEU 74 -1.054 9.525 -12.657 655 HD12 LEU 74 2HD1 LEU 74 -1.811 11.042 -13.142 656 HD13 LEU 74 3HD1 LEU 74 -2.052 9.587 -14.110 657 HD21 LEU 74 3HD2 LEU 74 -5.289 9.700 -12.442 658 HD22 LEU 74 1HD2 LEU 74 -4.461 9.271 -13.939 659 HD23 LEU 74 2HD2 LEU 74 -4.441 10.940 -13.367 660 H LEU 75 H LEU 75 -2.280 5.313 -10.831 661 HA LEU 75 HA LEU 75 -4.373 4.831 -8.954 662 HB2 LEU 75 1HB LEU 75 -2.757 3.273 -10.778 663 HB3 LEU 75 2HB LEU 75 -2.923 2.450 -9.240 664 HG LEU 75 HG LEU 75 -5.505 3.190 -9.722 665 HD11 LEU 75 1HD1 LEU 75 -4.278 2.502 -12.388 666 HD12 LEU 75 2HD1 LEU 75 -4.957 4.064 -11.930 667 HD13 LEU 75 3HD1 LEU 75 -6.003 2.648 -12.044 668 HD21 LEU 75 3HD2 LEU 75 -4.717 0.992 -9.002 669 HD22 LEU 75 1HD2 LEU 75 -4.147 0.659 -10.636 670 HD23 LEU 75 2HD2 LEU 75 -5.869 0.860 -10.329 671 H LEU 76 H LEU 76 -0.860 4.759 -8.800 672 HA LEU 76 HA LEU 76 -0.670 3.618 -6.202 673 HB2 LEU 76 1HB LEU 76 1.130 3.864 -8.070 674 HB3 LEU 76 2HB LEU 76 1.405 5.445 -7.365 675 HG LEU 76 HG LEU 76 1.642 4.048 -5.133 676 HD11 LEU 76 1HD1 LEU 76 2.668 1.883 -5.498 677 HD12 LEU 76 2HD1 LEU 76 2.448 2.048 -7.240 678 HD13 LEU 76 3HD1 LEU 76 1.043 1.909 -6.182 679 HD21 LEU 76 3HD2 LEU 76 3.367 5.470 -6.083 680 HD22 LEU 76 1HD2 LEU 76 3.778 4.216 -7.255 681 HD23 LEU 76 2HD2 LEU 76 4.059 3.942 -5.535 682 H LEU 77 H LEU 77 -0.878 6.917 -7.433 683 HA LEU 77 HA LEU 77 -0.338 8.224 -4.976 684 HB2 LEU 77 1HB LEU 77 -1.659 9.088 -7.531 685 HB3 LEU 77 2HB LEU 77 -1.574 10.159 -6.147 686 HG LEU 77 HG LEU 77 0.932 8.918 -7.221 687 HD11 LEU 77 1HD1 LEU 77 -0.169 9.882 -9.162 688 HD12 LEU 77 2HD1 LEU 77 1.224 10.854 -8.689 689 HD13 LEU 77 3HD1 LEU 77 -0.405 11.398 -8.293 690 HD21 LEU 77 3HD2 LEU 77 0.318 11.524 -5.829 691 HD22 LEU 77 1HD2 LEU 77 1.916 10.989 -6.345 692 HD23 LEU 77 2HD2 LEU 77 1.049 10.097 -5.097 693 H VAL 78 H VAL 78 -3.372 7.295 -6.593 694 HA VAL 78 HA VAL 78 -5.095 8.436 -4.647 695 HB VAL 78 HB VAL 78 -5.680 6.156 -6.553 696 HG11 VAL 78 1HG1 VAL 78 -8.031 6.807 -6.282 697 HG12 VAL 78 2HG1 VAL 78 -7.558 8.004 -5.077 698 HG13 VAL 78 3HG1 VAL 78 -7.319 6.287 -4.754 699 HG21 VAL 78 3HG2 VAL 78 -4.930 8.145 -7.742 700 HG22 VAL 78 1HG2 VAL 78 -6.112 9.126 -6.875 701 HG23 VAL 78 2HG2 VAL 78 -6.654 7.881 -8.001 702 H VAL 79 H VAL 79 -3.837 5.134 -5.088 703 HA VAL 79 HA VAL 79 -5.231 3.994 -2.896 704 HB VAL 79 HB VAL 79 -2.706 3.074 -4.290 705 HG11 VAL 79 1HG1 VAL 79 -2.736 2.062 -2.113 706 HG12 VAL 79 2HG1 VAL 79 -3.228 0.851 -3.297 707 HG13 VAL 79 3HG1 VAL 79 -4.440 1.637 -2.285 708 HG21 VAL 79 3HG2 VAL 79 -4.663 3.150 -5.738 709 HG22 VAL 79 1HG2 VAL 79 -5.579 2.195 -4.571 710 HG23 VAL 79 2HG2 VAL 79 -4.199 1.481 -5.406 711 H ALA 80 H ALA 80 -2.033 5.487 -3.199 712 HA ALA 80 HA ALA 80 -1.122 4.850 -0.588 713 HB1 ALA 80 3HB ALA 80 0.402 5.487 -2.398 714 HB2 ALA 80 1HB ALA 80 0.613 6.514 -0.980 715 HB3 ALA 80 2HB ALA 80 -0.267 7.119 -2.385 716 H LEU 81 H LEU 81 -2.802 7.659 -1.948 717 HA LEU 81 HA LEU 81 -2.758 9.210 0.436 718 HB2 LEU 81 1HB LEU 81 -4.456 9.325 -2.049 719 HB3 LEU 81 2HB LEU 81 -4.668 10.447 -0.720 720 HG LEU 81 HG LEU 81 -1.977 10.147 -2.008 721 HD11 LEU 81 1HD1 LEU 81 -3.525 10.513 -3.848 722 HD12 LEU 81 2HD1 LEU 81 -2.553 11.953 -3.553 723 HD13 LEU 81 3HD1 LEU 81 -4.227 11.890 -3.000 724 HD21 LEU 81 3HD2 LEU 81 -1.767 12.491 -1.299 725 HD22 LEU 81 1HD2 LEU 81 -2.117 11.420 0.058 726 HD23 LEU 81 2HD2 LEU 81 -3.395 12.425 -0.626 727 H GLY 82 H GLY 82 -4.958 6.815 -0.891 728 HA2 GLY 82 1HA GLY 82 -7.122 7.259 0.889 729 HA3 GLY 82 2HA GLY 82 -6.830 5.791 -0.033 730 H ILE 83 H ILE 83 -4.590 4.734 0.918 731 HA ILE 83 HA ILE 83 -5.346 3.678 3.438 732 HB ILE 83 HB ILE 83 -2.593 3.479 2.203 733 HG12 ILE 83 1HG1 ILE 83 -4.759 1.431 1.813 734 HG13 ILE 83 2HG1 ILE 83 -4.652 2.818 0.734 735 HG21 ILE 83 1HG2 ILE 83 -2.723 2.724 4.514 736 HG22 ILE 83 2HG2 ILE 83 -2.489 1.351 3.431 737 HG23 ILE 83 3HG2 ILE 83 -4.082 1.675 4.113 738 HD11 ILE 83 3HD1 ILE 83 -3.530 0.924 -0.238 739 HD12 ILE 83 1HD1 ILE 83 -2.523 0.743 1.198 740 HD13 ILE 83 2HD1 ILE 83 -2.347 2.166 0.173 741 H GLY 84 H GLY 84 -3.073 6.188 2.460 742 HA2 GLY 84 1HA GLY 84 -1.752 6.507 4.938 743 HA3 GLY 84 2HA GLY 84 -1.856 7.717 3.668 744 H LEU 85 H LEU 85 -4.564 8.189 3.553 745 HA LEU 85 HA LEU 85 -4.941 9.850 5.857 746 HB2 LEU 85 1HB LEU 85 -6.648 9.271 3.443 747 HB3 LEU 85 2HB LEU 85 -7.161 10.350 4.726 748 HG LEU 85 HG LEU 85 -4.545 10.843 3.359 749 HD11 LEU 85 1HD1 LEU 85 -6.125 10.534 1.537 750 HD12 LEU 85 2HD1 LEU 85 -5.690 12.236 1.703 751 HD13 LEU 85 3HD1 LEU 85 -7.246 11.662 2.300 752 HD21 LEU 85 3HD2 LEU 85 -6.631 12.646 4.585 753 HD22 LEU 85 1HD2 LEU 85 -5.093 13.167 3.899 754 HD23 LEU 85 2HD2 LEU 85 -5.118 12.149 5.339 755 H PHE 86 H PHE 86 -6.003 6.690 4.898 756 HA PHE 86 HA PHE 86 -8.234 6.555 6.704 757 HB2 PHE 86 1HB PHE 86 -7.754 5.181 4.522 758 HB3 PHE 86 2HB PHE 86 -6.867 4.121 5.613 759 HD1 PHE 86 HD2 PHE 86 -10.160 5.371 4.642 760 HD2 PHE 86 HD1 PHE 86 -8.024 2.806 7.282 761 HE1 PHE 86 HE2 PHE 86 -12.265 4.254 5.255 762 HE2 PHE 86 HE1 PHE 86 -10.125 1.685 7.898 763 HZ PHE 86 HZ PHE 86 -12.249 2.409 6.885 764 H ILE 87 H ILE 87 -4.845 5.573 6.790 765 HA ILE 87 HA ILE 87 -5.125 4.240 9.345 766 HB ILE 87 HB ILE 87 -2.626 4.899 7.775 767 HG12 ILE 87 1HG1 ILE 87 -4.031 3.354 6.534 768 HG13 ILE 87 2HG1 ILE 87 -2.635 2.495 7.168 769 HG21 ILE 87 1HG2 ILE 87 -1.521 3.225 9.205 770 HG22 ILE 87 2HG2 ILE 87 -2.994 3.100 10.167 771 HG23 ILE 87 3HG2 ILE 87 -2.100 4.619 10.116 772 HD11 ILE 87 3HD1 ILE 87 -4.466 1.057 7.465 773 HD12 ILE 87 1HD1 ILE 87 -5.488 2.351 8.092 774 HD13 ILE 87 2HD1 ILE 87 -4.148 1.737 9.061 775 H ARG 88 H ARG 88 -3.902 7.328 8.135 776 HA ARG 88 HA ARG 88 -2.695 8.179 10.558 777 HB2 ARG 88 1HB ARG 88 -3.605 9.586 8.069 778 HB3 ARG 88 2HB ARG 88 -3.062 10.513 9.461 779 HG2 ARG 88 1HG ARG 88 -1.326 8.321 8.443 780 HG3 ARG 88 2HG ARG 88 -1.404 9.835 7.543 781 HD2 ARG 88 1HD ARG 88 -0.779 11.067 9.564 782 HD3 ARG 88 2HD ARG 88 -0.702 9.552 10.464 783 HE ARG 88 HE ARG 88 0.990 9.351 8.243 784 HH11 ARG 88 1HH1 ARG 88 0.778 11.118 11.251 785 HH12 ARG 88 2HH1 ARG 88 2.494 11.299 11.408 786 HH21 ARG 88 1HH2 ARG 88 3.242 9.590 8.453 787 HH22 ARG 88 2HH2 ARG 88 3.892 10.432 9.820 788 H ARG 89 H ARG 89 -5.971 8.271 9.372 789 HA ARG 89 HA ARG 89 -6.889 10.152 11.362 790 HB2 ARG 89 1HB ARG 89 -8.236 8.523 9.230 791 HB3 ARG 89 2HB ARG 89 -9.183 9.351 10.458 792 HG2 ARG 89 1HG ARG 89 -8.217 11.484 9.780 793 HG3 ARG 89 2HG ARG 89 -7.244 10.659 8.561 794 HD2 ARG 89 1HD ARG 89 -9.287 9.896 7.449 795 HD3 ARG 89 2HD ARG 89 -10.257 10.723 8.667 796 HE ARG 89 HE ARG 89 -8.562 12.617 7.553 797 HH11 ARG 89 1HH1 ARG 89 -11.180 10.560 6.491 798 HH12 ARG 89 2HH1 ARG 89 -11.698 11.652 5.250 799 HH21 ARG 89 1HH2 ARG 89 -9.246 14.050 5.924 800 HH22 ARG 89 2HH2 ARG 89 -10.600 13.631 4.928 801 H ARG 90 H ARG 90 -6.364 6.780 11.206 802 HA ARG 90 HA ARG 90 -8.298 6.093 13.252 803 HB2 ARG 90 1HB ARG 90 -6.231 4.530 11.726 804 HB3 ARG 90 2HB ARG 90 -7.089 3.828 13.090 805 HG2 ARG 90 1HG ARG 90 -9.218 4.211 11.955 806 HG3 ARG 90 2HG ARG 90 -8.359 4.920 10.587 807 HD2 ARG 90 1HD ARG 90 -8.804 2.699 9.956 808 HD3 ARG 90 2HD ARG 90 -7.105 2.716 10.427 809 HE ARG 90 HE ARG 90 -8.633 2.020 12.665 810 HH11 ARG 90 1HH1 ARG 90 -7.753 0.697 9.552 811 HH12 ARG 90 2HH1 ARG 90 -7.879 -0.949 10.077 812 HH21 ARG 90 1HH2 ARG 90 -8.799 -0.143 13.351 813 HH22 ARG 90 2HH2 ARG 90 -8.474 -1.424 12.233 814 H HIS 91 H HIS 91 -4.999 7.072 13.094 815 HA HIS 91 HA HIS 91 -4.249 5.969 15.655 816 HB2 HIS 91 1HB HIS 91 -2.899 7.678 13.602 817 HB3 HIS 91 2HB HIS 91 -2.228 7.588 15.227 818 HD1 HIS 91 HD1 HIS 91 -2.451 5.745 12.052 819 HD2 HIS 91 HD2 HIS 91 -1.352 4.951 15.980 820 HE1 HIS 91 HE1 HIS 91 -1.189 3.569 11.972 821 HE2 HIS 91 HE2 HIS 91 -0.460 3.155 14.348 822 H ILE 92 H ILE 92 -5.871 8.761 14.579 823 HA ILE 92 HA ILE 92 -5.106 10.456 16.800 824 HB ILE 92 HB ILE 92 -7.457 10.990 15.006 825 HG12 ILE 92 1HG1 ILE 92 -5.672 10.418 13.462 826 HG13 ILE 92 2HG1 ILE 92 -5.928 12.156 13.432 827 HG21 ILE 92 1HG2 ILE 92 -5.482 12.801 16.391 828 HG22 ILE 92 2HG2 ILE 92 -7.145 12.485 16.887 829 HG23 ILE 92 3HG2 ILE 92 -6.823 13.333 15.375 830 HD11 ILE 92 3HD1 ILE 92 -3.955 12.469 14.840 831 HD12 ILE 92 1HD1 ILE 92 -3.565 11.609 13.349 832 HD13 ILE 92 2HD1 ILE 92 -3.701 10.723 14.868 833 H VAL 93 H VAL 93 -7.282 7.924 16.337 834 HA VAL 93 HA VAL 93 -9.193 8.883 18.335 835 HB VAL 93 HB VAL 93 -9.331 6.207 16.957 836 HG11 VAL 93 1HG1 VAL 93 -10.830 6.549 18.845 837 HG12 VAL 93 2HG1 VAL 93 -11.741 6.473 17.336 838 HG13 VAL 93 3HG1 VAL 93 -11.443 8.030 18.109 839 HG21 VAL 93 3HG2 VAL 93 -10.394 8.827 15.899 840 HG22 VAL 93 1HG2 VAL 93 -10.740 7.231 15.229 841 HG23 VAL 93 2HG2 VAL 93 -9.096 7.868 15.191 842 H ARG 94 H ARG 94 -6.423 6.885 18.069 843 HA ARG 94 HA ARG 94 -7.041 5.358 20.476 844 HB2 ARG 94 1HB ARG 94 -4.871 5.230 18.410 845 HB3 ARG 94 2HB ARG 94 -4.653 4.443 19.966 846 HG2 ARG 94 1HG ARG 94 -6.816 3.231 19.528 847 HG3 ARG 94 2HG ARG 94 -6.742 3.869 17.884 848 HD2 ARG 94 1HD ARG 94 -4.571 2.792 17.563 849 HD3 ARG 94 2HD ARG 94 -4.634 2.166 19.210 850 HE ARG 94 HE ARG 94 -6.935 1.327 17.857 851 HH11 ARG 94 1HH1 ARG 94 -3.483 0.783 17.785 852 HH12 ARG 94 2HH1 ARG 94 -3.626 -0.829 17.166 853 HH21 ARG 94 1HH2 ARG 94 -7.119 -0.790 17.044 854 HH22 ARG 94 2HH2 ARG 94 -5.689 -1.720 16.746 855 H LYS 95 H LYS 95 -5.708 5.366 22.327 856 HA LYS 95 HA LYS 95 -4.412 7.949 22.811 857 HB2 LYS 95 1HB LYS 95 -6.280 6.745 24.288 858 HB3 LYS 95 2HB LYS 95 -4.867 5.982 25.003 859 HG2 LYS 95 1HG LYS 95 -3.943 8.174 25.542 860 HG3 LYS 95 2HG LYS 95 -5.348 8.949 24.806 861 HD2 LYS 95 1HD LYS 95 -6.803 7.863 26.450 862 HD3 LYS 95 2HD LYS 95 -5.397 7.089 27.183 863 HE2 LYS 95 1HE LYS 95 -4.473 9.288 27.727 864 HE3 LYS 95 2HE LYS 95 -5.877 10.061 26.992 865 HZ1 LYS 95 3HZ LYS 95 -5.933 8.256 29.350 866 HZ2 LYS 95 1HZ LYS 95 -7.281 8.999 28.647 867 HZ3 LYS 95 2HZ LYS 95 -6.090 9.941 29.392 868 H ARG 96 H ARG 96 -2.542 7.759 24.498 869 HA ARG 96 HA ARG 96 -0.532 6.064 23.301 870 HB2 ARG 96 1HB ARG 96 -0.449 8.263 25.354 871 HB3 ARG 96 2HB ARG 96 0.968 7.288 24.985 872 HG2 ARG 96 1HG ARG 96 0.853 8.003 22.651 873 HG3 ARG 96 2HG ARG 96 -0.569 8.980 23.022 874 HD2 ARG 96 1HD ARG 96 0.757 10.306 24.596 875 HD3 ARG 96 2HD ARG 96 2.177 9.329 24.225 876 HE ARG 96 HE ARG 96 1.183 10.389 21.832 877 HH11 ARG 96 1HH1 ARG 96 2.715 11.492 24.774 878 HH12 ARG 96 2HH1 ARG 96 3.460 12.861 24.019 879 HH21 ARG 96 1HH2 ARG 96 2.162 12.188 20.843 880 HH22 ARG 96 2HH2 ARG 96 3.145 13.255 21.789 881 H THR 97 H THR 97 -2.669 4.832 24.915 882 HA THR 97 HA THR 97 -1.400 3.929 27.351 883 HB THR 97 HB THR 97 -3.807 4.244 27.379 884 HG1 THR 97 HG1 THR 97 -4.060 1.604 27.629 885 HG21 THR 97 3HG2 THR 97 -5.333 2.852 26.097 886 HG22 THR 97 1HG2 THR 97 -3.976 2.025 25.332 887 HG23 THR 97 2HG2 THR 97 -4.266 3.733 25.004 888 H LEU 98 H LEU 98 -1.352 2.982 24.097 889 HA LEU 98 HA LEU 98 -0.805 0.185 24.645 890 HB2 LEU 98 1HB LEU 98 -1.855 1.572 22.438 891 HB3 LEU 98 2HB LEU 98 -0.293 0.972 21.917 892 HG LEU 98 HG LEU 98 -1.917 -0.648 21.284 893 HD11 LEU 98 1HD1 LEU 98 -0.973 -2.559 22.126 894 HD12 LEU 98 2HD1 LEU 98 -0.902 -1.935 23.774 895 HD13 LEU 98 3HD1 LEU 98 0.253 -1.368 22.566 896 HD21 LEU 98 3HD2 LEU 98 -3.509 -1.649 22.800 897 HD22 LEU 98 1HD2 LEU 98 -3.705 0.103 22.805 898 HD23 LEU 98 2HD2 LEU 98 -2.878 -0.696 24.142 899 H ARG 99 H ARG 99 0.829 3.068 23.561 900 HA ARG 99 HA ARG 99 3.360 1.967 23.024 901 HB2 ARG 99 1HB ARG 99 2.435 4.773 23.646 902 HB3 ARG 99 2HB ARG 99 4.123 4.388 23.341 903 HG2 ARG 99 1HG ARG 99 3.536 3.565 21.116 904 HG3 ARG 99 2HG ARG 99 1.841 3.948 21.424 905 HD2 ARG 99 1HD ARG 99 2.426 6.310 21.687 906 HD3 ARG 99 2HD ARG 99 4.120 5.925 21.379 907 HE ARG 99 HE ARG 99 2.594 4.986 19.230 908 HH11 ARG 99 1HH1 ARG 99 3.553 8.028 20.658 909 HH12 ARG 99 2HH1 ARG 99 3.482 8.896 19.162 910 HH21 ARG 99 1HH2 ARG 99 2.499 6.129 17.265 911 HH22 ARG 99 2HH2 ARG 99 2.882 7.818 17.236 912 H ARG 100 H ARG 100 1.689 3.096 25.855 913 HA ARG 100 HA ARG 100 3.957 3.136 27.603 914 HB2 ARG 100 1HB ARG 100 0.976 2.940 28.076 915 HB3 ARG 100 2HB ARG 100 2.131 2.872 29.401 916 HG2 ARG 100 1HG ARG 100 2.959 5.090 28.794 917 HG3 ARG 100 2HG ARG 100 1.799 5.156 27.465 918 HD2 ARG 100 1HD ARG 100 -0.042 4.985 29.068 919 HD3 ARG 100 2HD ARG 100 1.118 4.918 30.394 920 HE ARG 100 HE ARG 100 1.606 7.240 28.909 921 HH11 ARG 100 1HH1 ARG 100 -0.860 5.914 31.002 922 HH12 ARG 100 2HH1 ARG 100 -1.401 7.464 31.553 923 HH21 ARG 100 1HH2 ARG 100 0.894 9.275 29.635 924 HH22 ARG 100 2HH2 ARG 100 -0.406 9.371 30.776 925 H LEU 101 H LEU 101 2.037 0.846 26.089 926 HA LEU 101 HA LEU 101 3.069 -1.364 27.703 927 HB2 LEU 101 1HB LEU 101 0.670 -1.246 25.874 928 HB3 LEU 101 2HB LEU 101 1.236 -2.698 26.668 929 HG LEU 101 HG LEU 101 0.396 -0.257 28.222 930 HD11 LEU 101 1HD1 LEU 101 -1.460 -0.980 26.770 931 HD12 LEU 101 2HD1 LEU 101 -1.796 -1.233 28.482 932 HD13 LEU 101 3HD1 LEU 101 -1.345 -2.598 27.461 933 HD21 LEU 101 3HD2 LEU 101 -0.180 -2.454 29.720 934 HD22 LEU 101 1HD2 LEU 101 1.313 -1.524 29.836 935 HD23 LEU 101 2HD2 LEU 101 1.262 -2.989 28.858 936 H LEU 102 H LEU 102 2.944 0.132 24.519 937 HA LEU 102 HA LEU 102 4.133 -2.224 23.258 938 HB2 LEU 102 1HB LEU 102 2.396 -0.492 22.258 939 HB3 LEU 102 2HB LEU 102 3.857 0.371 21.823 940 HG LEU 102 HG LEU 102 3.655 -2.508 21.070 941 HD11 LEU 102 1HD1 LEU 102 2.277 -0.272 19.588 942 HD12 LEU 102 2HD1 LEU 102 1.483 -1.606 20.426 943 HD13 LEU 102 3HD1 LEU 102 2.481 -1.926 19.009 944 HD21 LEU 102 3HD2 LEU 102 4.939 -1.728 19.142 945 HD22 LEU 102 1HD2 LEU 102 5.716 -1.263 20.655 946 HD23 LEU 102 2HD2 LEU 102 4.814 -0.067 19.724 947 H GLN 103 H GLN 103 5.027 1.198 23.702 948 HA GLN 103 HA GLN 103 7.709 0.781 22.784 949 HB2 GLN 103 1HB GLN 103 6.146 2.964 22.930 950 HB3 GLN 103 2HB GLN 103 7.065 3.174 24.414 951 HG2 GLN 103 1HG GLN 103 8.324 4.349 22.891 952 HG3 GLN 103 2HG GLN 103 9.129 2.781 22.904 953 HE21 GLN 103 2HE2 GLN 103 7.106 4.955 21.102 954 HE22 GLN 103 1HE2 GLN 103 7.250 4.152 19.578 955 H GLU 104 H GLU 104 6.102 0.580 25.848 956 HA GLU 104 HA GLU 104 8.544 0.807 27.394 957 HB2 GLU 104 1HB GLU 104 5.669 0.302 28.078 958 HB3 GLU 104 2HB GLU 104 6.929 0.018 29.271 959 HG2 GLU 104 1HG GLU 104 7.684 2.385 28.876 960 HG3 GLU 104 2HG GLU 104 6.213 2.608 27.931 961 H ARG 105 H ARG 105 6.807 -1.697 25.819 962 HA ARG 105 HA ARG 105 7.926 -3.819 27.461 963 HB2 ARG 105 1HB ARG 105 5.586 -3.720 26.219 964 HB3 ARG 105 2HB ARG 105 6.525 -4.361 24.879 965 HG2 ARG 105 1HG ARG 105 6.715 -5.685 27.543 966 HG3 ARG 105 2HG ARG 105 5.294 -5.962 26.536 967 HD2 ARG 105 1HD ARG 105 6.705 -6.737 24.718 968 HD3 ARG 105 2HD ARG 105 8.151 -6.396 25.667 969 HE ARG 105 HE ARG 105 6.353 -8.205 26.975 970 HH11 ARG 105 1HH1 ARG 105 8.930 -7.983 24.625 971 HH12 ARG 105 2HH1 ARG 105 9.429 -9.629 24.834 972 HH21 ARG 105 1HH2 ARG 105 7.010 -10.366 27.246 973 HH22 ARG 105 2HH2 ARG 105 8.339 -10.980 26.320 974 H GLU 106 H GLU 106 8.477 -2.286 24.366 975 HA GLU 106 HA GLU 106 10.492 -4.254 23.610 976 HB2 GLU 106 1HB GLU 106 9.281 -1.882 22.204 977 HB3 GLU 106 2HB GLU 106 10.685 -2.723 21.562 978 HG2 GLU 106 1HG GLU 106 9.397 -4.798 21.468 979 HG3 GLU 106 2HG GLU 106 7.990 -3.951 22.107 980 H LEU 107 H LEU 107 10.440 -1.696 25.619 981 HA LEU 107 HA LEU 107 11.956 -0.275 26.527 982 HB2 LEU 107 1HB LEU 107 13.725 -2.423 25.408 983 HB3 LEU 107 2HB LEU 107 14.414 -1.036 26.228 984 HG LEU 107 HG LEU 107 12.708 -1.747 28.130 985 HD11 LEU 107 1HD1 LEU 107 12.509 -4.179 28.277 986 HD12 LEU 107 2HD1 LEU 107 13.244 -4.338 26.682 987 HD13 LEU 107 3HD1 LEU 107 11.676 -3.549 26.855 988 HD21 LEU 107 3HD2 LEU 107 14.512 -3.059 29.151 989 HD22 LEU 107 1HD2 LEU 107 15.117 -1.583 28.396 990 HD23 LEU 107 2HD2 LEU 107 15.330 -3.138 27.589 991 H VAL 108 H VAL 108 10.966 0.416 23.957 992 HA VAL 108 HA VAL 108 11.271 1.855 22.222 993 HB VAL 108 HB VAL 108 13.594 3.064 23.712 994 HG11 VAL 108 1HG1 VAL 108 12.686 5.159 22.815 995 HG12 VAL 108 2HG1 VAL 108 11.391 4.256 22.030 996 HG13 VAL 108 3HG1 VAL 108 13.066 4.009 21.533 997 HG21 VAL 108 3HG2 VAL 108 11.652 2.540 25.262 998 HG22 VAL 108 1HG2 VAL 108 10.720 3.707 24.325 999 HG23 VAL 108 2HG2 VAL 108 12.166 4.225 25.191 1000 H GLU 109 H GLU 109 12.319 -0.483 21.564 1001 HA GLU 109 HA GLU 109 14.966 0.088 20.408 1002 HB2 GLU 109 1HB GLU 109 13.641 -2.504 21.183 1003 HB3 GLU 109 2HB GLU 109 15.039 -2.455 20.117 1004 HG2 GLU 109 1HG GLU 109 16.338 -1.357 21.869 1005 HG3 GLU 109 2HG GLU 109 14.936 -1.403 22.936 1006 HA PRO 110 HA PRO 110 13.090 0.107 16.387 1007 HB2 PRO 110 1HB PRO 110 15.276 -0.461 14.861 1008 HB3 PRO 110 2HB PRO 110 15.023 1.117 15.631 1009 HG2 PRO 110 1HG PRO 110 16.751 -1.147 16.497 1010 HG3 PRO 110 2HG PRO 110 17.075 0.599 16.523 1011 HD2 PRO 110 1HD PRO 110 16.333 -0.791 18.731 1012 HD3 PRO 110 2HD PRO 110 15.933 0.919 18.483 1013 H LEU 111 H LEU 111 12.701 -1.264 14.496 1014 HA LEU 111 HA LEU 111 13.328 -4.081 14.799 1015 HB2 LEU 111 1HB LEU 111 10.924 -3.164 15.730 1016 HB3 LEU 111 2HB LEU 111 10.514 -3.580 14.080 1017 HG LEU 111 HG LEU 111 9.983 -5.424 15.544 1018 HD11 LEU 111 1HD1 LEU 111 12.420 -6.044 13.884 1019 HD12 LEU 111 2HD1 LEU 111 10.751 -6.003 13.315 1020 HD13 LEU 111 3HD1 LEU 111 11.253 -7.222 14.485 1021 HD21 LEU 111 3HD2 LEU 111 12.875 -5.734 16.269 1022 HD22 LEU 111 1HD2 LEU 111 11.457 -6.469 17.016 1023 HD23 LEU 111 2HD2 LEU 111 11.782 -4.750 17.242 1024 H THR 112 H THR 112 14.629 -3.772 12.998 1025 HA THR 112 HA THR 112 13.165 -3.733 10.456 1026 HB THR 112 HB THR 112 15.123 -2.438 9.458 1027 HG1 THR 112 HG1 THR 112 15.880 -2.524 12.066 1028 HG21 THR 112 3HG2 THR 112 13.331 -1.021 11.438 1029 HG22 THR 112 1HG2 THR 112 12.917 -1.434 9.774 1030 HG23 THR 112 2HG2 THR 112 14.191 -0.259 10.100 1031 HA PRO 113 HA PRO 113 15.656 -7.291 9.567 1032 HB2 PRO 113 1HB PRO 113 15.620 -7.236 6.837 1033 HB3 PRO 113 2HB PRO 113 14.227 -7.730 7.815 1034 HG2 PRO 113 1HG PRO 113 14.762 -5.123 6.484 1035 HG3 PRO 113 2HG PRO 113 13.246 -6.036 6.614 1036 HD2 PRO 113 1HD PRO 113 13.804 -3.902 8.186 1037 HD3 PRO 113 2HD PRO 113 12.801 -5.261 8.727 1038 H SER 114 H SER 114 17.766 -7.336 9.918 1039 HA SER 114 HA SER 114 19.520 -5.534 8.387 1040 HB2 SER 114 1HB SER 114 21.179 -5.963 10.226 1041 HB3 SER 114 2HB SER 114 19.716 -5.134 10.755 1042 HG SER 114 HG SER 114 20.408 -7.855 11.109 1043 H GLY 115 H GLY 115 18.538 -8.733 8.656 1044 HA2 GLY 115 1HA GLY 115 21.096 -9.808 7.680 1045 HA3 GLY 115 2HA GLY 115 19.745 -10.759 8.283 1046 H GLU 116 H GLU 116 21.252 -9.373 5.546 1047 HA GLU 116 HA GLU 116 20.930 -9.555 3.309 1048 HB2 GLU 116 1HB GLU 116 19.076 -11.760 4.203 1049 HB3 GLU 116 2HB GLU 116 19.358 -11.390 2.508 1050 HG2 GLU 116 1HG GLU 116 21.642 -11.962 4.354 1051 HG3 GLU 116 2HG GLU 116 20.718 -13.268 3.615 1052 H LYS 117 H LYS 117 19.936 -8.209 1.975 1053 HA LYS 117 HA LYS 117 17.439 -6.993 2.774 1054 HB2 LYS 117 1HB LYS 117 19.417 -6.422 0.578 1055 HB3 LYS 117 2HB LYS 117 17.872 -5.588 0.678 1056 HG2 LYS 117 1HG LYS 117 18.465 -4.747 2.894 1057 HG3 LYS 117 2HG LYS 117 20.014 -5.584 2.794 1058 HD2 LYS 117 1HD LYS 117 20.610 -4.244 0.832 1059 HD3 LYS 117 2HD LYS 117 19.060 -3.408 0.933 1060 HE2 LYS 117 1HE LYS 117 21.047 -3.434 3.191 1061 HE3 LYS 117 2HE LYS 117 21.066 -2.211 1.922 1062 HZ1 LYS 117 3HZ LYS 117 18.806 -1.599 2.532 1063 HZ2 LYS 117 1HZ LYS 117 19.844 -1.454 3.861 1064 HZ3 LYS 117 2HZ LYS 117 18.791 -2.773 3.749 1065 H LEU 118 H LEU 118 18.637 -9.036 0.160 1066 HA LEU 118 HA LEU 118 16.046 -9.067 -1.141 1067 HB2 LEU 118 1HB LEU 118 18.682 -10.351 -1.827 1068 HB3 LEU 118 2HB LEU 118 17.220 -10.608 -2.760 1069 HG LEU 118 HG LEU 118 17.247 -7.951 -2.855 1070 HD11 LEU 118 1HD1 LEU 118 20.158 -8.679 -2.564 1071 HD12 LEU 118 2HD1 LEU 118 19.215 -7.698 -1.443 1072 HD13 LEU 118 3HD1 LEU 118 19.531 -7.113 -3.075 1073 HD21 LEU 118 3HD2 LEU 118 17.233 -9.427 -4.783 1074 HD22 LEU 118 1HD2 LEU 118 18.953 -9.752 -4.569 1075 HD23 LEU 118 2HD2 LEU 118 18.410 -8.133 -5.008 1076 H TRP 119 H TRP 119 17.539 -10.739 1.329 1077 HA TRP 119 HA TRP 119 15.673 -12.991 1.021 1078 HB2 TRP 119 1HB TRP 119 18.240 -13.429 0.568 1079 HB3 TRP 119 2HB TRP 119 18.325 -13.454 2.325 1080 HD1 TRP 119 HD1 TRP 119 17.178 -15.503 3.586 1081 HE1 TRP 119 HE1 TRP 119 16.392 -17.814 2.774 1082 HE3 TRP 119 HE3 TRP 119 17.184 -14.643 -1.459 1083 HZ2 TRP 119 HZ2 TRP 119 15.846 -19.103 0.324 1084 HZ3 TRP 119 HZ3 TRP 119 16.516 -16.471 -2.965 1085 HH2 TRP 119 HH2 TRP 119 15.862 -18.654 -2.090 1086 H SER 120 H SER 120 14.758 -13.778 2.908 1087 HA SER 120 HA SER 120 15.359 -12.281 5.372 1088 HB2 SER 120 1HB SER 120 12.619 -13.080 4.356 1089 HB3 SER 120 2HB SER 120 12.946 -12.319 5.914 1090 HG SER 120 HG SER 120 13.457 -11.212 3.350
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