NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
500915 | 2kyf | 16955 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 1 H SER 1 1.807 0.001 0.856 2 HA SER 1 HA SER 1 1.442 0.345 -2.032 3 HB2 SER 1 2HB SER 1 3.894 0.871 -2.018 4 HB3 SER 1 3HB SER 1 2.925 1.968 -1.035 5 HG SER 1 HG SER 1 5.001 0.843 -0.191 6 H LEU 2 H LEU 2 2.038 -1.161 -3.490 7 HA LEU 2 HA LEU 2 2.229 -3.835 -2.831 8 HB2 LEU 2 2HB LEU 2 1.727 -2.849 -5.081 9 HB3 LEU 2 3HB LEU 2 3.457 -2.576 -5.276 10 HG LEU 2 HG LEU 2 3.700 -5.107 -4.937 11 HD11 LEU 2 1HD1 LEU 2 1.048 -5.539 -6.059 12 HD12 LEU 2 2HD1 LEU 2 1.013 -4.956 -4.396 13 HD13 LEU 2 3HD1 LEU 2 1.905 -6.423 -4.796 14 HD21 LEU 2 3HD2 LEU 2 2.616 -5.326 -7.414 15 HD22 LEU 2 1HD2 LEU 2 4.208 -4.645 -7.075 16 HD23 LEU 2 2HD2 LEU 2 2.819 -3.578 -7.284 17 H THR 3 H THR 3 4.966 -2.140 -4.336 18 HA THR 3 HA THR 3 7.218 -2.494 -4.159 19 HB THR 3 HB THR 3 7.899 -2.703 -1.591 20 HG1 THR 3 HG1 THR 3 5.398 -1.399 -1.357 21 HG21 THR 3 3HG2 THR 3 7.632 -0.638 -3.433 22 HG22 THR 3 1HG2 THR 3 8.487 -0.568 -1.893 23 HG23 THR 3 2HG2 THR 3 6.805 -0.049 -1.991 24 H ASP 4 H ASP 4 5.544 -4.894 -4.441 25 HA ASP 4 HA ASP 4 7.432 -6.844 -3.297 26 HB2 ASP 4 2HB ASP 4 4.826 -6.656 -2.516 27 HB3 ASP 4 3HB ASP 4 4.706 -7.828 -3.825 28 H ILE 5 H ILE 5 6.324 -5.450 -6.044 29 HA ILE 5 HA ILE 5 7.214 -7.718 -7.662 30 HB ILE 5 HB ILE 5 4.666 -6.201 -8.233 31 HG12 ILE 5 2HG1 ILE 5 3.902 -8.770 -8.090 32 HG13 ILE 5 3HG1 ILE 5 5.254 -8.823 -6.964 33 HG21 ILE 5 1HG2 ILE 5 6.121 -6.924 -10.193 34 HG22 ILE 5 2HG2 ILE 5 5.728 -8.578 -9.728 35 HG23 ILE 5 3HG2 ILE 5 4.443 -7.466 -10.200 36 HD11 ILE 5 3HD1 ILE 5 3.372 -8.400 -5.650 37 HD12 ILE 5 1HD1 ILE 5 4.166 -6.834 -5.818 38 HD13 ILE 5 2HD1 ILE 5 2.738 -7.209 -6.785 39 H LEU 6 H LEU 6 5.796 -4.488 -8.206 40 HA LEU 6 HA LEU 6 7.961 -3.913 -10.088 41 HB2 LEU 6 2HB LEU 6 5.247 -2.765 -9.595 42 HB3 LEU 6 3HB LEU 6 6.464 -1.805 -10.433 43 HG LEU 6 HG LEU 6 5.733 -4.550 -11.397 44 HD11 LEU 6 1HD1 LEU 6 3.673 -3.871 -11.874 45 HD12 LEU 6 2HD1 LEU 6 4.387 -2.714 -12.997 46 HD13 LEU 6 3HD1 LEU 6 4.023 -2.227 -11.341 47 HD21 LEU 6 3HD2 LEU 6 7.636 -2.692 -12.161 48 HD22 LEU 6 1HD2 LEU 6 6.334 -2.475 -13.330 49 HD23 LEU 6 2HD2 LEU 6 7.067 -4.064 -13.112 50 H SER 7 H SER 7 9.017 -1.816 -10.035 51 HA SER 7 HA SER 7 9.848 -1.137 -7.373 52 HB2 SER 7 2HB SER 7 10.892 -0.838 -10.004 53 HB3 SER 7 3HB SER 7 10.807 0.767 -9.277 54 HG SER 7 HG SER 7 12.187 -1.518 -8.354 55 HA PRO 8 HA PRO 8 7.316 2.337 -6.506 56 HB2 PRO 8 2HB PRO 8 9.060 4.050 -5.325 57 HB3 PRO 8 3HB PRO 8 8.482 2.576 -4.541 58 HG2 PRO 8 2HG PRO 8 11.061 3.070 -5.978 59 HG3 PRO 8 3HG PRO 8 10.776 2.208 -4.455 60 HD2 PRO 8 2HD PRO 8 11.151 0.923 -6.809 61 HD3 PRO 8 3HD PRO 8 10.105 0.280 -5.526 62 H SER 9 H SER 9 10.475 3.402 -7.786 63 HA SER 9 HA SER 9 9.650 5.880 -8.756 64 HB2 SER 9 2HB SER 9 11.657 5.815 -10.167 65 HB3 SER 9 3HB SER 9 12.016 5.217 -8.547 66 HG SER 9 HG SER 9 11.804 3.804 -10.965 67 H ASP 10 H ASP 10 9.341 2.683 -10.123 68 HA ASP 10 HA ASP 10 8.646 3.543 -12.757 69 HB2 ASP 10 2HB ASP 10 8.262 0.907 -11.329 70 HB3 ASP 10 3HB ASP 10 7.863 1.170 -13.024 71 H ILE 11 H ILE 11 6.862 2.777 -9.830 72 HA ILE 11 HA ILE 11 4.287 2.875 -11.098 73 HB ILE 11 HB ILE 11 5.050 2.944 -8.177 74 HG12 ILE 11 2HG1 ILE 11 3.655 0.644 -9.446 75 HG13 ILE 11 3HG1 ILE 11 5.357 0.865 -9.839 76 HG21 ILE 11 1HG2 ILE 11 2.920 3.988 -8.373 77 HG22 ILE 11 2HG2 ILE 11 2.356 2.761 -9.507 78 HG23 ILE 11 3HG2 ILE 11 2.642 2.337 -7.819 79 HD11 ILE 11 3HD1 ILE 11 4.093 0.268 -7.200 80 HD12 ILE 11 1HD1 ILE 11 5.400 -0.575 -8.031 81 HD13 ILE 11 2HD1 ILE 11 5.695 1.000 -7.291 82 H ALA 12 H ALA 12 6.047 5.020 -8.862 83 HA ALA 12 HA ALA 12 4.175 7.065 -8.704 84 HB1 ALA 12 1HB ALA 12 6.734 8.264 -8.687 85 HB2 ALA 12 2HB ALA 12 5.723 7.824 -7.310 86 HB3 ALA 12 3HB ALA 12 6.894 6.671 -7.949 87 H ALA 13 H ALA 13 6.285 6.191 -11.300 88 HA ALA 13 HA ALA 13 6.030 8.736 -12.661 89 HB1 ALA 13 1HB ALA 13 7.569 6.255 -13.057 90 HB2 ALA 13 2HB ALA 13 7.104 7.116 -14.525 91 HB3 ALA 13 3HB ALA 13 8.045 7.939 -13.282 92 H ALA 14 H ALA 14 4.567 5.564 -12.735 93 HA ALA 14 HA ALA 14 3.175 6.026 -15.220 94 HB1 ALA 14 1HB ALA 14 2.735 3.844 -13.185 95 HB2 ALA 14 2HB ALA 14 2.170 3.866 -14.856 96 HB3 ALA 14 3HB ALA 14 3.896 3.767 -14.511 97 H LEU 15 H LEU 15 2.559 6.434 -11.820 98 HA LEU 15 HA LEU 15 -0.272 6.611 -11.976 99 HB2 LEU 15 2HB LEU 15 1.812 7.232 -9.966 100 HB3 LEU 15 3HB LEU 15 0.255 8.037 -9.780 101 HG LEU 15 HG LEU 15 0.601 5.046 -9.947 102 HD11 LEU 15 1HD1 LEU 15 1.408 5.181 -7.875 103 HD12 LEU 15 2HD1 LEU 15 -0.215 5.675 -7.393 104 HD13 LEU 15 3HD1 LEU 15 1.011 6.894 -7.742 105 HD21 LEU 15 3HD2 LEU 15 -1.657 4.879 -9.414 106 HD22 LEU 15 1HD2 LEU 15 -1.611 6.207 -10.574 107 HD23 LEU 15 2HD2 LEU 15 -1.748 6.548 -8.849 108 H ARG 16 H ARG 16 2.242 9.121 -11.660 109 HA ARG 16 HA ARG 16 0.456 11.291 -11.990 110 HB2 ARG 16 2HB ARG 16 3.434 11.222 -12.507 111 HB3 ARG 16 3HB ARG 16 2.456 12.660 -12.246 112 HG2 ARG 16 2HG ARG 16 1.892 11.673 -9.972 113 HG3 ARG 16 3HG ARG 16 3.206 10.534 -10.270 114 HD2 ARG 16 2HD ARG 16 4.820 12.230 -10.301 115 HD3 ARG 16 3HD ARG 16 3.613 13.495 -10.525 116 HE ARG 16 HE ARG 16 3.311 13.560 -8.256 117 HH11 ARG 16 1HH1 ARG 16 5.027 10.651 -9.099 118 HH12 ARG 16 2HH1 ARG 16 5.367 10.219 -7.456 119 HH21 ARG 16 1HH2 ARG 16 3.752 13.003 -6.088 120 HH22 ARG 16 2HH2 ARG 16 4.641 11.558 -5.744 121 H ASP 17 H ASP 17 2.098 9.208 -14.217 122 HA ASP 17 HA ASP 17 2.211 10.758 -16.509 123 HB2 ASP 17 2HB ASP 17 3.230 8.672 -16.704 124 HB3 ASP 17 3HB ASP 17 1.840 7.820 -16.037 125 H CYS 18 H CYS 18 -0.471 8.690 -15.406 126 HA CYS 18 HA CYS 18 -2.298 10.376 -16.973 127 HB2 CYS 18 2HB CYS 18 -2.312 7.354 -16.854 128 HB3 CYS 18 3HB CYS 18 -3.605 8.327 -17.546 129 HG CYS 18 HG CYS 18 -2.385 9.034 -19.784 130 H GLN 19 H GLN 19 -1.798 10.719 -14.277 131 HA GLN 19 HA GLN 19 -3.461 9.309 -12.527 132 HB2 GLN 19 2HB GLN 19 -3.332 11.426 -11.126 133 HB3 GLN 19 3HB GLN 19 -1.799 10.686 -11.566 134 HG2 GLN 19 2HG GLN 19 -1.257 12.366 -13.047 135 HG3 GLN 19 3HG GLN 19 -2.936 12.858 -13.263 136 HE21 GLN 19 1HE2 GLN 19 -0.468 12.633 -10.726 137 HE22 GLN 19 2HE2 GLN 19 -0.878 14.123 -9.956 138 H ALA 20 H ALA 20 -4.115 12.020 -14.657 139 HA ALA 20 HA ALA 20 -6.580 12.840 -13.641 140 HB1 ALA 20 1HB ALA 20 -6.927 13.952 -15.691 141 HB2 ALA 20 2HB ALA 20 -5.182 13.959 -15.432 142 HB3 ALA 20 3HB ALA 20 -5.901 12.818 -16.569 143 HA PRO 21 HA PRO 21 -9.408 9.612 -14.578 144 HB2 PRO 21 2HB PRO 21 -11.677 11.041 -15.001 145 HB3 PRO 21 3HB PRO 21 -10.970 10.813 -13.397 146 HG2 PRO 21 2HG PRO 21 -10.756 13.158 -15.245 147 HG3 PRO 21 3HG PRO 21 -11.019 13.136 -13.492 148 HD2 PRO 21 2HD PRO 21 -8.596 13.629 -14.595 149 HD3 PRO 21 3HD PRO 21 -8.785 12.805 -13.034 150 H ASP 22 H ASP 22 -10.278 8.512 -16.294 151 HA ASP 22 HA ASP 22 -10.494 7.890 -18.477 152 HB2 ASP 22 2HB ASP 22 -12.361 9.674 -18.051 153 HB3 ASP 22 3HB ASP 22 -11.388 10.678 -19.124 154 H SER 23 H SER 23 -7.939 9.077 -17.654 155 HA SER 23 HA SER 23 -7.039 10.139 -20.252 156 HB2 SER 23 2HB SER 23 -6.806 11.442 -17.920 157 HB3 SER 23 3HB SER 23 -5.331 10.479 -17.841 158 HG SER 23 HG SER 23 -4.640 11.403 -19.740 159 H PHE 24 H PHE 24 -6.617 7.701 -17.831 160 HA PHE 24 HA PHE 24 -4.181 6.696 -19.091 161 HB2 PHE 24 2HB PHE 24 -3.845 5.387 -17.182 162 HB3 PHE 24 3HB PHE 24 -4.579 6.852 -16.537 163 HD1 PHE 24 HD2 PHE 24 -7.090 6.826 -16.103 164 HD2 PHE 24 HD1 PHE 24 -4.792 3.306 -16.772 165 HE1 PHE 24 HE2 PHE 24 -8.855 5.477 -15.046 166 HE2 PHE 24 HE1 PHE 24 -6.555 1.951 -15.716 167 HZ PHE 24 HZ PHE 24 -8.589 3.036 -14.851 168 H SER 25 H SER 25 -4.253 4.071 -18.924 169 HA SER 25 HA SER 25 -6.743 3.020 -19.979 170 HB2 SER 25 2HB SER 25 -4.573 3.814 -21.707 171 HB3 SER 25 3HB SER 25 -4.826 2.072 -21.812 172 HG SER 25 HG SER 25 -6.312 2.742 -23.182 173 HA PRO 26 HA PRO 26 -5.436 -0.706 -18.069 174 HB2 PRO 26 2HB PRO 26 -6.427 -2.600 -19.742 175 HB3 PRO 26 3HB PRO 26 -7.452 -1.618 -18.687 176 HG2 PRO 26 2HG PRO 26 -6.859 -1.280 -21.602 177 HG3 PRO 26 3HG PRO 26 -8.407 -1.129 -20.750 178 HD2 PRO 26 2HD PRO 26 -6.927 1.020 -21.474 179 HD3 PRO 26 3HD PRO 26 -7.938 1.004 -20.014 180 H LYS 27 H LYS 27 -4.539 -0.168 -21.396 181 HA LYS 27 HA LYS 27 -2.307 -2.069 -21.085 182 HB2 LYS 27 2HB LYS 27 -2.315 -2.438 -23.429 183 HB3 LYS 27 3HB LYS 27 -3.994 -2.539 -22.914 184 HG2 LYS 27 2HG LYS 27 -3.752 0.105 -23.555 185 HG3 LYS 27 3HG LYS 27 -2.696 -0.668 -24.740 186 HD2 LYS 27 2HD LYS 27 -4.832 -0.595 -25.740 187 HD3 LYS 27 3HD LYS 27 -4.619 -2.262 -25.198 188 HE2 LYS 27 2HE LYS 27 -6.044 -1.939 -23.341 189 HE3 LYS 27 3HE LYS 27 -6.023 -0.187 -23.534 190 HZ1 LYS 27 3HZ LYS 27 -6.971 -1.407 -25.898 191 HZ2 LYS 27 1HZ LYS 27 -7.760 -0.312 -24.878 192 HZ3 LYS 27 2HZ LYS 27 -7.863 -1.973 -24.577 193 H LYS 28 H LYS 28 -2.415 0.718 -20.182 194 HA LYS 28 HA LYS 28 -0.089 1.697 -21.683 195 HB2 LYS 28 2HB LYS 28 -2.542 3.273 -20.914 196 HB3 LYS 28 3HB LYS 28 -1.006 4.045 -21.289 197 HG2 LYS 28 2HG LYS 28 -2.398 2.178 -23.188 198 HG3 LYS 28 3HG LYS 28 -2.678 3.921 -23.167 199 HD2 LYS 28 2HD LYS 28 -0.295 4.306 -23.581 200 HD3 LYS 28 3HD LYS 28 -0.017 2.563 -23.601 201 HE2 LYS 28 2HE LYS 28 -0.172 3.123 -25.857 202 HE3 LYS 28 3HE LYS 28 -1.778 2.510 -25.469 203 HZ1 LYS 28 3HZ LYS 28 -1.336 4.822 -26.713 204 HZ2 LYS 28 1HZ LYS 28 -1.409 5.363 -25.112 205 HZ3 LYS 28 2HZ LYS 28 -2.711 4.515 -25.778 206 H PHE 29 H PHE 29 -0.615 0.319 -19.048 207 HA PHE 29 HA PHE 29 0.727 2.304 -17.333 208 HB2 PHE 29 2HB PHE 29 -1.709 0.952 -16.866 209 HB3 PHE 29 3HB PHE 29 -0.522 0.230 -15.784 210 HD1 PHE 29 HD1 PHE 29 0.856 1.813 -14.325 211 HD2 PHE 29 HD2 PHE 29 -2.711 2.977 -16.336 212 HE1 PHE 29 HE1 PHE 29 0.614 3.718 -12.786 213 HE2 PHE 29 HE2 PHE 29 -2.958 4.883 -14.801 214 HZ PHE 29 HZ PHE 29 -1.295 5.257 -13.024 215 H PHE 30 H PHE 30 1.170 -0.446 -19.050 216 HA PHE 30 HA PHE 30 2.947 -1.729 -17.113 217 HB2 PHE 30 2HB PHE 30 2.944 -3.630 -18.527 218 HB3 PHE 30 3HB PHE 30 1.285 -3.042 -18.530 219 HD1 PHE 30 HD1 PHE 30 4.353 -3.407 -20.490 220 HD2 PHE 30 HD2 PHE 30 0.306 -2.088 -20.510 221 HE1 PHE 30 HE1 PHE 30 4.405 -3.297 -22.948 222 HE2 PHE 30 HE2 PHE 30 0.351 -1.977 -22.968 223 HZ PHE 30 HZ PHE 30 2.402 -2.582 -24.190 224 H GLN 31 H GLN 31 3.063 0.524 -19.606 225 HA GLN 31 HA GLN 31 5.726 -0.138 -20.526 226 HB2 GLN 31 2HB GLN 31 4.413 2.480 -21.117 227 HB3 GLN 31 3HB GLN 31 5.447 1.493 -22.142 228 HG2 GLN 31 2HG GLN 31 3.595 -0.146 -22.339 229 HG3 GLN 31 3HG GLN 31 2.570 0.970 -21.438 230 HE21 GLN 31 1HE2 GLN 31 3.346 3.376 -22.514 231 HE22 GLN 31 2HE2 GLN 31 2.887 3.437 -24.178 232 H ILE 32 H ILE 32 4.186 2.193 -18.390 233 HA ILE 32 HA ILE 32 6.702 3.551 -17.873 234 HB ILE 32 HB ILE 32 4.050 3.999 -16.506 235 HG12 ILE 32 2HG1 ILE 32 4.298 6.083 -18.219 236 HG13 ILE 32 3HG1 ILE 32 5.045 4.806 -19.173 237 HG21 ILE 32 1HG2 ILE 32 5.759 4.994 -15.235 238 HG22 ILE 32 2HG2 ILE 32 6.610 5.560 -16.672 239 HG23 ILE 32 3HG2 ILE 32 5.082 6.304 -16.202 240 HD11 ILE 32 3HD1 ILE 32 2.549 3.967 -17.961 241 HD12 ILE 32 1HD1 ILE 32 2.360 5.368 -19.015 242 HD13 ILE 32 2HD1 ILE 32 3.081 3.884 -19.640 243 H SER 33 H SER 33 4.589 1.210 -16.372 244 HA SER 33 HA SER 33 6.072 1.281 -13.870 245 HB2 SER 33 2HB SER 33 3.896 -0.680 -14.582 246 HB3 SER 33 3HB SER 33 4.401 -0.139 -12.981 247 HG SER 33 HG SER 33 2.967 1.371 -13.158 248 H GLY 34 H GLY 34 5.032 -1.431 -15.941 249 HA2 GLY 34 2HA GLY 34 6.883 -2.723 -17.028 250 HA3 GLY 34 3HA GLY 34 7.683 -2.648 -15.465 251 H MET 35 H MET 35 4.237 -3.161 -15.860 252 HA MET 35 HA MET 35 4.224 -5.438 -14.200 253 HB2 MET 35 2HB MET 35 2.099 -4.652 -16.197 254 HB3 MET 35 3HB MET 35 1.887 -5.640 -14.758 255 HG2 MET 35 2HG MET 35 2.281 -3.765 -13.331 256 HG3 MET 35 3HG MET 35 2.737 -2.757 -14.702 257 HE1 MET 35 3HE MET 35 -1.541 -4.268 -13.863 258 HE2 MET 35 1HE MET 35 -0.255 -5.339 -14.421 259 HE3 MET 35 2HE MET 35 -0.147 -4.587 -12.829 260 H SER 36 H SER 36 3.890 -5.114 -17.728 261 HA SER 36 HA SER 36 3.534 -7.777 -18.383 262 HB2 SER 36 2HB SER 36 4.232 -7.211 -20.599 263 HB3 SER 36 3HB SER 36 3.437 -5.780 -19.942 264 HG SER 36 HG SER 36 5.551 -5.501 -21.047 265 H LYS 37 H LYS 37 6.473 -6.063 -17.548 266 HA LYS 37 HA LYS 37 8.333 -8.001 -18.395 267 HB2 LYS 37 2HB LYS 37 8.718 -6.192 -16.017 268 HB3 LYS 37 3HB LYS 37 9.941 -6.820 -17.112 269 HG2 LYS 37 2HG LYS 37 7.872 -4.717 -17.691 270 HG3 LYS 37 3HG LYS 37 9.624 -4.518 -17.612 271 HD2 LYS 37 2HD LYS 37 8.111 -6.157 -19.647 272 HD3 LYS 37 3HD LYS 37 8.849 -4.578 -19.927 273 HE2 LYS 37 2HE LYS 37 10.730 -5.616 -20.489 274 HE3 LYS 37 3HE LYS 37 10.864 -6.188 -18.827 275 HZ1 LYS 37 3HZ LYS 37 10.712 -7.803 -20.937 276 HZ2 LYS 37 1HZ LYS 37 9.072 -7.701 -20.534 277 HZ3 LYS 37 2HZ LYS 37 10.192 -8.243 -19.388 278 H LYS 38 H LYS 38 6.178 -7.902 -15.721 279 HA LYS 38 HA LYS 38 7.645 -9.874 -14.178 280 HB2 LYS 38 2HB LYS 38 4.845 -8.879 -13.661 281 HB3 LYS 38 3HB LYS 38 5.956 -9.617 -12.515 282 HG2 LYS 38 2HG LYS 38 6.414 -6.955 -13.842 283 HG3 LYS 38 3HG LYS 38 5.696 -7.167 -12.243 284 HD2 LYS 38 2HD LYS 38 7.709 -7.358 -11.317 285 HD3 LYS 38 3HD LYS 38 8.133 -8.669 -12.421 286 HE2 LYS 38 2HE LYS 38 8.585 -6.824 -14.137 287 HE3 LYS 38 3HE LYS 38 8.540 -5.713 -12.770 288 HZ1 LYS 38 3HZ LYS 38 10.441 -7.927 -13.258 289 HZ2 LYS 38 1HZ LYS 38 10.269 -7.211 -11.735 290 HZ3 LYS 38 2HZ LYS 38 10.780 -6.283 -13.053 291 H SER 39 H SER 39 6.828 -11.956 -13.660 292 HA SER 39 HA SER 39 5.623 -13.285 -15.885 293 HB2 SER 39 2HB SER 39 7.334 -14.416 -14.574 294 HB3 SER 39 3HB SER 39 6.340 -14.295 -13.122 295 HG SER 39 HG SER 39 6.252 -16.122 -15.128 296 H SER 40 H SER 40 3.724 -14.688 -15.716 297 HA SER 40 HA SER 40 1.432 -13.320 -14.965 298 HB2 SER 40 2HB SER 40 0.832 -16.096 -14.870 299 HB3 SER 40 3HB SER 40 0.542 -14.967 -16.193 300 HG SER 40 HG SER 40 2.142 -16.991 -16.252 301 H SER 41 H SER 41 3.527 -15.333 -13.084 302 HA SER 41 HA SER 41 1.657 -15.811 -10.960 303 HB2 SER 41 2HB SER 41 3.608 -16.710 -9.748 304 HB3 SER 41 3HB SER 41 3.500 -17.374 -11.378 305 HG SER 41 HG SER 41 5.214 -15.300 -10.479 306 H GLN 42 H GLN 42 4.211 -13.486 -11.622 307 HA GLN 42 HA GLN 42 4.157 -12.299 -9.021 308 HB2 GLN 42 2HB GLN 42 5.467 -11.702 -11.625 309 HB3 GLN 42 3HB GLN 42 5.306 -10.380 -10.476 310 HG2 GLN 42 2HG GLN 42 6.393 -11.902 -8.776 311 HG3 GLN 42 3HG GLN 42 6.774 -12.974 -10.122 312 HE21 GLN 42 1HE2 GLN 42 7.161 -9.658 -8.974 313 HE22 GLN 42 2HE2 GLN 42 8.685 -9.381 -9.739 314 H LEU 43 H LEU 43 2.448 -11.804 -12.017 315 HA LEU 43 HA LEU 43 1.406 -9.226 -11.330 316 HB2 LEU 43 2HB LEU 43 0.434 -11.210 -13.380 317 HB3 LEU 43 3HB LEU 43 -0.030 -9.513 -13.277 318 HG LEU 43 HG LEU 43 2.857 -10.136 -13.601 319 HD11 LEU 43 1HD1 LEU 43 0.748 -10.726 -15.617 320 HD12 LEU 43 2HD1 LEU 43 2.260 -11.568 -15.285 321 HD13 LEU 43 3HD1 LEU 43 2.278 -10.036 -16.158 322 HD21 LEU 43 3HD2 LEU 43 0.945 -7.954 -14.243 323 HD22 LEU 43 1HD2 LEU 43 2.363 -8.148 -15.275 324 HD23 LEU 43 2HD2 LEU 43 2.563 -7.875 -13.544 325 H LYS 44 H LYS 44 0.697 -12.373 -10.354 326 HA LYS 44 HA LYS 44 -2.127 -11.973 -9.903 327 HB2 LYS 44 2HB LYS 44 -0.178 -14.178 -9.494 328 HB3 LYS 44 3HB LYS 44 -1.596 -14.165 -8.454 329 HG2 LYS 44 2HG LYS 44 -2.977 -13.987 -10.567 330 HG3 LYS 44 3HG LYS 44 -1.494 -14.356 -11.449 331 HD2 LYS 44 2HD LYS 44 -2.148 -16.150 -9.197 332 HD3 LYS 44 3HD LYS 44 -3.226 -16.231 -10.592 333 HE2 LYS 44 2HE LYS 44 -1.708 -17.329 -11.798 334 HE3 LYS 44 3HE LYS 44 -0.451 -16.159 -11.402 335 HZ1 LYS 44 3HZ LYS 44 -0.004 -17.320 -9.368 336 HZ2 LYS 44 1HZ LYS 44 0.060 -18.428 -10.645 337 HZ3 LYS 44 2HZ LYS 44 -1.291 -18.387 -9.628 338 H GLU 45 H GLU 45 0.850 -11.741 -8.078 339 HA GLU 45 HA GLU 45 -0.131 -11.734 -5.480 340 HB2 GLU 45 2HB GLU 45 2.124 -10.030 -6.551 341 HB3 GLU 45 3HB GLU 45 1.871 -10.489 -4.873 342 HG2 GLU 45 2HG GLU 45 2.500 -12.360 -7.145 343 HG3 GLU 45 3HG GLU 45 3.621 -11.823 -5.895 344 H ILE 46 H ILE 46 -0.294 -9.281 -7.943 345 HA ILE 46 HA ILE 46 -1.018 -7.144 -6.174 346 HB ILE 46 HB ILE 46 -1.344 -7.367 -9.169 347 HG12 ILE 46 2HG1 ILE 46 0.685 -5.565 -8.025 348 HG13 ILE 46 3HG1 ILE 46 0.996 -7.277 -7.757 349 HG21 ILE 46 1HG2 ILE 46 -2.548 -5.507 -9.020 350 HG22 ILE 46 2HG2 ILE 46 -2.273 -5.409 -7.281 351 HG23 ILE 46 3HG2 ILE 46 -1.115 -4.689 -8.399 352 HD11 ILE 46 3HD1 ILE 46 0.261 -7.060 -10.441 353 HD12 ILE 46 1HD1 ILE 46 1.349 -5.708 -10.128 354 HD13 ILE 46 2HD1 ILE 46 1.870 -7.358 -9.784 355 H PHE 47 H PHE 47 -2.756 -9.424 -8.232 356 HA PHE 47 HA PHE 47 -5.302 -8.324 -8.114 357 HB2 PHE 47 2HB PHE 47 -5.421 -10.082 -9.527 358 HB3 PHE 47 3HB PHE 47 -4.157 -10.968 -8.679 359 HD1 PHE 47 HD1 PHE 47 -4.710 -12.420 -6.793 360 HD2 PHE 47 HD2 PHE 47 -7.733 -10.427 -9.030 361 HE1 PHE 47 HE1 PHE 47 -6.405 -13.925 -5.836 362 HE2 PHE 47 HE2 PHE 47 -9.433 -11.928 -8.076 363 HZ PHE 47 HZ PHE 47 -8.771 -13.679 -6.476 364 H ARG 48 H ARG 48 -3.610 -10.360 -5.791 365 HA ARG 48 HA ARG 48 -5.801 -10.867 -4.089 366 HB2 ARG 48 2HB ARG 48 -3.023 -11.458 -4.142 367 HB3 ARG 48 3HB ARG 48 -3.378 -10.737 -2.578 368 HG2 ARG 48 2HG ARG 48 -4.826 -13.093 -3.770 369 HG3 ARG 48 3HG ARG 48 -3.550 -13.183 -2.554 370 HD2 ARG 48 2HD ARG 48 -5.644 -11.337 -1.785 371 HD3 ARG 48 3HD ARG 48 -6.280 -12.952 -2.096 372 HE ARG 48 HE ARG 48 -4.157 -13.463 -0.529 373 HH11 ARG 48 1HH1 ARG 48 -6.808 -11.227 -0.229 374 HH12 ARG 48 2HH1 ARG 48 -6.812 -11.261 1.503 375 HH21 ARG 48 1HH2 ARG 48 -4.152 -13.516 1.751 376 HH22 ARG 48 2HH2 ARG 48 -5.300 -12.563 2.628 377 H ILE 49 H ILE 49 -4.089 -8.023 -4.715 378 HA ILE 49 HA ILE 49 -4.746 -6.844 -2.115 379 HB ILE 49 HB ILE 49 -3.320 -5.375 -4.304 380 HG12 ILE 49 2HG1 ILE 49 -2.126 -7.482 -4.128 381 HG13 ILE 49 3HG1 ILE 49 -1.176 -6.210 -3.367 382 HG21 ILE 49 1HG2 ILE 49 -2.700 -3.918 -2.680 383 HG22 ILE 49 2HG2 ILE 49 -4.169 -4.530 -1.922 384 HG23 ILE 49 3HG2 ILE 49 -2.598 -5.170 -1.441 385 HD11 ILE 49 3HD1 ILE 49 -2.930 -8.149 -1.880 386 HD12 ILE 49 1HD1 ILE 49 -1.191 -8.332 -2.108 387 HD13 ILE 49 2HD1 ILE 49 -1.821 -6.967 -1.185 388 H LEU 50 H LEU 50 -5.926 -7.059 -5.287 389 HA LEU 50 HA LEU 50 -7.369 -4.531 -5.167 390 HB2 LEU 50 2HB LEU 50 -6.798 -6.562 -7.242 391 HB3 LEU 50 3HB LEU 50 -8.316 -5.679 -7.391 392 HG LEU 50 HG LEU 50 -6.555 -3.642 -7.012 393 HD11 LEU 50 1HD1 LEU 50 -5.110 -5.544 -8.831 394 HD12 LEU 50 2HD1 LEU 50 -4.714 -5.393 -7.120 395 HD13 LEU 50 3HD1 LEU 50 -4.556 -3.998 -8.187 396 HD21 LEU 50 3HD2 LEU 50 -7.073 -4.795 -9.735 397 HD22 LEU 50 1HD2 LEU 50 -6.955 -3.102 -9.254 398 HD23 LEU 50 2HD2 LEU 50 -8.357 -4.058 -8.774 399 H ASP 51 H ASP 51 -7.868 -7.911 -4.622 400 HA ASP 51 HA ASP 51 -10.690 -7.958 -4.879 401 HB2 ASP 51 2HB ASP 51 -9.240 -9.985 -4.899 402 HB3 ASP 51 3HB ASP 51 -8.946 -9.752 -3.178 403 H ASN 52 H ASN 52 -11.650 -6.288 -3.771 404 HA ASN 52 HA ASN 52 -11.074 -5.883 -0.958 405 HB2 ASN 52 2HB ASN 52 -12.446 -4.401 -3.087 406 HB3 ASN 52 3HB ASN 52 -13.252 -4.302 -1.524 407 HD21 ASN 52 1HD2 ASN 52 -9.855 -4.397 -2.548 408 HD22 ASN 52 2HD2 ASN 52 -9.385 -2.964 -1.705 409 H ASP 53 H ASP 53 -12.671 -8.211 -2.415 410 HA ASP 53 HA ASP 53 -14.803 -8.302 -0.382 411 HB2 ASP 53 2HB ASP 53 -15.020 -9.670 -3.054 412 HB3 ASP 53 3HB ASP 53 -16.302 -9.291 -1.907 413 H GLN 54 H GLN 54 -12.042 -9.754 -1.674 414 HA GLN 54 HA GLN 54 -10.926 -11.683 -1.225 415 HB2 GLN 54 2HB GLN 54 -12.836 -12.099 1.068 416 HB3 GLN 54 3HB GLN 54 -11.175 -12.659 0.927 417 HG2 GLN 54 2HG GLN 54 -11.878 -9.744 1.004 418 HG3 GLN 54 3HG GLN 54 -11.616 -10.693 2.466 419 HE21 GLN 54 1HE2 GLN 54 -10.178 -8.700 0.287 420 HE22 GLN 54 2HE2 GLN 54 -8.526 -9.140 0.537 421 H SER 55 H SER 55 -13.666 -11.613 -2.663 422 HA SER 55 HA SER 55 -14.744 -14.238 -2.298 423 HB2 SER 55 2HB SER 55 -15.780 -13.530 -4.665 424 HB3 SER 55 3HB SER 55 -16.391 -12.887 -3.140 425 HG SER 55 HG SER 55 -14.539 -11.660 -4.905 426 H GLY 56 H GLY 56 -12.458 -12.748 -4.516 427 HA2 GLY 56 2HA GLY 56 -10.726 -14.514 -5.186 428 HA3 GLY 56 3HA GLY 56 -12.117 -15.346 -5.867 429 H PHE 57 H PHE 57 -13.074 -12.410 -6.438 430 HA PHE 57 HA PHE 57 -11.406 -11.967 -8.817 431 HB2 PHE 57 2HB PHE 57 -14.428 -11.845 -8.801 432 HB3 PHE 57 3HB PHE 57 -13.373 -11.592 -10.187 433 HD1 PHE 57 HD1 PHE 57 -14.671 -14.096 -7.824 434 HD2 PHE 57 HD2 PHE 57 -12.480 -13.420 -11.410 435 HE1 PHE 57 HE1 PHE 57 -14.793 -16.497 -8.347 436 HE2 PHE 57 HE2 PHE 57 -12.600 -15.820 -11.939 437 HZ PHE 57 HZ PHE 57 -13.758 -17.362 -10.408 438 H ILE 58 H ILE 58 -11.952 -9.785 -9.843 439 HA ILE 58 HA ILE 58 -12.370 -7.813 -7.693 440 HB ILE 58 HB ILE 58 -10.689 -7.493 -10.181 441 HG12 ILE 58 2HG1 ILE 58 -9.629 -7.521 -7.375 442 HG13 ILE 58 3HG1 ILE 58 -9.910 -9.039 -8.221 443 HG21 ILE 58 1HG2 ILE 58 -11.756 -5.417 -9.364 444 HG22 ILE 58 2HG2 ILE 58 -10.975 -5.664 -7.803 445 HG23 ILE 58 3HG2 ILE 58 -9.997 -5.382 -9.243 446 HD11 ILE 58 3HD1 ILE 58 -7.582 -8.202 -8.362 447 HD12 ILE 58 1HD1 ILE 58 -8.352 -8.447 -9.929 448 HD13 ILE 58 2HD1 ILE 58 -8.181 -6.817 -9.275 449 H GLU 59 H GLU 59 -14.658 -7.885 -8.179 450 HA GLU 59 HA GLU 59 -15.817 -7.364 -10.647 451 HB2 GLU 59 2HB GLU 59 -16.913 -6.325 -8.037 452 HB3 GLU 59 3HB GLU 59 -17.809 -6.808 -9.470 453 HG2 GLU 59 2HG GLU 59 -18.080 -8.798 -8.551 454 HG3 GLU 59 3HG GLU 59 -16.346 -9.063 -8.728 455 H GLU 60 H GLU 60 -17.149 -5.282 -11.064 456 HA GLU 60 HA GLU 60 -15.343 -3.198 -11.594 457 HB2 GLU 60 2HB GLU 60 -18.334 -3.429 -11.694 458 HB3 GLU 60 3HB GLU 60 -17.554 -1.880 -11.982 459 HG2 GLU 60 2HG GLU 60 -16.620 -2.556 -13.958 460 HG3 GLU 60 3HG GLU 60 -16.612 -4.257 -13.499 461 H ASP 61 H ASP 61 -17.530 -3.779 -8.926 462 HA ASP 61 HA ASP 61 -17.531 -1.203 -7.803 463 HB2 ASP 61 2HB ASP 61 -18.130 -3.949 -6.819 464 HB3 ASP 61 3HB ASP 61 -17.873 -2.690 -5.614 465 H GLU 62 H GLU 62 -15.091 -3.592 -7.970 466 HA GLU 62 HA GLU 62 -13.509 -2.155 -5.941 467 HB2 GLU 62 2HB GLU 62 -12.144 -4.406 -6.052 468 HB3 GLU 62 3HB GLU 62 -13.582 -4.271 -5.051 469 HG2 GLU 62 2HG GLU 62 -14.873 -5.227 -6.997 470 HG3 GLU 62 3HG GLU 62 -13.314 -5.592 -7.732 471 H LEU 63 H LEU 63 -13.847 -2.804 -9.215 472 HA LEU 63 HA LEU 63 -11.047 -2.719 -9.904 473 HB2 LEU 63 2HB LEU 63 -13.258 -3.675 -11.158 474 HB3 LEU 63 3HB LEU 63 -13.032 -2.139 -11.993 475 HG LEU 63 HG LEU 63 -11.051 -4.408 -11.820 476 HD11 LEU 63 1HD1 LEU 63 -13.119 -3.644 -13.720 477 HD12 LEU 63 2HD1 LEU 63 -12.226 -5.156 -13.561 478 HD13 LEU 63 3HD1 LEU 63 -11.526 -3.809 -14.459 479 HD21 LEU 63 3HD2 LEU 63 -9.933 -2.225 -11.741 480 HD22 LEU 63 1HD2 LEU 63 -10.793 -1.739 -13.202 481 HD23 LEU 63 2HD2 LEU 63 -9.630 -3.064 -13.263 482 H LYS 64 H LYS 64 -13.683 -0.474 -9.575 483 HA LYS 64 HA LYS 64 -12.623 1.664 -11.078 484 HB2 LYS 64 2HB LYS 64 -14.125 3.065 -9.551 485 HB3 LYS 64 3HB LYS 64 -14.903 1.827 -10.529 486 HG2 LYS 64 2HG LYS 64 -15.533 0.618 -8.739 487 HG3 LYS 64 3HG LYS 64 -14.057 0.978 -7.841 488 HD2 LYS 64 2HD LYS 64 -15.874 2.014 -6.690 489 HD3 LYS 64 3HD LYS 64 -14.946 3.292 -7.479 490 HE2 LYS 64 2HE LYS 64 -16.595 3.729 -9.010 491 HE3 LYS 64 3HE LYS 64 -17.237 2.088 -8.948 492 HZ1 LYS 64 3HZ LYS 64 -18.249 2.547 -6.849 493 HZ2 LYS 64 1HZ LYS 64 -18.700 3.775 -7.922 494 HZ3 LYS 64 2HZ LYS 64 -17.513 4.067 -6.753 495 H TYR 65 H TYR 65 -11.584 0.273 -8.186 496 HA TYR 65 HA TYR 65 -10.302 2.725 -7.237 497 HB2 TYR 65 2HB TYR 65 -10.718 0.003 -6.021 498 HB3 TYR 65 3HB TYR 65 -9.583 1.156 -5.327 499 HD1 TYR 65 HD1 TYR 65 -11.027 3.698 -5.668 500 HD2 TYR 65 HD2 TYR 65 -12.460 -0.128 -4.481 501 HE1 TYR 65 HE1 TYR 65 -12.866 4.775 -4.441 502 HE2 TYR 65 HE2 TYR 65 -14.304 0.938 -3.251 503 HH TYR 65 HH TYR 65 -15.566 3.212 -3.433 504 H PHE 66 H PHE 66 -9.516 1.191 -9.686 505 HA PHE 66 HA PHE 66 -7.176 -0.262 -9.334 506 HB2 PHE 66 2HB PHE 66 -8.172 -0.251 -11.491 507 HB3 PHE 66 3HB PHE 66 -8.103 1.506 -11.595 508 HD1 PHE 66 HD1 PHE 66 -5.765 -1.364 -11.109 509 HD2 PHE 66 HD2 PHE 66 -6.497 2.399 -12.958 510 HE1 PHE 66 HE1 PHE 66 -3.608 -1.525 -12.281 511 HE2 PHE 66 HE2 PHE 66 -4.341 2.244 -14.134 512 HZ PHE 66 HZ PHE 66 -2.894 0.280 -13.797 513 H LEU 67 H LEU 67 -7.690 3.209 -9.396 514 HA LEU 67 HA LEU 67 -4.882 3.840 -9.412 515 HB2 LEU 67 2HB LEU 67 -6.935 5.803 -8.532 516 HB3 LEU 67 3HB LEU 67 -5.505 6.042 -9.534 517 HG LEU 67 HG LEU 67 -8.208 5.013 -10.337 518 HD11 LEU 67 1HD1 LEU 67 -6.846 6.895 -12.064 519 HD12 LEU 67 2HD1 LEU 67 -7.014 7.509 -10.420 520 HD13 LEU 67 3HD1 LEU 67 -8.441 6.995 -11.318 521 HD21 LEU 67 3HD2 LEU 67 -6.933 3.454 -11.458 522 HD22 LEU 67 1HD2 LEU 67 -5.558 4.545 -11.631 523 HD23 LEU 67 2HD2 LEU 67 -6.994 4.771 -12.630 524 H GLN 68 H GLN 68 -7.077 2.823 -7.068 525 HA GLN 68 HA GLN 68 -5.757 4.186 -4.862 526 HB2 GLN 68 2HB GLN 68 -8.290 2.811 -5.269 527 HB3 GLN 68 3HB GLN 68 -7.498 2.311 -3.780 528 HG2 GLN 68 2HG GLN 68 -8.370 4.107 -2.828 529 HG3 GLN 68 3HG GLN 68 -7.250 5.070 -3.791 530 HE21 GLN 68 1HE2 GLN 68 -8.245 4.911 -6.279 531 HE22 GLN 68 2HE2 GLN 68 -9.828 5.598 -6.352 532 H ARG 69 H ARG 69 -4.856 1.746 -6.714 533 HA ARG 69 HA ARG 69 -3.948 0.002 -4.534 534 HB2 ARG 69 2HB ARG 69 -3.525 -0.668 -7.414 535 HB3 ARG 69 3HB ARG 69 -3.801 -1.738 -6.046 536 HG2 ARG 69 2HG ARG 69 -5.832 -0.059 -7.494 537 HG3 ARG 69 3HG ARG 69 -5.722 -1.820 -7.444 538 HD2 ARG 69 2HD ARG 69 -6.634 0.089 -5.337 539 HD3 ARG 69 3HD ARG 69 -7.396 -1.394 -5.909 540 HE ARG 69 HE ARG 69 -5.152 -2.321 -4.768 541 HH11 ARG 69 1HH1 ARG 69 -7.579 -0.084 -3.659 542 HH12 ARG 69 2HH1 ARG 69 -7.379 -0.494 -1.987 543 HH21 ARG 69 1HH2 ARG 69 -4.880 -2.869 -2.571 544 HH22 ARG 69 2HH2 ARG 69 -5.843 -2.078 -1.369 545 H PHE 70 H PHE 70 -2.834 2.073 -7.129 546 HA PHE 70 HA PHE 70 -0.043 1.478 -6.456 547 HB2 PHE 70 2HB PHE 70 -1.323 2.885 -8.797 548 HB3 PHE 70 3HB PHE 70 0.414 2.920 -8.509 549 HD1 PHE 70 HD2 PHE 70 1.663 0.724 -8.440 550 HD2 PHE 70 HD1 PHE 70 -2.330 1.074 -9.871 551 HE1 PHE 70 HE2 PHE 70 1.901 -1.422 -9.619 552 HE2 PHE 70 HE1 PHE 70 -2.099 -1.072 -11.052 553 HZ PHE 70 HZ PHE 70 0.019 -2.323 -10.928 554 H GLU 71 H GLU 71 -2.486 3.851 -6.055 555 HA GLU 71 HA GLU 71 -0.491 5.805 -5.120 556 HB2 GLU 71 2HB GLU 71 -2.396 6.248 -6.973 557 HB3 GLU 71 3HB GLU 71 -3.301 6.655 -5.522 558 HG2 GLU 71 2HG GLU 71 -0.661 7.862 -6.315 559 HG3 GLU 71 3HG GLU 71 -2.240 8.608 -6.556 560 H SER 72 H SER 72 -3.457 4.103 -4.320 561 HA SER 72 HA SER 72 -4.505 3.696 -2.342 562 HB2 SER 72 2HB SER 72 -2.110 4.724 -0.847 563 HB3 SER 72 3HB SER 72 -3.191 3.393 -0.433 564 HG SER 72 HG SER 72 -0.924 3.054 -1.450 565 H GLY 73 H GLY 73 -5.501 5.844 -3.338 566 HA2 GLY 73 2HA GLY 73 -6.694 7.321 -1.456 567 HA3 GLY 73 3HA GLY 73 -5.148 8.144 -1.595 568 H ALA 74 H ALA 74 -5.206 7.281 -4.548 569 HA ALA 74 HA ALA 74 -6.113 9.724 -5.595 570 HB1 ALA 74 1HB ALA 74 -6.069 8.233 -7.800 571 HB2 ALA 74 2HB ALA 74 -4.597 8.796 -7.008 572 HB3 ALA 74 3HB ALA 74 -5.175 7.153 -6.730 573 H ARG 75 H ARG 75 -7.682 9.560 -7.643 574 HA ARG 75 HA ARG 75 -10.271 9.042 -6.538 575 HB2 ARG 75 2HB ARG 75 -11.138 9.953 -8.603 576 HB3 ARG 75 3HB ARG 75 -9.801 10.951 -8.048 577 HG2 ARG 75 2HG ARG 75 -8.341 9.613 -9.639 578 HG3 ARG 75 3HG ARG 75 -9.846 9.000 -10.325 579 HD2 ARG 75 2HD ARG 75 -8.844 11.832 -10.247 580 HD3 ARG 75 3HD ARG 75 -9.236 10.848 -11.657 581 HE ARG 75 HE ARG 75 -11.602 10.995 -10.407 582 HH11 ARG 75 1HH1 ARG 75 -9.259 13.432 -11.239 583 HH12 ARG 75 2HH1 ARG 75 -10.438 14.688 -11.424 584 HH21 ARG 75 1HH2 ARG 75 -13.163 12.640 -10.648 585 HH22 ARG 75 2HH2 ARG 75 -12.658 14.237 -11.087 586 H VAL 76 H VAL 76 -11.913 7.979 -8.200 587 HA VAL 76 HA VAL 76 -10.925 5.255 -8.597 588 HB VAL 76 HB VAL 76 -13.171 4.522 -8.592 589 HG11 VAL 76 1HG1 VAL 76 -13.898 5.133 -6.462 590 HG12 VAL 76 2HG1 VAL 76 -12.162 5.452 -6.417 591 HG13 VAL 76 3HG1 VAL 76 -13.300 6.784 -6.628 592 HG21 VAL 76 3HG2 VAL 76 -13.708 7.221 -9.547 593 HG22 VAL 76 1HG2 VAL 76 -14.617 5.730 -9.793 594 HG23 VAL 76 2HG2 VAL 76 -14.860 6.679 -8.327 595 H LEU 77 H LEU 77 -12.700 4.326 -10.484 596 HA LEU 77 HA LEU 77 -11.729 5.686 -12.899 597 HB2 LEU 77 2HB LEU 77 -12.858 2.904 -12.653 598 HB3 LEU 77 3HB LEU 77 -12.049 3.603 -14.055 599 HG LEU 77 HG LEU 77 -10.815 2.794 -11.429 600 HD11 LEU 77 1HD1 LEU 77 -10.659 1.804 -14.253 601 HD12 LEU 77 2HD1 LEU 77 -11.011 0.904 -12.779 602 HD13 LEU 77 3HD1 LEU 77 -9.373 1.478 -13.091 603 HD21 LEU 77 3HD2 LEU 77 -9.862 4.652 -13.531 604 HD22 LEU 77 1HD2 LEU 77 -8.698 3.496 -12.882 605 HD23 LEU 77 2HD2 LEU 77 -9.520 4.622 -11.801 606 H THR 78 H THR 78 -13.173 5.735 -14.777 607 HA THR 78 HA THR 78 -15.939 6.268 -13.938 608 HB THR 78 HB THR 78 -14.733 8.169 -14.953 609 HG1 THR 78 HG1 THR 78 -16.842 8.396 -15.356 610 HG21 THR 78 3HG2 THR 78 -14.830 7.338 -17.693 611 HG22 THR 78 1HG2 THR 78 -13.839 6.207 -16.773 612 HG23 THR 78 2HG2 THR 78 -13.454 7.928 -16.762 613 H ALA 79 H ALA 79 -17.440 6.095 -16.047 614 HA ALA 79 HA ALA 79 -17.707 3.328 -16.553 615 HB1 ALA 79 1HB ALA 79 -19.761 4.155 -16.838 616 HB2 ALA 79 2HB ALA 79 -19.155 5.768 -17.218 617 HB3 ALA 79 3HB ALA 79 -19.242 4.538 -18.479 618 H SER 80 H SER 80 -15.686 5.633 -17.941 619 HA SER 80 HA SER 80 -15.492 4.170 -20.479 620 HB2 SER 80 2HB SER 80 -15.766 6.566 -20.745 621 HB3 SER 80 3HB SER 80 -14.409 6.876 -19.663 622 HG SER 80 HG SER 80 -14.420 5.994 -22.310 623 H GLU 81 H GLU 81 -14.162 4.088 -17.493 624 HA GLU 81 HA GLU 81 -11.502 3.326 -18.505 625 HB2 GLU 81 2HB GLU 81 -12.358 4.365 -15.804 626 HB3 GLU 81 3HB GLU 81 -10.779 3.650 -16.097 627 HG2 GLU 81 2HG GLU 81 -11.913 6.178 -17.247 628 HG3 GLU 81 3HG GLU 81 -10.490 5.981 -16.226 629 H THR 82 H THR 82 -13.584 2.554 -15.711 630 HA THR 82 HA THR 82 -12.548 0.074 -15.114 631 HB THR 82 HB THR 82 -15.358 -0.116 -14.725 632 HG1 THR 82 HG1 THR 82 -15.784 1.886 -13.760 633 HG21 THR 82 3HG2 THR 82 -13.029 -0.439 -13.279 634 HG22 THR 82 1HG2 THR 82 -14.667 -0.629 -12.657 635 HG23 THR 82 2HG2 THR 82 -13.826 0.910 -12.470 636 H LYS 83 H LYS 83 -15.245 0.808 -17.316 637 HA LYS 83 HA LYS 83 -15.919 -1.773 -18.058 638 HB2 LYS 83 2HB LYS 83 -16.128 0.896 -19.367 639 HB3 LYS 83 3HB LYS 83 -16.422 -0.528 -20.356 640 HG2 LYS 83 2HG LYS 83 -18.031 -1.214 -18.442 641 HG3 LYS 83 3HG LYS 83 -17.961 0.497 -18.012 642 HD2 LYS 83 2HD LYS 83 -18.512 0.930 -20.486 643 HD3 LYS 83 3HD LYS 83 -18.979 -0.771 -20.536 644 HE2 LYS 83 2HE LYS 83 -20.571 -0.379 -18.714 645 HE3 LYS 83 3HE LYS 83 -20.104 1.321 -18.674 646 HZ1 LYS 83 3HZ LYS 83 -20.751 1.081 -21.227 647 HZ2 LYS 83 1HZ LYS 83 -21.877 1.496 -20.034 648 HZ3 LYS 83 2HZ LYS 83 -21.778 -0.100 -20.584 649 H THR 84 H THR 84 -13.589 0.405 -19.644 650 HA THR 84 HA THR 84 -12.748 -1.304 -21.663 651 HB THR 84 HB THR 84 -10.959 0.650 -20.210 652 HG1 THR 84 HG1 THR 84 -12.045 2.214 -21.151 653 HG21 THR 84 3HG2 THR 84 -10.186 -1.068 -22.079 654 HG22 THR 84 1HG2 THR 84 -9.566 0.582 -22.024 655 HG23 THR 84 2HG2 THR 84 -10.864 0.164 -23.142 656 H PHE 85 H PHE 85 -11.129 -0.754 -18.528 657 HA PHE 85 HA PHE 85 -9.147 -2.650 -18.734 658 HB2 PHE 85 2HB PHE 85 -9.624 -0.937 -16.854 659 HB3 PHE 85 3HB PHE 85 -10.600 -2.214 -16.137 660 HD1 PHE 85 HD2 PHE 85 -9.463 -4.457 -15.689 661 HD2 PHE 85 HD1 PHE 85 -7.330 -0.865 -16.509 662 HE1 PHE 85 HE2 PHE 85 -7.444 -5.427 -14.671 663 HE2 PHE 85 HE1 PHE 85 -5.308 -1.830 -15.492 664 HZ PHE 85 HZ PHE 85 -5.363 -4.113 -14.570 665 H LEU 86 H LEU 86 -12.463 -3.100 -17.556 666 HA LEU 86 HA LEU 86 -12.193 -5.826 -16.886 667 HB2 LEU 86 2HB LEU 86 -14.014 -4.578 -15.993 668 HB3 LEU 86 3HB LEU 86 -14.586 -4.148 -17.603 669 HG LEU 86 HG LEU 86 -14.972 -6.687 -17.896 670 HD11 LEU 86 1HD1 LEU 86 -14.475 -6.446 -14.962 671 HD12 LEU 86 2HD1 LEU 86 -13.965 -7.702 -16.089 672 HD13 LEU 86 3HD1 LEU 86 -15.646 -7.619 -15.564 673 HD21 LEU 86 3HD2 LEU 86 -17.140 -6.222 -17.588 674 HD22 LEU 86 1HD2 LEU 86 -16.582 -4.598 -17.186 675 HD23 LEU 86 2HD2 LEU 86 -16.902 -5.764 -15.901 676 H ALA 87 H ALA 87 -13.065 -4.179 -19.870 677 HA ALA 87 HA ALA 87 -13.713 -6.632 -21.246 678 HB1 ALA 87 1HB ALA 87 -14.903 -4.636 -21.866 679 HB2 ALA 87 2HB ALA 87 -13.394 -3.807 -22.246 680 HB3 ALA 87 3HB ALA 87 -13.924 -5.168 -23.233 681 H ALA 88 H ALA 88 -10.885 -5.545 -20.182 682 HA ALA 88 HA ALA 88 -9.402 -6.425 -22.573 683 HB1 ALA 88 1HB ALA 88 -8.825 -4.168 -22.166 684 HB2 ALA 88 2HB ALA 88 -8.639 -4.452 -20.435 685 HB3 ALA 88 3HB ALA 88 -7.477 -5.137 -21.570 686 H ALA 89 H ALA 89 -10.168 -7.095 -19.328 687 HA ALA 89 HA ALA 89 -7.967 -9.050 -19.165 688 HB1 ALA 89 1HB ALA 89 -9.051 -7.173 -17.203 689 HB2 ALA 89 2HB ALA 89 -8.868 -8.819 -16.597 690 HB3 ALA 89 3HB ALA 89 -7.477 -7.967 -17.268 691 H ASP 90 H ASP 90 -11.301 -8.506 -18.012 692 HA ASP 90 HA ASP 90 -11.856 -11.164 -17.351 693 HB2 ASP 90 2HB ASP 90 -13.307 -9.434 -16.550 694 HB3 ASP 90 3HB ASP 90 -13.677 -8.904 -18.188 695 H HIS 91 H HIS 91 -13.322 -9.490 -20.130 696 HA HIS 91 HA HIS 91 -13.920 -10.217 -22.201 697 HB2 HIS 91 2HB HIS 91 -11.323 -10.651 -22.101 698 HB3 HIS 91 3HB HIS 91 -11.814 -12.342 -22.119 699 HD1 HIS 91 HD1 HIS 91 -10.334 -11.933 -24.480 700 HD2 HIS 91 HD2 HIS 91 -14.261 -10.586 -24.316 701 HE1 HIS 91 HE1 HIS 91 -11.056 -11.670 -26.875 702 H ASP 92 H ASP 92 -14.580 -11.813 -19.570 703 HA ASP 92 HA ASP 92 -15.594 -14.238 -20.888 704 HB2 ASP 92 2HB ASP 92 -15.637 -13.840 -17.918 705 HB3 ASP 92 3HB ASP 92 -15.538 -15.338 -18.839 706 H GLY 93 H GLY 93 -16.536 -11.221 -19.654 707 HA2 GLY 93 2HA GLY 93 -18.615 -10.220 -19.640 708 HA3 GLY 93 3HA GLY 93 -19.285 -11.710 -20.287 709 H ASP 94 H ASP 94 -17.516 -11.150 -17.264 710 HA ASP 94 HA ASP 94 -19.902 -12.093 -15.813 711 HB2 ASP 94 2HB ASP 94 -17.279 -12.376 -14.487 712 HB3 ASP 94 3HB ASP 94 -18.643 -13.489 -14.541 713 H GLY 95 H GLY 95 -17.632 -9.586 -16.222 714 HA2 GLY 95 2HA GLY 95 -17.610 -7.471 -15.292 715 HA3 GLY 95 3HA GLY 95 -18.972 -7.944 -14.288 716 H LYS 96 H LYS 96 -16.164 -9.942 -14.241 717 HA LYS 96 HA LYS 96 -15.046 -8.610 -11.907 718 HB2 LYS 96 2HB LYS 96 -15.131 -10.653 -10.536 719 HB3 LYS 96 3HB LYS 96 -16.740 -10.060 -10.929 720 HG2 LYS 96 2HG LYS 96 -16.000 -11.887 -12.953 721 HG3 LYS 96 3HG LYS 96 -15.617 -12.629 -11.398 722 HD2 LYS 96 2HD LYS 96 -18.226 -11.262 -11.565 723 HD3 LYS 96 3HD LYS 96 -18.057 -12.719 -12.548 724 HE2 LYS 96 2HE LYS 96 -17.075 -13.736 -10.354 725 HE3 LYS 96 3HE LYS 96 -17.926 -12.401 -9.579 726 HZ1 LYS 96 3HZ LYS 96 -19.188 -14.397 -11.380 727 HZ2 LYS 96 1HZ LYS 96 -19.982 -13.163 -10.537 728 HZ3 LYS 96 2HZ LYS 96 -19.260 -14.437 -9.690 729 H ILE 97 H ILE 97 -12.899 -8.675 -11.997 730 HA ILE 97 HA ILE 97 -11.589 -10.268 -14.007 731 HB ILE 97 HB ILE 97 -10.441 -8.393 -11.937 732 HG12 ILE 97 2HG1 ILE 97 -11.871 -7.267 -13.573 733 HG13 ILE 97 3HG1 ILE 97 -10.182 -6.850 -13.840 734 HG21 ILE 97 1HG2 ILE 97 -9.192 -10.184 -13.905 735 HG22 ILE 97 2HG2 ILE 97 -8.580 -8.531 -13.894 736 HG23 ILE 97 3HG2 ILE 97 -8.539 -9.496 -12.418 737 HD11 ILE 97 3HD1 ILE 97 -12.077 -8.211 -15.580 738 HD12 ILE 97 1HD1 ILE 97 -10.606 -7.322 -15.973 739 HD13 ILE 97 2HD1 ILE 97 -10.509 -9.011 -15.475 740 H GLY 98 H GLY 98 -10.109 -11.916 -13.698 741 HA2 GLY 98 2HA GLY 98 -10.058 -13.061 -10.973 742 HA3 GLY 98 3HA GLY 98 -10.152 -14.043 -12.428 743 H ALA 99 H ALA 99 -8.224 -14.774 -10.824 744 HA ALA 99 HA ALA 99 -5.762 -13.350 -11.356 745 HB1 ALA 99 1HB ALA 99 -6.214 -15.979 -9.948 746 HB2 ALA 99 2HB ALA 99 -4.709 -15.060 -9.977 747 HB3 ALA 99 3HB ALA 99 -6.132 -14.395 -9.175 748 H GLU 100 H GLU 100 -7.576 -15.180 -13.271 749 HA GLU 100 HA GLU 100 -5.277 -16.534 -14.522 750 HB2 GLU 100 2HB GLU 100 -8.192 -17.274 -14.419 751 HB3 GLU 100 3HB GLU 100 -7.117 -17.940 -15.640 752 HG2 GLU 100 2HG GLU 100 -6.738 -18.191 -12.665 753 HG3 GLU 100 3HG GLU 100 -7.405 -19.434 -13.721 754 H GLU 101 H GLU 101 -7.727 -14.173 -14.881 755 HA GLU 101 HA GLU 101 -7.165 -13.967 -17.765 756 HB2 GLU 101 2HB GLU 101 -9.301 -13.075 -18.117 757 HB3 GLU 101 3HB GLU 101 -9.569 -14.362 -16.950 758 HG2 GLU 101 2HG GLU 101 -9.149 -12.258 -15.302 759 HG3 GLU 101 3HG GLU 101 -9.911 -11.464 -16.679 760 H PHE 102 H PHE 102 -5.991 -12.776 -15.085 761 HA PHE 102 HA PHE 102 -6.154 -9.938 -15.725 762 HB2 PHE 102 2HB PHE 102 -6.327 -10.597 -13.374 763 HB3 PHE 102 3HB PHE 102 -4.751 -11.376 -13.463 764 HD1 PHE 102 HD1 PHE 102 -2.716 -10.068 -13.525 765 HD2 PHE 102 HD2 PHE 102 -6.530 -8.195 -13.282 766 HE1 PHE 102 HE1 PHE 102 -1.633 -7.955 -12.879 767 HE2 PHE 102 HE2 PHE 102 -5.454 -6.079 -12.637 768 HZ PHE 102 HZ PHE 102 -3.002 -5.957 -12.436 769 H GLN 103 H GLN 103 -3.497 -12.210 -15.003 770 HA GLN 103 HA GLN 103 -1.395 -10.683 -15.906 771 HB2 GLN 103 2HB GLN 103 -0.202 -12.831 -16.295 772 HB3 GLN 103 3HB GLN 103 -1.006 -12.750 -14.733 773 HG2 GLN 103 2HG GLN 103 -2.924 -13.883 -16.318 774 HG3 GLN 103 3HG GLN 103 -1.436 -14.561 -16.975 775 HE21 GLN 103 1HE2 GLN 103 -2.515 -13.708 -13.704 776 HE22 GLN 103 2HE2 GLN 103 -2.192 -15.256 -13.009 777 H GLU 104 H GLU 104 -3.553 -12.758 -17.777 778 HA GLU 104 HA GLU 104 -2.219 -12.717 -20.218 779 HB2 GLU 104 2HB GLU 104 -4.466 -13.108 -21.231 780 HB3 GLU 104 3HB GLU 104 -4.093 -14.183 -19.890 781 HG2 GLU 104 2HG GLU 104 -5.571 -13.087 -18.448 782 HG3 GLU 104 3HG GLU 104 -5.679 -11.672 -19.494 783 H MET 105 H MET 105 -4.254 -10.303 -18.704 784 HA MET 105 HA MET 105 -4.449 -8.661 -21.057 785 HB2 MET 105 2HB MET 105 -5.855 -7.322 -19.839 786 HB3 MET 105 3HB MET 105 -6.019 -8.820 -18.934 787 HG2 MET 105 2HG MET 105 -5.564 -7.578 -17.147 788 HG3 MET 105 3HG MET 105 -3.892 -7.647 -17.699 789 HE1 MET 105 3HE MET 105 -6.658 -4.939 -19.600 790 HE2 MET 105 1HE MET 105 -7.171 -6.110 -18.385 791 HE3 MET 105 2HE MET 105 -6.975 -4.414 -17.946 792 H VAL 106 H VAL 106 -2.099 -9.185 -18.673 793 HA VAL 106 HA VAL 106 -0.936 -6.534 -18.809 794 HB VAL 106 HB VAL 106 0.315 -8.994 -17.594 795 HG11 VAL 106 1HG1 VAL 106 1.106 -6.261 -17.860 796 HG12 VAL 106 2HG1 VAL 106 0.872 -6.637 -16.152 797 HG13 VAL 106 3HG1 VAL 106 1.981 -7.604 -17.124 798 HG21 VAL 106 3HG2 VAL 106 -2.128 -7.986 -16.847 799 HG22 VAL 106 1HG2 VAL 106 -1.042 -8.919 -15.817 800 HG23 VAL 106 2HG2 VAL 106 -1.016 -7.157 -15.758 801 H GLN 107 H GLN 107 0.730 -9.642 -19.181 802 HA GLN 107 HA GLN 107 2.685 -8.635 -20.920 803 HB2 GLN 107 2HB GLN 107 1.764 -11.491 -20.546 804 HB3 GLN 107 3HB GLN 107 3.254 -11.001 -21.342 805 HG2 GLN 107 2HG GLN 107 4.326 -10.768 -19.411 806 HG3 GLN 107 3HG GLN 107 2.999 -9.858 -18.691 807 HE21 GLN 107 1HE2 GLN 107 1.011 -11.340 -18.274 808 HE22 GLN 107 2HE2 GLN 107 1.368 -12.815 -17.449 809 H SER 108 H SER 108 -0.425 -10.148 -21.528 810 HA SER 108 HA SER 108 -0.021 -9.688 -24.412 811 HB2 SER 108 2HB SER 108 -0.238 -12.057 -24.009 812 HB3 SER 108 3HB SER 108 -1.673 -11.804 -23.016 813 HG SER 108 HG SER 108 -2.511 -12.309 -24.941 Start of MODEL 2 1 H1 SER 1 H SER 1 0.117 -0.235 -1.376 2 HA SER 1 HA SER 1 3.000 0.357 -1.332 3 HB2 SER 1 2HB SER 1 1.547 0.681 0.777 4 HB3 SER 1 3HB SER 1 1.517 -1.080 0.861 5 HG SER 1 HG SER 1 3.236 -0.221 2.083 6 H LEU 2 H LEU 2 2.871 -1.119 -3.315 7 HA LEU 2 HA LEU 2 2.606 -3.942 -2.731 8 HB2 LEU 2 2HB LEU 2 1.857 -2.964 -4.876 9 HB3 LEU 2 3HB LEU 2 3.535 -2.574 -5.252 10 HG LEU 2 HG LEU 2 3.728 -5.239 -4.817 11 HD11 LEU 2 1HD1 LEU 2 1.027 -4.918 -4.778 12 HD12 LEU 2 2HD1 LEU 2 1.862 -6.406 -5.223 13 HD13 LEU 2 3HD1 LEU 2 1.317 -5.292 -6.477 14 HD21 LEU 2 3HD2 LEU 2 4.515 -5.123 -6.892 15 HD22 LEU 2 1HD2 LEU 2 3.939 -3.457 -6.955 16 HD23 LEU 2 2HD2 LEU 2 2.913 -4.767 -7.540 17 H THR 3 H THR 3 5.201 -2.292 -4.507 18 HA THR 3 HA THR 3 7.450 -2.687 -4.577 19 HB THR 3 HB THR 3 8.384 -3.004 -2.088 20 HG1 THR 3 HG1 THR 3 6.018 -1.560 -1.559 21 HG21 THR 3 3HG2 THR 3 8.041 -0.888 -3.860 22 HG22 THR 3 1HG2 THR 3 9.044 -0.893 -2.409 23 HG23 THR 3 2HG2 THR 3 7.387 -0.294 -2.334 24 H ASP 4 H ASP 4 5.660 -5.046 -4.680 25 HA ASP 4 HA ASP 4 7.592 -7.074 -3.761 26 HB2 ASP 4 2HB ASP 4 5.140 -6.904 -2.741 27 HB3 ASP 4 3HB ASP 4 4.737 -7.817 -4.193 28 H ILE 5 H ILE 5 6.337 -5.566 -6.405 29 HA ILE 5 HA ILE 5 7.138 -7.781 -8.143 30 HB ILE 5 HB ILE 5 4.591 -6.208 -8.550 31 HG12 ILE 5 2HG1 ILE 5 3.795 -8.774 -8.438 32 HG13 ILE 5 3HG1 ILE 5 5.188 -8.867 -7.366 33 HG21 ILE 5 1HG2 ILE 5 6.134 -7.140 -10.516 34 HG22 ILE 5 2HG2 ILE 5 5.232 -8.611 -10.153 35 HG23 ILE 5 3HG2 ILE 5 4.373 -7.139 -10.607 36 HD11 ILE 5 3HD1 ILE 5 3.321 -8.457 -5.999 37 HD12 ILE 5 1HD1 ILE 5 4.187 -6.924 -6.109 38 HD13 ILE 5 2HD1 ILE 5 2.725 -7.183 -7.062 39 H LEU 6 H LEU 6 6.155 -4.371 -7.984 40 HA LEU 6 HA LEU 6 8.226 -3.778 -9.992 41 HB2 LEU 6 2HB LEU 6 5.424 -2.751 -9.764 42 HB3 LEU 6 3HB LEU 6 6.673 -1.781 -10.542 43 HG LEU 6 HG LEU 6 6.260 -4.577 -11.481 44 HD11 LEU 6 1HD1 LEU 6 4.220 -4.278 -12.306 45 HD12 LEU 6 2HD1 LEU 6 4.640 -2.693 -12.955 46 HD13 LEU 6 3HD1 LEU 6 4.098 -2.847 -11.284 47 HD21 LEU 6 3HD2 LEU 6 7.583 -2.156 -12.348 48 HD22 LEU 6 1HD2 LEU 6 6.515 -2.797 -13.597 49 HD23 LEU 6 2HD2 LEU 6 7.782 -3.816 -12.913 50 H SER 7 H SER 7 9.136 -1.614 -9.856 51 HA SER 7 HA SER 7 9.680 -0.886 -7.138 52 HB2 SER 7 2HB SER 7 10.909 -0.485 -9.677 53 HB3 SER 7 3HB SER 7 10.655 1.099 -8.944 54 HG SER 7 HG SER 7 12.665 0.021 -8.372 55 HA PRO 8 HA PRO 8 6.841 2.392 -6.479 56 HB2 PRO 8 2HB PRO 8 8.355 4.224 -5.167 57 HB3 PRO 8 3HB PRO 8 7.827 2.707 -4.428 58 HG2 PRO 8 2HG PRO 8 10.468 3.397 -5.658 59 HG3 PRO 8 3HG PRO 8 10.129 2.510 -4.160 60 HD2 PRO 8 2HD PRO 8 10.782 1.266 -6.475 61 HD3 PRO 8 3HD PRO 8 9.689 0.542 -5.278 62 H SER 9 H SER 9 10.004 3.697 -7.501 63 HA SER 9 HA SER 9 9.128 6.121 -8.514 64 HB2 SER 9 2HB SER 9 11.181 6.032 -9.961 65 HB3 SER 9 3HB SER 9 11.485 5.698 -8.256 66 HG SER 9 HG SER 9 12.265 3.857 -8.861 67 H ASP 10 H ASP 10 9.431 3.003 -10.181 68 HA ASP 10 HA ASP 10 8.672 3.858 -12.732 69 HB2 ASP 10 2HB ASP 10 8.357 1.180 -11.371 70 HB3 ASP 10 3HB ASP 10 7.999 1.449 -13.074 71 H ILE 11 H ILE 11 6.754 2.951 -9.935 72 HA ILE 11 HA ILE 11 4.258 2.935 -11.345 73 HB ILE 11 HB ILE 11 4.833 3.056 -8.383 74 HG12 ILE 11 2HG1 ILE 11 3.726 0.681 -9.833 75 HG13 ILE 11 3HG1 ILE 11 5.456 0.999 -9.902 76 HG21 ILE 11 1HG2 ILE 11 2.661 3.952 -8.706 77 HG22 ILE 11 2HG2 ILE 11 2.253 2.714 -9.892 78 HG23 ILE 11 3HG2 ILE 11 2.446 2.279 -8.194 79 HD11 ILE 11 3HD1 ILE 11 3.764 0.329 -7.529 80 HD12 ILE 11 1HD1 ILE 11 5.210 -0.482 -8.130 81 HD13 ILE 11 2HD1 ILE 11 5.342 1.094 -7.349 82 H ALA 12 H ALA 12 5.731 5.152 -8.973 83 HA ALA 12 HA ALA 12 3.748 7.105 -9.000 84 HB1 ALA 12 1HB ALA 12 6.249 8.401 -8.692 85 HB2 ALA 12 2HB ALA 12 5.090 7.939 -7.445 86 HB3 ALA 12 3HB ALA 12 6.362 6.816 -7.926 87 H ALA 13 H ALA 13 6.141 6.336 -11.362 88 HA ALA 13 HA ALA 13 6.044 8.885 -12.705 89 HB1 ALA 13 1HB ALA 13 7.528 6.378 -12.993 90 HB2 ALA 13 2HB ALA 13 7.136 7.170 -14.520 91 HB3 ALA 13 3HB ALA 13 8.038 8.042 -13.280 92 H ALA 14 H ALA 14 4.272 5.926 -12.785 93 HA ALA 14 HA ALA 14 3.081 6.538 -15.381 94 HB1 ALA 14 1HB ALA 14 2.216 4.219 -13.723 95 HB2 ALA 14 2HB ALA 14 2.358 4.363 -15.475 96 HB3 ALA 14 3HB ALA 14 3.806 4.182 -14.485 97 H LEU 15 H LEU 15 2.374 6.683 -11.986 98 HA LEU 15 HA LEU 15 -0.453 6.868 -12.195 99 HB2 LEU 15 2HB LEU 15 1.497 7.690 -10.059 100 HB3 LEU 15 3HB LEU 15 -0.245 7.896 -9.889 101 HG LEU 15 HG LEU 15 1.233 5.281 -10.179 102 HD11 LEU 15 1HD1 LEU 15 1.374 5.284 -7.969 103 HD12 LEU 15 2HD1 LEU 15 -0.373 5.487 -7.842 104 HD13 LEU 15 3HD1 LEU 15 0.674 6.903 -7.928 105 HD21 LEU 15 3HD2 LEU 15 -0.977 4.259 -9.776 106 HD22 LEU 15 1HD2 LEU 15 -0.902 5.144 -11.300 107 HD23 LEU 15 2HD2 LEU 15 -1.716 5.856 -9.907 108 H ARG 16 H ARG 16 2.038 9.356 -11.618 109 HA ARG 16 HA ARG 16 0.219 11.524 -11.906 110 HB2 ARG 16 2HB ARG 16 3.219 11.638 -12.218 111 HB3 ARG 16 3HB ARG 16 2.139 12.947 -11.759 112 HG2 ARG 16 2HG ARG 16 1.610 11.727 -9.675 113 HG3 ARG 16 3HG ARG 16 2.798 10.504 -10.130 114 HD2 ARG 16 2HD ARG 16 3.803 12.060 -8.588 115 HD3 ARG 16 3HD ARG 16 4.533 12.263 -10.180 116 HE ARG 16 HE ARG 16 3.739 14.401 -10.216 117 HH11 ARG 16 1HH1 ARG 16 1.956 12.586 -7.839 118 HH12 ARG 16 2HH1 ARG 16 1.089 13.964 -7.247 119 HH21 ARG 16 1HH2 ARG 16 2.604 16.223 -9.445 120 HH22 ARG 16 2HH2 ARG 16 1.457 16.032 -8.162 121 H ASP 17 H ASP 17 1.655 9.463 -14.142 122 HA ASP 17 HA ASP 17 1.990 11.313 -16.301 123 HB2 ASP 17 2HB ASP 17 3.307 9.372 -16.473 124 HB3 ASP 17 3HB ASP 17 1.950 8.312 -16.099 125 H CYS 18 H CYS 18 -0.541 9.066 -15.289 126 HA CYS 18 HA CYS 18 -2.385 10.443 -17.112 127 HB2 CYS 18 2HB CYS 18 -2.003 7.470 -16.808 128 HB3 CYS 18 3HB CYS 18 -3.501 8.153 -17.428 129 HG CYS 18 HG CYS 18 -2.167 9.471 -19.578 130 H GLN 19 H GLN 19 -1.983 10.892 -14.339 131 HA GLN 19 HA GLN 19 -3.783 9.514 -12.687 132 HB2 GLN 19 2HB GLN 19 -3.683 11.624 -11.280 133 HB3 GLN 19 3HB GLN 19 -2.143 10.850 -11.629 134 HG2 GLN 19 2HG GLN 19 -1.494 12.511 -13.107 135 HG3 GLN 19 3HG GLN 19 -3.147 13.070 -13.358 136 HE21 GLN 19 1HE2 GLN 19 -1.153 12.502 -10.477 137 HE22 GLN 19 2HE2 GLN 19 -1.372 14.079 -9.806 138 H ALA 20 H ALA 20 -4.232 12.165 -14.922 139 HA ALA 20 HA ALA 20 -6.646 13.216 -14.112 140 HB1 ALA 20 1HB ALA 20 -6.964 13.969 -16.354 141 HB2 ALA 20 2HB ALA 20 -5.234 14.016 -16.014 142 HB3 ALA 20 3HB ALA 20 -5.905 12.708 -16.987 143 HA PRO 21 HA PRO 21 -9.699 10.091 -14.569 144 HB2 PRO 21 2HB PRO 21 -11.864 11.595 -15.220 145 HB3 PRO 21 3HB PRO 21 -11.168 11.565 -13.595 146 HG2 PRO 21 2HG PRO 21 -10.798 13.580 -15.778 147 HG3 PRO 21 3HG PRO 21 -11.055 13.844 -14.043 148 HD2 PRO 21 2HD PRO 21 -8.607 13.992 -15.192 149 HD3 PRO 21 3HD PRO 21 -8.847 13.431 -13.525 150 H ASP 22 H ASP 22 -10.390 8.730 -16.122 151 HA ASP 22 HA ASP 22 -10.808 7.838 -18.172 152 HB2 ASP 22 2HB ASP 22 -12.489 9.777 -18.152 153 HB3 ASP 22 3HB ASP 22 -11.341 10.626 -19.184 154 H SER 23 H SER 23 -8.171 9.261 -17.427 155 HA SER 23 HA SER 23 -7.081 9.607 -20.130 156 HB2 SER 23 2HB SER 23 -6.757 11.261 -18.078 157 HB3 SER 23 3HB SER 23 -5.448 10.146 -17.688 158 HG SER 23 HG SER 23 -5.719 11.192 -20.289 159 H PHE 24 H PHE 24 -6.690 7.748 -17.166 160 HA PHE 24 HA PHE 24 -4.359 6.351 -17.903 161 HB2 PHE 24 2HB PHE 24 -5.764 6.513 -15.624 162 HB3 PHE 24 3HB PHE 24 -6.372 4.969 -16.211 163 HD1 PHE 24 HD2 PHE 24 -3.262 6.802 -15.378 164 HD2 PHE 24 HD1 PHE 24 -5.117 3.017 -15.965 165 HE1 PHE 24 HE2 PHE 24 -1.251 5.685 -14.506 166 HE2 PHE 24 HE1 PHE 24 -3.110 1.893 -15.093 167 HZ PHE 24 HZ PHE 24 -1.172 3.227 -14.363 168 H SER 25 H SER 25 -4.376 3.888 -18.165 169 HA SER 25 HA SER 25 -6.610 2.780 -19.609 170 HB2 SER 25 2HB SER 25 -5.785 3.806 -21.529 171 HB3 SER 25 3HB SER 25 -4.106 3.655 -21.010 172 HG SER 25 HG SER 25 -5.392 2.070 -22.636 173 HA PRO 26 HA PRO 26 -4.959 -0.932 -17.935 174 HB2 PRO 26 2HB PRO 26 -6.049 -2.747 -19.635 175 HB3 PRO 26 3HB PRO 26 -6.993 -1.888 -18.413 176 HG2 PRO 26 2HG PRO 26 -6.721 -1.321 -21.339 177 HG3 PRO 26 3HG PRO 26 -8.176 -1.299 -20.326 178 HD2 PRO 26 2HD PRO 26 -6.861 0.959 -21.035 179 HD3 PRO 26 3HD PRO 26 -7.713 0.796 -19.486 180 H LYS 27 H LYS 27 -4.183 0.163 -21.068 181 HA LYS 27 HA LYS 27 -1.992 -1.802 -21.240 182 HB2 LYS 27 2HB LYS 27 -2.161 -1.856 -23.597 183 HB3 LYS 27 3HB LYS 27 -3.811 -2.006 -23.006 184 HG2 LYS 27 2HG LYS 27 -3.616 0.679 -23.290 185 HG3 LYS 27 3HG LYS 27 -2.555 0.122 -24.586 186 HD2 LYS 27 2HD LYS 27 -4.735 0.324 -25.513 187 HD3 LYS 27 3HD LYS 27 -4.419 -1.401 -25.316 188 HE2 LYS 27 2HE LYS 27 -5.793 -1.520 -23.386 189 HE3 LYS 27 3HE LYS 27 -5.900 0.236 -23.270 190 HZ1 LYS 27 3HZ LYS 27 -6.917 -1.178 -25.651 191 HZ2 LYS 27 1HZ LYS 27 -7.345 0.347 -25.057 192 HZ3 LYS 27 2HZ LYS 27 -7.867 -1.048 -24.257 193 H LYS 28 H LYS 28 -2.162 0.909 -20.006 194 HA LYS 28 HA LYS 28 0.111 2.086 -21.450 195 HB2 LYS 28 2HB LYS 28 -2.274 3.563 -20.328 196 HB3 LYS 28 3HB LYS 28 -0.786 4.350 -20.838 197 HG2 LYS 28 2HG LYS 28 -2.230 2.575 -22.748 198 HG3 LYS 28 3HG LYS 28 -2.827 4.209 -22.449 199 HD2 LYS 28 2HD LYS 28 -0.242 4.768 -22.830 200 HD3 LYS 28 3HD LYS 28 -0.353 3.301 -23.805 201 HE2 LYS 28 2HE LYS 28 -0.868 4.951 -25.340 202 HE3 LYS 28 3HE LYS 28 -2.464 4.430 -24.803 203 HZ1 LYS 28 3HZ LYS 28 -2.795 6.599 -24.452 204 HZ2 LYS 28 1HZ LYS 28 -1.144 6.970 -24.456 205 HZ3 LYS 28 2HZ LYS 28 -1.876 6.384 -23.049 206 H PHE 29 H PHE 29 -0.406 0.424 -18.928 207 HA PHE 29 HA PHE 29 1.029 2.198 -17.062 208 HB2 PHE 29 2HB PHE 29 -1.212 1.620 -16.238 209 HB3 PHE 29 3HB PHE 29 -0.834 -0.092 -16.399 210 HD1 PHE 29 HD1 PHE 29 1.509 2.462 -15.149 211 HD2 PHE 29 HD2 PHE 29 -1.141 -0.712 -14.135 212 HE1 PHE 29 HE1 PHE 29 2.406 2.450 -12.858 213 HE2 PHE 29 HE2 PHE 29 -0.249 -0.728 -11.842 214 HZ PHE 29 HZ PHE 29 1.526 0.854 -11.200 215 H PHE 30 H PHE 30 1.032 -0.754 -18.797 216 HA PHE 30 HA PHE 30 3.049 -2.033 -17.172 217 HB2 PHE 30 2HB PHE 30 2.874 -3.871 -18.643 218 HB3 PHE 30 3HB PHE 30 1.239 -3.228 -18.529 219 HD1 PHE 30 HD2 PHE 30 0.276 -1.956 -20.399 220 HD2 PHE 30 HD1 PHE 30 4.085 -3.832 -20.689 221 HE1 PHE 30 HE2 PHE 30 0.185 -1.753 -22.849 222 HE2 PHE 30 HE1 PHE 30 4.001 -3.631 -23.140 223 HZ PHE 30 HZ PHE 30 2.049 -2.591 -24.223 224 H GLN 31 H GLN 31 3.052 0.382 -19.475 225 HA GLN 31 HA GLN 31 5.634 -0.305 -20.626 226 HB2 GLN 31 2HB GLN 31 4.261 2.312 -21.094 227 HB3 GLN 31 3HB GLN 31 5.271 1.374 -22.186 228 HG2 GLN 31 2HG GLN 31 3.502 -0.237 -22.502 229 HG3 GLN 31 3HG GLN 31 2.493 0.603 -21.325 230 HE21 GLN 31 1HE2 GLN 31 4.529 1.917 -23.893 231 HE22 GLN 31 2HE2 GLN 31 3.250 2.697 -24.753 232 H ILE 32 H ILE 32 4.215 2.045 -18.415 233 HA ILE 32 HA ILE 32 6.778 3.351 -17.999 234 HB ILE 32 HB ILE 32 4.140 3.852 -16.616 235 HG12 ILE 32 2HG1 ILE 32 4.659 6.004 -18.260 236 HG13 ILE 32 3HG1 ILE 32 5.182 4.637 -19.238 237 HG21 ILE 32 1HG2 ILE 32 5.809 4.730 -15.233 238 HG22 ILE 32 2HG2 ILE 32 6.780 5.275 -16.600 239 HG23 ILE 32 3HG2 ILE 32 5.278 6.107 -16.199 240 HD11 ILE 32 3HD1 ILE 32 2.651 4.073 -18.014 241 HD12 ILE 32 1HD1 ILE 32 2.587 5.597 -18.899 242 HD13 ILE 32 2HD1 ILE 32 3.089 4.119 -19.722 243 H SER 33 H SER 33 4.776 0.949 -16.507 244 HA SER 33 HA SER 33 6.309 1.037 -14.022 245 HB2 SER 33 2HB SER 33 3.742 0.728 -14.170 246 HB3 SER 33 3HB SER 33 4.115 -0.932 -14.631 247 HG SER 33 HG SER 33 3.803 -0.387 -12.289 248 H GLY 34 H GLY 34 5.173 -1.642 -16.089 249 HA2 GLY 34 2HA GLY 34 6.983 -2.944 -17.237 250 HA3 GLY 34 3HA GLY 34 7.816 -2.904 -15.690 251 H MET 35 H MET 35 4.355 -3.356 -16.009 252 HA MET 35 HA MET 35 4.336 -5.654 -14.385 253 HB2 MET 35 2HB MET 35 2.181 -4.858 -16.342 254 HB3 MET 35 3HB MET 35 1.994 -5.800 -14.869 255 HG2 MET 35 2HG MET 35 2.588 -3.838 -13.539 256 HG3 MET 35 3HG MET 35 2.768 -2.896 -15.017 257 HE1 MET 35 3HE MET 35 -1.250 -4.703 -13.644 258 HE2 MET 35 1HE MET 35 0.131 -5.652 -14.194 259 HE3 MET 35 2HE MET 35 0.212 -4.787 -12.660 260 H SER 36 H SER 36 3.922 -5.293 -17.902 261 HA SER 36 HA SER 36 3.546 -7.956 -18.561 262 HB2 SER 36 2HB SER 36 4.225 -7.372 -20.802 263 HB3 SER 36 3HB SER 36 3.339 -6.006 -20.124 264 HG SER 36 HG SER 36 5.476 -5.650 -21.252 265 H LYS 37 H LYS 37 6.500 -6.231 -17.814 266 HA LYS 37 HA LYS 37 8.341 -8.147 -18.749 267 HB2 LYS 37 2HB LYS 37 8.804 -6.359 -16.369 268 HB3 LYS 37 3HB LYS 37 9.988 -6.965 -17.520 269 HG2 LYS 37 2HG LYS 37 7.876 -4.877 -17.996 270 HG3 LYS 37 3HG LYS 37 9.628 -4.657 -17.974 271 HD2 LYS 37 2HD LYS 37 8.066 -6.288 -19.977 272 HD3 LYS 37 3HD LYS 37 8.777 -4.697 -20.262 273 HE2 LYS 37 2HE LYS 37 10.294 -7.210 -19.562 274 HE3 LYS 37 3HE LYS 37 10.171 -6.498 -21.170 275 HZ1 LYS 37 3HZ LYS 37 11.195 -4.455 -20.180 276 HZ2 LYS 37 1HZ LYS 37 12.218 -5.801 -20.261 277 HZ3 LYS 37 2HZ LYS 37 11.516 -5.361 -18.787 278 H LYS 38 H LYS 38 6.190 -8.207 -16.123 279 HA LYS 38 HA LYS 38 7.757 -10.164 -14.625 280 HB2 LYS 38 2HB LYS 38 4.997 -9.157 -13.949 281 HB3 LYS 38 3HB LYS 38 6.163 -9.916 -12.874 282 HG2 LYS 38 2HG LYS 38 6.598 -7.248 -14.194 283 HG3 LYS 38 3HG LYS 38 5.907 -7.452 -12.582 284 HD2 LYS 38 2HD LYS 38 7.939 -7.645 -11.702 285 HD3 LYS 38 3HD LYS 38 8.308 -8.994 -12.780 286 HE2 LYS 38 2HE LYS 38 8.686 -7.101 -14.540 287 HE3 LYS 38 3HE LYS 38 8.876 -6.080 -13.115 288 HZ1 LYS 38 3HZ LYS 38 10.377 -8.437 -12.779 289 HZ2 LYS 38 1HZ LYS 38 10.924 -6.838 -12.861 290 HZ3 LYS 38 2HZ LYS 38 10.770 -7.752 -14.275 291 H SER 39 H SER 39 6.766 -12.198 -13.963 292 HA SER 39 HA SER 39 5.595 -13.551 -16.191 293 HB2 SER 39 2HB SER 39 7.225 -14.496 -14.421 294 HB3 SER 39 3HB SER 39 5.792 -14.700 -13.414 295 HG SER 39 HG SER 39 6.562 -16.052 -15.716 296 H SER 40 H SER 40 3.743 -15.223 -15.485 297 HA SER 40 HA SER 40 1.435 -13.574 -15.024 298 HB2 SER 40 2HB SER 40 0.939 -16.448 -15.007 299 HB3 SER 40 3HB SER 40 0.328 -15.209 -16.103 300 HG SER 40 HG SER 40 2.468 -15.319 -17.109 301 H SER 41 H SER 41 3.519 -15.418 -13.073 302 HA SER 41 HA SER 41 1.544 -15.897 -10.992 303 HB2 SER 41 2HB SER 41 3.484 -16.915 -9.772 304 HB3 SER 41 3HB SER 41 3.160 -17.655 -11.340 305 HG SER 41 HG SER 41 5.412 -17.165 -10.908 306 H GLN 42 H GLN 42 3.614 -13.421 -11.938 307 HA GLN 42 HA GLN 42 3.981 -12.379 -9.235 308 HB2 GLN 42 2HB GLN 42 5.210 -11.881 -11.878 309 HB3 GLN 42 3HB GLN 42 5.055 -10.477 -10.830 310 HG2 GLN 42 2HG GLN 42 6.211 -11.788 -9.044 311 HG3 GLN 42 3HG GLN 42 6.516 -13.038 -10.249 312 HE21 GLN 42 1HE2 GLN 42 6.897 -9.542 -9.786 313 HE22 GLN 42 2HE2 GLN 42 8.442 -9.436 -10.550 314 H LEU 43 H LEU 43 2.256 -11.690 -12.217 315 HA LEU 43 HA LEU 43 1.261 -9.148 -11.378 316 HB2 LEU 43 2HB LEU 43 0.071 -10.955 -13.469 317 HB3 LEU 43 3HB LEU 43 -0.092 -9.205 -13.337 318 HG LEU 43 HG LEU 43 2.641 -10.301 -13.719 319 HD11 LEU 43 1HD1 LEU 43 0.469 -10.377 -15.786 320 HD12 LEU 43 2HD1 LEU 43 1.630 -11.630 -15.352 321 HD13 LEU 43 3HD1 LEU 43 2.166 -10.198 -16.230 322 HD21 LEU 43 3HD2 LEU 43 1.113 -7.824 -14.292 323 HD22 LEU 43 1HD2 LEU 43 2.433 -8.243 -15.385 324 HD23 LEU 43 2HD2 LEU 43 2.748 -8.030 -13.662 325 H LYS 44 H LYS 44 0.372 -12.398 -10.760 326 HA LYS 44 HA LYS 44 -2.393 -11.987 -10.226 327 HB2 LYS 44 2HB LYS 44 -2.322 -14.189 -9.182 328 HB3 LYS 44 3HB LYS 44 -1.460 -14.208 -10.715 329 HG2 LYS 44 2HG LYS 44 0.466 -14.775 -9.749 330 HG3 LYS 44 3HG LYS 44 0.262 -13.601 -8.447 331 HD2 LYS 44 2HD LYS 44 0.262 -15.723 -7.409 332 HD3 LYS 44 3HD LYS 44 -1.426 -15.208 -7.449 333 HE2 LYS 44 2HE LYS 44 -1.657 -17.349 -8.209 334 HE3 LYS 44 3HE LYS 44 -1.404 -16.517 -9.742 335 HZ1 LYS 44 3HZ LYS 44 1.074 -17.253 -8.577 336 HZ2 LYS 44 1HZ LYS 44 0.438 -17.674 -10.087 337 HZ3 LYS 44 2HZ LYS 44 0.073 -18.609 -8.725 338 H GLU 45 H GLU 45 0.503 -11.391 -8.459 339 HA GLU 45 HA GLU 45 -0.477 -11.509 -5.829 340 HB2 GLU 45 2HB GLU 45 1.662 -9.651 -6.879 341 HB3 GLU 45 3HB GLU 45 1.446 -10.177 -5.215 342 HG2 GLU 45 2HG GLU 45 1.805 -12.544 -6.110 343 HG3 GLU 45 3HG GLU 45 2.411 -11.758 -7.568 344 H ILE 46 H ILE 46 -0.289 -8.806 -8.123 345 HA ILE 46 HA ILE 46 -1.257 -6.785 -6.480 346 HB ILE 46 HB ILE 46 -1.752 -7.102 -9.443 347 HG12 ILE 46 2HG1 ILE 46 0.261 -5.222 -9.017 348 HG13 ILE 46 3HG1 ILE 46 0.640 -6.522 -7.893 349 HG21 ILE 46 1HG2 ILE 46 -2.841 -5.171 -9.367 350 HG22 ILE 46 2HG2 ILE 46 -2.705 -5.181 -7.609 351 HG23 ILE 46 3HG2 ILE 46 -1.463 -4.397 -8.585 352 HD11 ILE 46 3HD1 ILE 46 -0.056 -7.391 -10.606 353 HD12 ILE 46 1HD1 ILE 46 1.427 -6.447 -10.471 354 HD13 ILE 46 2HD1 ILE 46 1.236 -7.927 -9.531 355 H PHE 47 H PHE 47 -2.996 -9.222 -8.336 356 HA PHE 47 HA PHE 47 -5.575 -8.220 -8.179 357 HB2 PHE 47 2HB PHE 47 -5.625 -10.081 -9.475 358 HB3 PHE 47 3HB PHE 47 -4.359 -10.881 -8.549 359 HD1 PHE 47 HD1 PHE 47 -4.916 -12.153 -6.527 360 HD2 PHE 47 HD2 PHE 47 -7.932 -10.427 -8.985 361 HE1 PHE 47 HE1 PHE 47 -6.604 -13.588 -5.457 362 HE2 PHE 47 HE2 PHE 47 -9.625 -11.858 -7.919 363 HZ PHE 47 HZ PHE 47 -8.963 -13.440 -6.152 364 H ARG 48 H ARG 48 -3.733 -10.062 -5.799 365 HA ARG 48 HA ARG 48 -5.846 -10.471 -3.971 366 HB2 ARG 48 2HB ARG 48 -3.082 -11.083 -4.123 367 HB3 ARG 48 3HB ARG 48 -3.341 -10.243 -2.600 368 HG2 ARG 48 2HG ARG 48 -4.765 -12.721 -3.545 369 HG3 ARG 48 3HG ARG 48 -3.543 -12.621 -2.275 370 HD2 ARG 48 2HD ARG 48 -5.456 -10.755 -1.533 371 HD3 ARG 48 3HD ARG 48 -6.395 -12.111 -2.157 372 HE ARG 48 HE ARG 48 -4.831 -12.046 0.257 373 HH11 ARG 48 1HH1 ARG 48 -6.243 -14.073 -2.196 374 HH12 ARG 48 2HH1 ARG 48 -6.302 -15.479 -1.186 375 HH21 ARG 48 1HH2 ARG 48 -4.902 -13.890 1.597 376 HH22 ARG 48 2HH2 ARG 48 -5.539 -15.373 0.972 377 H ILE 49 H ILE 49 -4.197 -7.668 -4.864 378 HA ILE 49 HA ILE 49 -4.708 -6.331 -2.308 379 HB ILE 49 HB ILE 49 -3.342 -5.162 -4.729 380 HG12 ILE 49 2HG1 ILE 49 -2.109 -7.144 -4.011 381 HG13 ILE 49 3HG1 ILE 49 -1.215 -5.687 -3.590 382 HG21 ILE 49 1HG2 ILE 49 -2.295 -3.891 -2.613 383 HG22 ILE 49 2HG2 ILE 49 -3.735 -3.332 -3.462 384 HG23 ILE 49 3HG2 ILE 49 -3.895 -4.262 -1.972 385 HD11 ILE 49 3HD1 ILE 49 -2.093 -7.813 -1.909 386 HD12 ILE 49 1HD1 ILE 49 -1.082 -6.424 -1.514 387 HD13 ILE 49 2HD1 ILE 49 -2.836 -6.305 -1.379 388 H LEU 50 H LEU 50 -6.118 -6.792 -5.340 389 HA LEU 50 HA LEU 50 -7.562 -4.256 -5.310 390 HB2 LEU 50 2HB LEU 50 -7.098 -6.416 -7.278 391 HB3 LEU 50 3HB LEU 50 -8.640 -5.569 -7.383 392 HG LEU 50 HG LEU 50 -6.892 -3.485 -7.259 393 HD11 LEU 50 1HD1 LEU 50 -5.553 -5.510 -9.031 394 HD12 LEU 50 2HD1 LEU 50 -5.024 -5.186 -7.381 395 HD13 LEU 50 3HD1 LEU 50 -4.989 -3.900 -8.586 396 HD21 LEU 50 3HD2 LEU 50 -7.100 -3.743 -9.902 397 HD22 LEU 50 1HD2 LEU 50 -8.461 -3.269 -8.886 398 HD23 LEU 50 2HD2 LEU 50 -8.301 -4.942 -9.421 399 H ASP 51 H ASP 51 -7.992 -7.600 -4.521 400 HA ASP 51 HA ASP 51 -10.830 -7.656 -4.571 401 HB2 ASP 51 2HB ASP 51 -9.211 -9.645 -4.544 402 HB3 ASP 51 3HB ASP 51 -9.101 -9.383 -2.806 403 H ASN 52 H ASN 52 -12.153 -6.566 -3.289 404 HA ASN 52 HA ASN 52 -11.215 -5.789 -0.613 405 HB2 ASN 52 2HB ASN 52 -12.705 -4.406 -2.685 406 HB3 ASN 52 3HB ASN 52 -13.569 -4.384 -1.150 407 HD21 ASN 52 1HD2 ASN 52 -10.249 -3.994 -2.347 408 HD22 ASN 52 2HD2 ASN 52 -9.877 -2.621 -1.365 409 H ASP 53 H ASP 53 -12.737 -8.273 -1.809 410 HA ASP 53 HA ASP 53 -14.569 -8.487 0.470 411 HB2 ASP 53 2HB ASP 53 -15.446 -9.712 -2.099 412 HB3 ASP 53 3HB ASP 53 -16.410 -9.069 -0.771 413 H GLN 54 H GLN 54 -11.987 -9.691 -1.141 414 HA GLN 54 HA GLN 54 -10.880 -11.681 -1.194 415 HB2 GLN 54 2HB GLN 54 -12.450 -12.462 1.248 416 HB3 GLN 54 3HB GLN 54 -10.790 -12.870 0.835 417 HG2 GLN 54 2HG GLN 54 -11.693 -10.070 1.441 418 HG3 GLN 54 3HG GLN 54 -11.085 -11.181 2.667 419 HE21 GLN 54 1HE2 GLN 54 -10.274 -8.842 0.425 420 HE22 GLN 54 2HE2 GLN 54 -8.564 -9.083 0.399 421 H SER 55 H SER 55 -13.667 -11.472 -2.373 422 HA SER 55 HA SER 55 -14.873 -14.039 -2.119 423 HB2 SER 55 2HB SER 55 -15.938 -13.194 -4.408 424 HB3 SER 55 3HB SER 55 -16.428 -12.514 -2.857 425 HG SER 55 HG SER 55 -15.296 -11.278 -4.936 426 H GLY 56 H GLY 56 -12.368 -12.711 -4.130 427 HA2 GLY 56 2HA GLY 56 -10.823 -14.487 -4.981 428 HA3 GLY 56 3HA GLY 56 -12.265 -15.262 -5.621 429 H PHE 57 H PHE 57 -13.201 -12.355 -6.189 430 HA PHE 57 HA PHE 57 -11.546 -11.886 -8.572 431 HB2 PHE 57 2HB PHE 57 -14.566 -11.768 -8.579 432 HB3 PHE 57 3HB PHE 57 -13.490 -11.584 -9.961 433 HD1 PHE 57 HD1 PHE 57 -14.931 -13.962 -7.567 434 HD2 PHE 57 HD2 PHE 57 -12.536 -13.485 -11.053 435 HE1 PHE 57 HE1 PHE 57 -15.084 -16.380 -7.999 436 HE2 PHE 57 HE2 PHE 57 -12.687 -15.901 -11.491 437 HZ PHE 57 HZ PHE 57 -13.962 -17.352 -9.964 438 H ILE 58 H ILE 58 -12.113 -9.713 -9.591 439 HA ILE 58 HA ILE 58 -12.606 -7.751 -7.447 440 HB ILE 58 HB ILE 58 -10.843 -7.409 -9.875 441 HG12 ILE 58 2HG1 ILE 58 -9.769 -7.310 -7.105 442 HG13 ILE 58 3HG1 ILE 58 -10.197 -8.896 -7.738 443 HG21 ILE 58 1HG2 ILE 58 -11.875 -5.323 -9.205 444 HG22 ILE 58 2HG2 ILE 58 -11.374 -5.584 -7.535 445 HG23 ILE 58 3HG2 ILE 58 -10.162 -5.308 -8.786 446 HD11 ILE 58 3HD1 ILE 58 -7.829 -8.313 -8.069 447 HD12 ILE 58 1HD1 ILE 58 -8.683 -8.618 -9.582 448 HD13 ILE 58 2HD1 ILE 58 -8.330 -6.962 -9.086 449 H GLU 59 H GLU 59 -14.860 -7.758 -7.961 450 HA GLU 59 HA GLU 59 -15.969 -7.293 -10.470 451 HB2 GLU 59 2HB GLU 59 -17.084 -6.233 -7.873 452 HB3 GLU 59 3HB GLU 59 -17.977 -6.649 -9.329 453 HG2 GLU 59 2HG GLU 59 -18.388 -8.571 -8.280 454 HG3 GLU 59 3HG GLU 59 -16.750 -9.004 -8.767 455 H GLU 60 H GLU 60 -17.306 -5.195 -10.907 456 HA GLU 60 HA GLU 60 -15.472 -3.140 -11.469 457 HB2 GLU 60 2HB GLU 60 -18.460 -3.361 -11.597 458 HB3 GLU 60 3HB GLU 60 -17.680 -1.811 -11.880 459 HG2 GLU 60 2HG GLU 60 -16.712 -2.496 -13.840 460 HG3 GLU 60 3HG GLU 60 -16.725 -4.197 -13.379 461 H ASP 61 H ASP 61 -17.630 -3.689 -8.783 462 HA ASP 61 HA ASP 61 -17.687 -1.103 -7.700 463 HB2 ASP 61 2HB ASP 61 -19.080 -3.147 -7.032 464 HB3 ASP 61 3HB ASP 61 -17.702 -3.622 -6.044 465 H GLU 62 H GLU 62 -15.159 -3.397 -7.887 466 HA GLU 62 HA GLU 62 -13.599 -1.902 -5.884 467 HB2 GLU 62 2HB GLU 62 -12.126 -4.131 -6.251 468 HB3 GLU 62 3HB GLU 62 -13.376 -3.984 -5.025 469 HG2 GLU 62 2HG GLU 62 -14.955 -4.895 -6.846 470 HG3 GLU 62 3HG GLU 62 -13.473 -5.407 -7.651 471 H LEU 63 H LEU 63 -13.732 -3.055 -9.167 472 HA LEU 63 HA LEU 63 -11.079 -2.668 -9.946 473 HB2 LEU 63 2HB LEU 63 -13.319 -3.532 -11.177 474 HB3 LEU 63 3HB LEU 63 -13.160 -1.933 -11.901 475 HG LEU 63 HG LEU 63 -11.181 -4.203 -12.029 476 HD11 LEU 63 1HD1 LEU 63 -13.199 -3.050 -13.852 477 HD12 LEU 63 2HD1 LEU 63 -12.593 -4.701 -13.722 478 HD13 LEU 63 3HD1 LEU 63 -11.642 -3.477 -14.562 479 HD21 LEU 63 3HD2 LEU 63 -9.996 -2.087 -11.746 480 HD22 LEU 63 1HD2 LEU 63 -10.916 -1.386 -13.077 481 HD23 LEU 63 2HD2 LEU 63 -9.796 -2.713 -13.383 482 H LYS 64 H LYS 64 -13.793 -0.402 -9.831 483 HA LYS 64 HA LYS 64 -12.688 1.783 -11.098 484 HB2 LYS 64 2HB LYS 64 -14.133 3.155 -9.530 485 HB3 LYS 64 3HB LYS 64 -14.963 1.903 -10.445 486 HG2 LYS 64 2HG LYS 64 -15.351 0.612 -8.595 487 HG3 LYS 64 3HG LYS 64 -13.961 1.256 -7.719 488 HD2 LYS 64 2HD LYS 64 -16.102 2.017 -6.768 489 HD3 LYS 64 3HD LYS 64 -15.120 3.357 -7.364 490 HE2 LYS 64 2HE LYS 64 -16.537 3.801 -9.104 491 HE3 LYS 64 3HE LYS 64 -17.092 2.131 -9.220 492 HZ1 LYS 64 3HZ LYS 64 -18.817 3.613 -8.378 493 HZ2 LYS 64 1HZ LYS 64 -17.836 4.037 -7.066 494 HZ3 LYS 64 2HZ LYS 64 -18.397 2.449 -7.225 495 H TYR 65 H TYR 65 -11.976 0.486 -7.945 496 HA TYR 65 HA TYR 65 -10.344 2.806 -7.248 497 HB2 TYR 65 2HB TYR 65 -10.994 0.307 -5.671 498 HB3 TYR 65 3HB TYR 65 -10.067 1.676 -5.067 499 HD1 TYR 65 HD1 TYR 65 -11.263 3.979 -5.096 500 HD2 TYR 65 HD2 TYR 65 -13.299 0.254 -5.377 501 HE1 TYR 65 HE1 TYR 65 -13.343 5.067 -4.358 502 HE2 TYR 65 HE2 TYR 65 -15.385 1.331 -4.641 503 HH TYR 65 HH TYR 65 -16.321 3.781 -4.728 504 H PHE 66 H PHE 66 -9.396 1.462 -9.458 505 HA PHE 66 HA PHE 66 -7.369 -0.432 -8.697 506 HB2 PHE 66 2HB PHE 66 -8.253 -0.758 -10.863 507 HB3 PHE 66 3HB PHE 66 -8.079 0.944 -11.280 508 HD1 PHE 66 HD1 PHE 66 -6.119 -2.110 -10.499 509 HD2 PHE 66 HD2 PHE 66 -6.190 1.695 -12.406 510 HE1 PHE 66 HE1 PHE 66 -3.940 -2.593 -11.535 511 HE2 PHE 66 HE2 PHE 66 -4.012 1.217 -13.446 512 HZ PHE 66 HZ PHE 66 -2.885 -0.929 -13.012 513 H LEU 67 H LEU 67 -7.591 2.997 -9.083 514 HA LEU 67 HA LEU 67 -4.727 3.389 -9.243 515 HB2 LEU 67 2HB LEU 67 -6.549 5.636 -8.602 516 HB3 LEU 67 3HB LEU 67 -5.169 5.575 -9.696 517 HG LEU 67 HG LEU 67 -8.006 4.737 -10.209 518 HD11 LEU 67 1HD1 LEU 67 -6.445 6.268 -12.168 519 HD12 LEU 67 2HD1 LEU 67 -6.741 7.091 -10.637 520 HD13 LEU 67 3HD1 LEU 67 -8.097 6.500 -11.596 521 HD21 LEU 67 3HD2 LEU 67 -7.052 2.937 -11.226 522 HD22 LEU 67 1HD2 LEU 67 -5.506 3.750 -11.467 523 HD23 LEU 67 2HD2 LEU 67 -6.870 4.119 -12.523 524 H GLN 68 H GLN 68 -6.998 2.875 -6.802 525 HA GLN 68 HA GLN 68 -5.637 4.418 -4.768 526 HB2 GLN 68 2HB GLN 68 -8.163 3.002 -5.016 527 HB3 GLN 68 3HB GLN 68 -7.368 2.656 -3.487 528 HG2 GLN 68 2HG GLN 68 -8.169 4.556 -2.698 529 HG3 GLN 68 3HG GLN 68 -7.146 5.420 -3.845 530 HE21 GLN 68 1HE2 GLN 68 -8.291 4.917 -6.222 531 HE22 GLN 68 2HE2 GLN 68 -9.898 5.548 -6.274 532 H ARG 69 H ARG 69 -4.908 1.638 -6.312 533 HA ARG 69 HA ARG 69 -3.887 0.252 -3.941 534 HB2 ARG 69 2HB ARG 69 -3.518 -0.894 -6.656 535 HB3 ARG 69 3HB ARG 69 -3.920 -1.693 -5.142 536 HG2 ARG 69 2HG ARG 69 -5.796 -0.077 -6.855 537 HG3 ARG 69 3HG ARG 69 -5.766 -1.834 -6.698 538 HD2 ARG 69 2HD ARG 69 -6.578 0.226 -4.675 539 HD3 ARG 69 3HD ARG 69 -7.498 -1.151 -5.281 540 HE ARG 69 HE ARG 69 -5.415 -2.337 -4.060 541 HH11 ARG 69 1HH1 ARG 69 -7.641 0.139 -3.040 542 HH12 ARG 69 2HH1 ARG 69 -7.568 -0.303 -1.367 543 HH21 ARG 69 1HH2 ARG 69 -5.312 -2.928 -1.859 544 HH22 ARG 69 2HH2 ARG 69 -6.243 -2.047 -0.696 545 H PHE 70 H PHE 70 -2.864 1.959 -6.808 546 HA PHE 70 HA PHE 70 -0.051 1.424 -6.147 547 HB2 PHE 70 2HB PHE 70 -1.379 2.403 -8.674 548 HB3 PHE 70 3HB PHE 70 0.365 2.446 -8.439 549 HD1 PHE 70 HD1 PHE 70 -2.557 0.178 -8.573 550 HD2 PHE 70 HD2 PHE 70 1.677 0.544 -8.808 551 HE1 PHE 70 HE1 PHE 70 -2.402 -2.152 -9.350 552 HE2 PHE 70 HE2 PHE 70 1.839 -1.785 -9.585 553 HZ PHE 70 HZ PHE 70 -0.202 -3.136 -9.858 554 H GLU 71 H GLU 71 -2.477 3.818 -6.035 555 HA GLU 71 HA GLU 71 -0.457 5.911 -5.569 556 HB2 GLU 71 2HB GLU 71 -2.372 6.055 -7.418 557 HB3 GLU 71 3HB GLU 71 -3.309 6.623 -6.043 558 HG2 GLU 71 2HG GLU 71 -0.656 7.823 -6.753 559 HG3 GLU 71 3HG GLU 71 -2.160 8.368 -7.493 560 H SER 72 H SER 72 -3.116 4.146 -4.247 561 HA SER 72 HA SER 72 -4.209 4.218 -2.243 562 HB2 SER 72 2HB SER 72 -2.776 4.353 -0.309 563 HB3 SER 72 3HB SER 72 -1.879 3.545 -1.594 564 HG SER 72 HG SER 72 -0.729 5.245 -0.423 565 H GLY 73 H GLY 73 -5.237 6.210 -3.426 566 HA2 GLY 73 2HA GLY 73 -6.251 8.004 -1.766 567 HA3 GLY 73 3HA GLY 73 -4.671 8.721 -2.045 568 H ALA 74 H ALA 74 -4.962 7.408 -4.861 569 HA ALA 74 HA ALA 74 -5.777 9.776 -6.185 570 HB1 ALA 74 1HB ALA 74 -5.762 8.114 -8.215 571 HB2 ALA 74 2HB ALA 74 -4.257 8.595 -7.431 572 HB3 ALA 74 3HB ALA 74 -4.990 7.037 -7.051 573 H ARG 75 H ARG 75 -7.410 9.514 -8.110 574 HA ARG 75 HA ARG 75 -9.975 9.110 -6.918 575 HB2 ARG 75 2HB ARG 75 -10.883 9.963 -8.937 576 HB3 ARG 75 3HB ARG 75 -9.397 10.859 -8.653 577 HG2 ARG 75 2HG ARG 75 -8.241 9.359 -10.249 578 HG3 ARG 75 3HG ARG 75 -9.794 8.592 -10.592 579 HD2 ARG 75 2HD ARG 75 -8.871 11.369 -11.225 580 HD3 ARG 75 3HD ARG 75 -9.577 10.160 -12.297 581 HE ARG 75 HE ARG 75 -10.978 12.087 -10.731 582 HH11 ARG 75 1HH1 ARG 75 -11.176 8.873 -12.055 583 HH12 ARG 75 2HH1 ARG 75 -12.908 8.860 -12.106 584 HH21 ARG 75 1HH2 ARG 75 -13.258 12.082 -10.793 585 HH22 ARG 75 2HH2 ARG 75 -14.091 10.686 -11.389 586 H VAL 76 H VAL 76 -11.572 8.037 -8.820 587 HA VAL 76 HA VAL 76 -10.670 5.238 -8.896 588 HB VAL 76 HB VAL 76 -12.943 4.550 -8.855 589 HG11 VAL 76 1HG1 VAL 76 -13.710 5.405 -6.754 590 HG12 VAL 76 2HG1 VAL 76 -11.947 5.335 -6.706 591 HG13 VAL 76 3HG1 VAL 76 -12.764 6.880 -6.952 592 HG21 VAL 76 3HG2 VAL 76 -13.421 7.218 -9.900 593 HG22 VAL 76 1HG2 VAL 76 -14.400 5.757 -10.036 594 HG23 VAL 76 2HG2 VAL 76 -14.546 6.787 -8.611 595 H LEU 77 H LEU 77 -12.482 4.215 -10.697 596 HA LEU 77 HA LEU 77 -11.521 5.399 -13.207 597 HB2 LEU 77 2HB LEU 77 -12.682 2.655 -12.763 598 HB3 LEU 77 3HB LEU 77 -11.887 3.249 -14.220 599 HG LEU 77 HG LEU 77 -10.566 2.740 -11.554 600 HD11 LEU 77 1HD1 LEU 77 -10.504 1.255 -14.173 601 HD12 LEU 77 2HD1 LEU 77 -11.091 0.668 -12.618 602 HD13 LEU 77 3HD1 LEU 77 -9.371 0.977 -12.850 603 HD21 LEU 77 3HD2 LEU 77 -9.593 3.939 -14.118 604 HD22 LEU 77 1HD2 LEU 77 -8.491 3.053 -13.065 605 HD23 LEU 77 2HD2 LEU 77 -9.331 4.481 -12.460 606 H THR 78 H THR 78 -12.895 6.156 -14.715 607 HA THR 78 HA THR 78 -15.638 6.567 -13.989 608 HB THR 78 HB THR 78 -14.370 8.289 -15.212 609 HG1 THR 78 HG1 THR 78 -16.052 8.767 -16.662 610 HG21 THR 78 3HG2 THR 78 -14.593 7.215 -17.860 611 HG22 THR 78 1HG2 THR 78 -13.634 6.123 -16.861 612 HG23 THR 78 2HG2 THR 78 -13.162 7.815 -17.022 613 H ALA 79 H ALA 79 -17.230 6.313 -16.025 614 HA ALA 79 HA ALA 79 -17.687 3.531 -16.270 615 HB1 ALA 79 1HB ALA 79 -19.639 4.742 -16.351 616 HB2 ALA 79 2HB ALA 79 -18.956 5.980 -17.405 617 HB3 ALA 79 3HB ALA 79 -19.381 4.399 -18.062 618 H SER 80 H SER 80 -15.616 5.591 -17.942 619 HA SER 80 HA SER 80 -15.619 3.891 -20.339 620 HB2 SER 80 2HB SER 80 -15.840 6.322 -20.723 621 HB3 SER 80 3HB SER 80 -14.302 6.584 -19.901 622 HG SER 80 HG SER 80 -14.414 4.794 -22.057 623 H GLU 81 H GLU 81 -14.035 4.275 -17.434 624 HA GLU 81 HA GLU 81 -11.442 3.390 -18.467 625 HB2 GLU 81 2HB GLU 81 -12.340 4.404 -15.776 626 HB3 GLU 81 3HB GLU 81 -10.764 3.663 -16.019 627 HG2 GLU 81 2HG GLU 81 -11.661 5.973 -17.696 628 HG3 GLU 81 3HG GLU 81 -10.948 6.218 -16.103 629 H THR 82 H THR 82 -13.649 2.499 -15.808 630 HA THR 82 HA THR 82 -12.520 0.039 -15.198 631 HB THR 82 HB THR 82 -15.259 -0.331 -14.795 632 HG1 THR 82 HG1 THR 82 -15.681 1.810 -13.754 633 HG21 THR 82 3HG2 THR 82 -12.946 -0.257 -13.305 634 HG22 THR 82 1HG2 THR 82 -14.564 -0.563 -12.675 635 HG23 THR 82 2HG2 THR 82 -13.893 1.067 -12.627 636 H LYS 83 H LYS 83 -15.194 0.751 -17.434 637 HA LYS 83 HA LYS 83 -15.794 -1.824 -18.243 638 HB2 LYS 83 2HB LYS 83 -15.953 0.836 -19.622 639 HB3 LYS 83 3HB LYS 83 -16.370 -0.635 -20.492 640 HG2 LYS 83 2HG LYS 83 -17.648 -0.435 -17.879 641 HG3 LYS 83 3HG LYS 83 -18.082 0.872 -18.983 642 HD2 LYS 83 2HD LYS 83 -18.982 -0.596 -20.557 643 HD3 LYS 83 3HD LYS 83 -18.126 -1.987 -19.887 644 HE2 LYS 83 2HE LYS 83 -20.248 -0.498 -18.363 645 HE3 LYS 83 3HE LYS 83 -20.621 -1.849 -19.432 646 HZ1 LYS 83 3HZ LYS 83 -20.318 -2.417 -17.024 647 HZ2 LYS 83 1HZ LYS 83 -18.676 -2.051 -17.205 648 HZ3 LYS 83 2HZ LYS 83 -19.365 -3.312 -18.098 649 H THR 84 H THR 84 -13.373 0.398 -19.588 650 HA THR 84 HA THR 84 -12.478 -1.169 -21.699 651 HB THR 84 HB THR 84 -10.767 0.647 -19.990 652 HG1 THR 84 HG1 THR 84 -11.736 2.266 -20.962 653 HG21 THR 84 3HG2 THR 84 -9.654 -0.925 -21.665 654 HG22 THR 84 1HG2 THR 84 -9.292 0.794 -21.823 655 HG23 THR 84 2HG2 THR 84 -10.446 0.031 -22.918 656 H PHE 85 H PHE 85 -11.153 -0.994 -18.393 657 HA PHE 85 HA PHE 85 -9.159 -2.899 -18.659 658 HB2 PHE 85 2HB PHE 85 -9.676 -1.354 -16.672 659 HB3 PHE 85 3HB PHE 85 -10.793 -2.609 -16.145 660 HD1 PHE 85 HD2 PHE 85 -9.926 -4.861 -15.565 661 HD2 PHE 85 HD1 PHE 85 -7.344 -1.576 -16.377 662 HE1 PHE 85 HE2 PHE 85 -8.071 -6.055 -14.475 663 HE2 PHE 85 HE1 PHE 85 -5.484 -2.765 -15.289 664 HZ PHE 85 HZ PHE 85 -5.847 -5.007 -14.336 665 H LEU 86 H LEU 86 -12.536 -3.367 -17.652 666 HA LEU 86 HA LEU 86 -12.353 -6.159 -17.291 667 HB2 LEU 86 2HB LEU 86 -14.151 -4.912 -16.304 668 HB3 LEU 86 3HB LEU 86 -14.707 -4.378 -17.888 669 HG LEU 86 HG LEU 86 -15.107 -6.890 -18.342 670 HD11 LEU 86 1HD1 LEU 86 -15.289 -6.983 -15.346 671 HD12 LEU 86 2HD1 LEU 86 -13.859 -7.527 -16.223 672 HD13 LEU 86 3HD1 LEU 86 -15.414 -8.312 -16.499 673 HD21 LEU 86 3HD2 LEU 86 -17.290 -6.485 -17.966 674 HD22 LEU 86 1HD2 LEU 86 -16.720 -4.858 -17.592 675 HD23 LEU 86 2HD2 LEU 86 -17.022 -6.007 -16.289 676 H ALA 87 H ALA 87 -13.046 -4.154 -20.086 677 HA ALA 87 HA ALA 87 -13.724 -6.437 -21.741 678 HB1 ALA 87 1HB ALA 87 -14.971 -4.519 -22.258 679 HB2 ALA 87 2HB ALA 87 -13.542 -3.484 -22.258 680 HB3 ALA 87 3HB ALA 87 -13.785 -4.651 -23.557 681 H ALA 88 H ALA 88 -10.909 -5.369 -20.553 682 HA ALA 88 HA ALA 88 -9.408 -6.042 -23.000 683 HB1 ALA 88 1HB ALA 88 -8.931 -3.781 -22.450 684 HB2 ALA 88 2HB ALA 88 -8.679 -4.179 -20.750 685 HB3 ALA 88 3HB ALA 88 -7.529 -4.736 -21.966 686 H ALA 89 H ALA 89 -10.152 -6.941 -19.814 687 HA ALA 89 HA ALA 89 -7.900 -8.844 -19.785 688 HB1 ALA 89 1HB ALA 89 -8.859 -7.018 -17.740 689 HB2 ALA 89 2HB ALA 89 -8.770 -8.686 -17.171 690 HB3 ALA 89 3HB ALA 89 -7.338 -7.905 -17.843 691 H ASP 90 H ASP 90 -11.184 -8.380 -18.461 692 HA ASP 90 HA ASP 90 -11.663 -11.107 -17.961 693 HB2 ASP 90 2HB ASP 90 -13.203 -8.620 -17.926 694 HB3 ASP 90 3HB ASP 90 -14.167 -10.019 -18.391 695 H HIS 91 H HIS 91 -13.369 -9.164 -20.410 696 HA HIS 91 HA HIS 91 -14.123 -9.662 -22.497 697 HB2 HIS 91 2HB HIS 91 -11.575 -10.189 -22.685 698 HB3 HIS 91 3HB HIS 91 -12.101 -11.870 -22.712 699 HD1 HIS 91 HD1 HIS 91 -10.715 -10.865 -25.168 700 HD2 HIS 91 HD2 HIS 91 -14.822 -10.537 -24.632 701 HE1 HIS 91 HE1 HIS 91 -11.679 -10.644 -27.480 702 H ASP 92 H ASP 92 -14.681 -11.443 -19.965 703 HA ASP 92 HA ASP 92 -15.919 -13.694 -21.394 704 HB2 ASP 92 2HB ASP 92 -16.194 -14.586 -18.985 705 HB3 ASP 92 3HB ASP 92 -14.582 -14.593 -19.695 706 H GLY 93 H GLY 93 -16.607 -10.741 -19.890 707 HA2 GLY 93 2HA GLY 93 -18.638 -9.649 -19.702 708 HA3 GLY 93 3HA GLY 93 -19.431 -11.100 -20.298 709 H ASP 94 H ASP 94 -17.293 -11.440 -17.621 710 HA ASP 94 HA ASP 94 -19.493 -12.260 -15.937 711 HB2 ASP 94 2HB ASP 94 -16.591 -12.077 -15.134 712 HB3 ASP 94 3HB ASP 94 -17.845 -13.104 -14.445 713 H GLY 95 H GLY 95 -17.127 -9.640 -16.043 714 HA2 GLY 95 2HA GLY 95 -17.478 -7.470 -15.221 715 HA3 GLY 95 3HA GLY 95 -18.849 -8.066 -14.297 716 H LYS 96 H LYS 96 -15.970 -9.904 -14.062 717 HA LYS 96 HA LYS 96 -14.984 -8.471 -11.736 718 HB2 LYS 96 2HB LYS 96 -15.118 -10.469 -10.281 719 HB3 LYS 96 3HB LYS 96 -16.702 -9.855 -10.737 720 HG2 LYS 96 2HG LYS 96 -15.785 -11.846 -12.611 721 HG3 LYS 96 3HG LYS 96 -15.782 -12.468 -10.959 722 HD2 LYS 96 2HD LYS 96 -18.169 -10.918 -11.601 723 HD3 LYS 96 3HD LYS 96 -17.965 -12.338 -12.629 724 HE2 LYS 96 2HE LYS 96 -17.417 -12.911 -9.837 725 HE3 LYS 96 3HE LYS 96 -19.046 -12.283 -10.079 726 HZ1 LYS 96 3HZ LYS 96 -19.618 -14.049 -11.425 727 HZ2 LYS 96 1HZ LYS 96 -18.627 -14.802 -10.279 728 HZ3 LYS 96 2HZ LYS 96 -18.016 -14.431 -11.812 729 H ILE 97 H ILE 97 -12.849 -8.444 -11.893 730 HA ILE 97 HA ILE 97 -11.445 -10.145 -13.707 731 HB ILE 97 HB ILE 97 -10.362 -8.232 -11.636 732 HG12 ILE 97 2HG1 ILE 97 -11.870 -7.382 -13.568 733 HG13 ILE 97 3HG1 ILE 97 -10.331 -6.575 -13.285 734 HG21 ILE 97 1HG2 ILE 97 -9.073 -9.933 -13.705 735 HG22 ILE 97 2HG2 ILE 97 -8.410 -8.326 -13.410 736 HG23 ILE 97 3HG2 ILE 97 -8.512 -9.493 -12.092 737 HD11 ILE 97 3HD1 ILE 97 -11.166 -7.366 -15.696 738 HD12 ILE 97 1HD1 ILE 97 -9.464 -7.257 -15.246 739 HD13 ILE 97 2HD1 ILE 97 -10.292 -8.814 -15.198 740 H GLY 98 H GLY 98 -9.752 -11.622 -13.204 741 HA2 GLY 98 2HA GLY 98 -9.741 -12.642 -10.444 742 HA3 GLY 98 3HA GLY 98 -10.068 -13.748 -11.770 743 H ALA 99 H ALA 99 -8.262 -15.020 -11.367 744 HA ALA 99 HA ALA 99 -5.649 -13.716 -11.730 745 HB1 ALA 99 1HB ALA 99 -6.186 -16.461 -10.608 746 HB2 ALA 99 2HB ALA 99 -4.657 -15.583 -10.603 747 HB3 ALA 99 3HB ALA 99 -6.009 -15.004 -9.630 748 H GLU 100 H GLU 100 -7.906 -15.224 -13.518 749 HA GLU 100 HA GLU 100 -5.915 -16.573 -15.221 750 HB2 GLU 100 2HB GLU 100 -7.843 -17.930 -14.154 751 HB3 GLU 100 3HB GLU 100 -8.867 -17.127 -15.336 752 HG2 GLU 100 2HG GLU 100 -7.571 -18.056 -17.148 753 HG3 GLU 100 3HG GLU 100 -6.446 -18.785 -16.004 754 H GLU 101 H GLU 101 -7.624 -13.807 -14.962 755 HA GLU 101 HA GLU 101 -7.669 -13.438 -17.876 756 HB2 GLU 101 2HB GLU 101 -9.733 -12.163 -17.731 757 HB3 GLU 101 3HB GLU 101 -9.979 -13.782 -17.092 758 HG2 GLU 101 2HG GLU 101 -9.329 -12.463 -14.833 759 HG3 GLU 101 3HG GLU 101 -10.110 -11.174 -15.746 760 H PHE 102 H PHE 102 -6.220 -12.574 -15.152 761 HA PHE 102 HA PHE 102 -6.186 -9.692 -15.617 762 HB2 PHE 102 2HB PHE 102 -6.368 -10.530 -13.298 763 HB3 PHE 102 3HB PHE 102 -4.807 -11.325 -13.475 764 HD1 PHE 102 HD1 PHE 102 -2.757 -9.944 -13.782 765 HD2 PHE 102 HD2 PHE 102 -6.525 -8.238 -12.779 766 HE1 PHE 102 HE1 PHE 102 -1.625 -7.891 -13.035 767 HE2 PHE 102 HE2 PHE 102 -5.400 -6.182 -12.032 768 HZ PHE 102 HZ PHE 102 -2.946 -6.006 -12.160 769 H GLN 103 H GLN 103 -3.618 -12.057 -14.895 770 HA GLN 103 HA GLN 103 -1.505 -10.624 -15.934 771 HB2 GLN 103 2HB GLN 103 -0.313 -12.763 -16.107 772 HB3 GLN 103 3HB GLN 103 -1.204 -12.642 -14.596 773 HG2 GLN 103 2HG GLN 103 -3.017 -13.858 -16.239 774 HG3 GLN 103 3HG GLN 103 -1.486 -14.532 -16.797 775 HE21 GLN 103 1HE2 GLN 103 -2.737 -13.592 -13.612 776 HE22 GLN 103 2HE2 GLN 103 -2.431 -15.113 -12.853 777 H GLU 104 H GLU 104 -3.772 -12.737 -17.604 778 HA GLU 104 HA GLU 104 -2.483 -12.971 -20.058 779 HB2 GLU 104 2HB GLU 104 -4.533 -13.682 -20.942 780 HB3 GLU 104 3HB GLU 104 -4.635 -14.105 -19.238 781 HG2 GLU 104 2HG GLU 104 -6.685 -13.170 -19.545 782 HG3 GLU 104 3HG GLU 104 -5.770 -11.749 -19.046 783 H MET 105 H MET 105 -4.294 -10.312 -18.696 784 HA MET 105 HA MET 105 -4.428 -8.858 -21.186 785 HB2 MET 105 2HB MET 105 -5.747 -7.334 -20.079 786 HB3 MET 105 3HB MET 105 -6.035 -8.769 -19.104 787 HG2 MET 105 2HG MET 105 -5.518 -7.494 -17.362 788 HG3 MET 105 3HG MET 105 -3.847 -7.661 -17.893 789 HE1 MET 105 3HE MET 105 -6.481 -4.682 -19.806 790 HE2 MET 105 1HE MET 105 -7.014 -6.054 -18.833 791 HE3 MET 105 2HE MET 105 -6.839 -4.463 -18.092 792 H VAL 106 H VAL 106 -2.135 -9.308 -18.725 793 HA VAL 106 HA VAL 106 -0.832 -6.744 -19.045 794 HB VAL 106 HB VAL 106 0.281 -9.175 -17.653 795 HG11 VAL 106 1HG1 VAL 106 1.225 -6.517 -18.106 796 HG12 VAL 106 2HG1 VAL 106 0.965 -6.757 -16.377 797 HG13 VAL 106 3HG1 VAL 106 2.021 -7.851 -17.272 798 HG21 VAL 106 3HG2 VAL 106 -2.105 -8.019 -16.994 799 HG22 VAL 106 1HG2 VAL 106 -1.051 -8.882 -15.874 800 HG23 VAL 106 2HG2 VAL 106 -0.971 -7.124 -15.984 801 H GLN 107 H GLN 107 0.687 -9.943 -19.183 802 HA GLN 107 HA GLN 107 2.679 -9.144 -20.996 803 HB2 GLN 107 2HB GLN 107 1.676 -11.923 -20.355 804 HB3 GLN 107 3HB GLN 107 3.168 -11.560 -21.212 805 HG2 GLN 107 2HG GLN 107 4.275 -11.211 -19.323 806 HG3 GLN 107 3HG GLN 107 3.014 -10.152 -18.692 807 HE21 GLN 107 1HE2 GLN 107 0.888 -11.692 -18.379 808 HE22 GLN 107 2HE2 GLN 107 1.199 -12.998 -17.292 809 H SER 108 H SER 108 -0.473 -10.621 -21.463 810 HA SER 108 HA SER 108 -0.056 -10.469 -24.377 811 HB2 SER 108 2HB SER 108 -0.425 -12.756 -23.795 812 HB3 SER 108 3HB SER 108 -1.773 -12.338 -22.737 813 HG SER 108 HG SER 108 -1.823 -11.759 -25.501 Start of MODEL 3 1 H1 SER 1 H SER 1 -1.105 -0.210 -1.574 2 HA SER 1 HA SER 1 1.580 0.641 -2.428 3 HB2 SER 1 2HB SER 1 0.619 1.181 -0.064 4 HB3 SER 1 3HB SER 1 0.982 -0.509 0.283 5 HG SER 1 HG SER 1 3.108 -0.124 0.011 6 H LEU 2 H LEU 2 2.098 -0.954 -3.879 7 HA LEU 2 HA LEU 2 1.759 -3.745 -3.177 8 HB2 LEU 2 2HB LEU 2 1.435 -2.825 -5.492 9 HB3 LEU 2 3HB LEU 2 3.179 -2.582 -5.564 10 HG LEU 2 HG LEU 2 3.393 -5.084 -5.159 11 HD11 LEU 2 1HD1 LEU 2 0.443 -4.816 -5.505 12 HD12 LEU 2 2HD1 LEU 2 1.360 -5.844 -4.405 13 HD13 LEU 2 3HD1 LEU 2 1.263 -6.252 -6.117 14 HD21 LEU 2 3HD2 LEU 2 2.507 -5.497 -7.623 15 HD22 LEU 2 1HD2 LEU 2 3.956 -4.544 -7.298 16 HD23 LEU 2 2HD2 LEU 2 2.422 -3.734 -7.619 17 H THR 3 H THR 3 4.610 -2.106 -4.527 18 HA THR 3 HA THR 3 6.840 -2.446 -4.163 19 HB THR 3 HB THR 3 7.298 -2.627 -1.531 20 HG1 THR 3 HG1 THR 3 5.417 -2.625 -0.544 21 HG21 THR 3 3HG2 THR 3 7.267 -0.607 -3.437 22 HG22 THR 3 1HG2 THR 3 7.968 -0.515 -1.822 23 HG23 THR 3 2HG2 THR 3 6.318 0.043 -2.100 24 H ASP 4 H ASP 4 5.204 -4.850 -4.545 25 HA ASP 4 HA ASP 4 6.979 -6.780 -3.202 26 HB2 ASP 4 2HB ASP 4 4.048 -6.672 -3.279 27 HB3 ASP 4 3HB ASP 4 4.711 -8.237 -3.741 28 H ILE 5 H ILE 5 6.149 -5.424 -6.063 29 HA ILE 5 HA ILE 5 7.211 -7.702 -7.555 30 HB ILE 5 HB ILE 5 4.707 -6.235 -8.393 31 HG12 ILE 5 2HG1 ILE 5 3.930 -8.781 -8.271 32 HG13 ILE 5 3HG1 ILE 5 5.209 -8.856 -7.064 33 HG21 ILE 5 1HG2 ILE 5 6.381 -6.994 -10.176 34 HG22 ILE 5 2HG2 ILE 5 5.903 -8.634 -9.738 35 HG23 ILE 5 3HG2 ILE 5 4.702 -7.501 -10.358 36 HD11 ILE 5 3HD1 ILE 5 3.443 -8.347 -5.734 37 HD12 ILE 5 1HD1 ILE 5 3.979 -6.717 -6.141 38 HD13 ILE 5 2HD1 ILE 5 2.612 -7.434 -6.994 39 H LEU 6 H LEU 6 5.789 -4.518 -8.313 40 HA LEU 6 HA LEU 6 8.129 -3.926 -9.964 41 HB2 LEU 6 2HB LEU 6 5.346 -2.861 -9.804 42 HB3 LEU 6 3HB LEU 6 6.617 -1.862 -10.506 43 HG LEU 6 HG LEU 6 6.132 -4.640 -11.518 44 HD11 LEU 6 1HD1 LEU 6 4.069 -4.065 -12.135 45 HD12 LEU 6 2HD1 LEU 6 4.839 -2.976 -13.289 46 HD13 LEU 6 3HD1 LEU 6 4.323 -2.371 -11.714 47 HD21 LEU 6 3HD2 LEU 6 8.033 -2.766 -12.081 48 HD22 LEU 6 1HD2 LEU 6 6.830 -2.452 -13.332 49 HD23 LEU 6 2HD2 LEU 6 7.532 -4.062 -13.168 50 H SER 7 H SER 7 9.098 -1.779 -9.860 51 HA SER 7 HA SER 7 9.658 -1.035 -7.150 52 HB2 SER 7 2HB SER 7 10.897 -0.692 -9.696 53 HB3 SER 7 3HB SER 7 10.693 0.903 -8.971 54 HG SER 7 HG SER 7 12.664 -0.137 -8.359 55 HA PRO 8 HA PRO 8 6.916 2.333 -6.534 56 HB2 PRO 8 2HB PRO 8 8.484 4.145 -5.257 57 HB3 PRO 8 3HB PRO 8 7.919 2.655 -4.492 58 HG2 PRO 8 2HG PRO 8 10.572 3.253 -5.741 59 HG3 PRO 8 3HG PRO 8 10.215 2.399 -4.229 60 HD2 PRO 8 2HD PRO 8 10.825 1.101 -6.525 61 HD3 PRO 8 3HD PRO 8 9.718 0.427 -5.313 62 H SER 9 H SER 9 10.108 3.520 -7.604 63 HA SER 9 HA SER 9 9.311 5.959 -8.641 64 HB2 SER 9 2HB SER 9 11.318 5.479 -10.295 65 HB3 SER 9 3HB SER 9 11.610 5.745 -8.576 66 HG SER 9 HG SER 9 11.599 3.322 -10.020 67 H ASP 10 H ASP 10 9.476 2.813 -10.276 68 HA ASP 10 HA ASP 10 8.696 3.670 -12.822 69 HB2 ASP 10 2HB ASP 10 8.445 1.028 -11.397 70 HB3 ASP 10 3HB ASP 10 7.863 1.247 -13.046 71 H ILE 11 H ILE 11 6.808 2.854 -9.978 72 HA ILE 11 HA ILE 11 4.284 2.884 -11.333 73 HB ILE 11 HB ILE 11 4.946 3.036 -8.391 74 HG12 ILE 11 2HG1 ILE 11 3.665 0.701 -9.755 75 HG13 ILE 11 3HG1 ILE 11 5.404 0.928 -9.906 76 HG21 ILE 11 1HG2 ILE 11 2.828 3.999 -8.527 77 HG22 ILE 11 2HG2 ILE 11 2.325 2.936 -9.840 78 HG23 ILE 11 3HG2 ILE 11 2.491 2.298 -8.204 79 HD11 ILE 11 3HD1 ILE 11 3.801 0.456 -7.415 80 HD12 ILE 11 1HD1 ILE 11 5.085 -0.540 -8.101 81 HD13 ILE 11 2HD1 ILE 11 5.470 1.025 -7.383 82 H ALA 12 H ALA 12 5.870 5.113 -9.047 83 HA ALA 12 HA ALA 12 3.952 7.119 -9.050 84 HB1 ALA 12 1HB ALA 12 6.486 8.368 -8.902 85 HB2 ALA 12 2HB ALA 12 5.391 7.951 -7.584 86 HB3 ALA 12 3HB ALA 12 6.617 6.798 -8.109 87 H ALA 13 H ALA 13 6.350 6.317 -11.443 88 HA ALA 13 HA ALA 13 6.150 8.801 -12.873 89 HB1 ALA 13 1HB ALA 13 7.485 6.175 -13.393 90 HB2 ALA 13 2HB ALA 13 7.346 7.379 -14.675 91 HB3 ALA 13 3HB ALA 13 8.202 7.773 -13.184 92 H ALA 14 H ALA 14 4.465 5.777 -12.859 93 HA ALA 14 HA ALA 14 3.223 6.243 -15.446 94 HB1 ALA 14 1HB ALA 14 2.685 4.059 -13.437 95 HB2 ALA 14 2HB ALA 14 2.134 4.111 -15.112 96 HB3 ALA 14 3HB ALA 14 3.855 3.962 -14.753 97 H LEU 15 H LEU 15 2.254 6.095 -12.032 98 HA LEU 15 HA LEU 15 -0.472 6.587 -12.379 99 HB2 LEU 15 2HB LEU 15 1.466 6.962 -10.153 100 HB3 LEU 15 3HB LEU 15 -0.125 7.706 -10.011 101 HG LEU 15 HG LEU 15 0.342 4.761 -10.464 102 HD11 LEU 15 1HD1 LEU 15 1.003 4.774 -8.324 103 HD12 LEU 15 2HD1 LEU 15 -0.710 4.996 -7.970 104 HD13 LEU 15 3HD1 LEU 15 0.366 6.392 -8.030 105 HD21 LEU 15 3HD2 LEU 15 -1.999 4.531 -9.918 106 HD22 LEU 15 1HD2 LEU 15 -1.816 5.656 -11.265 107 HD23 LEU 15 2HD2 LEU 15 -2.138 6.268 -9.643 108 H ARG 16 H ARG 16 2.205 8.865 -11.864 109 HA ARG 16 HA ARG 16 0.535 11.178 -11.986 110 HB2 ARG 16 2HB ARG 16 3.531 10.951 -12.334 111 HB3 ARG 16 3HB ARG 16 2.637 12.437 -12.043 112 HG2 ARG 16 2HG ARG 16 2.184 10.328 -10.057 113 HG3 ARG 16 3HG ARG 16 3.834 10.950 -10.123 114 HD2 ARG 16 2HD ARG 16 1.323 12.586 -9.782 115 HD3 ARG 16 3HD ARG 16 2.492 12.201 -8.520 116 HE ARG 16 HE ARG 16 2.721 14.238 -10.522 117 HH11 ARG 16 1HH1 ARG 16 4.502 12.088 -8.442 118 HH12 ARG 16 2HH1 ARG 16 5.920 13.083 -8.410 119 HH21 ARG 16 1HH2 ARG 16 4.581 15.557 -10.487 120 HH22 ARG 16 2HH2 ARG 16 5.964 15.057 -9.573 121 H ASP 17 H ASP 17 2.348 9.299 -14.307 122 HA ASP 17 HA ASP 17 2.555 11.066 -16.424 123 HB2 ASP 17 2HB ASP 17 3.634 9.026 -16.754 124 HB3 ASP 17 3HB ASP 17 2.223 8.089 -16.271 125 H CYS 18 H CYS 18 -0.207 9.104 -15.427 126 HA CYS 18 HA CYS 18 -1.923 10.786 -17.102 127 HB2 CYS 18 2HB CYS 18 -1.814 7.776 -17.123 128 HB3 CYS 18 3HB CYS 18 -3.258 8.650 -17.620 129 HG CYS 18 HG CYS 18 -2.326 9.645 -19.897 130 H GLN 19 H GLN 19 -1.510 11.024 -14.358 131 HA GLN 19 HA GLN 19 -3.248 9.629 -12.700 132 HB2 GLN 19 2HB GLN 19 -3.225 11.789 -11.320 133 HB3 GLN 19 3HB GLN 19 -1.679 11.010 -11.632 134 HG2 GLN 19 2HG GLN 19 -1.041 12.626 -13.186 135 HG3 GLN 19 3HG GLN 19 -2.692 13.211 -13.389 136 HE21 GLN 19 1HE2 GLN 19 0.057 13.112 -11.219 137 HE22 GLN 19 2HE2 GLN 19 -0.376 14.509 -10.300 138 H ALA 20 H ALA 20 -3.847 12.401 -14.786 139 HA ALA 20 HA ALA 20 -6.329 13.219 -13.912 140 HB1 ALA 20 1HB ALA 20 -6.718 14.050 -16.166 141 HB2 ALA 20 2HB ALA 20 -5.055 14.360 -15.664 142 HB3 ALA 20 3HB ALA 20 -5.408 13.039 -16.778 143 HA PRO 21 HA PRO 21 -9.185 9.977 -14.699 144 HB2 PRO 21 2HB PRO 21 -11.422 11.394 -15.299 145 HB3 PRO 21 3HB PRO 21 -10.765 11.285 -13.662 146 HG2 PRO 21 2HG PRO 21 -10.465 13.476 -15.680 147 HG3 PRO 21 3HG PRO 21 -10.780 13.593 -13.938 148 HD2 PRO 21 2HD PRO 21 -8.319 13.971 -15.003 149 HD3 PRO 21 3HD PRO 21 -8.564 13.274 -13.389 150 H ASP 22 H ASP 22 -9.948 8.737 -16.354 151 HA ASP 22 HA ASP 22 -10.156 7.958 -18.483 152 HB2 ASP 22 2HB ASP 22 -12.038 9.660 -18.345 153 HB3 ASP 22 3HB ASP 22 -10.978 10.770 -19.209 154 H SER 23 H SER 23 -7.603 9.213 -17.640 155 HA SER 23 HA SER 23 -6.570 10.016 -20.279 156 HB2 SER 23 2HB SER 23 -5.487 10.592 -17.511 157 HB3 SER 23 3HB SER 23 -4.673 11.031 -19.013 158 HG SER 23 HG SER 23 -7.250 11.906 -18.200 159 H PHE 24 H PHE 24 -6.367 7.698 -17.731 160 HA PHE 24 HA PHE 24 -3.886 6.556 -18.744 161 HB2 PHE 24 2HB PHE 24 -3.694 5.473 -16.746 162 HB3 PHE 24 3HB PHE 24 -4.779 6.757 -16.224 163 HD1 PHE 24 HD2 PHE 24 -7.370 6.134 -16.754 164 HD2 PHE 24 HD1 PHE 24 -4.214 3.376 -16.009 165 HE1 PHE 24 HE2 PHE 24 -9.015 4.452 -16.034 166 HE2 PHE 24 HE1 PHE 24 -5.854 1.689 -15.289 167 HZ PHE 24 HZ PHE 24 -8.258 2.226 -15.300 168 H SER 25 H SER 25 -3.940 4.024 -18.785 169 HA SER 25 HA SER 25 -6.396 2.958 -19.913 170 HB2 SER 25 2HB SER 25 -5.649 3.602 -21.989 171 HB3 SER 25 3HB SER 25 -3.952 3.552 -21.512 172 HG SER 25 HG SER 25 -5.010 1.804 -22.957 173 HA PRO 26 HA PRO 26 -5.022 -0.741 -17.989 174 HB2 PRO 26 2HB PRO 26 -6.230 -2.606 -19.549 175 HB3 PRO 26 3HB PRO 26 -7.116 -1.587 -18.409 176 HG2 PRO 26 2HG PRO 26 -6.792 -1.279 -21.369 177 HG3 PRO 26 3HG PRO 26 -8.246 -1.073 -20.375 178 HD2 PRO 26 2HD PRO 26 -6.771 1.022 -21.249 179 HD3 PRO 26 3HD PRO 26 -7.639 1.046 -19.701 180 H LYS 27 H LYS 27 -4.175 0.022 -21.209 181 HA LYS 27 HA LYS 27 -2.112 -2.083 -21.187 182 HB2 LYS 27 2HB LYS 27 -2.279 -2.327 -23.540 183 HB3 LYS 27 3HB LYS 27 -3.929 -2.358 -22.932 184 HG2 LYS 27 2HG LYS 27 -3.553 0.300 -23.455 185 HG3 LYS 27 3HG LYS 27 -2.630 -0.478 -24.742 186 HD2 LYS 27 2HD LYS 27 -4.858 -0.165 -25.539 187 HD3 LYS 27 3HD LYS 27 -4.647 -1.887 -25.217 188 HE2 LYS 27 2HE LYS 27 -5.802 -1.653 -23.094 189 HE3 LYS 27 3HE LYS 27 -5.953 0.085 -23.344 190 HZ1 LYS 27 3HZ LYS 27 -7.011 -1.206 -25.584 191 HZ2 LYS 27 1HZ LYS 27 -7.830 -0.279 -24.429 192 HZ3 LYS 27 2HZ LYS 27 -7.670 -1.949 -24.215 193 H LYS 28 H LYS 28 -2.175 0.789 -20.266 194 HA LYS 28 HA LYS 28 0.203 1.653 -21.764 195 HB2 LYS 28 2HB LYS 28 -2.082 3.410 -20.852 196 HB3 LYS 28 3HB LYS 28 -0.555 4.010 -21.487 197 HG2 LYS 28 2HG LYS 28 -2.306 2.149 -23.059 198 HG3 LYS 28 3HG LYS 28 -2.527 3.900 -23.086 199 HD2 LYS 28 2HD LYS 28 -0.273 4.208 -23.908 200 HD3 LYS 28 3HD LYS 28 0.045 2.478 -23.771 201 HE2 LYS 28 2HE LYS 28 -0.435 2.692 -26.016 202 HE3 LYS 28 3HE LYS 28 -2.008 2.252 -25.354 203 HZ1 LYS 28 3HZ LYS 28 -1.454 5.093 -25.440 204 HZ2 LYS 28 1HZ LYS 28 -2.866 4.252 -25.840 205 HZ3 LYS 28 2HZ LYS 28 -1.595 4.348 -26.952 206 H PHE 29 H PHE 29 -0.566 0.373 -19.043 207 HA PHE 29 HA PHE 29 0.890 2.280 -17.337 208 HB2 PHE 29 2HB PHE 29 -1.533 1.041 -16.871 209 HB3 PHE 29 3HB PHE 29 -0.400 0.036 -15.973 210 HD1 PHE 29 HD1 PHE 29 1.128 1.160 -14.295 211 HD2 PHE 29 HD2 PHE 29 -2.245 3.095 -16.026 212 HE1 PHE 29 HE1 PHE 29 1.133 2.802 -12.462 213 HE2 PHE 29 HE2 PHE 29 -2.245 4.740 -14.197 214 HZ PHE 29 HZ PHE 29 -0.554 4.595 -12.412 215 H PHE 30 H PHE 30 1.216 -0.583 -19.029 216 HA PHE 30 HA PHE 30 3.107 -1.801 -17.182 217 HB2 PHE 30 2HB PHE 30 3.067 -3.698 -18.574 218 HB3 PHE 30 3HB PHE 30 1.414 -3.094 -18.616 219 HD1 PHE 30 HD1 PHE 30 4.521 -3.493 -20.509 220 HD2 PHE 30 HD2 PHE 30 0.485 -2.148 -20.621 221 HE1 PHE 30 HE1 PHE 30 4.625 -3.397 -22.965 222 HE2 PHE 30 HE2 PHE 30 0.582 -2.051 -23.078 223 HZ PHE 30 HZ PHE 30 2.654 -2.676 -24.253 224 H GLN 31 H GLN 31 3.130 0.439 -19.710 225 HA GLN 31 HA GLN 31 5.798 -0.170 -20.651 226 HB2 GLN 31 2HB GLN 31 4.438 2.416 -21.260 227 HB3 GLN 31 3HB GLN 31 5.452 1.416 -22.291 228 HG2 GLN 31 2HG GLN 31 3.603 -0.238 -22.404 229 HG3 GLN 31 3HG GLN 31 2.594 0.900 -21.512 230 HE21 GLN 31 1HE2 GLN 31 3.335 3.277 -22.665 231 HE22 GLN 31 2HE2 GLN 31 2.846 3.293 -24.321 232 H ILE 32 H ILE 32 4.252 2.027 -18.415 233 HA ILE 32 HA ILE 32 6.754 3.468 -17.968 234 HB ILE 32 HB ILE 32 4.038 3.922 -16.728 235 HG12 ILE 32 2HG1 ILE 32 4.673 6.082 -18.356 236 HG13 ILE 32 3HG1 ILE 32 5.189 4.685 -19.295 237 HG21 ILE 32 1HG2 ILE 32 5.661 4.799 -15.259 238 HG22 ILE 32 2HG2 ILE 32 6.626 5.443 -16.587 239 HG23 ILE 32 3HG2 ILE 32 5.070 6.173 -16.193 240 HD11 ILE 32 3HD1 ILE 32 2.601 4.215 -18.151 241 HD12 ILE 32 1HD1 ILE 32 2.614 5.724 -19.062 242 HD13 ILE 32 2HD1 ILE 32 3.099 4.219 -19.842 243 H SER 33 H SER 33 4.632 1.151 -16.440 244 HA SER 33 HA SER 33 6.072 1.277 -13.919 245 HB2 SER 33 2HB SER 33 3.551 0.899 -14.134 246 HB3 SER 33 3HB SER 33 3.949 -0.732 -14.672 247 HG SER 33 HG SER 33 4.704 0.443 -12.199 248 H GLY 34 H GLY 34 5.150 -1.484 -15.984 249 HA2 GLY 34 2HA GLY 34 7.076 -2.730 -17.006 250 HA3 GLY 34 3HA GLY 34 7.810 -2.638 -15.412 251 H MET 35 H MET 35 4.390 -3.201 -15.878 252 HA MET 35 HA MET 35 4.374 -5.494 -14.249 253 HB2 MET 35 2HB MET 35 2.280 -4.747 -16.292 254 HB3 MET 35 3HB MET 35 2.056 -5.717 -14.842 255 HG2 MET 35 2HG MET 35 2.514 -3.770 -13.454 256 HG3 MET 35 3HG MET 35 2.769 -2.794 -14.899 257 HE1 MET 35 3HE MET 35 -1.296 -4.696 -13.819 258 HE2 MET 35 1HE MET 35 0.119 -5.612 -14.340 259 HE3 MET 35 2HE MET 35 0.118 -4.809 -12.770 260 H SER 36 H SER 36 3.954 -5.195 -17.778 261 HA SER 36 HA SER 36 3.757 -7.882 -18.398 262 HB2 SER 36 2HB SER 36 3.404 -6.774 -20.333 263 HB3 SER 36 3HB SER 36 4.427 -5.422 -19.847 264 HG SER 36 HG SER 36 5.899 -6.221 -21.095 265 H LYS 37 H LYS 37 6.603 -5.956 -17.713 266 HA LYS 37 HA LYS 37 8.577 -7.709 -18.638 267 HB2 LYS 37 2HB LYS 37 8.832 -5.956 -16.195 268 HB3 LYS 37 3HB LYS 37 10.114 -6.487 -17.276 269 HG2 LYS 37 2HG LYS 37 7.911 -4.533 -17.895 270 HG3 LYS 37 3HG LYS 37 9.633 -4.187 -17.718 271 HD2 LYS 37 2HD LYS 37 8.387 -5.916 -19.856 272 HD3 LYS 37 3HD LYS 37 8.972 -4.265 -20.074 273 HE2 LYS 37 2HE LYS 37 11.230 -5.073 -19.336 274 HE3 LYS 37 3HE LYS 37 10.590 -6.715 -19.396 275 HZ1 LYS 37 3HZ LYS 37 11.297 -4.920 -21.571 276 HZ2 LYS 37 1HZ LYS 37 9.906 -5.853 -21.806 277 HZ3 LYS 37 2HZ LYS 37 11.386 -6.607 -21.486 278 H LYS 38 H LYS 38 6.468 -7.937 -15.944 279 HA LYS 38 HA LYS 38 8.127 -9.826 -14.498 280 HB2 LYS 38 2HB LYS 38 5.238 -9.164 -13.945 281 HB3 LYS 38 3HB LYS 38 6.429 -9.820 -12.829 282 HG2 LYS 38 2HG LYS 38 6.607 -7.075 -14.048 283 HG3 LYS 38 3HG LYS 38 5.880 -7.417 -12.476 284 HD2 LYS 38 2HD LYS 38 7.908 -7.210 -11.582 285 HD3 LYS 38 3HD LYS 38 8.368 -8.688 -12.431 286 HE2 LYS 38 2HE LYS 38 8.625 -6.877 -14.418 287 HE3 LYS 38 3HE LYS 38 9.017 -5.874 -13.023 288 HZ1 LYS 38 3HZ LYS 38 10.901 -7.033 -12.601 289 HZ2 LYS 38 1HZ LYS 38 10.826 -7.314 -14.268 290 HZ3 LYS 38 2HZ LYS 38 10.288 -8.497 -13.186 291 H SER 39 H SER 39 6.135 -11.584 -13.583 292 HA SER 39 HA SER 39 5.483 -13.071 -16.043 293 HB2 SER 39 2HB SER 39 6.392 -14.164 -13.371 294 HB3 SER 39 3HB SER 39 5.838 -15.153 -14.721 295 HG SER 39 HG SER 39 7.881 -13.298 -15.176 296 H SER 40 H SER 40 3.664 -14.577 -15.840 297 HA SER 40 HA SER 40 1.349 -13.356 -14.926 298 HB2 SER 40 2HB SER 40 0.844 -16.134 -14.904 299 HB3 SER 40 3HB SER 40 0.516 -14.994 -16.208 300 HG SER 40 HG SER 40 2.563 -16.835 -15.929 301 H SER 41 H SER 41 3.639 -15.306 -13.220 302 HA SER 41 HA SER 41 1.895 -15.940 -11.022 303 HB2 SER 41 2HB SER 41 4.880 -16.040 -10.794 304 HB3 SER 41 3HB SER 41 3.670 -17.144 -10.138 305 HG SER 41 HG SER 41 3.802 -18.280 -11.895 306 H GLN 42 H GLN 42 4.086 -13.378 -11.858 307 HA GLN 42 HA GLN 42 4.150 -12.307 -9.163 308 HB2 GLN 42 2HB GLN 42 5.439 -11.602 -11.764 309 HB3 GLN 42 3HB GLN 42 5.319 -10.366 -10.518 310 HG2 GLN 42 2HG GLN 42 6.409 -12.046 -8.959 311 HG3 GLN 42 3HG GLN 42 6.773 -12.986 -10.405 312 HE21 GLN 42 1HE2 GLN 42 7.198 -9.814 -8.925 313 HE22 GLN 42 2HE2 GLN 42 8.706 -9.459 -9.690 314 H LEU 43 H LEU 43 2.480 -11.768 -12.178 315 HA LEU 43 HA LEU 43 1.377 -9.229 -11.404 316 HB2 LEU 43 2HB LEU 43 0.406 -11.060 -13.586 317 HB3 LEU 43 3HB LEU 43 0.142 -9.324 -13.442 318 HG LEU 43 HG LEU 43 2.953 -10.234 -13.649 319 HD11 LEU 43 1HD1 LEU 43 0.909 -10.628 -15.781 320 HD12 LEU 43 2HD1 LEU 43 2.299 -11.625 -15.352 321 HD13 LEU 43 3HD1 LEU 43 2.535 -10.112 -16.228 322 HD21 LEU 43 3HD2 LEU 43 1.290 -7.883 -14.329 323 HD22 LEU 43 1HD2 LEU 43 2.667 -8.219 -15.379 324 HD23 LEU 43 2HD2 LEU 43 2.917 -7.969 -13.651 325 H LYS 44 H LYS 44 0.587 -12.525 -10.887 326 HA LYS 44 HA LYS 44 -2.223 -12.164 -10.465 327 HB2 LYS 44 2HB LYS 44 -2.249 -14.436 -9.747 328 HB3 LYS 44 3HB LYS 44 -1.118 -14.339 -11.090 329 HG2 LYS 44 2HG LYS 44 0.482 -15.207 -9.837 330 HG3 LYS 44 3HG LYS 44 0.308 -13.900 -8.664 331 HD2 LYS 44 2HD LYS 44 -0.088 -15.822 -7.405 332 HD3 LYS 44 3HD LYS 44 -1.709 -15.239 -7.789 333 HE2 LYS 44 2HE LYS 44 -2.197 -17.092 -8.931 334 HE3 LYS 44 3HE LYS 44 -0.686 -17.016 -9.836 335 HZ1 LYS 44 3HZ LYS 44 -0.241 -18.882 -8.697 336 HZ2 LYS 44 1HZ LYS 44 -1.345 -18.540 -7.461 337 HZ3 LYS 44 2HZ LYS 44 0.186 -17.822 -7.450 338 H GLU 45 H GLU 45 0.566 -11.506 -8.636 339 HA GLU 45 HA GLU 45 -0.486 -11.894 -6.026 340 HB2 GLU 45 2HB GLU 45 1.702 -9.981 -6.850 341 HB3 GLU 45 3HB GLU 45 1.431 -10.655 -5.249 342 HG2 GLU 45 2HG GLU 45 1.735 -12.935 -6.536 343 HG3 GLU 45 3HG GLU 45 2.623 -11.907 -7.660 344 H ILE 46 H ILE 46 -0.079 -8.986 -8.039 345 HA ILE 46 HA ILE 46 -1.107 -7.088 -6.329 346 HB ILE 46 HB ILE 46 -1.592 -7.176 -9.308 347 HG12 ILE 46 2HG1 ILE 46 0.576 -5.470 -8.512 348 HG13 ILE 46 3HG1 ILE 46 0.856 -7.090 -7.885 349 HG21 ILE 46 1HG2 ILE 46 -2.870 -5.408 -8.647 350 HG22 ILE 46 2HG2 ILE 46 -1.896 -5.097 -7.210 351 HG23 ILE 46 3HG2 ILE 46 -1.313 -4.594 -8.797 352 HD11 ILE 46 3HD1 ILE 46 0.011 -7.434 -10.527 353 HD12 ILE 46 1HD1 ILE 46 1.155 -6.093 -10.551 354 HD13 ILE 46 2HD1 ILE 46 1.635 -7.650 -9.874 355 H PHE 47 H PHE 47 -2.824 -9.435 -8.291 356 HA PHE 47 HA PHE 47 -5.397 -8.396 -8.186 357 HB2 PHE 47 2HB PHE 47 -5.434 -10.219 -9.535 358 HB3 PHE 47 3HB PHE 47 -4.204 -11.061 -8.599 359 HD1 PHE 47 HD1 PHE 47 -4.824 -12.413 -6.663 360 HD2 PHE 47 HD2 PHE 47 -7.765 -10.516 -9.086 361 HE1 PHE 47 HE1 PHE 47 -6.559 -13.855 -5.680 362 HE2 PHE 47 HE2 PHE 47 -9.505 -11.954 -8.106 363 HZ PHE 47 HZ PHE 47 -8.903 -13.626 -6.400 364 H ARG 48 H ARG 48 -3.616 -10.270 -5.796 365 HA ARG 48 HA ARG 48 -5.783 -10.737 -4.040 366 HB2 ARG 48 2HB ARG 48 -2.980 -11.280 -4.108 367 HB3 ARG 48 3HB ARG 48 -3.366 -10.557 -2.553 368 HG2 ARG 48 2HG ARG 48 -4.821 -12.919 -3.718 369 HG3 ARG 48 3HG ARG 48 -3.469 -13.039 -2.589 370 HD2 ARG 48 2HD ARG 48 -5.700 -11.269 -1.799 371 HD3 ARG 48 3HD ARG 48 -6.040 -12.999 -1.820 372 HE ARG 48 HE ARG 48 -3.620 -12.273 -0.430 373 HH11 ARG 48 1HH1 ARG 48 -7.054 -12.788 -0.178 374 HH12 ARG 48 2HH1 ARG 48 -7.015 -13.097 1.526 375 HH21 ARG 48 1HH2 ARG 48 -3.555 -12.679 1.814 376 HH22 ARG 48 2HH2 ARG 48 -5.024 -13.034 2.659 377 H ILE 49 H ILE 49 -4.154 -7.905 -4.840 378 HA ILE 49 HA ILE 49 -4.718 -6.626 -2.264 379 HB ILE 49 HB ILE 49 -3.304 -5.429 -4.646 380 HG12 ILE 49 2HG1 ILE 49 -2.051 -7.367 -3.874 381 HG13 ILE 49 3HG1 ILE 49 -1.214 -5.893 -3.400 382 HG21 ILE 49 1HG2 ILE 49 -2.354 -4.073 -2.575 383 HG22 ILE 49 2HG2 ILE 49 -3.846 -3.609 -3.391 384 HG23 ILE 49 3HG2 ILE 49 -3.913 -4.527 -1.887 385 HD11 ILE 49 3HD1 ILE 49 -2.610 -7.909 -1.726 386 HD12 ILE 49 1HD1 ILE 49 -1.057 -7.111 -1.480 387 HD13 ILE 49 2HD1 ILE 49 -2.557 -6.235 -1.174 388 H LEU 50 H LEU 50 -6.065 -7.033 -5.336 389 HA LEU 50 HA LEU 50 -7.545 -4.519 -5.265 390 HB2 LEU 50 2HB LEU 50 -7.023 -6.620 -7.286 391 HB3 LEU 50 3HB LEU 50 -8.556 -5.759 -7.404 392 HG LEU 50 HG LEU 50 -6.793 -3.695 -7.168 393 HD11 LEU 50 1HD1 LEU 50 -5.436 -5.640 -9.009 394 HD12 LEU 50 2HD1 LEU 50 -4.953 -5.450 -7.324 395 HD13 LEU 50 3HD1 LEU 50 -4.855 -4.079 -8.429 396 HD21 LEU 50 3HD2 LEU 50 -6.970 -3.730 -9.770 397 HD22 LEU 50 1HD2 LEU 50 -8.419 -3.510 -8.789 398 HD23 LEU 50 2HD2 LEU 50 -8.058 -5.089 -9.486 399 H ASP 51 H ASP 51 -7.939 -7.889 -4.583 400 HA ASP 51 HA ASP 51 -10.776 -7.983 -4.699 401 HB2 ASP 51 2HB ASP 51 -9.125 -9.949 -4.706 402 HB3 ASP 51 3HB ASP 51 -9.064 -9.749 -2.957 403 H ASN 52 H ASN 52 -12.155 -6.993 -3.396 404 HA ASN 52 HA ASN 52 -11.268 -6.247 -0.695 405 HB2 ASN 52 2HB ASN 52 -12.807 -4.887 -2.741 406 HB3 ASN 52 3HB ASN 52 -13.695 -4.955 -1.222 407 HD21 ASN 52 1HD2 ASN 52 -10.355 -4.400 -2.295 408 HD22 ASN 52 2HD2 ASN 52 -10.084 -3.022 -1.290 409 H ASP 53 H ASP 53 -12.687 -8.764 -1.975 410 HA ASP 53 HA ASP 53 -14.479 -9.141 0.315 411 HB2 ASP 53 2HB ASP 53 -15.353 -10.286 -2.293 412 HB3 ASP 53 3HB ASP 53 -16.318 -9.740 -0.924 413 H GLN 54 H GLN 54 -11.870 -10.169 -1.354 414 HA GLN 54 HA GLN 54 -10.684 -12.108 -1.500 415 HB2 GLN 54 2HB GLN 54 -12.211 -13.142 0.865 416 HB3 GLN 54 3HB GLN 54 -10.509 -13.345 0.471 417 HG2 GLN 54 2HG GLN 54 -11.720 -10.704 1.236 418 HG3 GLN 54 3HG GLN 54 -11.010 -11.823 2.398 419 HE21 GLN 54 1HE2 GLN 54 -10.382 -9.691 -0.285 420 HE22 GLN 54 2HE2 GLN 54 -8.675 -9.576 -0.052 421 H SER 55 H SER 55 -13.478 -11.946 -2.678 422 HA SER 55 HA SER 55 -14.569 -14.577 -2.570 423 HB2 SER 55 2HB SER 55 -15.703 -13.658 -4.786 424 HB3 SER 55 3HB SER 55 -16.189 -13.061 -3.199 425 HG SER 55 HG SER 55 -14.485 -11.835 -5.094 426 H GLY 56 H GLY 56 -12.057 -13.078 -4.399 427 HA2 GLY 56 2HA GLY 56 -10.451 -14.640 -5.417 428 HA3 GLY 56 3HA GLY 56 -11.835 -15.532 -6.031 429 H PHE 57 H PHE 57 -12.942 -12.599 -6.433 430 HA PHE 57 HA PHE 57 -11.478 -12.033 -8.916 431 HB2 PHE 57 2HB PHE 57 -14.490 -11.952 -8.732 432 HB3 PHE 57 3HB PHE 57 -13.496 -11.788 -10.176 433 HD1 PHE 57 HD1 PHE 57 -14.772 -14.138 -7.657 434 HD2 PHE 57 HD2 PHE 57 -12.641 -13.700 -11.315 435 HE1 PHE 57 HE1 PHE 57 -14.957 -16.559 -8.051 436 HE2 PHE 57 HE2 PHE 57 -12.823 -16.121 -11.715 437 HZ PHE 57 HZ PHE 57 -13.983 -17.554 -10.082 438 H ILE 58 H ILE 58 -12.003 -9.850 -9.799 439 HA ILE 58 HA ILE 58 -12.525 -7.957 -7.601 440 HB ILE 58 HB ILE 58 -10.745 -7.539 -10.005 441 HG12 ILE 58 2HG1 ILE 58 -9.711 -7.508 -7.215 442 HG13 ILE 58 3HG1 ILE 58 -10.101 -9.077 -7.912 443 HG21 ILE 58 1HG2 ILE 58 -11.870 -5.496 -9.217 444 HG22 ILE 58 2HG2 ILE 58 -11.207 -5.771 -7.607 445 HG23 ILE 58 3HG2 ILE 58 -10.126 -5.442 -8.961 446 HD11 ILE 58 3HD1 ILE 58 -7.741 -8.460 -8.187 447 HD12 ILE 58 1HD1 ILE 58 -8.566 -8.692 -9.728 448 HD13 ILE 58 2HD1 ILE 58 -8.236 -7.062 -9.141 449 H GLU 59 H GLU 59 -14.732 -7.756 -8.026 450 HA GLU 59 HA GLU 59 -15.860 -7.293 -10.556 451 HB2 GLU 59 2HB GLU 59 -16.927 -6.329 -7.899 452 HB3 GLU 59 3HB GLU 59 -17.850 -6.594 -9.371 453 HG2 GLU 59 2HG GLU 59 -18.338 -8.573 -8.474 454 HG3 GLU 59 3HG GLU 59 -16.719 -9.037 -8.994 455 H GLU 60 H GLU 60 -17.178 -5.170 -10.935 456 HA GLU 60 HA GLU 60 -15.312 -3.120 -11.440 457 HB2 GLU 60 2HB GLU 60 -18.303 -3.300 -11.605 458 HB3 GLU 60 3HB GLU 60 -17.490 -1.765 -11.873 459 HG2 GLU 60 2HG GLU 60 -16.451 -2.500 -13.804 460 HG3 GLU 60 3HG GLU 60 -16.641 -4.200 -13.378 461 H ASP 61 H ASP 61 -17.571 -3.677 -8.827 462 HA ASP 61 HA ASP 61 -17.564 -1.111 -7.688 463 HB2 ASP 61 2HB ASP 61 -19.037 -3.176 -7.141 464 HB3 ASP 61 3HB ASP 61 -17.740 -3.613 -6.032 465 H GLU 62 H GLU 62 -15.112 -3.459 -7.885 466 HA GLU 62 HA GLU 62 -13.572 -2.081 -5.783 467 HB2 GLU 62 2HB GLU 62 -12.194 -4.337 -5.975 468 HB3 GLU 62 3HB GLU 62 -13.609 -4.208 -4.941 469 HG2 GLU 62 2HG GLU 62 -14.915 -5.063 -6.985 470 HG3 GLU 62 3HG GLU 62 -13.337 -5.557 -7.594 471 H LEU 63 H LEU 63 -13.790 -2.877 -9.092 472 HA LEU 63 HA LEU 63 -11.007 -2.681 -9.727 473 HB2 LEU 63 2HB LEU 63 -13.179 -3.630 -11.035 474 HB3 LEU 63 3HB LEU 63 -12.977 -2.069 -11.827 475 HG LEU 63 HG LEU 63 -10.989 -4.332 -11.718 476 HD11 LEU 63 1HD1 LEU 63 -12.916 -3.312 -13.701 477 HD12 LEU 63 2HD1 LEU 63 -12.270 -4.937 -13.471 478 HD13 LEU 63 3HD1 LEU 63 -11.313 -3.719 -14.314 479 HD21 LEU 63 3HD2 LEU 63 -9.866 -2.156 -11.477 480 HD22 LEU 63 1HD2 LEU 63 -10.663 -1.597 -12.947 481 HD23 LEU 63 2HD2 LEU 63 -9.507 -2.926 -13.022 482 H LYS 64 H LYS 64 -13.659 -0.443 -9.429 483 HA LYS 64 HA LYS 64 -12.608 1.721 -10.875 484 HB2 LYS 64 2HB LYS 64 -14.081 3.104 -9.327 485 HB3 LYS 64 3HB LYS 64 -14.885 1.847 -10.259 486 HG2 LYS 64 2HG LYS 64 -15.391 0.617 -8.428 487 HG3 LYS 64 3HG LYS 64 -13.934 1.105 -7.559 488 HD2 LYS 64 2HD LYS 64 -15.922 2.024 -6.493 489 HD3 LYS 64 3HD LYS 64 -14.920 3.315 -7.161 490 HE2 LYS 64 2HE LYS 64 -16.671 4.049 -8.310 491 HE3 LYS 64 3HE LYS 64 -16.714 2.523 -9.191 492 HZ1 LYS 64 3HZ LYS 64 -18.568 1.959 -8.147 493 HZ2 LYS 64 1HZ LYS 64 -18.616 3.496 -7.442 494 HZ3 LYS 64 2HZ LYS 64 -17.872 2.215 -6.626 495 H TYR 65 H TYR 65 -11.676 0.352 -7.880 496 HA TYR 65 HA TYR 65 -10.264 2.764 -7.030 497 HB2 TYR 65 2HB TYR 65 -10.717 0.091 -5.701 498 HB3 TYR 65 3HB TYR 65 -9.681 1.340 -5.020 499 HD1 TYR 65 HD1 TYR 65 -11.201 3.785 -5.541 500 HD2 TYR 65 HD2 TYR 65 -12.559 -0.049 -4.292 501 HE1 TYR 65 HE1 TYR 65 -13.156 4.831 -4.476 502 HE2 TYR 65 HE2 TYR 65 -14.517 0.986 -3.223 503 HH TYR 65 HH TYR 65 -15.722 3.724 -3.850 504 H PHE 66 H PHE 66 -9.555 0.992 -9.387 505 HA PHE 66 HA PHE 66 -7.258 -0.494 -8.908 506 HB2 PHE 66 2HB PHE 66 -8.259 -0.656 -11.054 507 HB3 PHE 66 3HB PHE 66 -8.151 1.081 -11.319 508 HD1 PHE 66 HD1 PHE 66 -5.931 -1.844 -10.667 509 HD2 PHE 66 HD2 PHE 66 -6.477 1.868 -12.677 510 HE1 PHE 66 HE1 PHE 66 -3.784 -2.160 -11.828 511 HE2 PHE 66 HE2 PHE 66 -4.333 1.557 -13.842 512 HZ PHE 66 HZ PHE 66 -2.983 -0.459 -13.419 513 H LEU 67 H LEU 67 -7.688 2.964 -9.184 514 HA LEU 67 HA LEU 67 -4.865 3.526 -9.324 515 HB2 LEU 67 2HB LEU 67 -6.879 5.579 -8.548 516 HB3 LEU 67 3HB LEU 67 -5.441 5.741 -9.553 517 HG LEU 67 HG LEU 67 -8.163 4.732 -10.307 518 HD11 LEU 67 1HD1 LEU 67 -6.673 6.444 -12.129 519 HD12 LEU 67 2HD1 LEU 67 -6.928 7.174 -10.544 520 HD13 LEU 67 3HD1 LEU 67 -8.308 6.616 -11.491 521 HD21 LEU 67 3HD2 LEU 67 -6.910 3.041 -11.276 522 HD22 LEU 67 1HD2 LEU 67 -5.527 4.094 -11.571 523 HD23 LEU 67 2HD2 LEU 67 -6.979 4.248 -12.560 524 H GLN 68 H GLN 68 -7.070 2.787 -6.865 525 HA GLN 68 HA GLN 68 -5.663 4.249 -4.789 526 HB2 GLN 68 2HB GLN 68 -8.211 2.835 -5.032 527 HB3 GLN 68 3HB GLN 68 -7.391 2.523 -3.508 528 HG2 GLN 68 2HG GLN 68 -8.163 4.440 -2.735 529 HG3 GLN 68 3HG GLN 68 -7.213 5.290 -3.952 530 HE21 GLN 68 1HE2 GLN 68 -8.352 5.006 -6.237 531 HE22 GLN 68 2HE2 GLN 68 -10.013 5.479 -6.241 532 H ARG 69 H ARG 69 -4.825 1.679 -6.482 533 HA ARG 69 HA ARG 69 -3.896 0.079 -4.201 534 HB2 ARG 69 2HB ARG 69 -3.541 -0.810 -7.029 535 HB3 ARG 69 3HB ARG 69 -3.819 -1.769 -5.581 536 HG2 ARG 69 2HG ARG 69 -5.841 -0.143 -7.103 537 HG3 ARG 69 3HG ARG 69 -5.757 -1.900 -6.969 538 HD2 ARG 69 2HD ARG 69 -5.855 -1.201 -4.359 539 HD3 ARG 69 3HD ARG 69 -6.799 0.102 -5.078 540 HE ARG 69 HE ARG 69 -7.706 -2.322 -6.134 541 HH11 ARG 69 1HH1 ARG 69 -7.629 -0.620 -3.097 542 HH12 ARG 69 2HH1 ARG 69 -9.082 -1.352 -2.502 543 HH21 ARG 69 1HH2 ARG 69 -9.620 -3.292 -5.360 544 HH22 ARG 69 2HH2 ARG 69 -10.213 -2.872 -3.789 545 H PHE 70 H PHE 70 -2.823 2.003 -6.907 546 HA PHE 70 HA PHE 70 -0.024 1.370 -6.315 547 HB2 PHE 70 2HB PHE 70 -1.318 2.808 -8.637 548 HB3 PHE 70 3HB PHE 70 0.425 2.679 -8.422 549 HD1 PHE 70 HD1 PHE 70 -2.665 0.700 -8.899 550 HD2 PHE 70 HD2 PHE 70 1.586 0.762 -9.102 551 HE1 PHE 70 HE1 PHE 70 -2.691 -1.476 -10.049 552 HE2 PHE 70 HE2 PHE 70 1.567 -1.412 -10.253 553 HZ PHE 70 HZ PHE 70 -0.573 -2.534 -10.728 554 H GLU 71 H GLU 71 -2.393 3.883 -6.058 555 HA GLU 71 HA GLU 71 -0.322 5.752 -5.114 556 HB2 GLU 71 2HB GLU 71 -1.872 6.366 -7.089 557 HB3 GLU 71 3HB GLU 71 -3.120 6.553 -5.865 558 HG2 GLU 71 2HG GLU 71 -2.219 8.450 -5.029 559 HG3 GLU 71 3HG GLU 71 -0.564 7.950 -5.377 560 H SER 72 H SER 72 -3.389 4.228 -4.364 561 HA SER 72 HA SER 72 -4.527 3.953 -2.413 562 HB2 SER 72 2HB SER 72 -2.101 3.414 -1.666 563 HB3 SER 72 3HB SER 72 -2.150 4.998 -0.894 564 HG SER 72 HG SER 72 -3.837 4.315 0.377 565 H GLY 73 H GLY 73 -5.429 6.059 -3.564 566 HA2 GLY 73 2HA GLY 73 -6.616 7.679 -1.772 567 HA3 GLY 73 3HA GLY 73 -5.063 8.470 -1.999 568 H ALA 74 H ALA 74 -5.140 7.393 -4.865 569 HA ALA 74 HA ALA 74 -6.025 9.735 -6.110 570 HB1 ALA 74 1HB ALA 74 -6.091 8.006 -8.159 571 HB2 ALA 74 2HB ALA 74 -4.596 8.669 -7.499 572 HB3 ALA 74 3HB ALA 74 -5.141 7.065 -7.008 573 H ARG 75 H ARG 75 -7.673 9.585 -8.018 574 HA ARG 75 HA ARG 75 -10.236 9.221 -6.853 575 HB2 ARG 75 2HB ARG 75 -11.084 9.803 -9.119 576 HB3 ARG 75 3HB ARG 75 -9.911 10.954 -8.494 577 HG2 ARG 75 2HG ARG 75 -8.232 10.201 -9.946 578 HG3 ARG 75 3HG ARG 75 -9.118 8.725 -10.336 579 HD2 ARG 75 2HD ARG 75 -9.067 10.830 -11.961 580 HD3 ARG 75 3HD ARG 75 -10.469 9.768 -11.833 581 HE ARG 75 HE ARG 75 -11.641 11.536 -11.008 582 HH11 ARG 75 1HH1 ARG 75 -8.250 12.125 -10.484 583 HH12 ARG 75 2HH1 ARG 75 -8.493 13.714 -9.838 584 HH21 ARG 75 1HH2 ARG 75 -11.974 13.626 -10.158 585 HH22 ARG 75 2HH2 ARG 75 -10.611 14.566 -9.652 586 H VAL 76 H VAL 76 -11.898 8.119 -8.618 587 HA VAL 76 HA VAL 76 -10.976 5.326 -8.806 588 HB VAL 76 HB VAL 76 -13.120 4.553 -8.317 589 HG11 VAL 76 1HG1 VAL 76 -13.739 5.581 -6.236 590 HG12 VAL 76 2HG1 VAL 76 -11.980 5.624 -6.383 591 HG13 VAL 76 3HG1 VAL 76 -12.928 7.081 -6.686 592 HG21 VAL 76 3HG2 VAL 76 -14.026 7.263 -9.195 593 HG22 VAL 76 1HG2 VAL 76 -14.564 5.672 -9.733 594 HG23 VAL 76 2HG2 VAL 76 -15.057 6.282 -8.154 595 H LEU 77 H LEU 77 -11.638 4.075 -10.604 596 HA LEU 77 HA LEU 77 -11.462 5.333 -13.082 597 HB2 LEU 77 2HB LEU 77 -12.780 2.673 -12.588 598 HB3 LEU 77 3HB LEU 77 -11.975 3.218 -14.058 599 HG LEU 77 HG LEU 77 -10.684 2.490 -11.432 600 HD11 LEU 77 1HD1 LEU 77 -10.714 1.255 -14.173 601 HD12 LEU 77 2HD1 LEU 77 -11.212 0.535 -12.642 602 HD13 LEU 77 3HD1 LEU 77 -9.505 0.851 -12.954 603 HD21 LEU 77 3HD2 LEU 77 -9.599 3.877 -13.856 604 HD22 LEU 77 1HD2 LEU 77 -8.563 2.867 -12.847 605 HD23 LEU 77 2HD2 LEU 77 -9.374 4.271 -12.151 606 H THR 78 H THR 78 -12.897 6.179 -14.480 607 HA THR 78 HA THR 78 -15.557 6.731 -13.549 608 HB THR 78 HB THR 78 -14.287 8.408 -14.830 609 HG1 THR 78 HG1 THR 78 -16.063 9.099 -15.898 610 HG21 THR 78 3HG2 THR 78 -14.731 7.430 -17.476 611 HG22 THR 78 1HG2 THR 78 -13.808 6.229 -16.573 612 HG23 THR 78 2HG2 THR 78 -13.210 7.883 -16.707 613 H ALA 79 H ALA 79 -17.239 6.634 -15.585 614 HA ALA 79 HA ALA 79 -17.889 3.875 -15.802 615 HB1 ALA 79 1HB ALA 79 -19.808 5.087 -15.803 616 HB2 ALA 79 2HB ALA 79 -19.094 6.428 -16.699 617 HB3 ALA 79 3HB ALA 79 -19.582 4.961 -17.548 618 H SER 80 H SER 80 -15.760 5.797 -17.528 619 HA SER 80 HA SER 80 -15.986 4.111 -19.932 620 HB2 SER 80 2HB SER 80 -16.213 6.550 -20.320 621 HB3 SER 80 3HB SER 80 -14.605 6.791 -19.636 622 HG SER 80 HG SER 80 -15.327 5.962 -22.127 623 H GLU 81 H GLU 81 -14.257 4.426 -17.136 624 HA GLU 81 HA GLU 81 -11.710 3.585 -18.313 625 HB2 GLU 81 2HB GLU 81 -12.496 4.535 -15.566 626 HB3 GLU 81 3HB GLU 81 -10.943 3.769 -15.870 627 HG2 GLU 81 2HG GLU 81 -10.294 5.501 -17.369 628 HG3 GLU 81 3HG GLU 81 -11.911 6.203 -17.343 629 H THR 82 H THR 82 -13.745 2.607 -15.548 630 HA THR 82 HA THR 82 -12.611 0.150 -15.044 631 HB THR 82 HB THR 82 -15.327 -0.301 -14.624 632 HG1 THR 82 HG1 THR 82 -16.175 1.626 -13.966 633 HG21 THR 82 3HG2 THR 82 -13.012 -0.155 -13.145 634 HG22 THR 82 1HG2 THR 82 -14.615 -0.520 -12.508 635 HG23 THR 82 2HG2 THR 82 -14.000 1.132 -12.454 636 H LYS 83 H LYS 83 -15.302 0.864 -17.258 637 HA LYS 83 HA LYS 83 -15.892 -1.685 -18.122 638 HB2 LYS 83 2HB LYS 83 -16.114 1.026 -19.307 639 HB3 LYS 83 3HB LYS 83 -16.259 -0.332 -20.416 640 HG2 LYS 83 2HG LYS 83 -18.023 -1.256 -18.877 641 HG3 LYS 83 3HG LYS 83 -17.975 0.291 -18.029 642 HD2 LYS 83 2HD LYS 83 -18.649 1.465 -20.011 643 HD3 LYS 83 3HD LYS 83 -18.508 -0.001 -20.983 644 HE2 LYS 83 2HE LYS 83 -20.292 -1.020 -19.563 645 HE3 LYS 83 3HE LYS 83 -20.495 0.548 -18.783 646 HZ1 LYS 83 3HZ LYS 83 -21.993 0.886 -20.389 647 HZ2 LYS 83 1HZ LYS 83 -21.385 -0.346 -21.377 648 HZ3 LYS 83 2HZ LYS 83 -20.662 1.183 -21.391 649 H THR 84 H THR 84 -13.424 0.524 -19.402 650 HA THR 84 HA THR 84 -12.507 -1.101 -21.484 651 HB THR 84 HB THR 84 -10.838 0.829 -19.863 652 HG1 THR 84 HG1 THR 84 -11.805 2.404 -20.933 653 HG21 THR 84 3HG2 THR 84 -9.985 -0.886 -21.781 654 HG22 THR 84 1HG2 THR 84 -9.246 0.682 -21.458 655 HG23 THR 84 2HG2 THR 84 -10.422 0.513 -22.761 656 H PHE 85 H PHE 85 -10.999 -0.631 -18.281 657 HA PHE 85 HA PHE 85 -9.038 -2.552 -18.459 658 HB2 PHE 85 2HB PHE 85 -9.514 -0.862 -16.574 659 HB3 PHE 85 3HB PHE 85 -10.566 -2.104 -15.905 660 HD1 PHE 85 HD2 PHE 85 -9.510 -4.424 -15.510 661 HD2 PHE 85 HD1 PHE 85 -7.259 -0.855 -16.068 662 HE1 PHE 85 HE2 PHE 85 -7.572 -5.482 -14.426 663 HE2 PHE 85 HE1 PHE 85 -5.316 -1.907 -14.986 664 HZ PHE 85 HZ PHE 85 -5.471 -4.223 -14.162 665 H LEU 86 H LEU 86 -12.373 -2.975 -17.310 666 HA LEU 86 HA LEU 86 -12.146 -5.722 -16.718 667 HB2 LEU 86 2HB LEU 86 -13.946 -4.490 -15.779 668 HB3 LEU 86 3HB LEU 86 -14.505 -3.973 -17.368 669 HG LEU 86 HG LEU 86 -14.896 -6.532 -17.742 670 HD11 LEU 86 1HD1 LEU 86 -14.540 -6.293 -14.792 671 HD12 LEU 86 2HD1 LEU 86 -14.051 -7.586 -15.887 672 HD13 LEU 86 3HD1 LEU 86 -15.745 -7.411 -15.431 673 HD21 LEU 86 3HD2 LEU 86 -16.788 -5.240 -17.873 674 HD22 LEU 86 1HD2 LEU 86 -16.555 -4.539 -16.272 675 HD23 LEU 86 2HD2 LEU 86 -17.145 -6.193 -16.432 676 H ALA 87 H ALA 87 -12.982 -3.978 -19.655 677 HA ALA 87 HA ALA 87 -13.700 -6.368 -21.099 678 HB1 ALA 87 1HB ALA 87 -14.846 -4.422 -21.769 679 HB2 ALA 87 2HB ALA 87 -13.352 -3.494 -21.910 680 HB3 ALA 87 3HB ALA 87 -13.709 -4.774 -23.071 681 H ALA 88 H ALA 88 -10.826 -5.303 -20.028 682 HA ALA 88 HA ALA 88 -9.364 -6.217 -22.418 683 HB1 ALA 88 1HB ALA 88 -8.740 -3.977 -21.921 684 HB2 ALA 88 2HB ALA 88 -8.520 -4.351 -20.211 685 HB3 ALA 88 3HB ALA 88 -7.408 -5.013 -21.408 686 H ALA 89 H ALA 89 -10.164 -6.939 -19.189 687 HA ALA 89 HA ALA 89 -8.018 -8.956 -19.054 688 HB1 ALA 89 1HB ALA 89 -9.160 -7.153 -17.038 689 HB2 ALA 89 2HB ALA 89 -8.933 -8.820 -16.505 690 HB3 ALA 89 3HB ALA 89 -7.563 -7.899 -17.125 691 H ASP 90 H ASP 90 -11.364 -8.395 -17.943 692 HA ASP 90 HA ASP 90 -11.979 -11.067 -17.403 693 HB2 ASP 90 2HB ASP 90 -13.383 -9.269 -16.584 694 HB3 ASP 90 3HB ASP 90 -13.791 -8.790 -18.229 695 H HIS 91 H HIS 91 -13.338 -9.244 -20.144 696 HA HIS 91 HA HIS 91 -13.887 -9.863 -22.263 697 HB2 HIS 91 2HB HIS 91 -11.333 -10.401 -22.140 698 HB3 HIS 91 3HB HIS 91 -11.868 -12.079 -22.147 699 HD1 HIS 91 HD1 HIS 91 -10.208 -11.142 -24.478 700 HD2 HIS 91 HD2 HIS 91 -14.354 -10.882 -24.416 701 HE1 HIS 91 HE1 HIS 91 -10.912 -11.040 -26.890 702 H ASP 92 H ASP 92 -14.681 -11.536 -19.701 703 HA ASP 92 HA ASP 92 -15.792 -13.845 -21.142 704 HB2 ASP 92 2HB ASP 92 -15.890 -13.565 -18.159 705 HB3 ASP 92 3HB ASP 92 -15.839 -15.028 -19.140 706 H GLY 93 H GLY 93 -16.606 -10.859 -19.693 707 HA2 GLY 93 2HA GLY 93 -18.645 -9.751 -19.790 708 HA3 GLY 93 3HA GLY 93 -19.383 -11.222 -20.405 709 H ASP 94 H ASP 94 -17.522 -11.604 -17.567 710 HA ASP 94 HA ASP 94 -19.909 -12.223 -16.053 711 HB2 ASP 94 2HB ASP 94 -17.225 -12.287 -14.773 712 HB3 ASP 94 3HB ASP 94 -18.555 -13.436 -14.657 713 H GLY 95 H GLY 95 -17.408 -9.765 -16.118 714 HA2 GLY 95 2HA GLY 95 -17.716 -7.563 -15.329 715 HA3 GLY 95 3HA GLY 95 -19.034 -8.135 -14.317 716 H LYS 96 H LYS 96 -16.278 -10.102 -14.162 717 HA LYS 96 HA LYS 96 -15.141 -8.642 -11.899 718 HB2 LYS 96 2HB LYS 96 -15.161 -10.658 -10.488 719 HB3 LYS 96 3HB LYS 96 -16.788 -10.126 -10.890 720 HG2 LYS 96 2HG LYS 96 -15.988 -11.970 -12.878 721 HG3 LYS 96 3HG LYS 96 -15.585 -12.666 -11.306 722 HD2 LYS 96 2HD LYS 96 -18.234 -11.385 -11.497 723 HD3 LYS 96 3HD LYS 96 -18.021 -12.848 -12.461 724 HE2 LYS 96 2HE LYS 96 -17.504 -14.144 -10.559 725 HE3 LYS 96 3HE LYS 96 -17.270 -12.716 -9.554 726 HZ1 LYS 96 3HZ LYS 96 -19.687 -12.247 -9.913 727 HZ2 LYS 96 1HZ LYS 96 -19.358 -13.626 -8.990 728 HZ3 LYS 96 2HZ LYS 96 -19.825 -13.784 -10.607 729 H ILE 97 H ILE 97 -12.992 -8.652 -11.981 730 HA ILE 97 HA ILE 97 -11.607 -10.094 -14.012 731 HB ILE 97 HB ILE 97 -10.501 -8.518 -11.685 732 HG12 ILE 97 2HG1 ILE 97 -11.913 -7.183 -13.200 733 HG13 ILE 97 3HG1 ILE 97 -10.221 -6.711 -13.311 734 HG21 ILE 97 1HG2 ILE 97 -9.237 -10.046 -13.847 735 HG22 ILE 97 2HG2 ILE 97 -8.620 -8.409 -13.638 736 HG23 ILE 97 3HG2 ILE 97 -8.593 -9.540 -12.286 737 HD11 ILE 97 3HD1 ILE 97 -12.000 -7.683 -15.353 738 HD12 ILE 97 1HD1 ILE 97 -10.418 -6.919 -15.504 739 HD13 ILE 97 2HD1 ILE 97 -10.536 -8.662 -15.260 740 H GLY 98 H GLY 98 -10.150 -11.786 -13.834 741 HA2 GLY 98 2HA GLY 98 -10.189 -13.218 -11.248 742 HA3 GLY 98 3HA GLY 98 -10.316 -14.047 -12.793 743 H ALA 99 H ALA 99 -8.366 -14.571 -10.787 744 HA ALA 99 HA ALA 99 -5.888 -13.332 -11.409 745 HB1 ALA 99 1HB ALA 99 -6.593 -15.866 -9.954 746 HB2 ALA 99 2HB ALA 99 -4.929 -15.323 -10.173 747 HB3 ALA 99 3HB ALA 99 -6.073 -14.323 -9.277 748 H GLU 100 H GLU 100 -7.758 -15.365 -13.223 749 HA GLU 100 HA GLU 100 -5.460 -16.652 -14.524 750 HB2 GLU 100 2HB GLU 100 -7.316 -18.121 -13.782 751 HB3 GLU 100 3HB GLU 100 -8.407 -17.245 -14.847 752 HG2 GLU 100 2HG GLU 100 -7.576 -19.418 -15.742 753 HG3 GLU 100 3HG GLU 100 -7.286 -18.026 -16.784 754 H GLU 101 H GLU 101 -7.846 -14.216 -14.915 755 HA GLU 101 HA GLU 101 -7.189 -13.976 -17.776 756 HB2 GLU 101 2HB GLU 101 -9.280 -12.993 -18.162 757 HB3 GLU 101 3HB GLU 101 -9.625 -14.292 -17.029 758 HG2 GLU 101 2HG GLU 101 -9.186 -12.265 -15.312 759 HG3 GLU 101 3HG GLU 101 -9.831 -11.379 -16.693 760 H PHE 102 H PHE 102 -6.303 -12.771 -14.884 761 HA PHE 102 HA PHE 102 -6.296 -9.959 -15.474 762 HB2 PHE 102 2HB PHE 102 -6.395 -10.807 -13.154 763 HB3 PHE 102 3HB PHE 102 -4.784 -11.490 -13.347 764 HD1 PHE 102 HD2 PHE 102 -6.655 -8.287 -13.409 765 HD2 PHE 102 HD1 PHE 102 -2.894 -10.213 -12.893 766 HE1 PHE 102 HE2 PHE 102 -5.669 -6.157 -12.672 767 HE2 PHE 102 HE1 PHE 102 -1.902 -8.086 -12.154 768 HZ PHE 102 HZ PHE 102 -3.290 -6.054 -12.043 769 H GLN 103 H GLN 103 -3.574 -12.166 -14.814 770 HA GLN 103 HA GLN 103 -1.556 -10.592 -15.828 771 HB2 GLN 103 2HB GLN 103 -0.265 -12.675 -16.118 772 HB3 GLN 103 3HB GLN 103 -1.101 -12.617 -14.572 773 HG2 GLN 103 2HG GLN 103 -2.913 -13.877 -16.209 774 HG3 GLN 103 3HG GLN 103 -1.362 -14.499 -16.769 775 HE21 GLN 103 1HE2 GLN 103 -2.541 -13.566 -13.560 776 HE22 GLN 103 2HE2 GLN 103 -2.220 -15.088 -12.809 777 H GLU 104 H GLU 104 -3.766 -12.709 -17.552 778 HA GLU 104 HA GLU 104 -2.498 -12.835 -20.022 779 HB2 GLU 104 2HB GLU 104 -5.484 -12.598 -19.682 780 HB3 GLU 104 3HB GLU 104 -4.604 -13.448 -20.945 781 HG2 GLU 104 2HG GLU 104 -4.857 -14.219 -18.052 782 HG3 GLU 104 3HG GLU 104 -5.502 -15.067 -19.456 783 H MET 105 H MET 105 -4.304 -10.245 -18.543 784 HA MET 105 HA MET 105 -4.502 -8.713 -20.985 785 HB2 MET 105 2HB MET 105 -5.808 -7.227 -19.800 786 HB3 MET 105 3HB MET 105 -6.093 -8.711 -18.901 787 HG2 MET 105 2HG MET 105 -5.588 -7.505 -17.102 788 HG3 MET 105 3HG MET 105 -3.914 -7.688 -17.623 789 HE1 MET 105 3HE MET 105 -6.455 -4.716 -19.525 790 HE2 MET 105 1HE MET 105 -7.056 -5.947 -18.414 791 HE3 MET 105 2HE MET 105 -6.785 -4.301 -17.843 792 H VAL 106 H VAL 106 -2.184 -9.196 -18.543 793 HA VAL 106 HA VAL 106 -0.920 -6.615 -18.759 794 HB VAL 106 HB VAL 106 0.249 -9.130 -17.570 795 HG11 VAL 106 1HG1 VAL 106 1.210 -6.458 -17.910 796 HG12 VAL 106 2HG1 VAL 106 1.029 -6.804 -16.189 797 HG13 VAL 106 3HG1 VAL 106 2.025 -7.852 -17.200 798 HG21 VAL 106 3HG2 VAL 106 -2.091 -8.038 -16.744 799 HG22 VAL 106 1HG2 VAL 106 -0.963 -8.891 -15.690 800 HG23 VAL 106 2HG2 VAL 106 -0.935 -7.129 -15.771 801 H GLN 107 H GLN 107 0.625 -9.778 -19.197 802 HA GLN 107 HA GLN 107 2.531 -8.787 -21.030 803 HB2 GLN 107 2HB GLN 107 1.696 -11.661 -20.615 804 HB3 GLN 107 3HB GLN 107 3.207 -11.098 -21.319 805 HG2 GLN 107 2HG GLN 107 4.154 -10.873 -19.328 806 HG3 GLN 107 3HG GLN 107 2.776 -9.977 -18.691 807 HE21 GLN 107 1HE2 GLN 107 0.811 -11.419 -18.276 808 HE22 GLN 107 2HE2 GLN 107 1.130 -12.909 -17.462 809 H SER 108 H SER 108 -0.581 -10.359 -21.430 810 HA SER 108 HA SER 108 -0.297 -10.078 -24.349 811 HB2 SER 108 2HB SER 108 -0.609 -12.377 -23.944 812 HB3 SER 108 3HB SER 108 -1.803 -12.083 -22.680 813 HG SER 108 HG SER 108 -2.908 -12.705 -24.498 Start of MODEL 4 1 H1 SER 1 H SER 1 2.068 0.856 -4.028 2 HA SER 1 HA SER 1 2.677 0.228 -1.313 3 HB2 SER 1 2HB SER 1 0.733 -0.746 -0.556 4 HB3 SER 1 3HB SER 1 0.047 0.528 -1.564 5 HG SER 1 HG SER 1 -0.024 -2.192 -1.882 6 H LEU 2 H LEU 2 2.154 -2.415 -1.181 7 HA LEU 2 HA LEU 2 2.783 -4.480 -1.908 8 HB2 LEU 2 2HB LEU 2 1.856 -3.153 -4.246 9 HB3 LEU 2 3HB LEU 2 3.296 -4.077 -4.671 10 HG LEU 2 HG LEU 2 0.801 -5.190 -3.387 11 HD11 LEU 2 1HD1 LEU 2 0.074 -4.967 -5.515 12 HD12 LEU 2 2HD1 LEU 2 1.003 -6.449 -5.739 13 HD13 LEU 2 3HD1 LEU 2 1.705 -4.894 -6.183 14 HD21 LEU 2 3HD2 LEU 2 1.792 -7.300 -3.458 15 HD22 LEU 2 1HD2 LEU 2 3.077 -6.253 -2.854 16 HD23 LEU 2 2HD2 LEU 2 3.078 -6.765 -4.542 17 H THR 3 H THR 3 4.505 -2.514 -4.314 18 HA THR 3 HA THR 3 6.720 -2.373 -4.839 19 HB THR 3 HB THR 3 8.044 -2.525 -2.380 20 HG1 THR 3 HG1 THR 3 6.670 -1.192 -1.063 21 HG21 THR 3 3HG2 THR 3 7.458 -0.621 -4.413 22 HG22 THR 3 1HG2 THR 3 8.768 -0.600 -3.233 23 HG23 THR 3 2HG2 THR 3 7.220 0.151 -2.846 24 H ASP 4 H ASP 4 5.497 -5.081 -4.459 25 HA ASP 4 HA ASP 4 7.929 -6.614 -3.830 26 HB2 ASP 4 2HB ASP 4 5.539 -6.993 -2.719 27 HB3 ASP 4 3HB ASP 4 5.293 -7.963 -4.168 28 H ILE 5 H ILE 5 6.015 -5.527 -6.374 29 HA ILE 5 HA ILE 5 7.084 -7.614 -8.160 30 HB ILE 5 HB ILE 5 4.625 -5.938 -8.661 31 HG12 ILE 5 2HG1 ILE 5 3.959 -8.669 -8.369 32 HG13 ILE 5 3HG1 ILE 5 4.979 -8.256 -6.995 33 HG21 ILE 5 1HG2 ILE 5 6.116 -7.058 -10.530 34 HG22 ILE 5 2HG2 ILE 5 5.210 -8.495 -10.057 35 HG23 ILE 5 3HG2 ILE 5 4.355 -7.063 -10.630 36 HD11 ILE 5 3HD1 ILE 5 2.728 -7.901 -6.353 37 HD12 ILE 5 1HD1 ILE 5 3.464 -6.314 -6.573 38 HD13 ILE 5 2HD1 ILE 5 2.392 -6.968 -7.812 39 H LEU 6 H LEU 6 6.206 -4.179 -7.947 40 HA LEU 6 HA LEU 6 8.366 -3.599 -9.855 41 HB2 LEU 6 2HB LEU 6 5.576 -2.480 -9.820 42 HB3 LEU 6 3HB LEU 6 6.907 -1.687 -10.660 43 HG LEU 6 HG LEU 6 6.419 -4.525 -11.341 44 HD11 LEU 6 1HD1 LEU 6 4.339 -4.334 -12.090 45 HD12 LEU 6 2HD1 LEU 6 4.720 -2.836 -12.939 46 HD13 LEU 6 3HD1 LEU 6 4.237 -2.789 -11.244 47 HD21 LEU 6 3HD2 LEU 6 7.707 -2.196 -12.435 48 HD22 LEU 6 1HD2 LEU 6 6.570 -2.880 -13.597 49 HD23 LEU 6 2HD2 LEU 6 7.848 -3.888 -12.917 50 H SER 7 H SER 7 9.227 -1.413 -9.692 51 HA SER 7 HA SER 7 9.570 -0.639 -6.956 52 HB2 SER 7 2HB SER 7 10.952 -0.234 -9.417 53 HB3 SER 7 3HB SER 7 10.620 1.349 -8.713 54 HG SER 7 HG SER 7 12.216 -0.729 -7.767 55 HA PRO 8 HA PRO 8 6.631 2.587 -6.523 56 HB2 PRO 8 2HB PRO 8 8.023 4.475 -5.156 57 HB3 PRO 8 3HB PRO 8 7.486 2.959 -4.423 58 HG2 PRO 8 2HG PRO 8 10.179 3.690 -5.505 59 HG3 PRO 8 3HG PRO 8 9.771 2.819 -4.016 60 HD2 PRO 8 2HD PRO 8 10.589 1.553 -6.266 61 HD3 PRO 8 3HD PRO 8 9.442 0.824 -5.123 62 H SER 9 H SER 9 9.820 3.941 -7.387 63 HA SER 9 HA SER 9 8.952 6.330 -8.490 64 HB2 SER 9 2HB SER 9 11.231 4.991 -9.844 65 HB3 SER 9 3HB SER 9 11.114 6.619 -9.175 66 HG SER 9 HG SER 9 12.054 5.885 -7.460 67 H ASP 10 H ASP 10 9.436 3.196 -10.085 68 HA ASP 10 HA ASP 10 8.799 3.998 -12.688 69 HB2 ASP 10 2HB ASP 10 8.496 1.324 -11.315 70 HB3 ASP 10 3HB ASP 10 8.234 1.564 -13.040 71 H ILE 11 H ILE 11 6.758 3.053 -9.992 72 HA ILE 11 HA ILE 11 4.347 2.921 -11.533 73 HB ILE 11 HB ILE 11 4.800 3.089 -8.554 74 HG12 ILE 11 2HG1 ILE 11 3.683 0.725 -10.009 75 HG13 ILE 11 3HG1 ILE 11 5.418 1.015 -10.061 76 HG21 ILE 11 1HG2 ILE 11 2.654 4.015 -8.913 77 HG22 ILE 11 2HG2 ILE 11 2.257 2.806 -10.133 78 HG23 ILE 11 3HG2 ILE 11 2.390 2.338 -8.438 79 HD11 ILE 11 3HD1 ILE 11 3.693 0.431 -7.682 80 HD12 ILE 11 1HD1 ILE 11 5.084 -0.469 -8.286 81 HD13 ILE 11 2HD1 ILE 11 5.314 1.106 -7.525 82 H ALA 12 H ALA 12 5.658 5.266 -9.195 83 HA ALA 12 HA ALA 12 3.610 7.139 -9.308 84 HB1 ALA 12 1HB ALA 12 5.915 8.648 -9.000 85 HB2 ALA 12 2HB ALA 12 4.950 7.924 -7.714 86 HB3 ALA 12 3HB ALA 12 6.345 7.061 -8.362 87 H ALA 13 H ALA 13 6.115 6.434 -11.602 88 HA ALA 13 HA ALA 13 5.910 8.898 -13.052 89 HB1 ALA 13 1HB ALA 13 7.362 6.340 -13.376 90 HB2 ALA 13 2HB ALA 13 7.067 7.286 -14.836 91 HB3 ALA 13 3HB ALA 13 7.947 8.001 -13.486 92 H ALA 14 H ALA 14 4.157 5.941 -12.988 93 HA ALA 14 HA ALA 14 2.964 6.405 -15.613 94 HB1 ALA 14 1HB ALA 14 2.136 4.184 -13.797 95 HB2 ALA 14 2HB ALA 14 2.195 4.232 -15.559 96 HB3 ALA 14 3HB ALA 14 3.689 4.105 -14.630 97 H LEU 15 H LEU 15 1.997 6.159 -12.205 98 HA LEU 15 HA LEU 15 -0.738 6.590 -12.532 99 HB2 LEU 15 2HB LEU 15 1.138 7.234 -10.274 100 HB3 LEU 15 3HB LEU 15 -0.599 7.518 -10.170 101 HG LEU 15 HG LEU 15 0.745 4.842 -10.550 102 HD11 LEU 15 1HD1 LEU 15 0.936 4.831 -8.342 103 HD12 LEU 15 2HD1 LEU 15 -0.822 4.908 -8.230 104 HD13 LEU 15 3HD1 LEU 15 0.127 6.394 -8.217 105 HD21 LEU 15 3HD2 LEU 15 -1.538 3.947 -10.203 106 HD22 LEU 15 1HD2 LEU 15 -1.373 4.871 -11.696 107 HD23 LEU 15 2HD2 LEU 15 -2.165 5.594 -10.296 108 H ARG 16 H ARG 16 1.842 8.955 -11.875 109 HA ARG 16 HA ARG 16 0.112 11.209 -12.017 110 HB2 ARG 16 2HB ARG 16 3.105 11.189 -12.416 111 HB3 ARG 16 3HB ARG 16 2.107 12.541 -11.901 112 HG2 ARG 16 2HG ARG 16 1.677 11.519 -9.792 113 HG3 ARG 16 3HG ARG 16 2.431 10.010 -10.311 114 HD2 ARG 16 2HD ARG 16 4.328 10.767 -9.427 115 HD3 ARG 16 3HD ARG 16 4.376 11.948 -10.736 116 HE ARG 16 HE ARG 16 3.667 12.430 -7.973 117 HH11 ARG 16 1HH1 ARG 16 3.587 13.602 -11.251 118 HH12 ARG 16 2HH1 ARG 16 3.379 15.259 -10.791 119 HH21 ARG 16 1HH2 ARG 16 3.394 14.609 -7.356 120 HH22 ARG 16 2HH2 ARG 16 3.271 15.831 -8.575 121 H ASP 17 H ASP 17 2.018 9.434 -14.346 122 HA ASP 17 HA ASP 17 2.202 11.239 -16.428 123 HB2 ASP 17 2HB ASP 17 3.334 9.241 -16.796 124 HB3 ASP 17 3HB ASP 17 1.954 8.254 -16.323 125 H CYS 18 H CYS 18 -0.500 9.101 -15.599 126 HA CYS 18 HA CYS 18 -2.240 10.794 -17.250 127 HB2 CYS 18 2HB CYS 18 -2.013 7.797 -17.298 128 HB3 CYS 18 3HB CYS 18 -3.517 8.592 -17.747 129 HG CYS 18 HG CYS 18 -1.110 7.875 -19.690 130 H GLN 19 H GLN 19 -1.881 11.045 -14.503 131 HA GLN 19 HA GLN 19 -3.660 9.599 -12.905 132 HB2 GLN 19 2HB GLN 19 -3.582 11.630 -11.407 133 HB3 GLN 19 3HB GLN 19 -2.020 10.943 -11.832 134 HG2 GLN 19 2HG GLN 19 -1.487 12.700 -13.249 135 HG3 GLN 19 3HG GLN 19 -3.168 13.206 -13.411 136 HE21 GLN 19 1HE2 GLN 19 -0.674 12.802 -10.921 137 HE22 GLN 19 2HE2 GLN 19 -1.072 14.237 -10.045 138 H ALA 20 H ALA 20 -4.176 12.300 -15.058 139 HA ALA 20 HA ALA 20 -6.583 13.316 -14.213 140 HB1 ALA 20 1HB ALA 20 -6.794 14.270 -16.288 141 HB2 ALA 20 2HB ALA 20 -5.074 13.879 -16.283 142 HB3 ALA 20 3HB ALA 20 -6.214 12.833 -17.130 143 HA PRO 21 HA PRO 21 -9.608 10.150 -14.577 144 HB2 PRO 21 2HB PRO 21 -11.812 11.638 -15.126 145 HB3 PRO 21 3HB PRO 21 -11.054 11.596 -13.530 146 HG2 PRO 21 2HG PRO 21 -10.788 13.641 -15.700 147 HG3 PRO 21 3HG PRO 21 -10.981 13.882 -13.953 148 HD2 PRO 21 2HD PRO 21 -8.581 14.070 -15.193 149 HD3 PRO 21 3HD PRO 21 -8.751 13.486 -13.525 150 H ASP 22 H ASP 22 -10.909 9.010 -16.068 151 HA ASP 22 HA ASP 22 -11.179 8.062 -18.138 152 HB2 ASP 22 2HB ASP 22 -12.501 9.396 -19.638 153 HB3 ASP 22 3HB ASP 22 -12.974 9.805 -17.991 154 H SER 23 H SER 23 -8.491 8.974 -17.615 155 HA SER 23 HA SER 23 -7.630 9.549 -20.375 156 HB2 SER 23 2HB SER 23 -6.953 10.891 -17.880 157 HB3 SER 23 3HB SER 23 -5.519 10.327 -18.737 158 HG SER 23 HG SER 23 -6.010 11.593 -20.430 159 H PHE 24 H PHE 24 -7.017 7.807 -17.390 160 HA PHE 24 HA PHE 24 -4.650 6.499 -18.192 161 HB2 PHE 24 2HB PHE 24 -5.945 6.675 -15.852 162 HB3 PHE 24 3HB PHE 24 -6.520 5.090 -16.360 163 HD1 PHE 24 HD2 PHE 24 -3.385 7.047 -15.931 164 HD2 PHE 24 HD1 PHE 24 -5.241 3.216 -15.929 165 HE1 PHE 24 HE2 PHE 24 -1.291 6.036 -15.128 166 HE2 PHE 24 HE1 PHE 24 -3.150 2.199 -15.126 167 HZ PHE 24 HZ PHE 24 -1.170 3.609 -14.726 168 H SER 25 H SER 25 -4.654 3.969 -18.251 169 HA SER 25 HA SER 25 -6.879 2.829 -19.712 170 HB2 SER 25 2HB SER 25 -4.622 3.924 -21.104 171 HB3 SER 25 3HB SER 25 -4.630 2.172 -21.308 172 HG SER 25 HG SER 25 -6.317 4.059 -22.336 173 HA PRO 26 HA PRO 26 -5.529 -0.871 -17.778 174 HB2 PRO 26 2HB PRO 26 -6.344 -2.741 -19.569 175 HB3 PRO 26 3HB PRO 26 -7.466 -1.840 -18.543 176 HG2 PRO 26 2HG PRO 26 -6.725 -1.372 -21.405 177 HG3 PRO 26 3HG PRO 26 -8.323 -1.315 -20.640 178 HD2 PRO 26 2HD PRO 26 -6.897 0.917 -21.203 179 HD3 PRO 26 3HD PRO 26 -7.987 0.808 -19.806 180 H LYS 27 H LYS 27 -4.275 0.089 -20.809 181 HA LYS 27 HA LYS 27 -2.084 -1.863 -20.543 182 HB2 LYS 27 2HB LYS 27 -1.823 -1.838 -22.963 183 HB3 LYS 27 3HB LYS 27 -3.461 -2.315 -22.534 184 HG2 LYS 27 2HG LYS 27 -3.137 0.557 -22.969 185 HG3 LYS 27 3HG LYS 27 -2.801 -0.435 -24.390 186 HD2 LYS 27 2HD LYS 27 -5.281 -0.796 -22.727 187 HD3 LYS 27 3HD LYS 27 -5.204 0.351 -24.067 188 HE2 LYS 27 2HE LYS 27 -4.252 -2.379 -24.649 189 HE3 LYS 27 3HE LYS 27 -5.977 -2.222 -24.323 190 HZ1 LYS 27 3HZ LYS 27 -6.169 -0.615 -26.070 191 HZ2 LYS 27 1HZ LYS 27 -5.402 -1.988 -26.692 192 HZ3 LYS 27 2HZ LYS 27 -4.497 -0.607 -26.327 193 H LYS 28 H LYS 28 -2.199 0.697 -19.287 194 HA LYS 28 HA LYS 28 0.053 2.008 -20.657 195 HB2 LYS 28 2HB LYS 28 -2.416 3.237 -19.477 196 HB3 LYS 28 3HB LYS 28 -0.914 4.150 -19.522 197 HG2 LYS 28 2HG LYS 28 -2.121 2.891 -21.967 198 HG3 LYS 28 3HG LYS 28 -2.514 4.527 -21.433 199 HD2 LYS 28 2HD LYS 28 0.357 3.805 -21.683 200 HD3 LYS 28 3HD LYS 28 -0.565 4.034 -23.172 201 HE2 LYS 28 2HE LYS 28 -0.460 6.035 -20.920 202 HE3 LYS 28 3HE LYS 28 0.589 6.087 -22.336 203 HZ1 LYS 28 3HZ LYS 28 -1.977 7.126 -22.080 204 HZ2 LYS 28 1HZ LYS 28 -2.088 5.835 -23.168 205 HZ3 LYS 28 2HZ LYS 28 -1.005 7.101 -23.464 206 H PHE 29 H PHE 29 -0.286 0.052 -18.359 207 HA PHE 29 HA PHE 29 1.218 1.614 -16.364 208 HB2 PHE 29 2HB PHE 29 -1.219 0.417 -15.936 209 HB3 PHE 29 3HB PHE 29 -0.096 -0.812 -15.365 210 HD1 PHE 29 HD1 PHE 29 2.063 1.096 -14.398 211 HD2 PHE 29 HD2 PHE 29 -2.159 1.040 -13.864 212 HE1 PHE 29 HE1 PHE 29 2.319 2.316 -12.277 213 HE2 PHE 29 HE2 PHE 29 -1.910 2.261 -11.743 214 HZ PHE 29 HZ PHE 29 0.331 2.901 -10.947 215 H PHE 30 H PHE 30 1.510 -0.653 -18.679 216 HA PHE 30 HA PHE 30 3.488 -2.250 -17.201 217 HB2 PHE 30 2HB PHE 30 3.179 -3.988 -18.750 218 HB3 PHE 30 3HB PHE 30 1.556 -3.354 -18.498 219 HD1 PHE 30 HD2 PHE 30 0.417 -2.119 -20.240 220 HD2 PHE 30 HD1 PHE 30 4.331 -3.677 -20.845 221 HE1 PHE 30 HE2 PHE 30 0.178 -1.768 -22.664 222 HE2 PHE 30 HE1 PHE 30 4.099 -3.328 -23.270 223 HZ PHE 30 HZ PHE 30 2.020 -2.374 -24.182 224 H GLN 31 H GLN 31 3.183 0.262 -19.432 225 HA GLN 31 HA GLN 31 5.727 -0.261 -20.749 226 HB2 GLN 31 2HB GLN 31 4.261 2.296 -21.153 227 HB3 GLN 31 3HB GLN 31 5.123 1.300 -22.318 228 HG2 GLN 31 2HG GLN 31 3.263 -0.353 -22.167 229 HG3 GLN 31 3HG GLN 31 2.388 0.808 -21.171 230 HE21 GLN 31 1HE2 GLN 31 0.785 1.517 -22.402 231 HE22 GLN 31 2HE2 GLN 31 0.950 2.157 -23.998 232 H ILE 32 H ILE 32 4.365 1.746 -18.251 233 HA ILE 32 HA ILE 32 6.858 3.271 -18.028 234 HB ILE 32 HB ILE 32 4.303 3.686 -16.478 235 HG12 ILE 32 2HG1 ILE 32 4.378 5.768 -18.191 236 HG13 ILE 32 3HG1 ILE 32 5.121 4.532 -19.200 237 HG21 ILE 32 1HG2 ILE 32 5.954 4.771 -15.286 238 HG22 ILE 32 2HG2 ILE 32 6.880 5.172 -16.732 239 HG23 ILE 32 3HG2 ILE 32 5.393 6.045 -16.368 240 HD11 ILE 32 3HD1 ILE 32 2.863 3.346 -18.032 241 HD12 ILE 32 1HD1 ILE 32 2.367 4.946 -18.583 242 HD13 ILE 32 2HD1 ILE 32 3.100 3.810 -19.716 243 H SER 33 H SER 33 5.030 0.771 -16.492 244 HA SER 33 HA SER 33 6.688 0.907 -14.081 245 HB2 SER 33 2HB SER 33 4.102 0.601 -14.085 246 HB3 SER 33 3HB SER 33 4.467 -1.074 -14.501 247 HG SER 33 HG SER 33 4.921 0.319 -12.133 248 H GLY 34 H GLY 34 5.401 -1.780 -16.047 249 HA2 GLY 34 2HA GLY 34 7.146 -3.089 -17.299 250 HA3 GLY 34 3HA GLY 34 8.047 -3.070 -15.790 251 H MET 35 H MET 35 4.566 -3.490 -16.015 252 HA MET 35 HA MET 35 4.565 -5.774 -14.371 253 HB2 MET 35 2HB MET 35 2.386 -4.958 -16.295 254 HB3 MET 35 3HB MET 35 2.210 -5.922 -14.836 255 HG2 MET 35 2HG MET 35 2.746 -4.019 -13.460 256 HG3 MET 35 3HG MET 35 3.072 -3.041 -14.890 257 HE1 MET 35 3HE MET 35 -1.127 -4.723 -13.985 258 HE2 MET 35 1HE MET 35 0.246 -5.684 -14.535 259 HE3 MET 35 2HE MET 35 0.240 -5.005 -12.907 260 H SER 36 H SER 36 4.112 -5.437 -17.885 261 HA SER 36 HA SER 36 3.697 -8.100 -18.520 262 HB2 SER 36 2HB SER 36 4.318 -7.541 -20.768 263 HB3 SER 36 3HB SER 36 3.526 -6.122 -20.082 264 HG SER 36 HG SER 36 5.608 -5.252 -19.692 265 H LYS 37 H LYS 37 6.695 -6.393 -17.873 266 HA LYS 37 HA LYS 37 8.475 -8.387 -18.776 267 HB2 LYS 37 2HB LYS 37 9.040 -6.486 -16.508 268 HB3 LYS 37 3HB LYS 37 10.179 -7.177 -17.656 269 HG2 LYS 37 2HG LYS 37 8.081 -5.093 -18.209 270 HG3 LYS 37 3HG LYS 37 9.833 -4.876 -18.201 271 HD2 LYS 37 2HD LYS 37 8.239 -6.567 -20.126 272 HD3 LYS 37 3HD LYS 37 9.024 -5.027 -20.482 273 HE2 LYS 37 2HE LYS 37 11.204 -6.083 -19.899 274 HE3 LYS 37 3HE LYS 37 10.362 -7.624 -19.736 275 HZ1 LYS 37 3HZ LYS 37 10.460 -7.914 -21.915 276 HZ2 LYS 37 1HZ LYS 37 11.399 -6.513 -22.048 277 HZ3 LYS 37 2HZ LYS 37 9.718 -6.423 -22.211 278 H LYS 38 H LYS 38 6.397 -8.281 -16.097 279 HA LYS 38 HA LYS 38 7.969 -10.044 -14.424 280 HB2 LYS 38 2HB LYS 38 5.066 -9.298 -14.074 281 HB3 LYS 38 3HB LYS 38 6.177 -9.893 -12.848 282 HG2 LYS 38 2HG LYS 38 6.464 -7.251 -14.261 283 HG3 LYS 38 3HG LYS 38 5.698 -7.469 -12.685 284 HD2 LYS 38 2HD LYS 38 7.715 -7.211 -11.776 285 HD3 LYS 38 3HD LYS 38 8.149 -8.774 -12.472 286 HE2 LYS 38 2HE LYS 38 8.613 -7.334 -14.615 287 HE3 LYS 38 3HE LYS 38 8.751 -6.019 -13.449 288 HZ1 LYS 38 3HZ LYS 38 10.723 -6.757 -12.767 289 HZ2 LYS 38 1HZ LYS 38 10.735 -7.737 -14.145 290 HZ3 LYS 38 2HZ LYS 38 10.204 -8.364 -12.667 291 H SER 39 H SER 39 5.955 -11.715 -13.428 292 HA SER 39 HA SER 39 5.383 -13.422 -15.762 293 HB2 SER 39 2HB SER 39 7.198 -14.324 -14.323 294 HB3 SER 39 3HB SER 39 6.076 -14.347 -12.963 295 HG SER 39 HG SER 39 5.738 -16.306 -13.704 296 H SER 40 H SER 40 3.542 -14.869 -15.523 297 HA SER 40 HA SER 40 1.205 -13.587 -14.796 298 HB2 SER 40 2HB SER 40 0.658 -16.332 -14.532 299 HB3 SER 40 3HB SER 40 0.444 -15.337 -15.972 300 HG SER 40 HG SER 40 1.848 -16.734 -16.736 301 H SER 41 H SER 41 3.343 -15.560 -12.863 302 HA SER 41 HA SER 41 1.539 -15.902 -10.673 303 HB2 SER 41 2HB SER 41 4.441 -16.425 -11.154 304 HB3 SER 41 3HB SER 41 3.865 -16.374 -9.488 305 HG SER 41 HG SER 41 2.686 -18.136 -9.818 306 H GLN 42 H GLN 42 4.020 -13.566 -11.521 307 HA GLN 42 HA GLN 42 4.042 -12.257 -8.983 308 HB2 GLN 42 2HB GLN 42 5.265 -11.827 -11.638 309 HB3 GLN 42 3HB GLN 42 5.012 -10.377 -10.676 310 HG2 GLN 42 2HG GLN 42 6.240 -11.472 -8.814 311 HG3 GLN 42 3HG GLN 42 6.599 -12.812 -9.902 312 HE21 GLN 42 1HE2 GLN 42 6.915 -9.302 -9.605 313 HE22 GLN 42 2HE2 GLN 42 8.425 -9.191 -10.437 314 H LEU 43 H LEU 43 2.535 -11.547 -12.118 315 HA LEU 43 HA LEU 43 1.327 -9.123 -11.368 316 HB2 LEU 43 2HB LEU 43 0.243 -11.077 -13.382 317 HB3 LEU 43 3HB LEU 43 0.002 -9.331 -13.337 318 HG LEU 43 HG LEU 43 2.776 -10.362 -13.652 319 HD11 LEU 43 1HD1 LEU 43 0.623 -10.503 -15.735 320 HD12 LEU 43 2HD1 LEU 43 1.797 -11.734 -15.270 321 HD13 LEU 43 3HD1 LEU 43 2.322 -10.309 -16.166 322 HD21 LEU 43 3HD2 LEU 43 1.202 -7.930 -14.336 323 HD22 LEU 43 1HD2 LEU 43 2.604 -8.339 -15.325 324 HD23 LEU 43 2HD2 LEU 43 2.795 -8.074 -13.592 325 H LYS 44 H LYS 44 0.593 -12.351 -10.544 326 HA LYS 44 HA LYS 44 -2.203 -12.073 -10.101 327 HB2 LYS 44 2HB LYS 44 -0.110 -14.072 -9.436 328 HB3 LYS 44 3HB LYS 44 -1.564 -14.088 -8.446 329 HG2 LYS 44 2HG LYS 44 -2.938 -14.603 -10.264 330 HG3 LYS 44 3HG LYS 44 -1.708 -14.132 -11.439 331 HD2 LYS 44 2HD LYS 44 -1.395 -16.370 -11.566 332 HD3 LYS 44 3HD LYS 44 -0.380 -16.079 -10.151 333 HE2 LYS 44 2HE LYS 44 -1.644 -17.585 -9.099 334 HE3 LYS 44 3HE LYS 44 -2.914 -16.363 -9.090 335 HZ1 LYS 44 3HZ LYS 44 -2.722 -18.795 -10.615 336 HZ2 LYS 44 1HZ LYS 44 -3.152 -17.451 -11.548 337 HZ3 LYS 44 2HZ LYS 44 -4.085 -17.881 -10.204 338 H GLU 45 H GLU 45 0.630 -11.267 -8.270 339 HA GLU 45 HA GLU 45 -0.433 -11.197 -5.685 340 HB2 GLU 45 2HB GLU 45 1.777 -9.645 -7.015 341 HB3 GLU 45 3HB GLU 45 1.355 -9.386 -5.328 342 HG2 GLU 45 2HG GLU 45 2.195 -12.020 -6.516 343 HG3 GLU 45 3HG GLU 45 3.246 -10.925 -5.619 344 H ILE 46 H ILE 46 -0.317 -8.680 -8.185 345 HA ILE 46 HA ILE 46 -1.385 -6.563 -6.763 346 HB ILE 46 HB ILE 46 -1.878 -7.236 -9.666 347 HG12 ILE 46 2HG1 ILE 46 0.037 -5.122 -8.998 348 HG13 ILE 46 3HG1 ILE 46 0.523 -6.710 -8.414 349 HG21 ILE 46 1HG2 ILE 46 -3.361 -5.554 -9.476 350 HG22 ILE 46 2HG2 ILE 46 -2.650 -4.958 -7.977 351 HG23 ILE 46 3HG2 ILE 46 -1.921 -4.537 -9.526 352 HD11 ILE 46 3HD1 ILE 46 -0.371 -7.061 -11.055 353 HD12 ILE 46 1HD1 ILE 46 0.667 -5.636 -11.049 354 HD13 ILE 46 2HD1 ILE 46 1.276 -7.174 -10.436 355 H PHE 47 H PHE 47 -3.061 -9.206 -8.408 356 HA PHE 47 HA PHE 47 -5.674 -8.303 -8.222 357 HB2 PHE 47 2HB PHE 47 -5.635 -10.232 -9.432 358 HB3 PHE 47 3HB PHE 47 -4.369 -10.950 -8.441 359 HD1 PHE 47 HD1 PHE 47 -4.933 -12.105 -6.354 360 HD2 PHE 47 HD2 PHE 47 -7.943 -10.585 -8.951 361 HE1 PHE 47 HE1 PHE 47 -6.612 -13.501 -5.219 362 HE2 PHE 47 HE2 PHE 47 -9.627 -11.977 -7.820 363 HZ PHE 47 HZ PHE 47 -8.963 -13.437 -5.951 364 H ARG 48 H ARG 48 -3.695 -9.953 -5.808 365 HA ARG 48 HA ARG 48 -5.744 -10.324 -3.897 366 HB2 ARG 48 2HB ARG 48 -2.975 -10.887 -4.108 367 HB3 ARG 48 3HB ARG 48 -3.201 -9.972 -2.623 368 HG2 ARG 48 2HG ARG 48 -4.611 -12.521 -3.386 369 HG3 ARG 48 3HG ARG 48 -3.339 -12.338 -2.175 370 HD2 ARG 48 2HD ARG 48 -5.309 -10.463 -1.504 371 HD3 ARG 48 3HD ARG 48 -6.177 -11.940 -1.923 372 HE ARG 48 HE ARG 48 -4.463 -11.515 0.357 373 HH11 ARG 48 1HH1 ARG 48 -5.963 -13.857 -1.737 374 HH12 ARG 48 2HH1 ARG 48 -5.888 -15.139 -0.573 375 HH21 ARG 48 1HH2 ARG 48 -4.358 -13.194 1.897 376 HH22 ARG 48 2HH2 ARG 48 -4.975 -14.760 1.494 377 H ILE 49 H ILE 49 -4.208 -7.532 -4.986 378 HA ILE 49 HA ILE 49 -4.633 -6.080 -2.480 379 HB ILE 49 HB ILE 49 -3.482 -4.951 -5.024 380 HG12 ILE 49 2HG1 ILE 49 -2.129 -6.878 -4.422 381 HG13 ILE 49 3HG1 ILE 49 -1.251 -5.402 -4.037 382 HG21 ILE 49 1HG2 ILE 49 -2.287 -3.618 -3.041 383 HG22 ILE 49 2HG2 ILE 49 -3.831 -3.122 -3.733 384 HG23 ILE 49 3HG2 ILE 49 -3.793 -4.040 -2.228 385 HD11 ILE 49 3HD1 ILE 49 -2.499 -7.393 -2.201 386 HD12 ILE 49 1HD1 ILE 49 -0.868 -6.721 -2.190 387 HD13 ILE 49 2HD1 ILE 49 -2.234 -5.733 -1.669 388 H LEU 50 H LEU 50 -6.123 -6.668 -5.486 389 HA LEU 50 HA LEU 50 -7.701 -4.218 -5.422 390 HB2 LEU 50 2HB LEU 50 -7.225 -6.394 -7.377 391 HB3 LEU 50 3HB LEU 50 -8.786 -5.578 -7.444 392 HG LEU 50 HG LEU 50 -7.071 -3.462 -7.399 393 HD11 LEU 50 1HD1 LEU 50 -5.761 -5.445 -9.231 394 HD12 LEU 50 2HD1 LEU 50 -5.197 -5.181 -7.581 395 HD13 LEU 50 3HD1 LEU 50 -5.191 -3.850 -8.738 396 HD21 LEU 50 3HD2 LEU 50 -7.433 -3.473 -9.915 397 HD22 LEU 50 1HD2 LEU 50 -8.877 -3.531 -8.903 398 HD23 LEU 50 2HD2 LEU 50 -8.284 -5.000 -9.678 399 H ASP 51 H ASP 51 -7.933 -7.564 -4.569 400 HA ASP 51 HA ASP 51 -10.744 -7.825 -4.552 401 HB2 ASP 51 2HB ASP 51 -8.797 -9.603 -4.292 402 HB3 ASP 51 3HB ASP 51 -9.070 -9.315 -2.576 403 H ASN 52 H ASN 52 -12.154 -6.770 -3.335 404 HA ASN 52 HA ASN 52 -11.278 -5.727 -0.729 405 HB2 ASN 52 2HB ASN 52 -12.883 -4.629 -2.879 406 HB3 ASN 52 3HB ASN 52 -13.759 -4.589 -1.351 407 HD21 ASN 52 1HD2 ASN 52 -10.509 -3.928 -2.612 408 HD22 ASN 52 2HD2 ASN 52 -10.266 -2.480 -1.701 409 H ASP 53 H ASP 53 -12.908 -8.274 -2.002 410 HA ASP 53 HA ASP 53 -14.489 -8.608 0.454 411 HB2 ASP 53 2HB ASP 53 -15.841 -10.026 -1.563 412 HB3 ASP 53 3HB ASP 53 -16.387 -8.575 -0.726 413 H GLN 54 H GLN 54 -11.999 -9.705 -1.334 414 HA GLN 54 HA GLN 54 -10.865 -11.672 -1.537 415 HB2 GLN 54 2HB GLN 54 -12.235 -12.567 0.983 416 HB3 GLN 54 3HB GLN 54 -10.593 -12.898 0.448 417 HG2 GLN 54 2HG GLN 54 -11.527 -10.137 1.159 418 HG3 GLN 54 3HG GLN 54 -10.875 -11.257 2.353 419 HE21 GLN 54 1HE2 GLN 54 -10.148 -8.882 0.120 420 HE22 GLN 54 2HE2 GLN 54 -8.437 -9.105 0.045 421 H SER 55 H SER 55 -13.704 -11.499 -2.546 422 HA SER 55 HA SER 55 -14.893 -14.060 -2.253 423 HB2 SER 55 2HB SER 55 -16.040 -13.241 -4.503 424 HB3 SER 55 3HB SER 55 -16.456 -12.517 -2.950 425 HG SER 55 HG SER 55 -15.456 -11.323 -5.091 426 H GLY 56 H GLY 56 -12.219 -12.969 -4.027 427 HA2 GLY 56 2HA GLY 56 -10.807 -14.721 -4.991 428 HA3 GLY 56 3HA GLY 56 -12.273 -15.445 -5.637 429 H PHE 57 H PHE 57 -13.190 -12.590 -6.262 430 HA PHE 57 HA PHE 57 -11.462 -12.101 -8.589 431 HB2 PHE 57 2HB PHE 57 -14.486 -12.077 -8.668 432 HB3 PHE 57 3HB PHE 57 -13.397 -11.790 -10.022 433 HD1 PHE 57 HD1 PHE 57 -14.768 -14.321 -7.749 434 HD2 PHE 57 HD2 PHE 57 -12.323 -13.601 -11.158 435 HE1 PHE 57 HE1 PHE 57 -14.794 -16.725 -8.272 436 HE2 PHE 57 HE2 PHE 57 -12.346 -16.004 -11.687 437 HZ PHE 57 HZ PHE 57 -13.584 -17.570 -10.243 438 H ILE 58 H ILE 58 -12.112 -9.942 -9.657 439 HA ILE 58 HA ILE 58 -12.672 -7.978 -7.530 440 HB ILE 58 HB ILE 58 -10.827 -7.640 -9.898 441 HG12 ILE 58 2HG1 ILE 58 -9.865 -7.422 -7.098 442 HG13 ILE 58 3HG1 ILE 58 -10.249 -9.040 -7.675 443 HG21 ILE 58 1HG2 ILE 58 -11.933 -5.561 -9.341 444 HG22 ILE 58 2HG2 ILE 58 -11.509 -5.761 -7.642 445 HG23 ILE 58 3HG2 ILE 58 -10.244 -5.492 -8.840 446 HD11 ILE 58 3HD1 ILE 58 -7.879 -8.440 -7.949 447 HD12 ILE 58 1HD1 ILE 58 -8.674 -8.818 -9.477 448 HD13 ILE 58 2HD1 ILE 58 -8.359 -7.139 -9.038 449 H GLU 59 H GLU 59 -14.767 -7.474 -7.901 450 HA GLU 59 HA GLU 59 -15.852 -7.190 -10.537 451 HB2 GLU 59 2HB GLU 59 -17.135 -6.138 -8.029 452 HB3 GLU 59 3HB GLU 59 -17.910 -6.733 -9.490 453 HG2 GLU 59 2HG GLU 59 -18.255 -8.549 -8.213 454 HG3 GLU 59 3HG GLU 59 -16.627 -8.957 -8.753 455 H GLU 60 H GLU 60 -17.053 -5.146 -11.142 456 HA GLU 60 HA GLU 60 -15.287 -3.057 -11.548 457 HB2 GLU 60 2HB GLU 60 -18.277 -3.251 -11.656 458 HB3 GLU 60 3HB GLU 60 -17.489 -1.699 -11.898 459 HG2 GLU 60 2HG GLU 60 -16.438 -2.396 -13.853 460 HG3 GLU 60 3HG GLU 60 -16.677 -4.103 -13.482 461 H ASP 61 H ASP 61 -17.394 -3.683 -8.846 462 HA ASP 61 HA ASP 61 -17.434 -1.124 -7.691 463 HB2 ASP 61 2HB ASP 61 -18.801 -3.227 -7.074 464 HB3 ASP 61 3HB ASP 61 -17.421 -3.657 -6.068 465 H GLU 62 H GLU 62 -14.952 -3.501 -7.889 466 HA GLU 62 HA GLU 62 -13.335 -2.004 -5.932 467 HB2 GLU 62 2HB GLU 62 -11.952 -4.325 -6.340 468 HB3 GLU 62 3HB GLU 62 -13.076 -4.043 -5.018 469 HG2 GLU 62 2HG GLU 62 -14.867 -4.928 -6.639 470 HG3 GLU 62 3HG GLU 62 -13.502 -5.561 -7.558 471 H LEU 63 H LEU 63 -13.695 -2.842 -9.213 472 HA LEU 63 HA LEU 63 -10.953 -2.611 -9.991 473 HB2 LEU 63 2HB LEU 63 -13.198 -3.573 -11.181 474 HB3 LEU 63 3HB LEU 63 -13.013 -2.024 -12.003 475 HG LEU 63 HG LEU 63 -11.062 -4.321 -11.955 476 HD11 LEU 63 1HD1 LEU 63 -13.129 -3.415 -13.768 477 HD12 LEU 63 2HD1 LEU 63 -12.214 -4.922 -13.759 478 HD13 LEU 63 3HD1 LEU 63 -11.551 -3.492 -14.551 479 HD21 LEU 63 3HD2 LEU 63 -9.745 -2.342 -11.782 480 HD22 LEU 63 1HD2 LEU 63 -10.729 -1.510 -12.986 481 HD23 LEU 63 2HD2 LEU 63 -9.701 -2.860 -13.467 482 H LYS 64 H LYS 64 -13.611 -0.402 -9.564 483 HA LYS 64 HA LYS 64 -12.649 1.767 -11.070 484 HB2 LYS 64 2HB LYS 64 -14.081 3.141 -9.487 485 HB3 LYS 64 3HB LYS 64 -14.905 1.854 -10.358 486 HG2 LYS 64 2HG LYS 64 -15.246 0.608 -8.479 487 HG3 LYS 64 3HG LYS 64 -13.818 1.248 -7.661 488 HD2 LYS 64 2HD LYS 64 -15.860 2.053 -6.600 489 HD3 LYS 64 3HD LYS 64 -14.968 3.387 -7.336 490 HE2 LYS 64 2HE LYS 64 -16.556 3.753 -8.921 491 HE3 LYS 64 3HE LYS 64 -17.013 2.053 -9.011 492 HZ1 LYS 64 3HZ LYS 64 -17.891 2.569 -6.603 493 HZ2 LYS 64 1HZ LYS 64 -18.830 2.896 -7.971 494 HZ3 LYS 64 2HZ LYS 64 -17.980 4.145 -7.211 495 H TYR 65 H TYR 65 -11.795 0.556 -7.923 496 HA TYR 65 HA TYR 65 -10.257 2.944 -7.275 497 HB2 TYR 65 2HB TYR 65 -10.653 0.374 -5.729 498 HB3 TYR 65 3HB TYR 65 -9.798 1.794 -5.137 499 HD1 TYR 65 HD1 TYR 65 -11.185 4.022 -5.144 500 HD2 TYR 65 HD2 TYR 65 -12.904 0.130 -5.239 501 HE1 TYR 65 HE1 TYR 65 -13.298 4.940 -4.284 502 HE2 TYR 65 HE2 TYR 65 -15.022 1.039 -4.380 503 HH TYR 65 HH TYR 65 -15.859 2.934 -3.178 504 H PHE 66 H PHE 66 -9.587 1.063 -9.517 505 HA PHE 66 HA PHE 66 -7.367 -0.512 -8.934 506 HB2 PHE 66 2HB PHE 66 -8.367 -0.731 -11.081 507 HB3 PHE 66 3HB PHE 66 -8.156 0.981 -11.433 508 HD1 PHE 66 HD1 PHE 66 -6.249 -2.144 -10.808 509 HD2 PHE 66 HD2 PHE 66 -6.290 1.717 -12.601 510 HE1 PHE 66 HE1 PHE 66 -4.113 -2.642 -11.922 511 HE2 PHE 66 HE2 PHE 66 -4.155 1.224 -13.718 512 HZ PHE 66 HZ PHE 66 -3.063 -0.957 -13.380 513 H LEU 67 H LEU 67 -7.661 2.937 -9.280 514 HA LEU 67 HA LEU 67 -4.801 3.364 -9.435 515 HB2 LEU 67 2HB LEU 67 -6.637 5.598 -8.806 516 HB3 LEU 67 3HB LEU 67 -5.269 5.534 -9.916 517 HG LEU 67 HG LEU 67 -8.098 4.631 -10.391 518 HD11 LEU 67 1HD1 LEU 67 -6.689 6.236 -12.381 519 HD12 LEU 67 2HD1 LEU 67 -6.867 7.035 -10.819 520 HD13 LEU 67 3HD1 LEU 67 -8.292 6.448 -11.676 521 HD21 LEU 67 3HD2 LEU 67 -5.826 3.299 -11.305 522 HD22 LEU 67 1HD2 LEU 67 -6.343 4.307 -12.657 523 HD23 LEU 67 2HD2 LEU 67 -7.469 3.158 -11.932 524 H GLN 68 H GLN 68 -7.086 2.850 -6.999 525 HA GLN 68 HA GLN 68 -5.713 4.399 -4.971 526 HB2 GLN 68 2HB GLN 68 -8.270 3.036 -5.221 527 HB3 GLN 68 3HB GLN 68 -7.492 2.693 -3.682 528 HG2 GLN 68 2HG GLN 68 -8.401 4.589 -2.973 529 HG3 GLN 68 3HG GLN 68 -7.167 5.404 -3.933 530 HE21 GLN 68 1HE2 GLN 68 -8.080 4.907 -6.478 531 HE22 GLN 68 2HE2 GLN 68 -9.583 5.723 -6.719 532 H ARG 69 H ARG 69 -4.859 1.725 -6.502 533 HA ARG 69 HA ARG 69 -3.958 0.278 -4.110 534 HB2 ARG 69 2HB ARG 69 -3.540 -0.865 -6.818 535 HB3 ARG 69 3HB ARG 69 -3.985 -1.664 -5.316 536 HG2 ARG 69 2HG ARG 69 -5.805 -0.025 -7.067 537 HG3 ARG 69 3HG ARG 69 -5.795 -1.783 -6.916 538 HD2 ARG 69 2HD ARG 69 -6.662 0.281 -4.927 539 HD3 ARG 69 3HD ARG 69 -7.545 -1.121 -5.529 540 HE ARG 69 HE ARG 69 -5.491 -2.268 -4.247 541 HH11 ARG 69 1HH1 ARG 69 -7.699 0.253 -3.304 542 HH12 ARG 69 2HH1 ARG 69 -7.636 -0.143 -1.619 543 HH21 ARG 69 1HH2 ARG 69 -5.400 -2.799 -2.031 544 HH22 ARG 69 2HH2 ARG 69 -6.327 -1.879 -0.895 545 H PHE 70 H PHE 70 -2.866 1.992 -6.946 546 HA PHE 70 HA PHE 70 -0.072 1.388 -6.293 547 HB2 PHE 70 2HB PHE 70 -1.364 2.596 -8.740 548 HB3 PHE 70 3HB PHE 70 0.380 2.537 -8.506 549 HD1 PHE 70 HD1 PHE 70 -2.624 0.348 -8.607 550 HD2 PHE 70 HD2 PHE 70 1.575 0.688 -9.211 551 HE1 PHE 70 HE1 PHE 70 -2.580 -1.923 -9.553 552 HE2 PHE 70 HE2 PHE 70 1.626 -1.582 -10.159 553 HZ PHE 70 HZ PHE 70 -0.453 -2.891 -10.332 554 H GLU 71 H GLU 71 -2.438 3.836 -6.030 555 HA GLU 71 HA GLU 71 -0.361 5.813 -5.353 556 HB2 GLU 71 2HB GLU 71 -1.974 6.271 -7.320 557 HB3 GLU 71 3HB GLU 71 -3.189 6.532 -6.076 558 HG2 GLU 71 2HG GLU 71 -2.233 8.634 -6.777 559 HG3 GLU 71 3HG GLU 71 -1.808 8.298 -5.100 560 H SER 72 H SER 72 -3.114 4.051 -4.280 561 HA SER 72 HA SER 72 -4.314 4.030 -2.336 562 HB2 SER 72 2HB SER 72 -2.991 4.048 -0.325 563 HB3 SER 72 3HB SER 72 -2.020 3.311 -1.599 564 HG SER 72 HG SER 72 -0.677 4.950 -1.539 565 H GLY 73 H GLY 73 -5.237 6.102 -3.494 566 HA2 GLY 73 2HA GLY 73 -6.306 7.821 -1.751 567 HA3 GLY 73 3HA GLY 73 -4.726 8.549 -2.006 568 H ALA 74 H ALA 74 -4.920 7.381 -4.855 569 HA ALA 74 HA ALA 74 -5.740 9.754 -6.123 570 HB1 ALA 74 1HB ALA 74 -5.815 8.016 -8.158 571 HB2 ALA 74 2HB ALA 74 -4.312 8.653 -7.489 572 HB3 ALA 74 3HB ALA 74 -4.892 7.062 -6.997 573 H ARG 75 H ARG 75 -7.365 9.488 -8.097 574 HA ARG 75 HA ARG 75 -9.943 9.095 -6.887 575 HB2 ARG 75 2HB ARG 75 -10.838 9.944 -8.988 576 HB3 ARG 75 3HB ARG 75 -9.521 10.965 -8.428 577 HG2 ARG 75 2HG ARG 75 -8.006 9.843 -10.007 578 HG3 ARG 75 3HG ARG 75 -9.365 8.882 -10.595 579 HD2 ARG 75 2HD ARG 75 -8.932 11.846 -10.825 580 HD3 ARG 75 3HD ARG 75 -9.132 10.666 -12.119 581 HE ARG 75 HE ARG 75 -11.435 10.675 -11.750 582 HH11 ARG 75 1HH1 ARG 75 -9.765 12.708 -9.471 583 HH12 ARG 75 2HH1 ARG 75 -11.202 13.519 -8.943 584 HH21 ARG 75 1HH2 ARG 75 -13.334 11.735 -11.064 585 HH22 ARG 75 2HH2 ARG 75 -13.232 12.965 -9.850 586 H VAL 76 H VAL 76 -11.664 8.002 -8.391 587 HA VAL 76 HA VAL 76 -10.742 5.261 -8.785 588 HB VAL 76 HB VAL 76 -13.001 4.577 -8.691 589 HG11 VAL 76 1HG1 VAL 76 -13.723 5.363 -6.571 590 HG12 VAL 76 2HG1 VAL 76 -11.959 5.412 -6.556 591 HG13 VAL 76 3HG1 VAL 76 -12.882 6.899 -6.779 592 HG21 VAL 76 3HG2 VAL 76 -13.511 7.256 -9.704 593 HG22 VAL 76 1HG2 VAL 76 -14.468 5.784 -9.864 594 HG23 VAL 76 2HG2 VAL 76 -14.628 6.786 -8.422 595 H LEU 77 H LEU 77 -12.542 4.293 -10.594 596 HA LEU 77 HA LEU 77 -11.661 5.603 -13.069 597 HB2 LEU 77 2HB LEU 77 -12.708 2.807 -12.655 598 HB3 LEU 77 3HB LEU 77 -12.077 3.470 -14.161 599 HG LEU 77 HG LEU 77 -10.489 2.979 -11.643 600 HD11 LEU 77 1HD1 LEU 77 -10.480 1.541 -14.292 601 HD12 LEU 77 2HD1 LEU 77 -11.139 0.918 -12.780 602 HD13 LEU 77 3HD1 LEU 77 -9.407 1.217 -12.931 603 HD21 LEU 77 3HD2 LEU 77 -9.886 4.349 -14.209 604 HD22 LEU 77 1HD2 LEU 77 -8.629 3.341 -13.491 605 HD23 LEU 77 2HD2 LEU 77 -9.307 4.689 -12.577 606 H THR 78 H THR 78 -13.086 6.252 -14.617 607 HA THR 78 HA THR 78 -15.800 6.691 -13.797 608 HB THR 78 HB THR 78 -14.601 8.383 -15.111 609 HG1 THR 78 HG1 THR 78 -16.891 8.273 -15.284 610 HG21 THR 78 3HG2 THR 78 -14.857 7.225 -17.719 611 HG22 THR 78 1HG2 THR 78 -13.869 6.174 -16.705 612 HG23 THR 78 2HG2 THR 78 -13.418 7.865 -16.926 613 H ALA 79 H ALA 79 -17.438 6.393 -15.820 614 HA ALA 79 HA ALA 79 -17.872 3.582 -15.965 615 HB1 ALA 79 1HB ALA 79 -19.746 5.103 -15.852 616 HB2 ALA 79 2HB ALA 79 -19.265 5.855 -17.374 617 HB3 ALA 79 3HB ALA 79 -19.820 4.181 -17.354 618 H SER 80 H SER 80 -15.886 5.606 -17.720 619 HA SER 80 HA SER 80 -16.033 3.915 -20.123 620 HB2 SER 80 2HB SER 80 -16.307 6.150 -20.811 621 HB3 SER 80 3HB SER 80 -15.083 6.739 -19.686 622 HG SER 80 HG SER 80 -13.799 6.596 -21.340 623 H GLU 81 H GLU 81 -14.274 4.384 -17.330 624 HA GLU 81 HA GLU 81 -11.721 3.582 -18.509 625 HB2 GLU 81 2HB GLU 81 -12.522 4.542 -15.770 626 HB3 GLU 81 3HB GLU 81 -10.945 3.826 -16.075 627 HG2 GLU 81 2HG GLU 81 -11.944 6.141 -17.690 628 HG3 GLU 81 3HG GLU 81 -11.153 6.373 -16.132 629 H THR 82 H THR 82 -13.685 2.578 -15.703 630 HA THR 82 HA THR 82 -12.464 0.158 -15.200 631 HB THR 82 HB THR 82 -15.158 -0.353 -14.695 632 HG1 THR 82 HG1 THR 82 -16.073 1.552 -14.792 633 HG21 THR 82 3HG2 THR 82 -12.810 -0.170 -13.290 634 HG22 THR 82 1HG2 THR 82 -14.390 -0.525 -12.592 635 HG23 THR 82 2HG2 THR 82 -13.774 1.128 -12.586 636 H LYS 83 H LYS 83 -15.237 0.780 -17.340 637 HA LYS 83 HA LYS 83 -15.814 -1.780 -18.157 638 HB2 LYS 83 2HB LYS 83 -15.975 0.878 -19.525 639 HB3 LYS 83 3HB LYS 83 -16.338 -0.582 -20.435 640 HG2 LYS 83 2HG LYS 83 -17.676 -0.278 -17.817 641 HG3 LYS 83 3HG LYS 83 -18.188 0.806 -19.113 642 HD2 LYS 83 2HD LYS 83 -18.936 -0.939 -20.448 643 HD3 LYS 83 3HD LYS 83 -17.942 -2.135 -19.615 644 HE2 LYS 83 2HE LYS 83 -20.184 -2.529 -18.951 645 HE3 LYS 83 3HE LYS 83 -19.380 -1.756 -17.585 646 HZ1 LYS 83 3HZ LYS 83 -21.111 -0.372 -17.621 647 HZ2 LYS 83 1HZ LYS 83 -21.582 -0.823 -19.182 648 HZ3 LYS 83 2HZ LYS 83 -20.376 0.342 -18.967 649 H THR 84 H THR 84 -13.431 0.433 -19.603 650 HA THR 84 HA THR 84 -12.522 -1.163 -21.665 651 HB THR 84 HB THR 84 -10.763 0.622 -19.974 652 HG1 THR 84 HG1 THR 84 -11.435 2.273 -21.391 653 HG21 THR 84 3HG2 THR 84 -9.895 -1.003 -21.872 654 HG22 THR 84 1HG2 THR 84 -9.254 0.630 -21.701 655 HG23 THR 84 2HG2 THR 84 -10.482 0.288 -22.920 656 H PHE 85 H PHE 85 -11.096 -0.930 -18.400 657 HA PHE 85 HA PHE 85 -9.159 -2.877 -18.654 658 HB2 PHE 85 2HB PHE 85 -9.605 -1.301 -16.686 659 HB3 PHE 85 3HB PHE 85 -10.758 -2.508 -16.126 660 HD1 PHE 85 HD2 PHE 85 -9.941 -4.814 -15.589 661 HD2 PHE 85 HD1 PHE 85 -7.300 -1.559 -16.328 662 HE1 PHE 85 HE2 PHE 85 -8.117 -6.049 -14.493 663 HE2 PHE 85 HE1 PHE 85 -5.472 -2.789 -15.234 664 HZ PHE 85 HZ PHE 85 -5.879 -5.037 -14.314 665 H LEU 86 H LEU 86 -12.533 -3.284 -17.620 666 HA LEU 86 HA LEU 86 -12.395 -6.062 -17.179 667 HB2 LEU 86 2HB LEU 86 -14.192 -4.719 -16.280 668 HB3 LEU 86 3HB LEU 86 -14.733 -4.304 -17.905 669 HG LEU 86 HG LEU 86 -15.192 -6.787 -18.220 670 HD11 LEU 86 1HD1 LEU 86 -15.053 -6.791 -15.211 671 HD12 LEU 86 2HD1 LEU 86 -13.828 -7.499 -16.265 672 HD13 LEU 86 3HD1 LEU 86 -15.471 -8.141 -16.267 673 HD21 LEU 86 3HD2 LEU 86 -17.285 -6.112 -17.934 674 HD22 LEU 86 1HD2 LEU 86 -16.704 -4.711 -17.033 675 HD23 LEU 86 2HD2 LEU 86 -17.094 -6.206 -16.182 676 H ALA 87 H ALA 87 -13.000 -4.145 -20.053 677 HA ALA 87 HA ALA 87 -13.661 -6.489 -21.639 678 HB1 ALA 87 1HB ALA 87 -14.891 -4.478 -22.110 679 HB2 ALA 87 2HB ALA 87 -13.397 -3.579 -22.383 680 HB3 ALA 87 3HB ALA 87 -13.872 -4.861 -23.498 681 H ALA 88 H ALA 88 -10.873 -5.366 -20.452 682 HA ALA 88 HA ALA 88 -9.336 -6.065 -22.869 683 HB1 ALA 88 1HB ALA 88 -8.899 -3.787 -22.298 684 HB2 ALA 88 2HB ALA 88 -8.613 -4.208 -20.609 685 HB3 ALA 88 3HB ALA 88 -7.481 -4.738 -21.854 686 H ALA 89 H ALA 89 -10.091 -6.907 -19.657 687 HA ALA 89 HA ALA 89 -7.847 -8.818 -19.595 688 HB1 ALA 89 1HB ALA 89 -8.800 -6.959 -17.595 689 HB2 ALA 89 2HB ALA 89 -8.784 -8.617 -16.992 690 HB3 ALA 89 3HB ALA 89 -7.309 -7.901 -17.641 691 H ASP 90 H ASP 90 -11.145 -8.353 -18.311 692 HA ASP 90 HA ASP 90 -11.624 -11.076 -17.791 693 HB2 ASP 90 2HB ASP 90 -13.157 -8.593 -17.776 694 HB3 ASP 90 3HB ASP 90 -14.123 -9.976 -18.282 695 H HIS 91 H HIS 91 -13.222 -9.134 -20.318 696 HA HIS 91 HA HIS 91 -14.030 -9.690 -22.373 697 HB2 HIS 91 2HB HIS 91 -11.430 -10.102 -22.522 698 HB3 HIS 91 3HB HIS 91 -11.918 -11.788 -22.665 699 HD1 HIS 91 HD1 HIS 91 -10.551 -10.809 -25.057 700 HD2 HIS 91 HD2 HIS 91 -14.621 -10.180 -24.506 701 HE1 HIS 91 HE1 HIS 91 -11.487 -10.405 -27.356 702 H ASP 92 H ASP 92 -14.650 -11.404 -19.896 703 HA ASP 92 HA ASP 92 -15.702 -13.749 -21.337 704 HB2 ASP 92 2HB ASP 92 -15.918 -14.678 -18.926 705 HB3 ASP 92 3HB ASP 92 -14.322 -14.625 -19.669 706 H GLY 93 H GLY 93 -16.538 -10.844 -19.856 707 HA2 GLY 93 2HA GLY 93 -18.618 -9.865 -19.619 708 HA3 GLY 93 3HA GLY 93 -19.339 -11.352 -20.217 709 H ASP 94 H ASP 94 -17.166 -11.634 -17.572 710 HA ASP 94 HA ASP 94 -19.311 -12.553 -15.870 711 HB2 ASP 94 2HB ASP 94 -16.412 -12.266 -15.090 712 HB3 ASP 94 3HB ASP 94 -17.618 -13.358 -14.414 713 H GLY 95 H GLY 95 -17.044 -9.846 -15.969 714 HA2 GLY 95 2HA GLY 95 -17.456 -7.701 -15.116 715 HA3 GLY 95 3HA GLY 95 -18.807 -8.350 -14.198 716 H LYS 96 H LYS 96 -15.800 -10.025 -14.034 717 HA LYS 96 HA LYS 96 -14.845 -8.608 -11.707 718 HB2 LYS 96 2HB LYS 96 -14.962 -10.594 -10.223 719 HB3 LYS 96 3HB LYS 96 -16.546 -9.960 -10.652 720 HG2 LYS 96 2HG LYS 96 -15.620 -12.023 -12.483 721 HG3 LYS 96 3HG LYS 96 -15.752 -12.583 -10.814 722 HD2 LYS 96 2HD LYS 96 -18.017 -10.951 -11.651 723 HD3 LYS 96 3HD LYS 96 -17.815 -12.404 -12.632 724 HE2 LYS 96 2HE LYS 96 -17.421 -13.163 -9.945 725 HE3 LYS 96 3HE LYS 96 -18.858 -12.143 -9.981 726 HZ1 LYS 96 3HZ LYS 96 -18.650 -14.813 -10.722 727 HZ2 LYS 96 1HZ LYS 96 -18.933 -13.943 -12.145 728 HZ3 LYS 96 2HZ LYS 96 -20.006 -13.809 -10.844 729 H ILE 97 H ILE 97 -12.714 -8.574 -11.915 730 HA ILE 97 HA ILE 97 -11.318 -10.259 -13.722 731 HB ILE 97 HB ILE 97 -10.198 -8.467 -11.564 732 HG12 ILE 97 2HG1 ILE 97 -11.702 -7.417 -13.341 733 HG13 ILE 97 3HG1 ILE 97 -10.086 -6.738 -13.177 734 HG21 ILE 97 1HG2 ILE 97 -8.967 -10.086 -13.722 735 HG22 ILE 97 2HG2 ILE 97 -8.285 -8.493 -13.402 736 HG23 ILE 97 3HG2 ILE 97 -8.361 -9.693 -12.113 737 HD11 ILE 97 3HD1 ILE 97 -11.264 -7.514 -15.513 738 HD12 ILE 97 1HD1 ILE 97 -9.534 -7.286 -15.261 739 HD13 ILE 97 2HD1 ILE 97 -10.240 -8.896 -15.124 740 H GLY 98 H GLY 98 -9.671 -11.795 -13.270 741 HA2 GLY 98 2HA GLY 98 -9.753 -12.946 -10.556 742 HA3 GLY 98 3HA GLY 98 -9.984 -13.974 -11.963 743 H ALA 99 H ALA 99 -8.182 -15.242 -11.524 744 HA ALA 99 HA ALA 99 -5.578 -13.877 -11.701 745 HB1 ALA 99 1HB ALA 99 -6.106 -16.657 -10.665 746 HB2 ALA 99 2HB ALA 99 -4.603 -15.739 -10.557 747 HB3 ALA 99 3HB ALA 99 -6.022 -15.219 -9.647 748 H GLU 100 H GLU 100 -7.731 -15.481 -13.583 749 HA GLU 100 HA GLU 100 -5.623 -16.715 -15.232 750 HB2 GLU 100 2HB GLU 100 -7.754 -18.004 -14.227 751 HB3 GLU 100 3HB GLU 100 -8.471 -17.399 -15.714 752 HG2 GLU 100 2HG GLU 100 -5.841 -18.775 -15.861 753 HG3 GLU 100 3HG GLU 100 -7.294 -19.741 -15.615 754 H GLU 101 H GLU 101 -7.498 -14.031 -15.007 755 HA GLU 101 HA GLU 101 -7.447 -13.631 -17.922 756 HB2 GLU 101 2HB GLU 101 -9.529 -12.429 -17.841 757 HB3 GLU 101 3HB GLU 101 -9.767 -14.005 -17.100 758 HG2 GLU 101 2HG GLU 101 -9.131 -12.536 -14.930 759 HG3 GLU 101 3HG GLU 101 -9.923 -11.317 -15.927 760 H PHE 102 H PHE 102 -6.177 -12.717 -15.067 761 HA PHE 102 HA PHE 102 -6.136 -9.853 -15.519 762 HB2 PHE 102 2HB PHE 102 -6.263 -10.736 -13.222 763 HB3 PHE 102 3HB PHE 102 -4.703 -11.523 -13.443 764 HD1 PHE 102 HD1 PHE 102 -2.657 -10.150 -13.696 765 HD2 PHE 102 HD2 PHE 102 -6.422 -8.437 -12.694 766 HE1 PHE 102 HE1 PHE 102 -1.518 -8.114 -12.915 767 HE2 PHE 102 HE2 PHE 102 -5.290 -6.397 -11.913 768 HZ PHE 102 HZ PHE 102 -2.835 -6.233 -12.023 769 H GLN 103 H GLN 103 -3.516 -12.199 -14.932 770 HA GLN 103 HA GLN 103 -1.435 -10.696 -15.926 771 HB2 GLN 103 2HB GLN 103 -0.242 -12.830 -16.271 772 HB3 GLN 103 3HB GLN 103 -1.063 -12.766 -14.717 773 HG2 GLN 103 2HG GLN 103 -2.939 -13.905 -16.380 774 HG3 GLN 103 3HG GLN 103 -1.417 -14.595 -16.941 775 HE21 GLN 103 1HE2 GLN 103 -2.447 -13.621 -13.701 776 HE22 GLN 103 2HE2 GLN 103 -2.252 -15.178 -12.979 777 H GLU 104 H GLU 104 -3.725 -12.709 -17.681 778 HA GLU 104 HA GLU 104 -2.476 -12.809 -20.162 779 HB2 GLU 104 2HB GLU 104 -5.453 -12.520 -19.762 780 HB3 GLU 104 3HB GLU 104 -4.622 -13.318 -21.090 781 HG2 GLU 104 2HG GLU 104 -4.739 -14.235 -18.228 782 HG3 GLU 104 3HG GLU 104 -5.553 -14.964 -19.611 783 H MET 105 H MET 105 -4.265 -10.223 -18.633 784 HA MET 105 HA MET 105 -4.417 -8.628 -21.031 785 HB2 MET 105 2HB MET 105 -5.701 -7.153 -19.816 786 HB3 MET 105 3HB MET 105 -5.997 -8.644 -18.932 787 HG2 MET 105 2HG MET 105 -5.453 -7.479 -17.120 788 HG3 MET 105 3HG MET 105 -3.788 -7.653 -17.668 789 HE1 MET 105 3HE MET 105 -6.458 -4.764 -19.414 790 HE2 MET 105 1HE MET 105 -6.971 -5.849 -18.122 791 HE3 MET 105 2HE MET 105 -6.596 -4.164 -17.761 792 H VAL 106 H VAL 106 -2.098 -9.222 -18.621 793 HA VAL 106 HA VAL 106 -0.780 -6.657 -18.810 794 HB VAL 106 HB VAL 106 0.340 -9.183 -17.602 795 HG11 VAL 106 1HG1 VAL 106 1.303 -6.508 -17.904 796 HG12 VAL 106 2HG1 VAL 106 1.083 -6.862 -16.189 797 HG13 VAL 106 3HG1 VAL 106 2.104 -7.903 -17.181 798 HG21 VAL 106 3HG2 VAL 106 -2.018 -8.053 -16.819 799 HG22 VAL 106 1HG2 VAL 106 -0.945 -8.985 -15.775 800 HG23 VAL 106 2HG2 VAL 106 -0.855 -7.224 -15.784 801 H GLN 107 H GLN 107 0.719 -9.846 -19.189 802 HA GLN 107 HA GLN 107 2.683 -8.940 -20.980 803 HB2 GLN 107 2HB GLN 107 1.666 -11.754 -20.545 804 HB3 GLN 107 3HB GLN 107 3.164 -11.327 -21.362 805 HG2 GLN 107 2HG GLN 107 4.264 -11.083 -19.445 806 HG3 GLN 107 3HG GLN 107 2.959 -10.150 -18.715 807 HE21 GLN 107 1HE2 GLN 107 0.986 -11.531 -18.165 808 HE22 GLN 107 2HE2 GLN 107 1.314 -13.034 -17.380 809 H SER 108 H SER 108 -0.492 -10.352 -21.494 810 HA SER 108 HA SER 108 -0.129 -9.979 -24.395 811 HB2 SER 108 2HB SER 108 -0.635 -12.346 -23.291 812 HB3 SER 108 3HB SER 108 -2.293 -11.748 -23.348 813 HG SER 108 HG SER 108 -0.506 -11.919 -25.549 Start of MODEL 5 1 H1 SER 1 H SER 1 -0.854 -0.539 -0.638 2 HA SER 1 HA SER 1 1.442 0.531 -2.145 3 HB2 SER 1 2HB SER 1 1.584 -0.466 0.702 4 HB3 SER 1 3HB SER 1 2.804 0.443 -0.191 5 HG SER 1 HG SER 1 1.856 2.207 0.414 6 H LEU 2 H LEU 2 2.078 -0.996 -3.518 7 HA LEU 2 HA LEU 2 1.726 -3.803 -2.914 8 HB2 LEU 2 2HB LEU 2 1.338 -2.805 -5.175 9 HB3 LEU 2 3HB LEU 2 3.077 -2.548 -5.296 10 HG LEU 2 HG LEU 2 3.253 -5.099 -4.939 11 HD11 LEU 2 1HD1 LEU 2 0.396 -4.728 -4.969 12 HD12 LEU 2 2HD1 LEU 2 1.339 -6.171 -4.599 13 HD13 LEU 2 3HD1 LEU 2 0.908 -5.804 -6.269 14 HD21 LEU 2 3HD2 LEU 2 2.403 -5.295 -7.486 15 HD22 LEU 2 1HD2 LEU 2 3.944 -4.575 -7.021 16 HD23 LEU 2 2HD2 LEU 2 2.551 -3.543 -7.343 17 H THR 3 H THR 3 4.564 -2.163 -4.290 18 HA THR 3 HA THR 3 6.797 -2.572 -4.022 19 HB THR 3 HB THR 3 7.378 -2.799 -1.439 20 HG1 THR 3 HG1 THR 3 4.826 -1.551 -1.337 21 HG21 THR 3 3HG2 THR 3 7.177 -0.710 -3.266 22 HG22 THR 3 1HG2 THR 3 7.993 -0.667 -1.703 23 HG23 THR 3 2HG2 THR 3 6.317 -0.133 -1.839 24 H ASP 4 H ASP 4 5.104 -4.928 -4.414 25 HA ASP 4 HA ASP 4 6.890 -6.928 -3.198 26 HB2 ASP 4 2HB ASP 4 4.263 -6.687 -2.513 27 HB3 ASP 4 3HB ASP 4 4.162 -7.842 -3.840 28 H ILE 5 H ILE 5 5.945 -5.489 -5.975 29 HA ILE 5 HA ILE 5 6.836 -7.771 -7.571 30 HB ILE 5 HB ILE 5 4.354 -6.181 -8.233 31 HG12 ILE 5 2HG1 ILE 5 3.513 -8.724 -8.152 32 HG13 ILE 5 3HG1 ILE 5 4.823 -8.837 -6.981 33 HG21 ILE 5 1HG2 ILE 5 5.841 -6.892 -10.152 34 HG22 ILE 5 2HG2 ILE 5 5.458 -8.555 -9.710 35 HG23 ILE 5 3HG2 ILE 5 4.172 -7.458 -10.212 36 HD11 ILE 5 3HD1 ILE 5 2.947 -8.368 -5.699 37 HD12 ILE 5 1HD1 ILE 5 3.740 -6.803 -5.870 38 HD13 ILE 5 2HD1 ILE 5 2.331 -7.190 -6.858 39 H LEU 6 H LEU 6 5.508 -4.519 -8.198 40 HA LEU 6 HA LEU 6 7.796 -3.983 -9.941 41 HB2 LEU 6 2HB LEU 6 5.036 -2.924 -9.694 42 HB3 LEU 6 3HB LEU 6 6.278 -1.826 -10.291 43 HG LEU 6 HG LEU 6 5.882 -4.512 -11.558 44 HD11 LEU 6 1HD1 LEU 6 3.983 -3.954 -12.575 45 HD12 LEU 6 2HD1 LEU 6 4.560 -2.327 -12.935 46 HD13 LEU 6 3HD1 LEU 6 3.829 -2.676 -11.369 47 HD21 LEU 6 3HD2 LEU 6 7.454 -2.129 -12.037 48 HD22 LEU 6 1HD2 LEU 6 6.483 -2.569 -13.442 49 HD23 LEU 6 2HD2 LEU 6 7.601 -3.740 -12.742 50 H SER 7 H SER 7 8.854 -1.883 -9.841 51 HA SER 7 HA SER 7 9.538 -1.199 -7.141 52 HB2 SER 7 2HB SER 7 10.719 -0.897 -9.713 53 HB3 SER 7 3HB SER 7 10.592 0.707 -8.992 54 HG SER 7 HG SER 7 12.260 0.159 -7.855 55 HA PRO 8 HA PRO 8 6.964 2.276 -6.406 56 HB2 PRO 8 2HB PRO 8 8.646 3.996 -5.148 57 HB3 PRO 8 3HB PRO 8 8.034 2.522 -4.387 58 HG2 PRO 8 2HG PRO 8 10.678 3.018 -5.701 59 HG3 PRO 8 3HG PRO 8 10.322 2.159 -4.191 60 HD2 PRO 8 2HD PRO 8 10.812 0.869 -6.520 61 HD3 PRO 8 3HD PRO 8 9.707 0.228 -5.287 62 H SER 9 H SER 9 10.178 3.341 -7.539 63 HA SER 9 HA SER 9 9.454 5.824 -8.527 64 HB2 SER 9 2HB SER 9 11.424 4.509 -10.225 65 HB3 SER 9 3HB SER 9 11.607 5.913 -9.174 66 HG SER 9 HG SER 9 12.512 4.671 -7.753 67 H ASP 10 H ASP 10 9.482 2.697 -10.209 68 HA ASP 10 HA ASP 10 8.689 3.610 -12.727 69 HB2 ASP 10 2HB ASP 10 8.297 0.960 -11.338 70 HB3 ASP 10 3HB ASP 10 7.791 1.239 -13.002 71 H ILE 11 H ILE 11 6.821 2.866 -9.855 72 HA ILE 11 HA ILE 11 4.277 3.016 -11.176 73 HB ILE 11 HB ILE 11 4.984 3.077 -8.241 74 HG12 ILE 11 2HG1 ILE 11 3.595 0.824 -9.639 75 HG13 ILE 11 3HG1 ILE 11 5.341 0.985 -9.801 76 HG21 ILE 11 1HG2 ILE 11 2.881 4.183 -8.512 77 HG22 ILE 11 2HG2 ILE 11 2.304 2.929 -9.608 78 HG23 ILE 11 3HG2 ILE 11 2.566 2.558 -7.904 79 HD11 ILE 11 3HD1 ILE 11 3.723 0.450 -7.343 80 HD12 ILE 11 1HD1 ILE 11 5.059 -0.480 -8.022 81 HD13 ILE 11 2HD1 ILE 11 5.370 1.072 -7.244 82 H ALA 12 H ALA 12 6.012 5.127 -8.888 83 HA ALA 12 HA ALA 12 4.178 7.215 -8.811 84 HB1 ALA 12 1HB ALA 12 6.689 8.420 -8.633 85 HB2 ALA 12 2HB ALA 12 5.684 7.842 -7.304 86 HB3 ALA 12 3HB ALA 12 6.910 6.786 -8.006 87 H ALA 13 H ALA 13 6.338 6.265 -11.324 88 HA ALA 13 HA ALA 13 6.305 8.815 -12.681 89 HB1 ALA 13 1HB ALA 13 7.620 6.212 -13.063 90 HB2 ALA 13 2HB ALA 13 7.236 7.092 -14.542 91 HB3 ALA 13 3HB ALA 13 8.239 7.846 -13.302 92 H ALA 14 H ALA 14 4.464 5.874 -12.697 93 HA ALA 14 HA ALA 14 3.140 6.536 -15.206 94 HB1 ALA 14 1HB ALA 14 2.517 4.236 -13.367 95 HB2 ALA 14 2HB ALA 14 2.101 4.406 -15.072 96 HB3 ALA 14 3HB ALA 14 3.784 4.184 -14.593 97 H LEU 15 H LEU 15 2.513 6.514 -11.753 98 HA LEU 15 HA LEU 15 -0.263 6.856 -11.797 99 HB2 LEU 15 2HB LEU 15 1.883 7.604 -9.848 100 HB3 LEU 15 3HB LEU 15 0.211 8.085 -9.566 101 HG LEU 15 HG LEU 15 1.253 5.263 -9.790 102 HD11 LEU 15 1HD1 LEU 15 1.630 5.432 -7.613 103 HD12 LEU 15 2HD1 LEU 15 -0.087 5.746 -7.365 104 HD13 LEU 15 3HD1 LEU 15 1.030 7.090 -7.603 105 HD21 LEU 15 3HD2 LEU 15 -1.223 4.962 -8.855 106 HD22 LEU 15 1HD2 LEU 15 -0.849 4.936 -10.579 107 HD23 LEU 15 2HD2 LEU 15 -1.479 6.406 -9.835 108 H ARG 16 H ARG 16 2.271 9.347 -11.460 109 HA ARG 16 HA ARG 16 0.461 11.518 -11.721 110 HB2 ARG 16 2HB ARG 16 3.433 11.576 -12.250 111 HB3 ARG 16 3HB ARG 16 2.403 12.923 -11.782 112 HG2 ARG 16 2HG ARG 16 1.956 11.571 -9.644 113 HG3 ARG 16 3HG ARG 16 3.374 10.633 -10.119 114 HD2 ARG 16 2HD ARG 16 4.014 13.384 -10.384 115 HD3 ARG 16 3HD ARG 16 3.262 13.153 -8.806 116 HE ARG 16 HE ARG 16 5.102 11.959 -8.134 117 HH11 ARG 16 1HH1 ARG 16 5.178 12.361 -11.592 118 HH12 ARG 16 2HH1 ARG 16 6.789 11.746 -11.759 119 HH21 ARG 16 1HH2 ARG 16 7.224 11.147 -8.341 120 HH22 ARG 16 2HH2 ARG 16 7.951 11.054 -9.909 121 H ASP 17 H ASP 17 2.285 9.598 -13.986 122 HA ASP 17 HA ASP 17 2.378 11.224 -16.211 123 HB2 ASP 17 2HB ASP 17 3.469 9.159 -16.411 124 HB3 ASP 17 3HB ASP 17 2.048 8.253 -15.897 125 H CYS 18 H CYS 18 -0.285 9.106 -15.181 126 HA CYS 18 HA CYS 18 -2.112 10.767 -16.767 127 HB2 CYS 18 2HB CYS 18 -2.102 7.741 -16.722 128 HB3 CYS 18 3HB CYS 18 -3.341 8.737 -17.478 129 HG CYS 18 HG CYS 18 -0.887 7.474 -18.966 130 H GLN 19 H GLN 19 -1.683 11.037 -14.051 131 HA GLN 19 HA GLN 19 -3.324 9.535 -12.369 132 HB2 GLN 19 2HB GLN 19 -3.338 11.650 -10.943 133 HB3 GLN 19 3HB GLN 19 -1.765 10.966 -11.334 134 HG2 GLN 19 2HG GLN 19 -1.300 12.647 -12.901 135 HG3 GLN 19 3HG GLN 19 -2.981 13.175 -12.954 136 HE21 GLN 19 1HE2 GLN 19 0.034 13.392 -11.315 137 HE22 GLN 19 2HE2 GLN 19 -0.418 14.618 -10.186 138 H ALA 20 H ALA 20 -4.060 12.288 -14.430 139 HA ALA 20 HA ALA 20 -6.546 13.027 -13.495 140 HB1 ALA 20 1HB ALA 20 -7.003 13.881 -15.711 141 HB2 ALA 20 2HB ALA 20 -5.318 14.188 -15.288 142 HB3 ALA 20 3HB ALA 20 -5.724 12.875 -16.392 143 HA PRO 21 HA PRO 21 -9.301 9.682 -14.216 144 HB2 PRO 21 2HB PRO 21 -11.607 11.025 -14.714 145 HB3 PRO 21 3HB PRO 21 -10.887 10.917 -13.103 146 HG2 PRO 21 2HG PRO 21 -10.741 13.145 -15.097 147 HG3 PRO 21 3HG PRO 21 -10.996 13.227 -13.344 148 HD2 PRO 21 2HD PRO 21 -8.591 13.709 -14.491 149 HD3 PRO 21 3HD PRO 21 -8.751 12.981 -12.880 150 H ASP 22 H ASP 22 -10.236 8.480 -15.847 151 HA ASP 22 HA ASP 22 -10.310 7.704 -18.005 152 HB2 ASP 22 2HB ASP 22 -11.899 8.876 -19.382 153 HB3 ASP 22 3HB ASP 22 -12.436 8.988 -17.708 154 H SER 23 H SER 23 -7.858 9.040 -17.395 155 HA SER 23 HA SER 23 -7.206 10.205 -20.023 156 HB2 SER 23 2HB SER 23 -6.253 10.883 -17.262 157 HB3 SER 23 3HB SER 23 -5.194 11.173 -18.642 158 HG SER 23 HG SER 23 -7.258 12.233 -19.506 159 H PHE 24 H PHE 24 -6.919 7.482 -18.234 160 HA PHE 24 HA PHE 24 -4.384 6.753 -19.542 161 HB2 PHE 24 2HB PHE 24 -3.637 5.572 -17.655 162 HB3 PHE 24 3HB PHE 24 -4.305 7.056 -16.985 163 HD1 PHE 24 HD1 PHE 24 -4.758 3.446 -17.349 164 HD2 PHE 24 HD2 PHE 24 -6.324 7.030 -15.670 165 HE1 PHE 24 HE1 PHE 24 -6.229 2.116 -15.892 166 HE2 PHE 24 HE2 PHE 24 -7.797 5.706 -14.210 167 HZ PHE 24 HZ PHE 24 -7.750 3.246 -14.319 168 H SER 25 H SER 25 -4.146 4.295 -19.656 169 HA SER 25 HA SER 25 -6.754 3.040 -20.195 170 HB2 SER 25 2HB SER 25 -4.682 3.674 -22.083 171 HB3 SER 25 3HB SER 25 -4.868 1.923 -21.983 172 HG SER 25 HG SER 25 -6.913 3.824 -22.498 173 HA PRO 26 HA PRO 26 -5.368 -0.490 -17.992 174 HB2 PRO 26 2HB PRO 26 -6.335 -2.547 -19.476 175 HB3 PRO 26 3HB PRO 26 -7.370 -1.492 -18.507 176 HG2 PRO 26 2HG PRO 26 -6.804 -1.411 -21.446 177 HG3 PRO 26 3HG PRO 26 -8.349 -1.211 -20.598 178 HD2 PRO 26 2HD PRO 26 -6.915 0.889 -21.528 179 HD3 PRO 26 3HD PRO 26 -7.915 0.989 -20.065 180 H LYS 27 H LYS 27 -4.263 0.077 -21.165 181 HA LYS 27 HA LYS 27 -2.093 -1.877 -20.779 182 HB2 LYS 27 2HB LYS 27 -1.995 -2.177 -23.213 183 HB3 LYS 27 3HB LYS 27 -3.565 -2.641 -22.572 184 HG2 LYS 27 2HG LYS 27 -3.331 0.147 -23.490 185 HG3 LYS 27 3HG LYS 27 -3.226 -1.094 -24.741 186 HD2 LYS 27 2HD LYS 27 -5.448 -0.813 -22.717 187 HD3 LYS 27 3HD LYS 27 -5.533 -0.334 -24.414 188 HE2 LYS 27 2HE LYS 27 -6.329 -2.386 -24.793 189 HE3 LYS 27 3HE LYS 27 -4.675 -2.944 -24.547 190 HZ1 LYS 27 3HZ LYS 27 -6.972 -3.084 -22.736 191 HZ2 LYS 27 1HZ LYS 27 -5.433 -2.912 -22.054 192 HZ3 LYS 27 2HZ LYS 27 -5.774 -4.236 -23.050 193 H LYS 28 H LYS 28 -2.349 1.014 -20.117 194 HA LYS 28 HA LYS 28 -0.073 1.986 -21.718 195 HB2 LYS 28 2HB LYS 28 -2.547 3.393 -20.794 196 HB3 LYS 28 3HB LYS 28 -1.054 4.308 -20.958 197 HG2 LYS 28 2HG LYS 28 -2.154 2.627 -23.188 198 HG3 LYS 28 3HG LYS 28 -2.629 4.310 -22.941 199 HD2 LYS 28 2HD LYS 28 -0.199 4.914 -23.030 200 HD3 LYS 28 3HD LYS 28 0.137 3.246 -23.498 201 HE2 LYS 28 2HE LYS 28 -1.684 5.128 -24.994 202 HE3 LYS 28 3HE LYS 28 -0.007 4.798 -25.424 203 HZ1 LYS 28 3HZ LYS 28 -2.364 3.082 -25.686 204 HZ2 LYS 28 1HZ LYS 28 -0.876 2.340 -25.377 205 HZ3 LYS 28 2HZ LYS 28 -1.069 3.307 -26.751 206 H PHE 29 H PHE 29 -0.666 0.665 -18.911 207 HA PHE 29 HA PHE 29 0.913 2.571 -17.322 208 HB2 PHE 29 2HB PHE 29 -1.398 1.032 -16.707 209 HB3 PHE 29 3HB PHE 29 -0.072 0.414 -15.728 210 HD1 PHE 29 HD2 PHE 29 -2.158 3.336 -16.465 211 HD2 PHE 29 HD1 PHE 29 0.911 1.735 -13.988 212 HE1 PHE 29 HE2 PHE 29 -2.445 5.214 -14.901 213 HE2 PHE 29 HE1 PHE 29 0.628 3.610 -12.420 214 HZ PHE 29 HZ PHE 29 -1.050 5.353 -12.876 215 H PHE 30 H PHE 30 0.818 -0.664 -18.605 216 HA PHE 30 HA PHE 30 2.956 -1.731 -17.072 217 HB2 PHE 30 2HB PHE 30 2.790 -3.626 -18.417 218 HB3 PHE 30 3HB PHE 30 1.164 -2.957 -18.505 219 HD1 PHE 30 HD1 PHE 30 4.289 -3.521 -20.320 220 HD2 PHE 30 HD2 PHE 30 0.324 -1.991 -20.543 221 HE1 PHE 30 HE1 PHE 30 4.453 -3.465 -22.774 222 HE2 PHE 30 HE2 PHE 30 0.481 -1.933 -22.998 223 HZ PHE 30 HZ PHE 30 2.546 -2.672 -24.117 224 H GLN 31 H GLN 31 2.889 0.592 -19.490 225 HA GLN 31 HA GLN 31 5.495 -0.029 -20.600 226 HB2 GLN 31 2HB GLN 31 4.127 2.578 -21.089 227 HB3 GLN 31 3HB GLN 31 5.080 1.591 -22.189 228 HG2 GLN 31 2HG GLN 31 3.221 -0.036 -22.272 229 HG3 GLN 31 3HG GLN 31 2.267 1.053 -21.266 230 HE21 GLN 31 1HE2 GLN 31 2.907 3.486 -22.341 231 HE22 GLN 31 2HE2 GLN 31 2.323 3.577 -23.964 232 H ILE 32 H ILE 32 4.071 2.136 -18.253 233 HA ILE 32 HA ILE 32 6.622 3.518 -17.879 234 HB ILE 32 HB ILE 32 3.950 4.056 -16.576 235 HG12 ILE 32 2HG1 ILE 32 4.613 6.200 -18.210 236 HG13 ILE 32 3HG1 ILE 32 5.073 4.795 -19.165 237 HG21 ILE 32 1HG2 ILE 32 5.607 4.890 -15.135 238 HG22 ILE 32 2HG2 ILE 32 6.598 5.468 -16.472 239 HG23 ILE 32 3HG2 ILE 32 5.083 6.282 -16.082 240 HD11 ILE 32 3HD1 ILE 32 2.446 4.589 -17.895 241 HD12 ILE 32 1HD1 ILE 32 2.592 5.879 -19.088 242 HD13 ILE 32 2HD1 ILE 32 2.949 4.213 -19.543 243 H SER 33 H SER 33 4.512 1.210 -16.353 244 HA SER 33 HA SER 33 5.984 1.303 -13.844 245 HB2 SER 33 2HB SER 33 4.350 -0.319 -13.041 246 HB3 SER 33 3HB SER 33 3.518 1.021 -13.831 247 HG SER 33 HG SER 33 2.601 -0.526 -14.925 248 H GLY 34 H GLY 34 5.036 -1.335 -16.061 249 HA2 GLY 34 2HA GLY 34 6.893 -2.633 -17.077 250 HA3 GLY 34 3HA GLY 34 7.658 -2.579 -15.496 251 H MET 35 H MET 35 4.227 -3.120 -16.044 252 HA MET 35 HA MET 35 4.163 -5.400 -14.387 253 HB2 MET 35 2HB MET 35 2.096 -4.741 -16.476 254 HB3 MET 35 3HB MET 35 1.863 -5.570 -14.943 255 HG2 MET 35 2HG MET 35 2.488 -3.437 -13.797 256 HG3 MET 35 3HG MET 35 2.456 -2.657 -15.376 257 HE1 MET 35 3HE MET 35 -1.226 -4.581 -13.366 258 HE2 MET 35 1HE MET 35 0.160 -5.503 -13.949 259 HE3 MET 35 2HE MET 35 0.340 -4.419 -12.570 260 H SER 36 H SER 36 3.905 -5.085 -17.926 261 HA SER 36 HA SER 36 3.652 -7.760 -18.575 262 HB2 SER 36 2HB SER 36 4.163 -7.159 -20.771 263 HB3 SER 36 3HB SER 36 3.620 -5.629 -20.082 264 HG SER 36 HG SER 36 6.185 -6.447 -20.820 265 H LYS 37 H LYS 37 6.512 -5.945 -17.693 266 HA LYS 37 HA LYS 37 8.476 -7.760 -18.528 267 HB2 LYS 37 2HB LYS 37 8.698 -6.068 -16.046 268 HB3 LYS 37 3HB LYS 37 9.982 -6.572 -17.137 269 HG2 LYS 37 2HG LYS 37 7.842 -4.522 -17.629 270 HG3 LYS 37 3HG LYS 37 9.588 -4.278 -17.546 271 HD2 LYS 37 2HD LYS 37 9.386 -6.136 -19.530 272 HD3 LYS 37 3HD LYS 37 7.911 -5.197 -19.772 273 HE2 LYS 37 2HE LYS 37 9.345 -3.132 -19.702 274 HE3 LYS 37 3HE LYS 37 10.751 -4.194 -19.734 275 HZ1 LYS 37 3HZ LYS 37 9.910 -3.264 -21.936 276 HZ2 LYS 37 1HZ LYS 37 8.646 -4.380 -21.797 277 HZ3 LYS 37 2HZ LYS 37 10.247 -4.921 -21.870 278 H LYS 38 H LYS 38 6.212 -7.921 -15.958 279 HA LYS 38 HA LYS 38 7.715 -9.844 -14.403 280 HB2 LYS 38 2HB LYS 38 4.797 -9.151 -14.092 281 HB3 LYS 38 3HB LYS 38 5.881 -9.825 -12.882 282 HG2 LYS 38 2HG LYS 38 6.177 -7.076 -14.069 283 HG3 LYS 38 3HG LYS 38 5.345 -7.424 -12.552 284 HD2 LYS 38 2HD LYS 38 7.312 -7.230 -11.526 285 HD3 LYS 38 3HD LYS 38 7.811 -8.714 -12.341 286 HE2 LYS 38 2HE LYS 38 8.295 -7.019 -14.320 287 HE3 LYS 38 3HE LYS 38 8.439 -5.880 -12.982 288 HZ1 LYS 38 3HZ LYS 38 10.558 -6.626 -13.040 289 HZ2 LYS 38 1HZ LYS 38 10.150 -8.128 -13.702 290 HZ3 LYS 38 2HZ LYS 38 9.927 -7.844 -12.049 291 H SER 39 H SER 39 5.738 -11.631 -13.648 292 HA SER 39 HA SER 39 5.191 -13.071 -16.162 293 HB2 SER 39 2HB SER 39 7.040 -14.019 -14.672 294 HB3 SER 39 3HB SER 39 5.765 -14.416 -13.521 295 HG SER 39 HG SER 39 6.527 -15.898 -15.478 296 H SER 40 H SER 40 3.582 -14.999 -15.563 297 HA SER 40 HA SER 40 1.136 -13.710 -14.834 298 HB2 SER 40 2HB SER 40 0.407 -16.293 -14.982 299 HB3 SER 40 3HB SER 40 0.660 -15.293 -16.412 300 HG SER 40 HG SER 40 2.205 -17.362 -15.386 301 H SER 41 H SER 41 3.577 -15.055 -13.021 302 HA SER 41 HA SER 41 1.798 -15.983 -10.887 303 HB2 SER 41 2HB SER 41 4.773 -16.258 -11.326 304 HB3 SER 41 3HB SER 41 3.986 -16.719 -9.818 305 HG SER 41 HG SER 41 2.954 -18.336 -10.829 306 H GLN 42 H GLN 42 3.722 -13.311 -11.806 307 HA GLN 42 HA GLN 42 3.943 -12.294 -9.081 308 HB2 GLN 42 2HB GLN 42 5.112 -11.541 -11.722 309 HB3 GLN 42 3HB GLN 42 4.987 -10.303 -10.479 310 HG2 GLN 42 2HG GLN 42 6.175 -11.978 -8.955 311 HG3 GLN 42 3HG GLN 42 6.567 -12.846 -10.438 312 HE21 GLN 42 1HE2 GLN 42 6.802 -9.677 -8.897 313 HE22 GLN 42 2HE2 GLN 42 8.286 -9.220 -9.655 314 H LEU 43 H LEU 43 2.485 -11.369 -12.185 315 HA LEU 43 HA LEU 43 1.259 -9.007 -11.331 316 HB2 LEU 43 2HB LEU 43 0.158 -10.901 -13.394 317 HB3 LEU 43 3HB LEU 43 -0.107 -9.162 -13.283 318 HG LEU 43 HG LEU 43 2.676 -10.146 -13.677 319 HD11 LEU 43 1HD1 LEU 43 0.541 -10.112 -15.799 320 HD12 LEU 43 2HD1 LEU 43 1.549 -11.471 -15.303 321 HD13 LEU 43 3HD1 LEU 43 2.270 -10.100 -16.144 322 HD21 LEU 43 3HD2 LEU 43 1.064 -7.707 -14.256 323 HD22 LEU 43 1HD2 LEU 43 2.473 -8.060 -15.257 324 HD23 LEU 43 2HD2 LEU 43 2.658 -7.858 -13.514 325 H LYS 44 H LYS 44 0.466 -12.299 -10.725 326 HA LYS 44 HA LYS 44 -2.300 -11.911 -10.123 327 HB2 LYS 44 2HB LYS 44 -2.344 -14.159 -9.526 328 HB3 LYS 44 3HB LYS 44 -1.047 -14.103 -10.713 329 HG2 LYS 44 2HG LYS 44 0.510 -13.822 -8.684 330 HG3 LYS 44 3HG LYS 44 -0.867 -14.396 -7.741 331 HD2 LYS 44 2HD LYS 44 -0.065 -15.940 -10.156 332 HD3 LYS 44 3HD LYS 44 0.940 -16.065 -8.711 333 HE2 LYS 44 2HE LYS 44 -1.321 -16.479 -7.497 334 HE3 LYS 44 3HE LYS 44 -1.916 -16.863 -9.112 335 HZ1 LYS 44 3HZ LYS 44 0.016 -18.303 -7.451 336 HZ2 LYS 44 1HZ LYS 44 0.228 -18.352 -9.129 337 HZ3 LYS 44 2HZ LYS 44 -1.215 -18.905 -8.442 338 H GLU 45 H GLU 45 0.675 -11.562 -8.370 339 HA GLU 45 HA GLU 45 -0.286 -11.748 -5.742 340 HB2 GLU 45 2HB GLU 45 1.939 -9.943 -6.699 341 HB3 GLU 45 3HB GLU 45 1.720 -10.591 -5.079 342 HG2 GLU 45 2HG GLU 45 2.378 -12.159 -7.561 343 HG3 GLU 45 3HG GLU 45 3.471 -11.784 -6.230 344 H ILE 46 H ILE 46 -0.637 -9.287 -8.131 345 HA ILE 46 HA ILE 46 -1.258 -7.159 -6.305 346 HB ILE 46 HB ILE 46 -1.792 -7.377 -9.270 347 HG12 ILE 46 2HG1 ILE 46 0.290 -5.553 -8.266 348 HG13 ILE 46 3HG1 ILE 46 0.642 -7.261 -8.032 349 HG21 ILE 46 1HG2 ILE 46 -3.070 -5.579 -8.948 350 HG22 ILE 46 2HG2 ILE 46 -2.518 -5.386 -7.285 351 HG23 ILE 46 3HG2 ILE 46 -1.574 -4.708 -8.611 352 HD11 ILE 46 3HD1 ILE 46 -0.319 -6.931 -10.672 353 HD12 ILE 46 1HD1 ILE 46 0.908 -5.699 -10.377 354 HD13 ILE 46 2HD1 ILE 46 1.293 -7.403 -10.135 355 H PHE 47 H PHE 47 -3.047 -9.611 -8.039 356 HA PHE 47 HA PHE 47 -5.620 -8.559 -7.902 357 HB2 PHE 47 2HB PHE 47 -5.598 -10.462 -9.176 358 HB3 PHE 47 3HB PHE 47 -4.468 -11.291 -8.110 359 HD1 PHE 47 HD1 PHE 47 -5.255 -12.491 -6.152 360 HD2 PHE 47 HD2 PHE 47 -7.970 -10.560 -8.800 361 HE1 PHE 47 HE1 PHE 47 -7.117 -13.758 -5.161 362 HE2 PHE 47 HE2 PHE 47 -9.836 -11.823 -7.813 363 HZ PHE 47 HZ PHE 47 -9.412 -13.424 -5.991 364 H ARG 48 H ARG 48 -3.610 -9.883 -5.420 365 HA ARG 48 HA ARG 48 -5.739 -10.388 -3.557 366 HB2 ARG 48 2HB ARG 48 -2.986 -11.003 -3.733 367 HB3 ARG 48 3HB ARG 48 -3.195 -10.052 -2.268 368 HG2 ARG 48 2HG ARG 48 -4.803 -12.505 -2.945 369 HG3 ARG 48 3HG ARG 48 -3.370 -12.496 -1.915 370 HD2 ARG 48 2HD ARG 48 -5.517 -10.570 -1.249 371 HD3 ARG 48 3HD ARG 48 -5.857 -12.275 -0.957 372 HE ARG 48 HE ARG 48 -3.404 -11.870 0.165 373 HH11 ARG 48 1HH1 ARG 48 -6.541 -10.401 0.517 374 HH12 ARG 48 2HH1 ARG 48 -6.300 -9.977 2.180 375 HH21 ARG 48 1HH2 ARG 48 -3.075 -11.317 2.353 376 HH22 ARG 48 2HH2 ARG 48 -4.328 -10.498 3.223 377 H ILE 49 H ILE 49 -4.578 -7.598 -4.769 378 HA ILE 49 HA ILE 49 -4.929 -6.128 -2.240 379 HB ILE 49 HB ILE 49 -3.576 -5.092 -4.729 380 HG12 ILE 49 2HG1 ILE 49 -2.293 -6.977 -3.867 381 HG13 ILE 49 3HG1 ILE 49 -1.449 -5.470 -3.526 382 HG21 ILE 49 1HG2 ILE 49 -2.608 -3.712 -2.572 383 HG22 ILE 49 2HG2 ILE 49 -3.889 -3.159 -3.650 384 HG23 ILE 49 3HG2 ILE 49 -4.298 -3.964 -2.136 385 HD11 ILE 49 3HD1 ILE 49 -3.071 -7.098 -1.586 386 HD12 ILE 49 1HD1 ILE 49 -1.316 -6.933 -1.625 387 HD13 ILE 49 2HD1 ILE 49 -2.324 -5.542 -1.226 388 H LEU 50 H LEU 50 -6.315 -6.806 -5.243 389 HA LEU 50 HA LEU 50 -7.853 -4.319 -5.316 390 HB2 LEU 50 2HB LEU 50 -7.365 -6.546 -7.241 391 HB3 LEU 50 3HB LEU 50 -8.803 -5.545 -7.425 392 HG LEU 50 HG LEU 50 -6.841 -3.660 -7.219 393 HD11 LEU 50 1HD1 LEU 50 -5.602 -5.520 -9.149 394 HD12 LEU 50 2HD1 LEU 50 -5.330 -5.857 -7.439 395 HD13 LEU 50 3HD1 LEU 50 -4.867 -4.295 -8.114 396 HD21 LEU 50 3HD2 LEU 50 -7.342 -4.728 -9.928 397 HD22 LEU 50 1HD2 LEU 50 -7.516 -3.089 -9.301 398 HD23 LEU 50 2HD2 LEU 50 -8.762 -4.295 -8.975 399 H ASP 51 H ASP 51 -8.136 -7.667 -4.490 400 HA ASP 51 HA ASP 51 -10.954 -7.901 -4.641 401 HB2 ASP 51 2HB ASP 51 -9.020 -9.702 -4.321 402 HB3 ASP 51 3HB ASP 51 -9.427 -9.477 -2.622 403 H ASN 52 H ASN 52 -12.401 -6.845 -3.469 404 HA ASN 52 HA ASN 52 -11.632 -5.846 -0.817 405 HB2 ASN 52 2HB ASN 52 -13.264 -4.801 -2.989 406 HB3 ASN 52 3HB ASN 52 -14.116 -4.758 -1.449 407 HD21 ASN 52 1HD2 ASN 52 -10.823 -4.146 -2.632 408 HD22 ASN 52 2HD2 ASN 52 -10.621 -2.648 -1.797 409 H ASP 53 H ASP 53 -13.225 -8.394 -2.194 410 HA ASP 53 HA ASP 53 -14.804 -8.825 0.250 411 HB2 ASP 53 2HB ASP 53 -16.119 -10.207 -1.818 412 HB3 ASP 53 3HB ASP 53 -16.697 -8.794 -0.939 413 H GLN 54 H GLN 54 -12.300 -9.842 -1.582 414 HA GLN 54 HA GLN 54 -11.136 -11.786 -1.828 415 HB2 GLN 54 2HB GLN 54 -12.490 -12.752 0.675 416 HB3 GLN 54 3HB GLN 54 -10.848 -13.062 0.126 417 HG2 GLN 54 2HG GLN 54 -11.792 -10.321 0.897 418 HG3 GLN 54 3HG GLN 54 -11.135 -11.463 2.068 419 HE21 GLN 54 1HE2 GLN 54 -10.421 -9.056 -0.147 420 HE22 GLN 54 2HE2 GLN 54 -8.707 -9.267 -0.217 421 H SER 55 H SER 55 -13.989 -11.629 -2.815 422 HA SER 55 HA SER 55 -15.147 -14.205 -2.584 423 HB2 SER 55 2HB SER 55 -16.265 -13.341 -4.848 424 HB3 SER 55 3HB SER 55 -16.733 -12.695 -3.275 425 HG SER 55 HG SER 55 -16.309 -10.991 -4.667 426 H GLY 56 H GLY 56 -12.462 -13.075 -4.307 427 HA2 GLY 56 2HA GLY 56 -11.039 -14.809 -5.293 428 HA3 GLY 56 3HA GLY 56 -12.497 -15.514 -5.975 429 H PHE 57 H PHE 57 -13.405 -12.647 -6.548 430 HA PHE 57 HA PHE 57 -11.645 -12.107 -8.840 431 HB2 PHE 57 2HB PHE 57 -14.667 -12.064 -8.953 432 HB3 PHE 57 3HB PHE 57 -13.561 -11.754 -10.287 433 HD1 PHE 57 HD1 PHE 57 -14.965 -14.328 -8.081 434 HD2 PHE 57 HD2 PHE 57 -12.494 -13.545 -11.457 435 HE1 PHE 57 HE1 PHE 57 -15.001 -16.720 -8.657 436 HE2 PHE 57 HE2 PHE 57 -12.527 -15.936 -12.040 437 HZ PHE 57 HZ PHE 57 -13.782 -17.526 -10.639 438 H ILE 58 H ILE 58 -12.218 -9.920 -9.849 439 HA ILE 58 HA ILE 58 -12.820 -8.005 -7.689 440 HB ILE 58 HB ILE 58 -10.909 -7.649 -10.002 441 HG12 ILE 58 2HG1 ILE 58 -10.051 -7.443 -7.164 442 HG13 ILE 58 3HG1 ILE 58 -10.404 -9.057 -7.772 443 HG21 ILE 58 1HG2 ILE 58 -12.006 -5.562 -9.499 444 HG22 ILE 58 2HG2 ILE 58 -11.683 -5.768 -7.778 445 HG23 ILE 58 3HG2 ILE 58 -10.348 -5.506 -8.901 446 HD11 ILE 58 3HD1 ILE 58 -8.022 -8.402 -7.935 447 HD12 ILE 58 1HD1 ILE 58 -8.750 -8.840 -9.480 448 HD13 ILE 58 2HD1 ILE 58 -8.489 -7.143 -9.078 449 H GLU 59 H GLU 59 -14.966 -7.663 -8.154 450 HA GLU 59 HA GLU 59 -15.982 -7.262 -10.770 451 HB2 GLU 59 2HB GLU 59 -17.266 -6.214 -8.257 452 HB3 GLU 59 3HB GLU 59 -18.046 -6.748 -9.739 453 HG2 GLU 59 2HG GLU 59 -18.449 -8.595 -8.532 454 HG3 GLU 59 3HG GLU 59 -16.815 -9.023 -9.038 455 H GLU 60 H GLU 60 -17.092 -5.222 -11.450 456 HA GLU 60 HA GLU 60 -15.293 -3.146 -11.771 457 HB2 GLU 60 2HB GLU 60 -18.303 -3.181 -11.949 458 HB3 GLU 60 3HB GLU 60 -17.345 -1.770 -12.378 459 HG2 GLU 60 2HG GLU 60 -16.484 -2.749 -14.258 460 HG3 GLU 60 3HG GLU 60 -16.679 -4.384 -13.629 461 H ASP 61 H ASP 61 -17.482 -3.780 -9.155 462 HA ASP 61 HA ASP 61 -17.606 -1.205 -8.026 463 HB2 ASP 61 2HB ASP 61 -18.878 -3.473 -7.471 464 HB3 ASP 61 3HB ASP 61 -17.616 -3.600 -6.249 465 H GLU 62 H GLU 62 -15.120 -3.600 -8.059 466 HA GLU 62 HA GLU 62 -13.600 -2.084 -6.044 467 HB2 GLU 62 2HB GLU 62 -12.179 -4.392 -6.412 468 HB3 GLU 62 3HB GLU 62 -13.356 -4.125 -5.134 469 HG2 GLU 62 2HG GLU 62 -15.077 -5.013 -6.824 470 HG3 GLU 62 3HG GLU 62 -13.676 -5.625 -7.701 471 H LEU 63 H LEU 63 -13.584 -3.351 -9.301 472 HA LEU 63 HA LEU 63 -10.897 -2.960 -9.956 473 HB2 LEU 63 2HB LEU 63 -13.119 -3.858 -11.264 474 HB3 LEU 63 3HB LEU 63 -12.805 -2.332 -12.088 475 HG LEU 63 HG LEU 63 -10.879 -4.641 -11.829 476 HD11 LEU 63 1HD1 LEU 63 -12.950 -3.985 -13.744 477 HD12 LEU 63 2HD1 LEU 63 -11.993 -5.456 -13.572 478 HD13 LEU 63 3HD1 LEU 63 -11.360 -4.097 -14.500 479 HD21 LEU 63 3HD2 LEU 63 -9.796 -2.411 -11.829 480 HD22 LEU 63 1HD2 LEU 63 -10.583 -2.066 -13.370 481 HD23 LEU 63 2HD2 LEU 63 -9.409 -3.377 -13.254 482 H LYS 64 H LYS 64 -13.501 -0.703 -9.578 483 HA LYS 64 HA LYS 64 -12.447 1.452 -11.059 484 HB2 LYS 64 2HB LYS 64 -13.916 2.845 -9.518 485 HB3 LYS 64 3HB LYS 64 -14.725 1.593 -10.451 486 HG2 LYS 64 2HG LYS 64 -15.306 0.420 -8.623 487 HG3 LYS 64 3HG LYS 64 -13.794 0.775 -7.784 488 HD2 LYS 64 2HD LYS 64 -15.574 1.835 -6.585 489 HD3 LYS 64 3HD LYS 64 -14.641 3.093 -7.399 490 HE2 LYS 64 2HE LYS 64 -16.294 3.331 -9.094 491 HE3 LYS 64 3HE LYS 64 -17.148 1.888 -8.551 492 HZ1 LYS 64 3HZ LYS 64 -16.847 3.899 -6.513 493 HZ2 LYS 64 1HZ LYS 64 -18.222 3.030 -6.982 494 HZ3 LYS 64 2HZ LYS 64 -17.764 4.415 -7.837 495 H TYR 65 H TYR 65 -11.287 -0.029 -8.295 496 HA TYR 65 HA TYR 65 -9.996 2.403 -7.289 497 HB2 TYR 65 2HB TYR 65 -10.453 -0.330 -6.132 498 HB3 TYR 65 3HB TYR 65 -9.219 0.730 -5.460 499 HD1 TYR 65 HD1 TYR 65 -10.483 3.360 -5.593 500 HD2 TYR 65 HD2 TYR 65 -12.163 -0.411 -4.563 501 HE1 TYR 65 HE1 TYR 65 -12.193 4.498 -4.240 502 HE2 TYR 65 HE2 TYR 65 -13.878 0.716 -3.208 503 HH TYR 65 HH TYR 65 -14.934 2.848 -2.976 504 H PHE 66 H PHE 66 -9.035 1.713 -9.717 505 HA PHE 66 HA PHE 66 -6.737 -0.008 -9.486 506 HB2 PHE 66 2HB PHE 66 -7.948 0.136 -11.606 507 HB3 PHE 66 3HB PHE 66 -7.595 1.858 -11.707 508 HD1 PHE 66 HD1 PHE 66 -6.196 -1.519 -11.965 509 HD2 PHE 66 HD2 PHE 66 -5.436 2.647 -12.384 510 HE1 PHE 66 HE1 PHE 66 -4.110 -2.025 -13.168 511 HE2 PHE 66 HE2 PHE 66 -3.349 2.149 -13.589 512 HZ PHE 66 HZ PHE 66 -2.684 -0.189 -13.983 513 H LEU 67 H LEU 67 -7.424 3.299 -8.941 514 HA LEU 67 HA LEU 67 -4.598 4.052 -9.104 515 HB2 LEU 67 2HB LEU 67 -6.758 5.964 -8.355 516 HB3 LEU 67 3HB LEU 67 -5.255 6.255 -9.228 517 HG LEU 67 HG LEU 67 -7.883 5.267 -10.250 518 HD11 LEU 67 1HD1 LEU 67 -6.246 6.958 -11.938 519 HD12 LEU 67 2HD1 LEU 67 -6.520 7.672 -10.349 520 HD13 LEU 67 3HD1 LEU 67 -7.892 7.198 -11.352 521 HD21 LEU 67 3HD2 LEU 67 -6.715 3.589 -11.253 522 HD22 LEU 67 1HD2 LEU 67 -5.187 4.468 -11.199 523 HD23 LEU 67 2HD2 LEU 67 -6.398 4.880 -12.413 524 H GLN 68 H GLN 68 -6.820 2.930 -6.872 525 HA GLN 68 HA GLN 68 -5.669 4.356 -4.606 526 HB2 GLN 68 2HB GLN 68 -8.145 2.939 -5.135 527 HB3 GLN 68 3HB GLN 68 -7.408 2.405 -3.630 528 HG2 GLN 68 2HG GLN 68 -8.365 4.153 -2.668 529 HG3 GLN 68 3HG GLN 68 -7.202 5.159 -3.529 530 HE21 GLN 68 1HE2 GLN 68 -8.121 4.931 -6.107 531 HE22 GLN 68 2HE2 GLN 68 -9.678 5.669 -6.231 532 H ARG 69 H ARG 69 -4.732 1.839 -6.419 533 HA ARG 69 HA ARG 69 -3.743 0.248 -4.154 534 HB2 ARG 69 2HB ARG 69 -3.156 -1.404 -6.038 535 HB3 ARG 69 3HB ARG 69 -4.851 -1.205 -5.615 536 HG2 ARG 69 2HG ARG 69 -5.117 0.340 -7.516 537 HG3 ARG 69 3HG ARG 69 -3.434 0.043 -7.959 538 HD2 ARG 69 2HD ARG 69 -5.160 -2.331 -7.584 539 HD3 ARG 69 3HD ARG 69 -5.486 -1.328 -8.997 540 HE ARG 69 HE ARG 69 -2.716 -2.074 -8.619 541 HH11 ARG 69 1HH1 ARG 69 -5.765 -2.838 -10.116 542 HH12 ARG 69 2HH1 ARG 69 -5.058 -3.811 -11.363 543 HH21 ARG 69 1HH2 ARG 69 -1.773 -3.352 -10.256 544 HH22 ARG 69 2HH2 ARG 69 -2.787 -4.103 -11.441 545 H PHE 70 H PHE 70 -2.775 2.178 -6.892 546 HA PHE 70 HA PHE 70 0.048 1.563 -6.414 547 HB2 PHE 70 2HB PHE 70 -1.404 2.960 -8.655 548 HB3 PHE 70 3HB PHE 70 0.348 3.032 -8.495 549 HD1 PHE 70 HD2 PHE 70 1.647 0.867 -8.518 550 HD2 PHE 70 HD1 PHE 70 -2.451 1.119 -9.640 551 HE1 PHE 70 HE2 PHE 70 1.843 -1.279 -9.705 552 HE2 PHE 70 HE1 PHE 70 -2.262 -1.027 -10.828 553 HZ PHE 70 HZ PHE 70 -0.112 -2.229 -10.862 554 H GLU 71 H GLU 71 -2.324 4.018 -5.919 555 HA GLU 71 HA GLU 71 -0.225 5.887 -5.036 556 HB2 GLU 71 2HB GLU 71 -1.859 6.556 -6.918 557 HB3 GLU 71 3HB GLU 71 -3.062 6.681 -5.642 558 HG2 GLU 71 2HG GLU 71 -2.172 8.570 -4.794 559 HG3 GLU 71 3HG GLU 71 -0.518 8.091 -5.169 560 H SER 72 H SER 72 -3.239 4.308 -4.197 561 HA SER 72 HA SER 72 -4.278 3.952 -2.204 562 HB2 SER 72 2HB SER 72 -1.826 3.428 -1.572 563 HB3 SER 72 3HB SER 72 -1.842 5.004 -0.781 564 HG SER 72 HG SER 72 -2.662 3.915 0.821 565 H GLY 73 H GLY 73 -5.422 5.958 -3.133 566 HA2 GLY 73 2HA GLY 73 -6.544 7.528 -1.335 567 HA3 GLY 73 3HA GLY 73 -5.003 8.355 -1.512 568 H ALA 74 H ALA 74 -5.161 7.336 -4.447 569 HA ALA 74 HA ALA 74 -6.077 9.768 -5.552 570 HB1 ALA 74 1HB ALA 74 -5.932 8.424 -7.741 571 HB2 ALA 74 2HB ALA 74 -4.453 8.674 -6.812 572 HB3 ALA 74 3HB ALA 74 -5.295 7.126 -6.730 573 H ARG 75 H ARG 75 -7.624 9.396 -7.653 574 HA ARG 75 HA ARG 75 -10.210 8.873 -6.488 575 HB2 ARG 75 2HB ARG 75 -11.104 9.710 -8.602 576 HB3 ARG 75 3HB ARG 75 -9.877 10.798 -7.968 577 HG2 ARG 75 2HG ARG 75 -8.250 9.584 -9.516 578 HG3 ARG 75 3HG ARG 75 -9.687 8.919 -10.294 579 HD2 ARG 75 2HD ARG 75 -8.836 11.792 -10.077 580 HD3 ARG 75 3HD ARG 75 -9.122 10.841 -11.534 581 HE ARG 75 HE ARG 75 -11.541 10.829 -10.391 582 HH11 ARG 75 1HH1 ARG 75 -9.287 13.411 -11.001 583 HH12 ARG 75 2HH1 ARG 75 -10.517 14.617 -11.184 584 HH21 ARG 75 1HH2 ARG 75 -13.170 12.408 -10.630 585 HH22 ARG 75 2HH2 ARG 75 -12.725 14.046 -10.972 586 H VAL 76 H VAL 76 -11.836 7.743 -8.094 587 HA VAL 76 HA VAL 76 -10.752 5.063 -8.538 588 HB VAL 76 HB VAL 76 -12.976 4.246 -8.490 589 HG11 VAL 76 1HG1 VAL 76 -13.633 4.769 -6.317 590 HG12 VAL 76 2HG1 VAL 76 -11.910 5.152 -6.329 591 HG13 VAL 76 3HG1 VAL 76 -13.103 6.445 -6.457 592 HG21 VAL 76 3HG2 VAL 76 -13.632 6.942 -9.361 593 HG22 VAL 76 1HG2 VAL 76 -14.517 5.433 -9.585 594 HG23 VAL 76 2HG2 VAL 76 -14.710 6.355 -8.094 595 H LEU 77 H LEU 77 -12.498 4.049 -10.378 596 HA LEU 77 HA LEU 77 -11.704 5.494 -12.810 597 HB2 LEU 77 2HB LEU 77 -12.631 2.639 -12.604 598 HB3 LEU 77 3HB LEU 77 -11.841 3.418 -13.973 599 HG LEU 77 HG LEU 77 -10.613 2.601 -11.349 600 HD11 LEU 77 1HD1 LEU 77 -10.412 1.707 -14.188 601 HD12 LEU 77 2HD1 LEU 77 -10.565 0.750 -12.715 602 HD13 LEU 77 3HD1 LEU 77 -9.028 1.520 -13.111 603 HD21 LEU 77 3HD2 LEU 77 -9.474 4.335 -13.534 604 HD22 LEU 77 1HD2 LEU 77 -8.507 3.551 -12.285 605 HD23 LEU 77 2HD2 LEU 77 -9.710 4.761 -11.838 606 H THR 78 H THR 78 -13.172 6.065 -14.355 607 HA THR 78 HA THR 78 -15.905 6.317 -13.519 608 HB THR 78 HB THR 78 -14.809 8.097 -14.816 609 HG1 THR 78 HG1 THR 78 -16.576 8.461 -16.162 610 HG21 THR 78 3HG2 THR 78 -15.049 6.945 -17.435 611 HG22 THR 78 1HG2 THR 78 -13.966 5.966 -16.448 612 HG23 THR 78 2HG2 THR 78 -13.644 7.686 -16.671 613 H ALA 79 H ALA 79 -17.560 5.925 -15.480 614 HA ALA 79 HA ALA 79 -17.784 3.096 -15.696 615 HB1 ALA 79 1HB ALA 79 -19.727 4.606 -15.513 616 HB2 ALA 79 2HB ALA 79 -19.379 5.214 -17.132 617 HB3 ALA 79 3HB ALA 79 -19.832 3.525 -16.903 618 H SER 80 H SER 80 -16.012 5.319 -17.453 619 HA SER 80 HA SER 80 -16.121 3.723 -19.917 620 HB2 SER 80 2HB SER 80 -16.482 6.120 -20.232 621 HB3 SER 80 3HB SER 80 -14.957 6.474 -19.421 622 HG SER 80 HG SER 80 -13.850 5.636 -21.117 623 H GLU 81 H GLU 81 -14.280 4.183 -17.139 624 HA GLU 81 HA GLU 81 -11.762 3.419 -18.408 625 HB2 GLU 81 2HB GLU 81 -12.485 4.312 -15.623 626 HB3 GLU 81 3HB GLU 81 -10.906 3.639 -16.003 627 HG2 GLU 81 2HG GLU 81 -11.333 5.590 -17.939 628 HG3 GLU 81 3HG GLU 81 -11.926 6.296 -16.436 629 H THR 82 H THR 82 -13.618 2.343 -15.555 630 HA THR 82 HA THR 82 -12.352 -0.069 -15.136 631 HB THR 82 HB THR 82 -14.948 -0.690 -14.490 632 HG1 THR 82 HG1 THR 82 -15.684 1.383 -13.568 633 HG21 THR 82 3HG2 THR 82 -12.560 -0.037 -13.179 634 HG22 THR 82 1HG2 THR 82 -13.999 -0.771 -12.473 635 HG23 THR 82 2HG2 THR 82 -13.798 0.981 -12.445 636 H LYS 83 H LYS 83 -15.210 0.547 -17.163 637 HA LYS 83 HA LYS 83 -15.773 -2.007 -18.006 638 HB2 LYS 83 2HB LYS 83 -16.117 0.695 -19.188 639 HB3 LYS 83 3HB LYS 83 -16.304 -0.675 -20.275 640 HG2 LYS 83 2HG LYS 83 -17.970 -1.617 -18.667 641 HG3 LYS 83 3HG LYS 83 -17.871 -0.098 -17.773 642 HD2 LYS 83 2HD LYS 83 -18.373 0.971 -20.103 643 HD3 LYS 83 3HD LYS 83 -18.992 -0.636 -20.492 644 HE2 LYS 83 2HE LYS 83 -19.863 1.004 -18.116 645 HE3 LYS 83 3HE LYS 83 -20.724 0.941 -19.653 646 HZ1 LYS 83 3HZ LYS 83 -21.818 -0.746 -18.712 647 HZ2 LYS 83 1HZ LYS 83 -20.655 -0.978 -17.506 648 HZ3 LYS 83 2HZ LYS 83 -20.436 -1.666 -19.036 649 H THR 84 H THR 84 -13.420 0.255 -19.402 650 HA THR 84 HA THR 84 -12.582 -1.312 -21.551 651 HB THR 84 HB THR 84 -10.839 0.569 -19.950 652 HG1 THR 84 HG1 THR 84 -12.177 2.042 -20.655 653 HG21 THR 84 3HG2 THR 84 -9.966 -1.056 -21.850 654 HG22 THR 84 1HG2 THR 84 -9.381 0.602 -21.718 655 HG23 THR 84 2HG2 THR 84 -10.630 0.199 -22.896 656 H PHE 85 H PHE 85 -10.999 -0.968 -18.369 657 HA PHE 85 HA PHE 85 -8.999 -2.825 -18.666 658 HB2 PHE 85 2HB PHE 85 -9.531 -1.271 -16.673 659 HB3 PHE 85 3HB PHE 85 -10.525 -2.599 -16.083 660 HD1 PHE 85 HD2 PHE 85 -9.467 -4.778 -15.540 661 HD2 PHE 85 HD1 PHE 85 -7.178 -1.319 -16.492 662 HE1 PHE 85 HE2 PHE 85 -7.477 -5.824 -14.540 663 HE2 PHE 85 HE1 PHE 85 -5.184 -2.359 -15.495 664 HZ PHE 85 HZ PHE 85 -5.332 -4.614 -14.516 665 H LEU 86 H LEU 86 -12.280 -3.431 -17.422 666 HA LEU 86 HA LEU 86 -11.963 -6.208 -17.083 667 HB2 LEU 86 2HB LEU 86 -13.754 -5.193 -15.957 668 HB3 LEU 86 3HB LEU 86 -14.356 -4.432 -17.429 669 HG LEU 86 HG LEU 86 -14.616 -7.063 -18.056 670 HD11 LEU 86 1HD1 LEU 86 -15.111 -6.798 -15.096 671 HD12 LEU 86 2HD1 LEU 86 -13.941 -7.854 -15.885 672 HD13 LEU 86 3HD1 LEU 86 -15.668 -8.139 -16.096 673 HD21 LEU 86 3HD2 LEU 86 -16.800 -6.538 -18.199 674 HD22 LEU 86 1HD2 LEU 86 -16.235 -4.911 -17.818 675 HD23 LEU 86 2HD2 LEU 86 -16.875 -5.944 -16.540 676 H ALA 87 H ALA 87 -13.020 -4.261 -19.822 677 HA ALA 87 HA ALA 87 -13.787 -6.500 -21.433 678 HB1 ALA 87 1HB ALA 87 -14.799 -4.336 -21.810 679 HB2 ALA 87 2HB ALA 87 -13.224 -3.635 -22.188 680 HB3 ALA 87 3HB ALA 87 -13.929 -4.849 -23.256 681 H ALA 88 H ALA 88 -10.832 -5.500 -20.397 682 HA ALA 88 HA ALA 88 -9.485 -6.479 -22.831 683 HB1 ALA 88 1HB ALA 88 -8.854 -4.213 -22.487 684 HB2 ALA 88 2HB ALA 88 -8.543 -4.493 -20.774 685 HB3 ALA 88 3HB ALA 88 -7.489 -5.213 -21.991 686 H ALA 89 H ALA 89 -10.151 -7.082 -19.564 687 HA ALA 89 HA ALA 89 -7.970 -9.061 -19.427 688 HB1 ALA 89 1HB ALA 89 -9.011 -7.161 -17.449 689 HB2 ALA 89 2HB ALA 89 -8.755 -8.798 -16.843 690 HB3 ALA 89 3HB ALA 89 -7.420 -7.912 -17.579 691 H ASP 90 H ASP 90 -11.258 -8.456 -18.176 692 HA ASP 90 HA ASP 90 -11.815 -11.118 -17.495 693 HB2 ASP 90 2HB ASP 90 -13.290 -9.615 -16.529 694 HB3 ASP 90 3HB ASP 90 -13.484 -8.690 -18.015 695 H HIS 91 H HIS 91 -13.268 -9.335 -20.221 696 HA HIS 91 HA HIS 91 -14.037 -10.032 -22.248 697 HB2 HIS 91 2HB HIS 91 -11.437 -10.539 -22.256 698 HB3 HIS 91 3HB HIS 91 -11.994 -12.208 -22.332 699 HD1 HIS 91 HD1 HIS 91 -10.452 -11.026 -24.685 700 HD2 HIS 91 HD2 HIS 91 -14.596 -10.979 -24.389 701 HE1 HIS 91 HE1 HIS 91 -11.292 -10.804 -27.045 702 H ASP 92 H ASP 92 -14.714 -11.578 -19.645 703 HA ASP 92 HA ASP 92 -15.736 -14.031 -20.904 704 HB2 ASP 92 2HB ASP 92 -15.686 -13.441 -17.946 705 HB3 ASP 92 3HB ASP 92 -15.866 -15.003 -18.740 706 H GLY 93 H GLY 93 -16.666 -10.977 -19.699 707 HA2 GLY 93 2HA GLY 93 -18.744 -9.958 -19.827 708 HA3 GLY 93 3HA GLY 93 -19.422 -11.486 -20.369 709 H ASP 94 H ASP 94 -17.546 -11.396 -17.459 710 HA ASP 94 HA ASP 94 -19.982 -11.966 -15.928 711 HB2 ASP 94 2HB ASP 94 -17.333 -12.303 -14.650 712 HB3 ASP 94 3HB ASP 94 -18.750 -13.348 -14.602 713 H GLY 95 H GLY 95 -17.614 -9.559 -16.417 714 HA2 GLY 95 2HA GLY 95 -17.498 -7.424 -15.544 715 HA3 GLY 95 3HA GLY 95 -18.885 -7.808 -14.536 716 H LYS 96 H LYS 96 -16.208 -9.956 -14.387 717 HA LYS 96 HA LYS 96 -15.075 -8.605 -12.058 718 HB2 LYS 96 2HB LYS 96 -15.191 -10.658 -10.703 719 HB3 LYS 96 3HB LYS 96 -16.791 -10.055 -11.118 720 HG2 LYS 96 2HG LYS 96 -16.094 -11.847 -13.156 721 HG3 LYS 96 3HG LYS 96 -15.621 -12.617 -11.639 722 HD2 LYS 96 2HD LYS 96 -18.277 -11.304 -11.717 723 HD3 LYS 96 3HD LYS 96 -18.091 -12.793 -12.646 724 HE2 LYS 96 2HE LYS 96 -16.964 -13.621 -10.399 725 HE3 LYS 96 3HE LYS 96 -17.968 -12.348 -9.707 726 HZ1 LYS 96 3HZ LYS 96 -19.913 -13.381 -10.506 727 HZ2 LYS 96 1HZ LYS 96 -18.995 -14.618 -9.808 728 HZ3 LYS 96 2HZ LYS 96 -19.050 -14.452 -11.490 729 H ILE 97 H ILE 97 -12.919 -8.841 -11.906 730 HA ILE 97 HA ILE 97 -11.582 -10.390 -13.969 731 HB ILE 97 HB ILE 97 -10.528 -8.440 -11.923 732 HG12 ILE 97 2HG1 ILE 97 -11.802 -7.430 -13.757 733 HG13 ILE 97 3HG1 ILE 97 -10.093 -7.032 -13.893 734 HG21 ILE 97 1HG2 ILE 97 -9.126 -10.304 -13.754 735 HG22 ILE 97 2HG2 ILE 97 -8.471 -8.676 -13.585 736 HG23 ILE 97 3HG2 ILE 97 -8.652 -9.705 -12.165 737 HD11 ILE 97 3HD1 ILE 97 -11.795 -8.729 -15.623 738 HD12 ILE 97 1HD1 ILE 97 -10.541 -7.565 -16.052 739 HD13 ILE 97 2HD1 ILE 97 -10.094 -9.163 -15.451 740 H GLY 98 H GLY 98 -10.110 -12.038 -13.608 741 HA2 GLY 98 2HA GLY 98 -10.136 -13.159 -10.873 742 HA3 GLY 98 3HA GLY 98 -10.188 -14.152 -12.322 743 H ALA 99 H ALA 99 -8.320 -15.091 -10.999 744 HA ALA 99 HA ALA 99 -5.832 -13.602 -11.275 745 HB1 ALA 99 1HB ALA 99 -6.338 -16.327 -10.084 746 HB2 ALA 99 2HB ALA 99 -4.825 -15.423 -10.007 747 HB3 ALA 99 3HB ALA 99 -6.262 -14.808 -9.190 748 H GLU 100 H GLU 100 -7.617 -15.275 -13.361 749 HA GLU 100 HA GLU 100 -5.262 -16.380 -14.744 750 HB2 GLU 100 2HB GLU 100 -7.232 -17.940 -13.765 751 HB3 GLU 100 3HB GLU 100 -7.911 -17.564 -15.343 752 HG2 GLU 100 2HG GLU 100 -6.249 -18.670 -16.477 753 HG3 GLU 100 3HG GLU 100 -5.092 -18.508 -15.157 754 H GLU 101 H GLU 101 -7.402 -13.959 -14.779 755 HA GLU 101 HA GLU 101 -7.398 -13.807 -17.720 756 HB2 GLU 101 2HB GLU 101 -9.546 -12.253 -16.944 757 HB3 GLU 101 3HB GLU 101 -9.635 -13.865 -17.640 758 HG2 GLU 101 2HG GLU 101 -9.793 -14.870 -15.489 759 HG3 GLU 101 3HG GLU 101 -9.436 -13.342 -14.687 760 H PHE 102 H PHE 102 -6.183 -12.542 -14.971 761 HA PHE 102 HA PHE 102 -6.310 -9.745 -15.787 762 HB2 PHE 102 2HB PHE 102 -6.616 -10.194 -13.421 763 HB3 PHE 102 3HB PHE 102 -5.091 -11.070 -13.357 764 HD1 PHE 102 HD1 PHE 102 -2.958 -9.860 -13.534 765 HD2 PHE 102 HD2 PHE 102 -6.688 -7.818 -13.341 766 HE1 PHE 102 HE1 PHE 102 -1.783 -7.776 -12.961 767 HE2 PHE 102 HE2 PHE 102 -5.519 -5.730 -12.769 768 HZ PHE 102 HZ PHE 102 -3.064 -5.707 -12.578 769 H GLN 103 H GLN 103 -3.733 -12.027 -14.839 770 HA GLN 103 HA GLN 103 -1.588 -10.515 -15.764 771 HB2 GLN 103 2HB GLN 103 -0.356 -12.694 -15.843 772 HB3 GLN 103 3HB GLN 103 -1.186 -12.385 -14.324 773 HG2 GLN 103 2HG GLN 103 -3.064 -13.756 -15.787 774 HG3 GLN 103 3HG GLN 103 -1.548 -14.530 -16.248 775 HE21 GLN 103 1HE2 GLN 103 -2.687 -13.114 -13.205 776 HE22 GLN 103 2HE2 GLN 103 -2.441 -14.533 -12.252 777 H GLU 104 H GLU 104 -3.665 -12.798 -17.458 778 HA GLU 104 HA GLU 104 -2.216 -13.110 -19.809 779 HB2 GLU 104 2HB GLU 104 -4.244 -13.830 -20.829 780 HB3 GLU 104 3HB GLU 104 -4.310 -14.340 -19.148 781 HG2 GLU 104 2HG GLU 104 -5.810 -12.565 -18.597 782 HG3 GLU 104 3HG GLU 104 -5.625 -11.848 -20.196 783 H MET 105 H MET 105 -4.184 -10.444 -18.707 784 HA MET 105 HA MET 105 -4.220 -9.126 -21.272 785 HB2 MET 105 2HB MET 105 -5.630 -7.587 -20.315 786 HB3 MET 105 3HB MET 105 -5.918 -8.964 -19.261 787 HG2 MET 105 2HG MET 105 -5.516 -7.553 -17.592 788 HG3 MET 105 3HG MET 105 -3.818 -7.726 -18.031 789 HE1 MET 105 3HE MET 105 -6.517 -4.834 -20.073 790 HE2 MET 105 1HE MET 105 -6.997 -6.206 -19.074 791 HE3 MET 105 2HE MET 105 -6.815 -4.609 -18.348 792 H VAL 106 H VAL 106 -2.065 -9.348 -18.641 793 HA VAL 106 HA VAL 106 -0.804 -6.786 -19.017 794 HB VAL 106 HB VAL 106 0.326 -9.163 -17.543 795 HG11 VAL 106 1HG1 VAL 106 1.234 -6.495 -18.033 796 HG12 VAL 106 2HG1 VAL 106 0.949 -6.714 -16.306 797 HG13 VAL 106 3HG1 VAL 106 2.038 -7.803 -17.166 798 HG21 VAL 106 3HG2 VAL 106 -2.094 -8.065 -16.969 799 HG22 VAL 106 1HG2 VAL 106 -1.031 -8.825 -15.784 800 HG23 VAL 106 2HG2 VAL 106 -1.020 -7.073 -15.983 801 H GLN 107 H GLN 107 0.792 -9.953 -19.070 802 HA GLN 107 HA GLN 107 2.830 -9.130 -20.818 803 HB2 GLN 107 2HB GLN 107 1.885 -11.961 -20.352 804 HB3 GLN 107 3HB GLN 107 3.470 -11.459 -20.923 805 HG2 GLN 107 2HG GLN 107 4.222 -11.172 -18.858 806 HG3 GLN 107 3HG GLN 107 2.812 -10.217 -18.400 807 HE21 GLN 107 1HE2 GLN 107 0.783 -11.573 -18.091 808 HE22 GLN 107 2HE2 GLN 107 0.977 -13.041 -17.201 809 H SER 108 H SER 108 -0.284 -10.647 -21.390 810 HA SER 108 HA SER 108 0.204 -10.412 -24.288 811 HB2 SER 108 2HB SER 108 0.003 -12.776 -23.435 812 HB3 SER 108 3HB SER 108 -1.657 -12.401 -22.972 813 HG SER 108 HG SER 108 -2.149 -12.040 -25.124 Start of MODEL 6 1 H1 SER 1 H SER 1 1.717 1.050 -3.200 2 HA SER 1 HA SER 1 3.413 0.730 -0.857 3 HB2 SER 1 2HB SER 1 1.335 -0.535 -0.006 4 HB3 SER 1 3HB SER 1 1.183 1.204 -0.262 5 HG SER 1 HG SER 1 0.182 -0.916 -1.824 6 H LEU 2 H LEU 2 2.356 -1.056 -3.625 7 HA LEU 2 HA LEU 2 2.611 -3.680 -2.808 8 HB2 LEU 2 2HB LEU 2 1.885 -2.797 -5.063 9 HB3 LEU 2 3HB LEU 2 3.596 -2.646 -5.456 10 HG LEU 2 HG LEU 2 3.875 -5.056 -5.234 11 HD11 LEU 2 1HD1 LEU 2 1.884 -6.494 -4.963 12 HD12 LEU 2 2HD1 LEU 2 0.927 -5.056 -4.606 13 HD13 LEU 2 3HD1 LEU 2 2.241 -5.530 -3.529 14 HD21 LEU 2 3HD2 LEU 2 1.969 -5.605 -7.048 15 HD22 LEU 2 1HD2 LEU 2 3.455 -4.734 -7.427 16 HD23 LEU 2 2HD2 LEU 2 1.963 -3.843 -7.124 17 H THR 3 H THR 3 5.173 -2.079 -4.687 18 HA THR 3 HA THR 3 7.432 -2.420 -4.729 19 HB THR 3 HB THR 3 8.353 -2.583 -2.218 20 HG1 THR 3 HG1 THR 3 6.910 -1.894 -0.751 21 HG21 THR 3 3HG2 THR 3 8.006 -0.585 -4.110 22 HG22 THR 3 1HG2 THR 3 8.969 -0.475 -2.638 23 HG23 THR 3 2HG2 THR 3 7.298 0.088 -2.642 24 H ASP 4 H ASP 4 5.740 -4.825 -4.769 25 HA ASP 4 HA ASP 4 7.701 -6.749 -3.701 26 HB2 ASP 4 2HB ASP 4 5.112 -6.561 -2.867 27 HB3 ASP 4 3HB ASP 4 4.965 -7.746 -4.162 28 H ILE 5 H ILE 5 6.453 -5.410 -6.441 29 HA ILE 5 HA ILE 5 7.345 -7.689 -8.050 30 HB ILE 5 HB ILE 5 4.779 -6.186 -8.581 31 HG12 ILE 5 2HG1 ILE 5 3.980 -8.716 -8.373 32 HG13 ILE 5 3HG1 ILE 5 5.401 -8.827 -7.340 33 HG21 ILE 5 1HG2 ILE 5 6.261 -6.999 -10.537 34 HG22 ILE 5 2HG2 ILE 5 5.714 -8.608 -10.068 35 HG23 ILE 5 3HG2 ILE 5 4.540 -7.385 -10.552 36 HD11 ILE 5 3HD1 ILE 5 3.882 -8.273 -5.768 37 HD12 ILE 5 1HD1 ILE 5 4.302 -6.642 -6.292 38 HD13 ILE 5 2HD1 ILE 5 2.844 -7.419 -6.910 39 H LEU 6 H LEU 6 6.452 -4.271 -7.936 40 HA LEU 6 HA LEU 6 8.437 -3.767 -10.053 41 HB2 LEU 6 2HB LEU 6 5.725 -2.548 -9.645 42 HB3 LEU 6 3HB LEU 6 6.978 -1.730 -10.576 43 HG LEU 6 HG LEU 6 6.237 -4.518 -11.323 44 HD11 LEU 6 1HD1 LEU 6 4.164 -4.061 -11.970 45 HD12 LEU 6 2HD1 LEU 6 4.679 -2.583 -12.782 46 HD13 LEU 6 3HD1 LEU 6 4.279 -2.551 -11.065 47 HD21 LEU 6 3HD2 LEU 6 7.735 -2.313 -12.410 48 HD22 LEU 6 1HD2 LEU 6 6.479 -2.828 -13.535 49 HD23 LEU 6 2HD2 LEU 6 7.664 -3.993 -12.943 50 H SER 7 H SER 7 9.431 -1.630 -9.975 51 HA SER 7 HA SER 7 10.186 -0.946 -7.298 52 HB2 SER 7 2HB SER 7 11.245 -0.557 -9.914 53 HB3 SER 7 3HB SER 7 11.095 1.026 -9.153 54 HG SER 7 HG SER 7 13.070 0.174 -8.580 55 HA PRO 8 HA PRO 8 7.510 2.415 -6.411 56 HB2 PRO 8 2HB PRO 8 9.172 4.181 -5.192 57 HB3 PRO 8 3HB PRO 8 8.647 2.674 -4.432 58 HG2 PRO 8 2HG PRO 8 11.217 3.292 -5.838 59 HG3 PRO 8 3HG PRO 8 10.954 2.399 -4.328 60 HD2 PRO 8 2HD PRO 8 11.402 1.161 -6.695 61 HD3 PRO 8 3HD PRO 8 10.371 0.460 -5.430 62 H SER 9 H SER 9 10.633 3.610 -7.661 63 HA SER 9 HA SER 9 9.705 6.067 -8.610 64 HB2 SER 9 2HB SER 9 11.744 6.161 -9.924 65 HB3 SER 9 3HB SER 9 12.106 5.451 -8.351 66 HG SER 9 HG SER 9 13.051 4.080 -9.727 67 H ASP 10 H ASP 10 9.272 2.894 -9.840 68 HA ASP 10 HA ASP 10 8.666 3.747 -12.540 69 HB2 ASP 10 2HB ASP 10 8.462 1.071 -11.150 70 HB3 ASP 10 3HB ASP 10 8.012 1.330 -12.834 71 H ILE 11 H ILE 11 6.938 2.831 -9.624 72 HA ILE 11 HA ILE 11 4.359 2.840 -10.909 73 HB ILE 11 HB ILE 11 5.177 2.684 -8.012 74 HG12 ILE 11 2HG1 ILE 11 3.693 0.589 -9.560 75 HG13 ILE 11 3HG1 ILE 11 5.436 0.744 -9.754 76 HG21 ILE 11 1HG2 ILE 11 3.099 3.775 -7.923 77 HG22 ILE 11 2HG2 ILE 11 2.441 2.808 -9.242 78 HG23 ILE 11 3HG2 ILE 11 2.730 2.069 -7.667 79 HD11 ILE 11 3HD1 ILE 11 3.875 -0.015 -7.319 80 HD12 ILE 11 1HD1 ILE 11 5.186 -0.882 -8.119 81 HD13 ILE 11 2HD1 ILE 11 5.530 0.584 -7.199 82 H ALA 12 H ALA 12 6.206 5.016 -8.827 83 HA ALA 12 HA ALA 12 4.143 6.942 -8.509 84 HB1 ALA 12 1HB ALA 12 6.679 8.191 -8.276 85 HB2 ALA 12 2HB ALA 12 5.573 7.697 -6.993 86 HB3 ALA 12 3HB ALA 12 6.800 6.574 -7.581 87 H ALA 13 H ALA 13 6.337 6.231 -11.054 88 HA ALA 13 HA ALA 13 6.159 8.860 -12.267 89 HB1 ALA 13 1HB ALA 13 7.617 6.339 -12.876 90 HB2 ALA 13 2HB ALA 13 7.342 7.493 -14.181 91 HB3 ALA 13 3HB ALA 13 8.222 7.990 -12.735 92 H ALA 14 H ALA 14 4.526 5.820 -12.422 93 HA ALA 14 HA ALA 14 3.261 6.429 -14.972 94 HB1 ALA 14 1HB ALA 14 2.695 4.089 -13.165 95 HB2 ALA 14 2HB ALA 14 2.331 4.245 -14.884 96 HB3 ALA 14 3HB ALA 14 4.005 4.112 -14.345 97 H LEU 15 H LEU 15 2.531 6.421 -11.549 98 HA LEU 15 HA LEU 15 -0.255 6.560 -11.649 99 HB2 LEU 15 2HB LEU 15 1.795 7.543 -9.705 100 HB3 LEU 15 3HB LEU 15 0.091 7.926 -9.469 101 HG LEU 15 HG LEU 15 1.187 5.124 -9.675 102 HD11 LEU 15 1HD1 LEU 15 1.758 5.195 -7.535 103 HD12 LEU 15 2HD1 LEU 15 0.180 5.841 -7.087 104 HD13 LEU 15 3HD1 LEU 15 1.480 6.936 -7.559 105 HD21 LEU 15 3HD2 LEU 15 -1.124 4.859 -8.396 106 HD22 LEU 15 1HD2 LEU 15 -1.019 4.845 -10.157 107 HD23 LEU 15 2HD2 LEU 15 -1.506 6.316 -9.315 108 H ARG 16 H ARG 16 2.024 9.283 -11.266 109 HA ARG 16 HA ARG 16 0.055 11.268 -11.713 110 HB2 ARG 16 2HB ARG 16 2.153 12.723 -12.137 111 HB3 ARG 16 3HB ARG 16 1.914 12.032 -10.537 112 HG2 ARG 16 2HG ARG 16 3.787 10.835 -10.658 113 HG3 ARG 16 3HG ARG 16 3.438 10.293 -12.301 114 HD2 ARG 16 2HD ARG 16 5.511 11.651 -12.111 115 HD3 ARG 16 3HD ARG 16 4.318 12.324 -13.222 116 HE ARG 16 HE ARG 16 4.136 14.153 -11.861 117 HH11 ARG 16 1HH1 ARG 16 5.707 11.585 -10.113 118 HH12 ARG 16 2HH1 ARG 16 6.104 12.578 -8.750 119 HH21 ARG 16 1HH2 ARG 16 4.653 15.472 -10.073 120 HH22 ARG 16 2HH2 ARG 16 5.503 14.789 -8.728 121 H ASP 17 H ASP 17 2.165 9.459 -13.820 122 HA ASP 17 HA ASP 17 2.220 11.010 -16.095 123 HB2 ASP 17 2HB ASP 17 3.492 9.029 -16.137 124 HB3 ASP 17 3HB ASP 17 2.105 8.027 -15.716 125 H CYS 18 H CYS 18 -0.369 8.915 -14.930 126 HA CYS 18 HA CYS 18 -2.210 10.267 -16.756 127 HB2 CYS 18 2HB CYS 18 -3.305 7.999 -17.184 128 HB3 CYS 18 3HB CYS 18 -1.786 8.314 -18.015 129 HG CYS 18 HG CYS 18 -2.114 6.413 -15.187 130 H GLN 19 H GLN 19 -1.869 10.711 -14.023 131 HA GLN 19 HA GLN 19 -3.644 9.216 -12.409 132 HB2 GLN 19 2HB GLN 19 -3.511 11.209 -10.879 133 HB3 GLN 19 3HB GLN 19 -1.961 10.511 -11.328 134 HG2 GLN 19 2HG GLN 19 -1.600 12.270 -12.947 135 HG3 GLN 19 3HG GLN 19 -3.190 12.946 -12.598 136 HE21 GLN 19 1HE2 GLN 19 -0.002 13.311 -12.027 137 HE22 GLN 19 2HE2 GLN 19 -0.059 14.153 -10.520 138 H ALA 20 H ALA 20 -4.063 11.998 -14.494 139 HA ALA 20 HA ALA 20 -6.518 12.949 -13.612 140 HB1 ALA 20 1HB ALA 20 -6.765 13.970 -15.755 141 HB2 ALA 20 2HB ALA 20 -5.051 14.002 -15.340 142 HB3 ALA 20 3HB ALA 20 -5.656 12.815 -16.495 143 HA PRO 21 HA PRO 21 -9.496 9.869 -14.581 144 HB2 PRO 21 2HB PRO 21 -11.657 11.414 -15.146 145 HB3 PRO 21 3HB PRO 21 -11.032 11.198 -13.506 146 HG2 PRO 21 2HG PRO 21 -10.602 13.465 -15.413 147 HG3 PRO 21 3HG PRO 21 -10.939 13.515 -13.673 148 HD2 PRO 21 2HD PRO 21 -8.447 13.830 -14.684 149 HD3 PRO 21 3HD PRO 21 -8.749 13.070 -13.109 150 H ASP 22 H ASP 22 -10.506 8.824 -16.294 151 HA ASP 22 HA ASP 22 -10.550 8.117 -18.475 152 HB2 ASP 22 2HB ASP 22 -11.907 9.505 -19.899 153 HB3 ASP 22 3HB ASP 22 -12.521 9.643 -18.254 154 H SER 23 H SER 23 -7.997 9.146 -17.685 155 HA SER 23 HA SER 23 -7.037 10.109 -20.298 156 HB2 SER 23 2HB SER 23 -6.976 11.635 -18.037 157 HB3 SER 23 3HB SER 23 -5.400 10.847 -17.958 158 HG SER 23 HG SER 23 -6.446 12.449 -20.046 159 H PHE 24 H PHE 24 -7.185 7.483 -18.572 160 HA PHE 24 HA PHE 24 -4.455 6.634 -19.257 161 HB2 PHE 24 2HB PHE 24 -4.049 5.689 -17.215 162 HB3 PHE 24 3HB PHE 24 -5.120 6.986 -16.695 163 HD1 PHE 24 HD2 PHE 24 -7.743 6.217 -17.033 164 HD2 PHE 24 HD1 PHE 24 -4.425 3.694 -16.173 165 HE1 PHE 24 HE2 PHE 24 -9.265 4.561 -16.038 166 HE2 PHE 24 HE1 PHE 24 -5.942 2.032 -15.177 167 HZ PHE 24 HZ PHE 24 -8.365 2.465 -15.107 168 H SER 25 H SER 25 -4.384 4.095 -19.078 169 HA SER 25 HA SER 25 -6.864 2.862 -19.983 170 HB2 SER 25 2HB SER 25 -4.790 3.672 -21.794 171 HB3 SER 25 3HB SER 25 -4.882 1.911 -21.771 172 HG SER 25 HG SER 25 -6.430 2.356 -23.170 173 HA PRO 26 HA PRO 26 -5.379 -0.684 -17.872 174 HB2 PRO 26 2HB PRO 26 -6.309 -2.714 -19.416 175 HB3 PRO 26 3HB PRO 26 -7.361 -1.715 -18.408 176 HG2 PRO 26 2HG PRO 26 -6.817 -1.527 -21.345 177 HG3 PRO 26 3HG PRO 26 -8.360 -1.390 -20.482 178 HD2 PRO 26 2HD PRO 26 -6.981 0.772 -21.352 179 HD3 PRO 26 3HD PRO 26 -7.973 0.802 -19.881 180 H LYS 27 H LYS 27 -4.372 -0.069 -21.094 181 HA LYS 27 HA LYS 27 -2.150 -1.980 -20.779 182 HB2 LYS 27 2HB LYS 27 -2.094 -2.315 -23.142 183 HB3 LYS 27 3HB LYS 27 -3.764 -2.521 -22.630 184 HG2 LYS 27 2HG LYS 27 -3.752 0.111 -23.244 185 HG3 LYS 27 3HG LYS 27 -2.559 -0.505 -24.390 186 HD2 LYS 27 2HD LYS 27 -4.487 -0.782 -25.604 187 HD3 LYS 27 3HD LYS 27 -4.386 -2.351 -24.802 188 HE2 LYS 27 2HE LYS 27 -6.022 -1.753 -23.211 189 HE3 LYS 27 3HE LYS 27 -5.920 -0.044 -23.634 190 HZ1 LYS 27 3HZ LYS 27 -7.898 -0.952 -24.578 191 HZ2 LYS 27 1HZ LYS 27 -7.050 -2.226 -25.298 192 HZ3 LYS 27 2HZ LYS 27 -6.820 -0.642 -25.844 193 H LYS 28 H LYS 28 -2.257 0.750 -19.827 194 HA LYS 28 HA LYS 28 -0.003 1.830 -21.372 195 HB2 LYS 28 2HB LYS 28 -2.430 3.327 -20.390 196 HB3 LYS 28 3HB LYS 28 -0.926 4.138 -20.809 197 HG2 LYS 28 2HG LYS 28 -2.368 2.340 -22.733 198 HG3 LYS 28 3HG LYS 28 -2.727 4.062 -22.588 199 HD2 LYS 28 2HD LYS 28 -0.234 4.446 -22.954 200 HD3 LYS 28 3HD LYS 28 -0.159 2.753 -23.449 201 HE2 LYS 28 2HE LYS 28 -2.027 4.772 -24.678 202 HE3 LYS 28 3HE LYS 28 -0.425 4.411 -25.319 203 HZ1 LYS 28 3HZ LYS 28 -2.789 2.645 -25.178 204 HZ2 LYS 28 1HZ LYS 28 -1.231 2.010 -25.358 205 HZ3 LYS 28 2HZ LYS 28 -1.858 3.057 -26.528 206 H PHE 29 H PHE 29 -0.646 0.401 -18.672 207 HA PHE 29 HA PHE 29 0.829 2.282 -16.953 208 HB2 PHE 29 2HB PHE 29 -1.548 0.837 -16.474 209 HB3 PHE 29 3HB PHE 29 -0.302 0.081 -15.486 210 HD1 PHE 29 HD1 PHE 29 1.169 1.706 -14.082 211 HD2 PHE 29 HD2 PHE 29 -2.649 2.699 -15.681 212 HE1 PHE 29 HE1 PHE 29 0.943 3.504 -12.418 213 HE2 PHE 29 HE2 PHE 29 -2.880 4.499 -14.020 214 HZ PHE 29 HZ PHE 29 -1.082 4.905 -12.386 215 H PHE 30 H PHE 30 0.973 -0.694 -18.590 216 HA PHE 30 HA PHE 30 2.988 -1.870 -16.877 217 HB2 PHE 30 2HB PHE 30 2.904 -3.757 -18.304 218 HB3 PHE 30 3HB PHE 30 1.245 -3.178 -18.201 219 HD1 PHE 30 HD1 PHE 30 4.191 -3.507 -20.347 220 HD2 PHE 30 HD2 PHE 30 0.143 -2.212 -20.109 221 HE1 PHE 30 HE1 PHE 30 4.093 -3.374 -22.802 222 HE2 PHE 30 HE2 PHE 30 0.038 -2.079 -22.564 223 HZ PHE 30 HZ PHE 30 2.014 -2.660 -23.913 224 H GLN 31 H GLN 31 2.924 0.405 -19.353 225 HA GLN 31 HA GLN 31 5.510 -0.226 -20.474 226 HB2 GLN 31 2HB GLN 31 4.157 2.412 -20.869 227 HB3 GLN 31 3HB GLN 31 5.130 1.479 -21.999 228 HG2 GLN 31 2HG GLN 31 3.283 -0.170 -22.142 229 HG3 GLN 31 3HG GLN 31 2.310 0.896 -21.130 230 HE21 GLN 31 1HE2 GLN 31 2.861 3.348 -22.110 231 HE22 GLN 31 2HE2 GLN 31 2.344 3.473 -23.754 232 H ILE 32 H ILE 32 4.153 2.091 -18.192 233 HA ILE 32 HA ILE 32 6.720 3.390 -17.809 234 HB ILE 32 HB ILE 32 4.130 3.826 -16.318 235 HG12 ILE 32 2HG1 ILE 32 4.623 6.025 -17.944 236 HG13 ILE 32 3HG1 ILE 32 5.025 4.650 -18.966 237 HG21 ILE 32 1HG2 ILE 32 5.953 4.628 -15.017 238 HG22 ILE 32 2HG2 ILE 32 6.708 5.376 -16.423 239 HG23 ILE 32 3HG2 ILE 32 5.203 6.030 -15.779 240 HD11 ILE 32 3HD1 ILE 32 2.531 4.295 -17.518 241 HD12 ILE 32 1HD1 ILE 32 2.526 5.700 -18.584 242 HD13 ILE 32 2HD1 ILE 32 2.888 4.101 -19.234 243 H SER 33 H SER 33 4.683 1.040 -16.218 244 HA SER 33 HA SER 33 6.320 1.033 -13.817 245 HB2 SER 33 2HB SER 33 3.719 0.634 -14.031 246 HB3 SER 33 3HB SER 33 4.216 -1.028 -14.347 247 HG SER 33 HG SER 33 3.828 -0.215 -12.049 248 H GLY 34 H GLY 34 5.190 -1.600 -15.945 249 HA2 GLY 34 2HA GLY 34 6.989 -2.845 -17.160 250 HA3 GLY 34 3HA GLY 34 7.861 -2.828 -15.634 251 H MET 35 H MET 35 4.406 -3.312 -15.792 252 HA MET 35 HA MET 35 4.460 -5.645 -14.248 253 HB2 MET 35 2HB MET 35 2.263 -4.850 -16.160 254 HB3 MET 35 3HB MET 35 2.111 -5.845 -14.718 255 HG2 MET 35 2HG MET 35 2.710 -3.903 -13.339 256 HG3 MET 35 3HG MET 35 2.794 -2.916 -14.796 257 HE1 MET 35 3HE MET 35 -1.084 -4.896 -13.269 258 HE2 MET 35 1HE MET 35 0.318 -5.787 -13.861 259 HE3 MET 35 2HE MET 35 0.415 -4.900 -12.339 260 H SER 36 H SER 36 3.953 -5.255 -17.751 261 HA SER 36 HA SER 36 3.649 -7.926 -18.426 262 HB2 SER 36 2HB SER 36 4.115 -7.297 -20.668 263 HB3 SER 36 3HB SER 36 3.387 -5.874 -19.924 264 HG SER 36 HG SER 36 5.609 -5.165 -19.545 265 H LYS 37 H LYS 37 6.570 -6.089 -17.798 266 HA LYS 37 HA LYS 37 8.435 -7.955 -18.788 267 HB2 LYS 37 2HB LYS 37 8.943 -6.124 -16.451 268 HB3 LYS 37 3HB LYS 37 10.090 -6.697 -17.655 269 HG2 LYS 37 2HG LYS 37 7.887 -4.687 -18.035 270 HG3 LYS 37 3HG LYS 37 9.629 -4.411 -18.112 271 HD2 LYS 37 2HD LYS 37 8.015 -6.113 -20.012 272 HD3 LYS 37 3HD LYS 37 8.652 -4.501 -20.348 273 HE2 LYS 37 2HE LYS 37 10.287 -6.960 -19.726 274 HE3 LYS 37 3HE LYS 37 10.062 -6.246 -21.322 275 HZ1 LYS 37 3HZ LYS 37 11.825 -4.996 -20.899 276 HZ2 LYS 37 1HZ LYS 37 11.912 -5.539 -19.299 277 HZ3 LYS 37 2HZ LYS 37 10.948 -4.205 -19.688 278 H LYS 38 H LYS 38 6.398 -8.051 -16.073 279 HA LYS 38 HA LYS 38 8.090 -9.849 -14.541 280 HB2 LYS 38 2HB LYS 38 5.211 -9.153 -13.975 281 HB3 LYS 38 3HB LYS 38 6.422 -9.748 -12.846 282 HG2 LYS 38 2HG LYS 38 6.546 -7.068 -14.210 283 HG3 LYS 38 3HG LYS 38 5.897 -7.340 -12.591 284 HD2 LYS 38 2HD LYS 38 7.967 -7.053 -11.818 285 HD3 LYS 38 3HD LYS 38 8.387 -8.589 -12.580 286 HE2 LYS 38 2HE LYS 38 8.648 -7.067 -14.715 287 HE3 LYS 38 3HE LYS 38 8.878 -5.801 -13.510 288 HZ1 LYS 38 3HZ LYS 38 10.430 -8.329 -13.566 289 HZ2 LYS 38 1HZ LYS 38 10.715 -6.977 -12.590 290 HZ3 LYS 38 2HZ LYS 38 10.961 -6.881 -14.260 291 H SER 39 H SER 39 6.101 -11.546 -13.501 292 HA SER 39 HA SER 39 5.417 -13.166 -15.867 293 HB2 SER 39 2HB SER 39 7.309 -14.022 -14.363 294 HB3 SER 39 3HB SER 39 6.059 -14.322 -13.156 295 HG SER 39 HG SER 39 6.514 -16.152 -14.503 296 H SER 40 H SER 40 3.579 -14.616 -15.595 297 HA SER 40 HA SER 40 1.274 -13.365 -14.772 298 HB2 SER 40 2HB SER 40 0.739 -16.100 -14.456 299 HB3 SER 40 3HB SER 40 0.494 -15.133 -15.911 300 HG SER 40 HG SER 40 2.145 -16.084 -16.797 301 H SER 41 H SER 41 3.227 -15.708 -12.960 302 HA SER 41 HA SER 41 1.580 -15.872 -10.696 303 HB2 SER 41 2HB SER 41 3.485 -17.415 -11.246 304 HB3 SER 41 3HB SER 41 4.594 -16.142 -10.737 305 HG SER 41 HG SER 41 2.546 -16.900 -8.990 306 H GLN 42 H GLN 42 4.126 -13.610 -11.577 307 HA GLN 42 HA GLN 42 4.217 -12.312 -9.033 308 HB2 GLN 42 2HB GLN 42 5.393 -11.852 -11.723 309 HB3 GLN 42 3HB GLN 42 5.280 -10.462 -10.650 310 HG2 GLN 42 2HG GLN 42 6.465 -11.841 -8.916 311 HG3 GLN 42 3HG GLN 42 6.755 -13.035 -10.180 312 HE21 GLN 42 1HE2 GLN 42 7.230 -9.627 -9.381 313 HE22 GLN 42 2HE2 GLN 42 8.715 -9.448 -10.245 314 H LEU 43 H LEU 43 2.492 -11.774 -12.051 315 HA LEU 43 HA LEU 43 1.430 -9.231 -11.289 316 HB2 LEU 43 2HB LEU 43 0.388 -11.131 -13.381 317 HB3 LEU 43 3HB LEU 43 0.069 -9.402 -13.264 318 HG LEU 43 HG LEU 43 2.895 -10.258 -13.579 319 HD11 LEU 43 1HD1 LEU 43 0.764 -10.616 -15.639 320 HD12 LEU 43 2HD1 LEU 43 2.141 -11.648 -15.255 321 HD13 LEU 43 3HD1 LEU 43 2.389 -10.134 -16.126 322 HD21 LEU 43 3HD2 LEU 43 1.168 -7.929 -14.240 323 HD22 LEU 43 1HD2 LEU 43 2.591 -8.230 -15.238 324 HD23 LEU 43 2HD2 LEU 43 2.769 -7.978 -13.501 325 H LYS 44 H LYS 44 0.709 -12.413 -10.423 326 HA LYS 44 HA LYS 44 -2.111 -12.149 -10.050 327 HB2 LYS 44 2HB LYS 44 -0.031 -14.157 -9.410 328 HB3 LYS 44 3HB LYS 44 -1.453 -14.163 -8.375 329 HG2 LYS 44 2HG LYS 44 -2.654 -14.077 -10.765 330 HG3 LYS 44 3HG LYS 44 -1.166 -14.912 -11.214 331 HD2 LYS 44 2HD LYS 44 -2.879 -15.759 -8.888 332 HD3 LYS 44 3HD LYS 44 -3.109 -16.382 -10.523 333 HE2 LYS 44 2HE LYS 44 -0.553 -16.563 -8.932 334 HE3 LYS 44 3HE LYS 44 -1.724 -17.867 -9.125 335 HZ1 LYS 44 3HZ LYS 44 -1.336 -17.751 -11.537 336 HZ2 LYS 44 1HZ LYS 44 0.064 -18.154 -10.678 337 HZ3 LYS 44 2HZ LYS 44 -0.136 -16.587 -11.283 338 H GLU 45 H GLU 45 0.723 -11.501 -8.111 339 HA GLU 45 HA GLU 45 -0.389 -11.386 -5.570 340 HB2 GLU 45 2HB GLU 45 1.874 -9.884 -6.859 341 HB3 GLU 45 3HB GLU 45 1.415 -9.576 -5.191 342 HG2 GLU 45 2HG GLU 45 2.101 -12.315 -6.210 343 HG3 GLU 45 3HG GLU 45 3.302 -11.205 -5.554 344 H ILE 46 H ILE 46 -0.119 -8.794 -7.990 345 HA ILE 46 HA ILE 46 -1.240 -6.717 -6.552 346 HB ILE 46 HB ILE 46 -1.596 -7.265 -9.501 347 HG12 ILE 46 2HG1 ILE 46 0.345 -5.238 -8.689 348 HG13 ILE 46 3HG1 ILE 46 0.754 -6.845 -8.098 349 HG21 ILE 46 1HG2 ILE 46 -3.087 -5.574 -9.197 350 HG22 ILE 46 2HG2 ILE 46 -2.269 -4.962 -7.760 351 HG23 ILE 46 3HG2 ILE 46 -1.616 -4.615 -9.361 352 HD11 ILE 46 3HD1 ILE 46 -0.022 -7.086 -10.810 353 HD12 ILE 46 1HD1 ILE 46 1.131 -5.758 -10.682 354 HD13 ILE 46 2HD1 ILE 46 1.562 -7.361 -10.085 355 H PHE 47 H PHE 47 -2.870 -9.227 -8.447 356 HA PHE 47 HA PHE 47 -5.474 -8.280 -8.309 357 HB2 PHE 47 2HB PHE 47 -5.474 -10.100 -9.659 358 HB3 PHE 47 3HB PHE 47 -4.193 -10.896 -8.751 359 HD1 PHE 47 HD1 PHE 47 -4.733 -12.232 -6.759 360 HD2 PHE 47 HD2 PHE 47 -7.769 -10.541 -9.217 361 HE1 PHE 47 HE1 PHE 47 -6.389 -13.746 -5.750 362 HE2 PHE 47 HE2 PHE 47 -9.430 -12.052 -8.211 363 HZ PHE 47 HZ PHE 47 -8.741 -13.657 -6.475 364 H ARG 48 H ARG 48 -3.615 -10.114 -5.945 365 HA ARG 48 HA ARG 48 -5.749 -10.649 -4.170 366 HB2 ARG 48 2HB ARG 48 -2.955 -11.151 -4.281 367 HB3 ARG 48 3HB ARG 48 -3.292 -10.388 -2.733 368 HG2 ARG 48 2HG ARG 48 -4.683 -12.834 -3.807 369 HG3 ARG 48 3HG ARG 48 -3.383 -12.832 -2.613 370 HD2 ARG 48 2HD ARG 48 -5.506 -11.029 -1.852 371 HD3 ARG 48 3HD ARG 48 -6.123 -12.657 -2.126 372 HE ARG 48 HE ARG 48 -3.971 -13.112 -0.583 373 HH11 ARG 48 1HH1 ARG 48 -6.647 -10.906 -0.282 374 HH12 ARG 48 2HH1 ARG 48 -6.624 -10.910 1.451 375 HH21 ARG 48 1HH2 ARG 48 -3.931 -13.126 1.698 376 HH22 ARG 48 2HH2 ARG 48 -5.078 -12.172 2.576 377 H ILE 49 H ILE 49 -4.180 -7.771 -4.959 378 HA ILE 49 HA ILE 49 -4.786 -6.522 -2.378 379 HB ILE 49 HB ILE 49 -3.380 -5.268 -4.734 380 HG12 ILE 49 2HG1 ILE 49 -2.150 -7.254 -3.934 381 HG13 ILE 49 3HG1 ILE 49 -1.281 -5.763 -3.590 382 HG21 ILE 49 1HG2 ILE 49 -2.456 -3.868 -2.751 383 HG22 ILE 49 2HG2 ILE 49 -4.067 -3.527 -3.380 384 HG23 ILE 49 3HG2 ILE 49 -3.880 -4.466 -1.899 385 HD11 ILE 49 3HD1 ILE 49 -3.013 -7.150 -1.569 386 HD12 ILE 49 1HD1 ILE 49 -1.291 -7.478 -1.761 387 HD13 ILE 49 2HD1 ILE 49 -1.836 -5.865 -1.297 388 H LEU 50 H LEU 50 -6.098 -6.933 -5.463 389 HA LEU 50 HA LEU 50 -7.608 -4.439 -5.413 390 HB2 LEU 50 2HB LEU 50 -7.057 -6.555 -7.405 391 HB3 LEU 50 3HB LEU 50 -8.614 -5.738 -7.529 392 HG LEU 50 HG LEU 50 -6.933 -3.616 -7.342 393 HD11 LEU 50 1HD1 LEU 50 -5.465 -5.601 -9.058 394 HD12 LEU 50 2HD1 LEU 50 -5.000 -5.231 -7.398 395 HD13 LEU 50 3HD1 LEU 50 -4.976 -3.963 -8.624 396 HD21 LEU 50 3HD2 LEU 50 -7.174 -3.475 -9.814 397 HD22 LEU 50 1HD2 LEU 50 -8.685 -3.810 -8.967 398 HD23 LEU 50 2HD2 LEU 50 -7.834 -5.111 -9.800 399 H ASP 51 H ASP 51 -7.977 -7.802 -4.681 400 HA ASP 51 HA ASP 51 -10.815 -7.912 -4.788 401 HB2 ASP 51 2HB ASP 51 -9.232 -9.890 -4.819 402 HB3 ASP 51 3HB ASP 51 -9.018 -9.646 -3.088 403 H ASN 52 H ASN 52 -12.194 -6.917 -3.488 404 HA ASN 52 HA ASN 52 -11.313 -6.212 -0.769 405 HB2 ASN 52 2HB ASN 52 -12.723 -4.734 -2.830 406 HB3 ASN 52 3HB ASN 52 -13.639 -4.765 -1.326 407 HD21 ASN 52 1HD2 ASN 52 -10.324 -4.271 -2.485 408 HD22 ASN 52 2HD2 ASN 52 -9.957 -2.976 -1.402 409 H ASP 53 H ASP 53 -12.702 -8.693 -1.982 410 HA ASP 53 HA ASP 53 -14.657 -8.943 0.180 411 HB2 ASP 53 2HB ASP 53 -15.411 -10.096 -2.467 412 HB3 ASP 53 3HB ASP 53 -16.441 -9.544 -1.149 413 H GLN 54 H GLN 54 -11.983 -10.083 -1.271 414 HA GLN 54 HA GLN 54 -10.863 -12.068 -1.327 415 HB2 GLN 54 2HB GLN 54 -12.561 -12.954 0.986 416 HB3 GLN 54 3HB GLN 54 -10.863 -13.288 0.675 417 HG2 GLN 54 2HG GLN 54 -11.915 -10.545 1.307 418 HG3 GLN 54 3HG GLN 54 -11.337 -11.673 2.532 419 HE21 GLN 54 1HE2 GLN 54 -10.490 -9.244 0.387 420 HE22 GLN 54 2HE2 GLN 54 -8.773 -9.408 0.473 421 H SER 55 H SER 55 -13.562 -11.849 -2.680 422 HA SER 55 HA SER 55 -14.731 -14.455 -2.566 423 HB2 SER 55 2HB SER 55 -15.760 -13.536 -4.832 424 HB3 SER 55 3HB SER 55 -16.296 -12.916 -3.271 425 HG SER 55 HG SER 55 -15.047 -11.624 -5.289 426 H GLY 56 H GLY 56 -12.115 -13.028 -4.299 427 HA2 GLY 56 2HA GLY 56 -10.498 -14.606 -5.251 428 HA3 GLY 56 3HA GLY 56 -11.866 -15.507 -5.886 429 H PHE 57 H PHE 57 -12.951 -12.582 -6.388 430 HA PHE 57 HA PHE 57 -11.413 -12.080 -8.841 431 HB2 PHE 57 2HB PHE 57 -14.431 -12.001 -8.723 432 HB3 PHE 57 3HB PHE 57 -13.413 -11.822 -10.148 433 HD1 PHE 57 HD1 PHE 57 -14.687 -14.197 -7.648 434 HD2 PHE 57 HD2 PHE 57 -12.537 -13.717 -11.290 435 HE1 PHE 57 HE1 PHE 57 -14.837 -16.620 -8.052 436 HE2 PHE 57 HE2 PHE 57 -12.685 -16.138 -11.701 437 HZ PHE 57 HZ PHE 57 -13.837 -17.593 -10.081 438 H ILE 58 H ILE 58 -11.980 -9.915 -9.810 439 HA ILE 58 HA ILE 58 -12.478 -7.967 -7.653 440 HB ILE 58 HB ILE 58 -10.739 -7.584 -10.093 441 HG12 ILE 58 2HG1 ILE 58 -9.663 -7.568 -7.313 442 HG13 ILE 58 3HG1 ILE 58 -10.038 -9.127 -8.038 443 HG21 ILE 58 1HG2 ILE 58 -11.862 -5.543 -9.255 444 HG22 ILE 58 2HG2 ILE 58 -11.101 -5.806 -7.687 445 HG23 ILE 58 3HG2 ILE 58 -10.106 -5.480 -9.107 446 HD11 ILE 58 3HD1 ILE 58 -7.688 -8.462 -8.318 447 HD12 ILE 58 1HD1 ILE 58 -8.523 -8.694 -9.854 448 HD13 ILE 58 2HD1 ILE 58 -8.218 -7.064 -9.253 449 H GLU 59 H GLU 59 -14.696 -7.806 -8.068 450 HA GLU 59 HA GLU 59 -15.854 -7.405 -10.590 451 HB2 GLU 59 2HB GLU 59 -16.873 -6.396 -7.930 452 HB3 GLU 59 3HB GLU 59 -17.824 -6.638 -9.388 453 HG2 GLU 59 2HG GLU 59 -18.331 -8.619 -8.514 454 HG3 GLU 59 3HG GLU 59 -16.714 -9.103 -9.019 455 H GLU 60 H GLU 60 -17.187 -5.292 -11.001 456 HA GLU 60 HA GLU 60 -15.322 -3.252 -11.580 457 HB2 GLU 60 2HB GLU 60 -18.285 -3.543 -11.811 458 HB3 GLU 60 3HB GLU 60 -17.585 -1.938 -11.973 459 HG2 GLU 60 2HG GLU 60 -16.300 -2.589 -13.852 460 HG3 GLU 60 3HG GLU 60 -16.664 -4.294 -13.593 461 H ASP 61 H ASP 61 -17.584 -3.745 -8.955 462 HA ASP 61 HA ASP 61 -17.598 -1.148 -7.891 463 HB2 ASP 61 2HB ASP 61 -19.087 -3.143 -7.272 464 HB3 ASP 61 3HB ASP 61 -17.769 -3.648 -6.218 465 H GLU 62 H GLU 62 -15.135 -3.504 -7.990 466 HA GLU 62 HA GLU 62 -13.608 -2.050 -5.931 467 HB2 GLU 62 2HB GLU 62 -12.194 -4.272 -6.058 468 HB3 GLU 62 3HB GLU 62 -13.644 -4.176 -5.068 469 HG2 GLU 62 2HG GLU 62 -14.882 -5.109 -7.089 470 HG3 GLU 62 3HG GLU 62 -13.288 -5.497 -7.734 471 H LEU 63 H LEU 63 -13.812 -2.898 -9.227 472 HA LEU 63 HA LEU 63 -11.037 -2.682 -9.872 473 HB2 LEU 63 2HB LEU 63 -13.251 -3.606 -11.170 474 HB3 LEU 63 3HB LEU 63 -12.964 -2.076 -11.995 475 HG LEU 63 HG LEU 63 -11.105 -4.439 -11.808 476 HD11 LEU 63 1HD1 LEU 63 -12.918 -3.328 -13.839 477 HD12 LEU 63 2HD1 LEU 63 -12.334 -4.976 -13.612 478 HD13 LEU 63 3HD1 LEU 63 -11.316 -3.783 -14.418 479 HD21 LEU 63 3HD2 LEU 63 -9.810 -2.398 -11.536 480 HD22 LEU 63 1HD2 LEU 63 -10.581 -1.701 -12.961 481 HD23 LEU 63 2HD2 LEU 63 -9.527 -3.106 -13.127 482 H LYS 64 H LYS 64 -13.683 -0.451 -9.544 483 HA LYS 64 HA LYS 64 -12.680 1.710 -11.021 484 HB2 LYS 64 2HB LYS 64 -14.103 3.096 -9.431 485 HB3 LYS 64 3HB LYS 64 -14.936 1.834 -10.329 486 HG2 LYS 64 2HG LYS 64 -15.325 0.573 -8.472 487 HG3 LYS 64 3HG LYS 64 -13.889 1.165 -7.633 488 HD2 LYS 64 2HD LYS 64 -15.918 2.000 -6.573 489 HD3 LYS 64 3HD LYS 64 -14.993 3.326 -7.282 490 HE2 LYS 64 2HE LYS 64 -16.575 3.773 -8.839 491 HE3 LYS 64 3HE LYS 64 -17.031 2.080 -9.017 492 HZ1 LYS 64 3HZ LYS 64 -18.867 2.969 -7.995 493 HZ2 LYS 64 1HZ LYS 64 -17.974 4.059 -7.058 494 HZ3 LYS 64 2HZ LYS 64 -17.997 2.417 -6.653 495 H TYR 65 H TYR 65 -11.762 0.421 -7.950 496 HA TYR 65 HA TYR 65 -10.260 2.815 -7.229 497 HB2 TYR 65 2HB TYR 65 -10.727 0.200 -5.788 498 HB3 TYR 65 3HB TYR 65 -9.701 1.487 -5.164 499 HD1 TYR 65 HD1 TYR 65 -11.202 3.903 -5.728 500 HD2 TYR 65 HD2 TYR 65 -12.607 0.099 -4.440 501 HE1 TYR 65 HE1 TYR 65 -13.165 4.979 -4.710 502 HE2 TYR 65 HE2 TYR 65 -14.575 1.164 -3.420 503 HH TYR 65 HH TYR 65 -15.811 3.746 -4.064 504 H PHE 66 H PHE 66 -9.611 0.976 -9.533 505 HA PHE 66 HA PHE 66 -7.354 -0.565 -9.028 506 HB2 PHE 66 2HB PHE 66 -8.372 -0.768 -11.160 507 HB3 PHE 66 3HB PHE 66 -8.233 0.958 -11.475 508 HD1 PHE 66 HD1 PHE 66 -6.165 -2.081 -10.917 509 HD2 PHE 66 HD2 PHE 66 -6.456 1.765 -12.717 510 HE1 PHE 66 HE1 PHE 66 -4.037 -2.472 -12.089 511 HE2 PHE 66 HE2 PHE 66 -4.330 1.380 -13.893 512 HZ PHE 66 HZ PHE 66 -3.118 -0.741 -13.580 513 H LEU 67 H LEU 67 -7.722 2.868 -9.160 514 HA LEU 67 HA LEU 67 -4.872 3.362 -9.415 515 HB2 LEU 67 2HB LEU 67 -6.752 5.524 -8.658 516 HB3 LEU 67 3HB LEU 67 -5.391 5.549 -9.778 517 HG LEU 67 HG LEU 67 -8.206 4.624 -10.273 518 HD11 LEU 67 1HD1 LEU 67 -6.821 6.269 -12.240 519 HD12 LEU 67 2HD1 LEU 67 -6.960 7.036 -10.658 520 HD13 LEU 67 3HD1 LEU 67 -8.407 6.478 -11.498 521 HD21 LEU 67 3HD2 LEU 67 -7.158 2.900 -11.354 522 HD22 LEU 67 1HD2 LEU 67 -5.689 3.831 -11.650 523 HD23 LEU 67 2HD2 LEU 67 -7.131 4.125 -12.623 524 H GLN 68 H GLN 68 -7.104 2.748 -6.941 525 HA GLN 68 HA GLN 68 -5.673 4.222 -4.895 526 HB2 GLN 68 2HB GLN 68 -8.239 2.852 -5.120 527 HB3 GLN 68 3HB GLN 68 -7.424 2.513 -3.599 528 HG2 GLN 68 2HG GLN 68 -8.177 4.435 -2.818 529 HG3 GLN 68 3HG GLN 68 -7.177 5.273 -4.004 530 HE21 GLN 68 1HE2 GLN 68 -8.304 4.972 -6.327 531 HE22 GLN 68 2HE2 GLN 68 -9.939 5.528 -6.353 532 H ARG 69 H ARG 69 -4.704 1.735 -6.529 533 HA ARG 69 HA ARG 69 -3.855 0.115 -4.225 534 HB2 ARG 69 2HB ARG 69 -3.217 -0.983 -6.845 535 HB3 ARG 69 3HB ARG 69 -4.079 -1.717 -5.500 536 HG2 ARG 69 2HG ARG 69 -5.518 0.328 -7.088 537 HG3 ARG 69 3HG ARG 69 -5.229 -1.242 -7.839 538 HD2 ARG 69 2HD ARG 69 -7.384 -1.214 -6.714 539 HD3 ARG 69 3HD ARG 69 -6.285 -2.346 -5.926 540 HE ARG 69 HE ARG 69 -5.926 -0.154 -4.450 541 HH11 ARG 69 1HH1 ARG 69 -8.834 -1.693 -5.586 542 HH12 ARG 69 2HH1 ARG 69 -9.789 -1.183 -4.234 543 HH21 ARG 69 1HH2 ARG 69 -7.172 0.525 -2.664 544 HH22 ARG 69 2HH2 ARG 69 -8.842 0.080 -2.572 545 H PHE 70 H PHE 70 -2.740 2.022 -6.930 546 HA PHE 70 HA PHE 70 0.050 1.404 -6.297 547 HB2 PHE 70 2HB PHE 70 -1.222 2.876 -8.608 548 HB3 PHE 70 3HB PHE 70 0.519 2.757 -8.374 549 HD1 PHE 70 HD2 PHE 70 1.676 0.649 -8.688 550 HD2 PHE 70 HD1 PHE 70 -2.522 0.975 -9.308 551 HE1 PHE 70 HE2 PHE 70 1.688 -1.506 -9.876 552 HE2 PHE 70 HE1 PHE 70 -2.517 -1.180 -10.496 553 HZ PHE 70 HZ PHE 70 -0.410 -2.423 -10.783 554 H GLU 71 H GLU 71 -2.337 3.837 -5.879 555 HA GLU 71 HA GLU 71 -0.277 5.706 -4.904 556 HB2 GLU 71 2HB GLU 71 -1.833 6.333 -6.913 557 HB3 GLU 71 3HB GLU 71 -3.035 6.600 -5.658 558 HG2 GLU 71 2HG GLU 71 -0.336 7.926 -5.737 559 HG3 GLU 71 3HG GLU 71 -1.825 8.645 -6.347 560 H SER 72 H SER 72 -3.325 4.123 -4.263 561 HA SER 72 HA SER 72 -4.508 3.791 -2.347 562 HB2 SER 72 2HB SER 72 -2.010 3.444 -1.551 563 HB3 SER 72 3HB SER 72 -2.316 4.938 -0.665 564 HG SER 72 HG SER 72 -3.046 3.488 0.728 565 H GLY 73 H GLY 73 -5.362 5.925 -3.577 566 HA2 GLY 73 2HA GLY 73 -6.728 7.470 -1.838 567 HA3 GLY 73 3HA GLY 73 -5.185 8.305 -1.939 568 H ALA 74 H ALA 74 -5.005 7.309 -4.819 569 HA ALA 74 HA ALA 74 -5.825 9.637 -6.095 570 HB1 ALA 74 1HB ALA 74 -5.804 7.933 -8.163 571 HB2 ALA 74 2HB ALA 74 -4.335 8.557 -7.409 572 HB3 ALA 74 3HB ALA 74 -4.941 6.959 -6.972 573 H ARG 75 H ARG 75 -7.357 9.469 -8.127 574 HA ARG 75 HA ARG 75 -9.990 9.185 -7.103 575 HB2 ARG 75 2HB ARG 75 -10.681 9.698 -9.455 576 HB3 ARG 75 3HB ARG 75 -9.576 10.871 -8.752 577 HG2 ARG 75 2HG ARG 75 -7.732 9.961 -9.991 578 HG3 ARG 75 3HG ARG 75 -8.739 8.642 -10.592 579 HD2 ARG 75 2HD ARG 75 -8.317 10.624 -12.153 580 HD3 ARG 75 3HD ARG 75 -9.979 10.063 -11.972 581 HE ARG 75 HE ARG 75 -8.855 12.557 -10.955 582 HH11 ARG 75 1HH1 ARG 75 -11.570 10.393 -11.211 583 HH12 ARG 75 2HH1 ARG 75 -12.733 11.587 -10.739 584 HH21 ARG 75 1HH2 ARG 75 -10.377 14.138 -10.333 585 HH22 ARG 75 2HH2 ARG 75 -12.054 13.718 -10.241 586 H VAL 76 H VAL 76 -11.580 8.067 -8.909 587 HA VAL 76 HA VAL 76 -10.727 5.249 -8.945 588 HB VAL 76 HB VAL 76 -12.986 4.581 -8.741 589 HG11 VAL 76 1HG1 VAL 76 -13.626 5.477 -6.639 590 HG12 VAL 76 2HG1 VAL 76 -11.862 5.520 -6.690 591 HG13 VAL 76 3HG1 VAL 76 -12.790 6.997 -6.956 592 HG21 VAL 76 3HG2 VAL 76 -13.521 7.221 -9.855 593 HG22 VAL 76 1HG2 VAL 76 -14.478 5.741 -9.935 594 HG23 VAL 76 2HG2 VAL 76 -14.602 6.797 -8.528 595 H LEU 77 H LEU 77 -12.604 4.192 -10.630 596 HA LEU 77 HA LEU 77 -11.801 5.351 -13.207 597 HB2 LEU 77 2HB LEU 77 -12.906 2.599 -12.692 598 HB3 LEU 77 3HB LEU 77 -12.144 3.189 -14.168 599 HG LEU 77 HG LEU 77 -10.816 2.582 -11.532 600 HD11 LEU 77 1HD1 LEU 77 -10.643 1.391 -14.290 601 HD12 LEU 77 2HD1 LEU 77 -11.184 0.609 -12.805 602 HD13 LEU 77 3HD1 LEU 77 -9.487 1.048 -13.002 603 HD21 LEU 77 3HD2 LEU 77 -9.960 4.280 -13.790 604 HD22 LEU 77 1HD2 LEU 77 -8.770 3.132 -13.179 605 HD23 LEU 77 2HD2 LEU 77 -9.486 4.321 -12.091 606 H THR 78 H THR 78 -13.267 6.141 -14.589 607 HA THR 78 HA THR 78 -15.988 6.433 -13.731 608 HB THR 78 HB THR 78 -14.819 8.236 -14.947 609 HG1 THR 78 HG1 THR 78 -16.580 8.587 -16.483 610 HG21 THR 78 3HG2 THR 78 -15.150 7.289 -17.620 611 HG22 THR 78 1HG2 THR 78 -14.151 6.141 -16.729 612 HG23 THR 78 2HG2 THR 78 -13.679 7.838 -16.818 613 H ALA 79 H ALA 79 -17.625 6.222 -15.772 614 HA ALA 79 HA ALA 79 -18.034 3.435 -16.069 615 HB1 ALA 79 1HB ALA 79 -20.060 4.399 -16.197 616 HB2 ALA 79 2HB ALA 79 -19.420 5.898 -16.873 617 HB3 ALA 79 3HB ALA 79 -19.697 4.505 -17.920 618 H SER 80 H SER 80 -16.044 5.580 -17.732 619 HA SER 80 HA SER 80 -16.054 3.923 -20.161 620 HB2 SER 80 2HB SER 80 -16.383 6.324 -20.547 621 HB3 SER 80 3HB SER 80 -14.875 6.675 -19.702 622 HG SER 80 HG SER 80 -15.272 5.895 -22.270 623 H GLU 81 H GLU 81 -14.435 4.278 -17.289 624 HA GLU 81 HA GLU 81 -11.824 3.543 -18.397 625 HB2 GLU 81 2HB GLU 81 -12.701 4.430 -15.652 626 HB3 GLU 81 3HB GLU 81 -11.095 3.790 -15.969 627 HG2 GLU 81 2HG GLU 81 -10.581 5.589 -17.438 628 HG3 GLU 81 3HG GLU 81 -12.248 6.162 -17.410 629 H THR 82 H THR 82 -13.926 2.493 -15.711 630 HA THR 82 HA THR 82 -12.690 0.072 -15.181 631 HB THR 82 HB THR 82 -15.356 -0.490 -14.719 632 HG1 THR 82 HG1 THR 82 -16.147 1.531 -13.864 633 HG21 THR 82 3HG2 THR 82 -13.034 -0.026 -13.254 634 HG22 THR 82 1HG2 THR 82 -14.570 -0.628 -12.633 635 HG23 THR 82 2HG2 THR 82 -14.216 1.099 -12.584 636 H LYS 83 H LYS 83 -15.404 0.717 -17.389 637 HA LYS 83 HA LYS 83 -15.946 -1.837 -18.253 638 HB2 LYS 83 2HB LYS 83 -16.168 0.862 -19.485 639 HB3 LYS 83 3HB LYS 83 -16.340 -0.527 -20.551 640 HG2 LYS 83 2HG LYS 83 -18.023 -1.336 -18.711 641 HG3 LYS 83 3HG LYS 83 -18.088 0.385 -18.323 642 HD2 LYS 83 2HD LYS 83 -18.355 -0.444 -21.171 643 HD3 LYS 83 3HD LYS 83 -19.728 -0.692 -20.090 644 HE2 LYS 83 2HE LYS 83 -19.412 1.753 -19.419 645 HE3 LYS 83 3HE LYS 83 -18.367 1.882 -20.833 646 HZ1 LYS 83 3HZ LYS 83 -20.704 0.627 -21.656 647 HZ2 LYS 83 1HZ LYS 83 -20.172 2.183 -22.052 648 HZ3 LYS 83 2HZ LYS 83 -21.179 1.948 -20.713 649 H THR 84 H THR 84 -13.495 0.397 -19.525 650 HA THR 84 HA THR 84 -12.542 -1.223 -21.594 651 HB THR 84 HB THR 84 -10.900 0.721 -19.963 652 HG1 THR 84 HG1 THR 84 -11.611 2.256 -21.507 653 HG21 THR 84 3HG2 THR 84 -9.892 -0.941 -21.739 654 HG22 THR 84 1HG2 THR 84 -9.368 0.742 -21.679 655 HG23 THR 84 2HG2 THR 84 -10.549 0.228 -22.884 656 H PHE 85 H PHE 85 -11.110 -0.755 -18.357 657 HA PHE 85 HA PHE 85 -9.115 -2.655 -18.523 658 HB2 PHE 85 2HB PHE 85 -9.635 -0.956 -16.646 659 HB3 PHE 85 3HB PHE 85 -10.657 -2.223 -15.977 660 HD1 PHE 85 HD2 PHE 85 -9.568 -4.493 -15.520 661 HD2 PHE 85 HD1 PHE 85 -7.359 -0.918 -16.199 662 HE1 PHE 85 HE2 PHE 85 -7.605 -5.503 -14.434 663 HE2 PHE 85 HE1 PHE 85 -5.392 -1.924 -15.115 664 HZ PHE 85 HZ PHE 85 -5.514 -4.219 -14.230 665 H LEU 86 H LEU 86 -12.453 -3.092 -17.387 666 HA LEU 86 HA LEU 86 -12.217 -5.834 -16.783 667 HB2 LEU 86 2HB LEU 86 -14.031 -4.576 -15.879 668 HB3 LEU 86 3HB LEU 86 -14.594 -4.127 -17.488 669 HG LEU 86 HG LEU 86 -14.945 -6.697 -17.777 670 HD11 LEU 86 1HD1 LEU 86 -14.554 -6.372 -14.844 671 HD12 LEU 86 2HD1 LEU 86 -14.083 -7.697 -15.907 672 HD13 LEU 86 3HD1 LEU 86 -15.768 -7.512 -15.424 673 HD21 LEU 86 3HD2 LEU 86 -16.875 -5.485 -17.933 674 HD22 LEU 86 1HD2 LEU 86 -16.623 -4.673 -16.387 675 HD23 LEU 86 2HD2 LEU 86 -17.185 -6.345 -16.424 676 H ALA 87 H ALA 87 -13.040 -4.114 -19.738 677 HA ALA 87 HA ALA 87 -13.716 -6.524 -21.173 678 HB1 ALA 87 1HB ALA 87 -14.909 -4.670 -21.920 679 HB2 ALA 87 2HB ALA 87 -13.481 -3.634 -21.930 680 HB3 ALA 87 3HB ALA 87 -13.670 -4.888 -23.156 681 H ALA 88 H ALA 88 -10.872 -5.446 -20.077 682 HA ALA 88 HA ALA 88 -9.382 -6.342 -22.458 683 HB1 ALA 88 1HB ALA 88 -8.795 -4.087 -22.011 684 HB2 ALA 88 2HB ALA 88 -8.596 -4.410 -20.288 685 HB3 ALA 88 3HB ALA 88 -7.452 -5.084 -21.450 686 H ALA 89 H ALA 89 -10.182 -7.030 -19.225 687 HA ALA 89 HA ALA 89 -7.994 -8.997 -19.047 688 HB1 ALA 89 1HB ALA 89 -9.139 -7.159 -17.082 689 HB2 ALA 89 2HB ALA 89 -8.960 -8.815 -16.501 690 HB3 ALA 89 3HB ALA 89 -7.559 -7.942 -17.121 691 H ASP 90 H ASP 90 -11.352 -8.486 -17.948 692 HA ASP 90 HA ASP 90 -11.914 -11.160 -17.366 693 HB2 ASP 90 2HB ASP 90 -13.353 -9.375 -16.578 694 HB3 ASP 90 3HB ASP 90 -13.772 -8.935 -18.231 695 H HIS 91 H HIS 91 -13.285 -9.402 -20.145 696 HA HIS 91 HA HIS 91 -13.812 -10.063 -22.257 697 HB2 HIS 91 2HB HIS 91 -11.250 -10.599 -22.084 698 HB3 HIS 91 3HB HIS 91 -11.795 -12.274 -22.103 699 HD1 HIS 91 HD1 HIS 91 -10.388 -12.266 -24.420 700 HD2 HIS 91 HD2 HIS 91 -13.950 -10.129 -24.392 701 HE1 HIS 91 HE1 HIS 91 -10.983 -11.919 -26.839 702 H ASP 92 H ASP 92 -14.632 -11.678 -19.674 703 HA ASP 92 HA ASP 92 -15.707 -14.030 -21.072 704 HB2 ASP 92 2HB ASP 92 -15.838 -13.664 -18.098 705 HB3 ASP 92 3HB ASP 92 -15.795 -15.156 -19.033 706 H GLY 93 H GLY 93 -16.561 -11.022 -19.674 707 HA2 GLY 93 2HA GLY 93 -18.602 -9.923 -19.830 708 HA3 GLY 93 3HA GLY 93 -19.321 -11.406 -20.441 709 H ASP 94 H ASP 94 -17.515 -11.746 -17.564 710 HA ASP 94 HA ASP 94 -19.930 -12.356 -16.088 711 HB2 ASP 94 2HB ASP 94 -17.280 -12.396 -14.743 712 HB3 ASP 94 3HB ASP 94 -18.601 -13.558 -14.664 713 H GLY 95 H GLY 95 -17.346 -9.955 -16.024 714 HA2 GLY 95 2HA GLY 95 -17.728 -7.716 -15.308 715 HA3 GLY 95 3HA GLY 95 -19.038 -8.296 -14.291 716 H LYS 96 H LYS 96 -16.248 -10.221 -14.137 717 HA LYS 96 HA LYS 96 -15.109 -8.733 -11.898 718 HB2 LYS 96 2HB LYS 96 -15.134 -10.718 -10.442 719 HB3 LYS 96 3HB LYS 96 -16.760 -10.180 -10.846 720 HG2 LYS 96 2HG LYS 96 -15.990 -12.074 -12.797 721 HG3 LYS 96 3HG LYS 96 -15.580 -12.740 -11.215 722 HD2 LYS 96 2HD LYS 96 -18.237 -11.449 -11.530 723 HD3 LYS 96 3HD LYS 96 -17.994 -13.026 -12.284 724 HE2 LYS 96 2HE LYS 96 -17.039 -13.704 -9.973 725 HE3 LYS 96 3HE LYS 96 -17.886 -12.273 -9.387 726 HZ1 LYS 96 3HZ LYS 96 -19.536 -13.779 -9.150 727 HZ2 LYS 96 1HZ LYS 96 -18.962 -14.796 -10.374 728 HZ3 LYS 96 2HZ LYS 96 -19.825 -13.397 -10.773 729 H ILE 97 H ILE 97 -12.963 -8.747 -12.009 730 HA ILE 97 HA ILE 97 -11.610 -10.302 -13.991 731 HB ILE 97 HB ILE 97 -10.493 -8.531 -11.815 732 HG12 ILE 97 2HG1 ILE 97 -11.873 -7.291 -13.386 733 HG13 ILE 97 3HG1 ILE 97 -10.177 -6.915 -13.671 734 HG21 ILE 97 1HG2 ILE 97 -9.220 -10.238 -13.835 735 HG22 ILE 97 2HG2 ILE 97 -8.610 -8.586 -13.765 736 HG23 ILE 97 3HG2 ILE 97 -8.581 -9.598 -12.322 737 HD11 ILE 97 3HD1 ILE 97 -12.146 -8.157 -15.421 738 HD12 ILE 97 1HD1 ILE 97 -10.659 -7.293 -15.811 739 HD13 ILE 97 2HD1 ILE 97 -10.598 -9.002 -15.378 740 H GLY 98 H GLY 98 -10.179 -11.991 -13.735 741 HA2 GLY 98 2HA GLY 98 -10.162 -13.240 -11.056 742 HA3 GLY 98 3HA GLY 98 -10.256 -14.163 -12.549 743 H ALA 99 H ALA 99 -8.350 -14.961 -10.932 744 HA ALA 99 HA ALA 99 -5.866 -13.557 -11.404 745 HB1 ALA 99 1HB ALA 99 -6.264 -16.263 -10.139 746 HB2 ALA 99 2HB ALA 99 -4.847 -15.220 -10.015 747 HB3 ALA 99 3HB ALA 99 -6.368 -14.734 -9.266 748 H GLU 100 H GLU 100 -7.691 -15.320 -13.382 749 HA GLU 100 HA GLU 100 -5.395 -16.654 -14.661 750 HB2 GLU 100 2HB GLU 100 -7.281 -18.131 -13.876 751 HB3 GLU 100 3HB GLU 100 -8.311 -17.330 -15.053 752 HG2 GLU 100 2HG GLU 100 -6.947 -18.130 -16.865 753 HG3 GLU 100 3HG GLU 100 -5.788 -18.823 -15.732 754 H GLU 101 H GLU 101 -7.819 -14.256 -14.966 755 HA GLU 101 HA GLU 101 -7.222 -13.961 -17.836 756 HB2 GLU 101 2HB GLU 101 -9.348 -13.033 -18.180 757 HB3 GLU 101 3HB GLU 101 -9.637 -14.368 -17.074 758 HG2 GLU 101 2HG GLU 101 -9.211 -12.310 -15.347 759 HG3 GLU 101 3HG GLU 101 -10.001 -11.493 -16.694 760 H PHE 102 H PHE 102 -6.155 -12.841 -15.046 761 HA PHE 102 HA PHE 102 -6.270 -9.993 -15.606 762 HB2 PHE 102 2HB PHE 102 -6.460 -10.708 -13.285 763 HB3 PHE 102 3HB PHE 102 -4.911 -11.539 -13.389 764 HD1 PHE 102 HD1 PHE 102 -2.828 -10.291 -13.423 765 HD2 PHE 102 HD2 PHE 102 -6.583 -8.317 -13.074 766 HE1 PHE 102 HE1 PHE 102 -1.679 -8.241 -12.694 767 HE2 PHE 102 HE2 PHE 102 -5.440 -6.264 -12.345 768 HZ PHE 102 HZ PHE 102 -2.985 -6.224 -12.155 769 H GLN 103 H GLN 103 -3.584 -12.225 -14.873 770 HA GLN 103 HA GLN 103 -1.515 -10.651 -15.782 771 HB2 GLN 103 2HB GLN 103 -0.245 -12.753 -16.088 772 HB3 GLN 103 3HB GLN 103 -1.109 -12.699 -14.558 773 HG2 GLN 103 2HG GLN 103 -2.908 -13.907 -16.253 774 HG3 GLN 103 3HG GLN 103 -1.354 -14.554 -16.777 775 HE21 GLN 103 1HE2 GLN 103 -2.540 -13.607 -13.578 776 HE22 GLN 103 2HE2 GLN 103 -2.292 -15.147 -12.837 777 H GLU 104 H GLU 104 -3.652 -12.754 -17.627 778 HA GLU 104 HA GLU 104 -2.299 -12.798 -20.055 779 HB2 GLU 104 2HB GLU 104 -4.334 -13.472 -21.051 780 HB3 GLU 104 3HB GLU 104 -4.386 -14.089 -19.405 781 HG2 GLU 104 2HG GLU 104 -6.479 -13.231 -19.551 782 HG3 GLU 104 3HG GLU 104 -5.626 -11.807 -18.957 783 H MET 105 H MET 105 -4.285 -10.302 -18.614 784 HA MET 105 HA MET 105 -4.416 -8.712 -21.010 785 HB2 MET 105 2HB MET 105 -5.790 -7.290 -19.834 786 HB3 MET 105 3HB MET 105 -6.044 -8.787 -18.946 787 HG2 MET 105 2HG MET 105 -5.602 -7.575 -17.135 788 HG3 MET 105 3HG MET 105 -3.916 -7.708 -17.631 789 HE1 MET 105 3HE MET 105 -6.538 -4.919 -19.582 790 HE2 MET 105 1HE MET 105 -7.120 -6.016 -18.329 791 HE3 MET 105 2HE MET 105 -6.835 -4.317 -17.950 792 H VAL 106 H VAL 106 -2.140 -9.204 -18.533 793 HA VAL 106 HA VAL 106 -0.923 -6.592 -18.678 794 HB VAL 106 HB VAL 106 0.272 -9.093 -17.487 795 HG11 VAL 106 1HG1 VAL 106 1.152 -6.381 -17.746 796 HG12 VAL 106 2HG1 VAL 106 0.938 -6.775 -16.039 797 HG13 VAL 106 3HG1 VAL 106 1.995 -7.764 -17.047 798 HG21 VAL 106 3HG2 VAL 106 -2.127 -8.066 -16.720 799 HG22 VAL 106 1HG2 VAL 106 -1.021 -8.936 -15.656 800 HG23 VAL 106 2HG2 VAL 106 -1.017 -7.173 -15.680 801 H GLN 107 H GLN 107 0.696 -9.719 -19.100 802 HA GLN 107 HA GLN 107 2.654 -8.696 -20.840 803 HB2 GLN 107 2HB GLN 107 1.773 -11.574 -20.564 804 HB3 GLN 107 3HB GLN 107 3.314 -11.005 -21.193 805 HG2 GLN 107 2HG GLN 107 4.193 -10.842 -19.162 806 HG3 GLN 107 3HG GLN 107 2.786 -9.985 -18.536 807 HE21 GLN 107 1HE2 GLN 107 0.851 -11.390 -18.132 808 HE22 GLN 107 2HE2 GLN 107 1.140 -12.938 -17.422 809 H SER 108 H SER 108 -0.452 -10.228 -21.421 810 HA SER 108 HA SER 108 -0.070 -9.777 -24.309 811 HB2 SER 108 2HB SER 108 -0.395 -12.198 -23.361 812 HB3 SER 108 3HB SER 108 -2.090 -11.725 -23.249 813 HG SER 108 HG SER 108 -0.832 -12.594 -25.371 Start of MODEL 7 1 H1 SER 1 H SER 1 0.728 1.414 -3.085 2 HA SER 1 HA SER 1 2.483 0.594 -0.976 3 HB2 SER 1 2HB SER 1 -0.012 1.396 -0.865 4 HB3 SER 1 3HB SER 1 -0.373 -0.305 -1.156 5 HG SER 1 HG SER 1 -0.185 0.374 1.109 6 H LEU 2 H LEU 2 3.133 -0.677 -3.413 7 HA LEU 2 HA LEU 2 2.368 -3.471 -2.886 8 HB2 LEU 2 2HB LEU 2 1.826 -2.455 -5.131 9 HB3 LEU 2 3HB LEU 2 3.562 -2.376 -5.422 10 HG LEU 2 HG LEU 2 3.642 -4.860 -5.161 11 HD11 LEU 2 1HD1 LEU 2 0.758 -5.102 -5.661 12 HD12 LEU 2 2HD1 LEU 2 1.200 -4.625 -4.022 13 HD13 LEU 2 3HD1 LEU 2 1.838 -6.119 -4.707 14 HD21 LEU 2 3HD2 LEU 2 2.100 -5.122 -7.354 15 HD22 LEU 2 1HD2 LEU 2 3.722 -4.432 -7.373 16 HD23 LEU 2 2HD2 LEU 2 2.314 -3.371 -7.330 17 H THR 3 H THR 3 5.128 -1.953 -4.540 18 HA THR 3 HA THR 3 7.360 -2.445 -4.477 19 HB THR 3 HB THR 3 8.182 -2.702 -1.974 20 HG1 THR 3 HG1 THR 3 5.684 -1.405 -1.586 21 HG21 THR 3 3HG2 THR 3 7.844 -0.587 -3.743 22 HG22 THR 3 1HG2 THR 3 8.799 -0.573 -2.262 23 HG23 THR 3 2HG2 THR 3 7.127 -0.014 -2.238 24 H ASP 4 H ASP 4 5.516 -4.735 -4.680 25 HA ASP 4 HA ASP 4 7.308 -6.813 -3.604 26 HB2 ASP 4 2HB ASP 4 4.397 -6.524 -3.402 27 HB3 ASP 4 3HB ASP 4 4.910 -8.107 -3.981 28 H ILE 5 H ILE 5 6.297 -5.308 -6.334 29 HA ILE 5 HA ILE 5 7.085 -7.586 -7.987 30 HB ILE 5 HB ILE 5 4.605 -5.955 -8.545 31 HG12 ILE 5 2HG1 ILE 5 3.678 -8.442 -8.413 32 HG13 ILE 5 3HG1 ILE 5 5.067 -8.652 -7.354 33 HG21 ILE 5 1HG2 ILE 5 6.068 -6.760 -10.493 34 HG22 ILE 5 2HG2 ILE 5 5.515 -8.377 -10.058 35 HG23 ILE 5 3HG2 ILE 5 4.348 -7.145 -10.536 36 HD11 ILE 5 3HD1 ILE 5 3.566 -8.048 -5.790 37 HD12 ILE 5 1HD1 ILE 5 4.044 -6.426 -6.289 38 HD13 ILE 5 2HD1 ILE 5 2.569 -7.149 -6.933 39 H LEU 6 H LEU 6 6.165 -4.152 -7.974 40 HA LEU 6 HA LEU 6 8.366 -3.654 -9.865 41 HB2 LEU 6 2HB LEU 6 5.615 -2.441 -9.799 42 HB3 LEU 6 3HB LEU 6 6.958 -1.712 -10.678 43 HG LEU 6 HG LEU 6 6.266 -4.544 -11.273 44 HD11 LEU 6 1HD1 LEU 6 4.181 -4.112 -11.884 45 HD12 LEU 6 2HD1 LEU 6 4.795 -2.953 -13.062 46 HD13 LEU 6 3HD1 LEU 6 4.361 -2.415 -11.440 47 HD21 LEU 6 3HD2 LEU 6 7.953 -2.551 -12.326 48 HD22 LEU 6 1HD2 LEU 6 6.680 -2.819 -13.517 49 HD23 LEU 6 2HD2 LEU 6 7.662 -4.173 -12.957 50 H SER 7 H SER 7 9.282 -1.481 -9.747 51 HA SER 7 HA SER 7 9.704 -0.694 -7.026 52 HB2 SER 7 2HB SER 7 11.040 -0.342 -9.520 53 HB3 SER 7 3HB SER 7 10.763 1.254 -8.823 54 HG SER 7 HG SER 7 11.888 -0.912 -7.381 55 HA PRO 8 HA PRO 8 6.847 2.600 -6.558 56 HB2 PRO 8 2HB PRO 8 8.306 4.457 -5.218 57 HB3 PRO 8 3HB PRO 8 7.743 2.956 -4.473 58 HG2 PRO 8 2HG PRO 8 10.437 3.617 -5.600 59 HG3 PRO 8 3HG PRO 8 10.030 2.761 -4.101 60 HD2 PRO 8 2HD PRO 8 10.781 1.469 -6.359 61 HD3 PRO 8 3HD PRO 8 9.635 0.772 -5.197 62 H SER 9 H SER 9 10.053 3.892 -7.455 63 HA SER 9 HA SER 9 9.221 6.291 -8.561 64 HB2 SER 9 2HB SER 9 11.459 4.886 -9.924 65 HB3 SER 9 3HB SER 9 11.379 6.530 -9.291 66 HG SER 9 HG SER 9 12.431 5.768 -7.651 67 H ASP 10 H ASP 10 9.629 3.145 -10.155 68 HA ASP 10 HA ASP 10 8.971 3.957 -12.752 69 HB2 ASP 10 2HB ASP 10 8.628 1.284 -11.382 70 HB3 ASP 10 3HB ASP 10 8.383 1.538 -13.108 71 H ILE 11 H ILE 11 6.954 3.051 -10.026 72 HA ILE 11 HA ILE 11 4.520 2.949 -11.534 73 HB ILE 11 HB ILE 11 5.028 3.107 -8.565 74 HG12 ILE 11 2HG1 ILE 11 3.815 0.782 -10.009 75 HG13 ILE 11 3HG1 ILE 11 5.558 1.019 -10.081 76 HG21 ILE 11 1HG2 ILE 11 2.910 4.070 -8.795 77 HG22 ILE 11 2HG2 ILE 11 2.459 2.983 -10.107 78 HG23 ILE 11 3HG2 ILE 11 2.579 2.372 -8.458 79 HD11 ILE 11 3HD1 ILE 11 3.840 0.212 -7.818 80 HD12 ILE 11 1HD1 ILE 11 5.460 -0.321 -8.265 81 HD13 ILE 11 2HD1 ILE 11 5.234 1.228 -7.453 82 H ALA 12 H ALA 12 5.898 5.282 -9.222 83 HA ALA 12 HA ALA 12 3.886 7.184 -9.287 84 HB1 ALA 12 1HB ALA 12 6.249 8.648 -9.102 85 HB2 ALA 12 2HB ALA 12 5.291 8.000 -7.770 86 HB3 ALA 12 3HB ALA 12 6.637 7.066 -8.424 87 H ALA 13 H ALA 13 6.398 6.516 -11.620 88 HA ALA 13 HA ALA 13 6.137 8.938 -13.096 89 HB1 ALA 13 1HB ALA 13 7.561 6.381 -13.411 90 HB2 ALA 13 2HB ALA 13 7.162 7.223 -14.909 91 HB3 ALA 13 3HB ALA 13 8.119 8.034 -13.670 92 H ALA 14 H ALA 14 4.369 5.973 -12.999 93 HA ALA 14 HA ALA 14 3.077 6.461 -15.564 94 HB1 ALA 14 1HB ALA 14 2.295 4.279 -13.670 95 HB2 ALA 14 2HB ALA 14 2.215 4.313 -15.432 96 HB3 ALA 14 3HB ALA 14 3.775 4.156 -14.623 97 H LEU 15 H LEU 15 2.227 6.295 -12.121 98 HA LEU 15 HA LEU 15 -0.508 6.780 -12.355 99 HB2 LEU 15 2HB LEU 15 1.491 7.347 -10.196 100 HB3 LEU 15 3HB LEU 15 -0.197 7.819 -10.017 101 HG LEU 15 HG LEU 15 0.774 4.995 -10.448 102 HD11 LEU 15 1HD1 LEU 15 1.436 5.303 -8.300 103 HD12 LEU 15 2HD1 LEU 15 -0.264 4.943 -8.003 104 HD13 LEU 15 3HD1 LEU 15 0.293 6.616 -8.015 105 HD21 LEU 15 3HD2 LEU 15 -1.567 4.459 -9.729 106 HD22 LEU 15 1HD2 LEU 15 -1.432 5.229 -11.310 107 HD23 LEU 15 2HD2 LEU 15 -1.945 6.173 -9.912 108 H ARG 16 H ARG 16 2.143 9.102 -11.847 109 HA ARG 16 HA ARG 16 0.447 11.387 -11.988 110 HB2 ARG 16 2HB ARG 16 3.435 11.266 -12.421 111 HB3 ARG 16 3HB ARG 16 2.488 12.683 -11.988 112 HG2 ARG 16 2HG ARG 16 1.952 11.689 -9.834 113 HG3 ARG 16 3HG ARG 16 2.860 10.239 -10.269 114 HD2 ARG 16 2HD ARG 16 4.314 11.514 -8.926 115 HD3 ARG 16 3HD ARG 16 4.862 11.762 -10.583 116 HE ARG 16 HE ARG 16 3.590 13.723 -8.849 117 HH11 ARG 16 1HH1 ARG 16 4.775 12.894 -12.016 118 HH12 ARG 16 2HH1 ARG 16 4.870 14.538 -12.553 119 HH21 ARG 16 1HH2 ARG 16 3.711 15.891 -9.545 120 HH22 ARG 16 2HH2 ARG 16 4.265 16.242 -11.147 121 H ASP 17 H ASP 17 2.264 9.524 -14.318 122 HA ASP 17 HA ASP 17 2.461 11.263 -16.445 123 HB2 ASP 17 2HB ASP 17 3.484 9.228 -16.844 124 HB3 ASP 17 3HB ASP 17 2.114 8.301 -16.238 125 H CYS 18 H CYS 18 -0.309 9.231 -15.552 126 HA CYS 18 HA CYS 18 -2.026 11.019 -17.121 127 HB2 CYS 18 2HB CYS 18 -1.854 8.028 -17.314 128 HB3 CYS 18 3HB CYS 18 -3.369 8.853 -17.663 129 HG CYS 18 HG CYS 18 -1.521 10.579 -19.449 130 H GLN 19 H GLN 19 -1.633 11.176 -14.386 131 HA GLN 19 HA GLN 19 -3.357 9.709 -12.772 132 HB2 GLN 19 2HB GLN 19 -3.348 11.819 -11.319 133 HB3 GLN 19 3HB GLN 19 -1.796 11.066 -11.661 134 HG2 GLN 19 2HG GLN 19 -1.167 12.743 -13.142 135 HG3 GLN 19 3HG GLN 19 -2.824 13.308 -13.354 136 HE21 GLN 19 1HE2 GLN 19 -0.409 12.882 -10.789 137 HE22 GLN 19 2HE2 GLN 19 -0.760 14.366 -9.976 138 H ALA 20 H ALA 20 -3.973 12.564 -14.744 139 HA ALA 20 HA ALA 20 -6.482 13.289 -13.837 140 HB1 ALA 20 1HB ALA 20 -6.717 14.522 -15.779 141 HB2 ALA 20 2HB ALA 20 -4.966 14.348 -15.655 142 HB3 ALA 20 3HB ALA 20 -5.877 13.324 -16.765 143 HA PRO 21 HA PRO 21 -9.209 9.999 -14.871 144 HB2 PRO 21 2HB PRO 21 -11.520 11.386 -15.197 145 HB3 PRO 21 3HB PRO 21 -10.787 11.098 -13.614 146 HG2 PRO 21 2HG PRO 21 -10.658 13.536 -15.346 147 HG3 PRO 21 3HG PRO 21 -10.899 13.420 -13.593 148 HD2 PRO 21 2HD PRO 21 -8.504 14.032 -14.697 149 HD3 PRO 21 3HD PRO 21 -8.651 13.127 -13.176 150 H ASP 22 H ASP 22 -10.267 9.021 -16.606 151 HA ASP 22 HA ASP 22 -10.685 8.534 -18.789 152 HB2 ASP 22 2HB ASP 22 -12.097 10.715 -18.363 153 HB3 ASP 22 3HB ASP 22 -10.919 11.443 -19.452 154 H SER 23 H SER 23 -7.942 9.475 -17.809 155 HA SER 23 HA SER 23 -6.784 9.971 -20.475 156 HB2 SER 23 2HB SER 23 -6.572 11.699 -18.440 157 HB3 SER 23 3HB SER 23 -5.212 10.649 -18.039 158 HG SER 23 HG SER 23 -5.209 12.583 -19.771 159 H PHE 24 H PHE 24 -7.044 7.818 -17.901 160 HA PHE 24 HA PHE 24 -4.489 6.510 -18.480 161 HB2 PHE 24 2HB PHE 24 -5.659 6.955 -16.097 162 HB3 PHE 24 3HB PHE 24 -6.333 5.369 -16.456 163 HD1 PHE 24 HD2 PHE 24 -3.211 7.248 -15.923 164 HD2 PHE 24 HD1 PHE 24 -5.005 3.411 -16.341 165 HE1 PHE 24 HE2 PHE 24 -1.129 6.193 -15.143 166 HE2 PHE 24 HE1 PHE 24 -2.926 2.350 -15.561 167 HZ PHE 24 HZ PHE 24 -0.985 3.742 -14.962 168 H SER 25 H SER 25 -4.555 4.074 -18.578 169 HA SER 25 HA SER 25 -6.993 2.966 -19.719 170 HB2 SER 25 2HB SER 25 -4.843 3.888 -21.359 171 HB3 SER 25 3HB SER 25 -4.889 2.128 -21.448 172 HG SER 25 HG SER 25 -6.860 4.001 -22.164 173 HA PRO 26 HA PRO 26 -5.688 -0.763 -17.815 174 HB2 PRO 26 2HB PRO 26 -6.522 -2.653 -19.576 175 HB3 PRO 26 3HB PRO 26 -7.635 -1.722 -18.567 176 HG2 PRO 26 2HG PRO 26 -6.883 -1.311 -21.436 177 HG3 PRO 26 3HG PRO 26 -8.482 -1.222 -20.674 178 HD2 PRO 26 2HD PRO 26 -7.029 0.983 -21.272 179 HD3 PRO 26 3HD PRO 26 -8.122 0.910 -19.875 180 H LYS 27 H LYS 27 -4.393 0.161 -20.829 181 HA LYS 27 HA LYS 27 -2.239 -1.829 -20.542 182 HB2 LYS 27 2HB LYS 27 -1.984 -1.904 -22.932 183 HB3 LYS 27 3HB LYS 27 -3.672 -2.216 -22.547 184 HG2 LYS 27 2HG LYS 27 -3.693 0.479 -22.892 185 HG3 LYS 27 3HG LYS 27 -2.455 -0.018 -24.048 186 HD2 LYS 27 2HD LYS 27 -4.427 -0.122 -25.286 187 HD3 LYS 27 3HD LYS 27 -4.168 -1.796 -24.789 188 HE2 LYS 27 2HE LYS 27 -5.855 -1.704 -23.182 189 HE3 LYS 27 3HE LYS 27 -5.850 0.058 -23.141 190 HZ1 LYS 27 3HZ LYS 27 -7.025 -1.736 -25.166 191 HZ2 LYS 27 1HZ LYS 27 -6.631 -0.138 -25.558 192 HZ3 LYS 27 2HZ LYS 27 -7.750 -0.456 -24.331 193 H LYS 28 H LYS 28 -2.397 0.806 -19.358 194 HA LYS 28 HA LYS 28 -0.072 2.034 -20.683 195 HB2 LYS 28 2HB LYS 28 -2.533 3.358 -19.571 196 HB3 LYS 28 3HB LYS 28 -1.014 4.234 -19.710 197 HG2 LYS 28 2HG LYS 28 -2.178 2.814 -22.072 198 HG3 LYS 28 3HG LYS 28 -2.744 4.420 -21.607 199 HD2 LYS 28 2HD LYS 28 0.186 4.045 -21.771 200 HD3 LYS 28 3HD LYS 28 -0.701 4.012 -23.297 201 HE2 LYS 28 2HE LYS 28 -1.790 6.173 -22.549 202 HE3 LYS 28 3HE LYS 28 -0.593 6.221 -21.256 203 HZ1 LYS 28 3HZ LYS 28 0.068 6.092 -24.148 204 HZ2 LYS 28 1HZ LYS 28 1.158 6.289 -22.869 205 HZ3 LYS 28 2HZ LYS 28 0.051 7.515 -23.232 206 H PHE 29 H PHE 29 -0.533 0.162 -18.328 207 HA PHE 29 HA PHE 29 0.968 1.753 -16.355 208 HB2 PHE 29 2HB PHE 29 -1.536 0.758 -15.926 209 HB3 PHE 29 3HB PHE 29 -0.537 -0.557 -15.316 210 HD1 PHE 29 HD1 PHE 29 1.766 1.261 -14.394 211 HD2 PHE 29 HD2 PHE 29 -2.449 1.400 -13.824 212 HE1 PHE 29 HE1 PHE 29 2.095 2.487 -12.287 213 HE2 PHE 29 HE2 PHE 29 -2.127 2.627 -11.716 214 HZ PHE 29 HZ PHE 29 0.147 3.173 -10.945 215 H PHE 30 H PHE 30 1.374 -0.481 -18.589 216 HA PHE 30 HA PHE 30 3.196 -2.125 -16.958 217 HB2 PHE 30 2HB PHE 30 2.830 -3.960 -18.379 218 HB3 PHE 30 3HB PHE 30 1.230 -3.254 -18.175 219 HD1 PHE 30 HD2 PHE 30 0.184 -2.003 -20.001 220 HD2 PHE 30 HD1 PHE 30 3.936 -3.950 -20.494 221 HE1 PHE 30 HE2 PHE 30 -0.047 -1.820 -22.443 222 HE2 PHE 30 HE1 PHE 30 3.712 -3.770 -22.938 223 HZ PHE 30 HZ PHE 30 1.718 -2.705 -23.915 224 H GLN 31 H GLN 31 3.025 0.273 -19.290 225 HA GLN 31 HA GLN 31 5.547 -0.453 -20.572 226 HB2 GLN 31 2HB GLN 31 4.197 2.115 -21.202 227 HB3 GLN 31 3HB GLN 31 4.992 0.970 -22.273 228 HG2 GLN 31 2HG GLN 31 3.057 -0.547 -22.021 229 HG3 GLN 31 3HG GLN 31 2.256 0.691 -21.055 230 HE21 GLN 31 1HE2 GLN 31 2.686 2.969 -22.335 231 HE22 GLN 31 2HE2 GLN 31 2.045 2.929 -23.939 232 H ILE 32 H ILE 32 4.263 1.677 -18.168 233 HA ILE 32 HA ILE 32 6.748 3.230 -18.088 234 HB ILE 32 HB ILE 32 4.224 3.674 -16.493 235 HG12 ILE 32 2HG1 ILE 32 4.328 5.731 -18.266 236 HG13 ILE 32 3HG1 ILE 32 4.988 4.426 -19.246 237 HG21 ILE 32 1HG2 ILE 32 5.907 4.770 -15.342 238 HG22 ILE 32 2HG2 ILE 32 6.789 5.175 -16.814 239 HG23 ILE 32 3HG2 ILE 32 5.300 6.031 -16.416 240 HD11 ILE 32 3HD1 ILE 32 2.767 3.303 -18.046 241 HD12 ILE 32 1HD1 ILE 32 2.263 4.945 -18.444 242 HD13 ILE 32 2HD1 ILE 32 2.890 3.885 -19.706 243 H SER 33 H SER 33 4.980 0.792 -16.380 244 HA SER 33 HA SER 33 6.757 1.014 -14.058 245 HB2 SER 33 2HB SER 33 5.183 -0.230 -12.833 246 HB3 SER 33 3HB SER 33 4.188 0.790 -13.871 247 HG SER 33 HG SER 33 3.525 -1.424 -13.853 248 H GLY 34 H GLY 34 5.382 -1.619 -16.045 249 HA2 GLY 34 2HA GLY 34 7.051 -3.030 -17.244 250 HA3 GLY 34 3HA GLY 34 7.967 -3.022 -15.744 251 H MET 35 H MET 35 4.471 -3.383 -16.078 252 HA MET 35 HA MET 35 4.389 -5.612 -14.343 253 HB2 MET 35 2HB MET 35 2.252 -4.823 -16.322 254 HB3 MET 35 3HB MET 35 2.043 -5.702 -14.813 255 HG2 MET 35 2HG MET 35 2.765 -3.683 -13.585 256 HG3 MET 35 3HG MET 35 2.839 -2.818 -15.119 257 HE1 MET 35 3HE MET 35 -1.039 -4.502 -13.271 258 HE2 MET 35 1HE MET 35 0.135 -5.536 -14.085 259 HE3 MET 35 2HE MET 35 0.574 -4.715 -12.587 260 H SER 36 H SER 36 4.025 -5.342 -17.871 261 HA SER 36 HA SER 36 3.545 -8.007 -18.458 262 HB2 SER 36 2HB SER 36 4.211 -7.514 -20.701 263 HB3 SER 36 3HB SER 36 3.477 -6.045 -20.059 264 HG SER 36 HG SER 36 5.643 -5.974 -21.219 265 H LYS 37 H LYS 37 6.556 -6.385 -17.712 266 HA LYS 37 HA LYS 37 8.306 -8.445 -18.551 267 HB2 LYS 37 2HB LYS 37 8.913 -6.551 -16.296 268 HB3 LYS 37 3HB LYS 37 10.018 -7.240 -17.478 269 HG2 LYS 37 2HG LYS 37 7.975 -5.078 -17.908 270 HG3 LYS 37 3HG LYS 37 9.732 -4.953 -18.025 271 HD2 LYS 37 2HD LYS 37 7.933 -6.560 -19.839 272 HD3 LYS 37 3HD LYS 37 8.722 -5.033 -20.241 273 HE2 LYS 37 2HE LYS 37 10.913 -6.235 -19.701 274 HE3 LYS 37 3HE LYS 37 9.971 -7.724 -19.768 275 HZ1 LYS 37 3HZ LYS 37 10.406 -5.770 -21.955 276 HZ2 LYS 37 1HZ LYS 37 9.268 -7.019 -22.040 277 HZ3 LYS 37 2HZ LYS 37 10.913 -7.383 -21.896 278 H LYS 38 H LYS 38 6.134 -8.259 -15.972 279 HA LYS 38 HA LYS 38 7.628 -10.106 -14.278 280 HB2 LYS 38 2HB LYS 38 4.847 -9.055 -13.782 281 HB3 LYS 38 3HB LYS 38 5.982 -9.712 -12.610 282 HG2 LYS 38 2HG LYS 38 6.474 -7.171 -14.138 283 HG3 LYS 38 3HG LYS 38 5.691 -7.225 -12.557 284 HD2 LYS 38 2HD LYS 38 7.716 -7.158 -11.636 285 HD3 LYS 38 3HD LYS 38 8.006 -8.771 -12.293 286 HE2 LYS 38 2HE LYS 38 8.559 -7.361 -14.474 287 HE3 LYS 38 3HE LYS 38 8.913 -6.118 -13.275 288 HZ1 LYS 38 3HZ LYS 38 10.179 -8.779 -13.562 289 HZ2 LYS 38 1HZ LYS 38 10.352 -7.838 -12.166 290 HZ3 LYS 38 2HZ LYS 38 10.916 -7.258 -13.651 291 H SER 39 H SER 39 6.717 -12.119 -13.578 292 HA SER 39 HA SER 39 5.508 -13.578 -15.724 293 HB2 SER 39 2HB SER 39 7.151 -14.701 -14.365 294 HB3 SER 39 3HB SER 39 6.235 -14.369 -12.895 295 HG SER 39 HG SER 39 5.880 -16.495 -13.616 296 H SER 40 H SER 40 3.574 -14.924 -15.464 297 HA SER 40 HA SER 40 1.308 -13.447 -14.854 298 HB2 SER 40 2HB SER 40 0.265 -15.193 -15.805 299 HB3 SER 40 3HB SER 40 1.842 -15.970 -15.937 300 HG SER 40 HG SER 40 0.680 -17.394 -14.792 301 H SER 41 H SER 41 3.284 -15.453 -12.807 302 HA SER 41 HA SER 41 1.397 -15.671 -10.670 303 HB2 SER 41 2HB SER 41 4.306 -16.293 -11.012 304 HB3 SER 41 3HB SER 41 3.626 -16.235 -9.386 305 HG SER 41 HG SER 41 3.078 -18.001 -11.491 306 H GLN 42 H GLN 42 3.946 -13.430 -11.534 307 HA GLN 42 HA GLN 42 4.057 -12.079 -9.035 308 HB2 GLN 42 2HB GLN 42 5.070 -11.568 -11.789 309 HB3 GLN 42 3HB GLN 42 4.993 -10.206 -10.678 310 HG2 GLN 42 2HG GLN 42 6.290 -11.656 -9.049 311 HG3 GLN 42 3HG GLN 42 6.580 -12.736 -10.412 312 HE21 GLN 42 1HE2 GLN 42 6.986 -9.418 -9.298 313 HE22 GLN 42 2HE2 GLN 42 8.398 -9.084 -10.236 314 H LEU 43 H LEU 43 2.423 -11.355 -12.108 315 HA LEU 43 HA LEU 43 1.232 -8.947 -11.288 316 HB2 LEU 43 2HB LEU 43 0.089 -10.888 -13.283 317 HB3 LEU 43 3HB LEU 43 -0.171 -9.147 -13.207 318 HG LEU 43 HG LEU 43 2.606 -10.123 -13.629 319 HD11 LEU 43 1HD1 LEU 43 0.429 -10.209 -15.707 320 HD12 LEU 43 2HD1 LEU 43 1.471 -11.529 -15.178 321 HD13 LEU 43 3HD1 LEU 43 2.151 -10.182 -16.089 322 HD21 LEU 43 3HD2 LEU 43 0.949 -7.733 -14.286 323 HD22 LEU 43 1HD2 LEU 43 2.354 -8.108 -15.285 324 HD23 LEU 43 2HD2 LEU 43 2.552 -7.830 -13.555 325 H LYS 44 H LYS 44 0.497 -12.214 -10.545 326 HA LYS 44 HA LYS 44 -2.267 -11.893 -9.946 327 HB2 LYS 44 2HB LYS 44 -0.208 -13.979 -9.567 328 HB3 LYS 44 3HB LYS 44 -1.532 -14.002 -8.409 329 HG2 LYS 44 2HG LYS 44 -3.126 -14.414 -10.054 330 HG3 LYS 44 3HG LYS 44 -2.058 -13.880 -11.354 331 HD2 LYS 44 2HD LYS 44 -2.161 -16.249 -11.482 332 HD3 LYS 44 3HD LYS 44 -0.583 -15.846 -10.801 333 HE2 LYS 44 2HE LYS 44 -1.153 -16.597 -8.696 334 HE3 LYS 44 3HE LYS 44 -2.880 -16.371 -8.968 335 HZ1 LYS 44 3HZ LYS 44 -2.512 -18.237 -10.720 336 HZ2 LYS 44 1HZ LYS 44 -2.688 -18.635 -9.085 337 HZ3 LYS 44 2HZ LYS 44 -1.149 -18.598 -9.785 338 H GLU 45 H GLU 45 0.636 -11.083 -8.301 339 HA GLU 45 HA GLU 45 -0.219 -11.196 -5.631 340 HB2 GLU 45 2HB GLU 45 1.762 -9.310 -6.920 341 HB3 GLU 45 3HB GLU 45 1.585 -9.564 -5.189 342 HG2 GLU 45 2HG GLU 45 2.163 -11.867 -7.000 343 HG3 GLU 45 3HG GLU 45 3.457 -10.793 -6.472 344 H ILE 46 H ILE 46 -0.347 -8.550 -7.995 345 HA ILE 46 HA ILE 46 -1.436 -6.593 -6.325 346 HB ILE 46 HB ILE 46 -1.950 -6.918 -9.282 347 HG12 ILE 46 2HG1 ILE 46 -0.009 -4.996 -9.001 348 HG13 ILE 46 3HG1 ILE 46 0.442 -6.157 -7.757 349 HG21 ILE 46 1HG2 ILE 46 -3.159 -5.067 -9.110 350 HG22 ILE 46 2HG2 ILE 46 -2.860 -5.013 -7.373 351 HG23 ILE 46 3HG2 ILE 46 -1.748 -4.213 -8.484 352 HD11 ILE 46 3HD1 ILE 46 -0.216 -7.395 -10.309 353 HD12 ILE 46 1HD1 ILE 46 1.149 -6.282 -10.390 354 HD13 ILE 46 2HD1 ILE 46 1.177 -7.630 -9.254 355 H PHE 47 H PHE 47 -2.974 -9.164 -8.172 356 HA PHE 47 HA PHE 47 -5.626 -8.362 -8.017 357 HB2 PHE 47 2HB PHE 47 -5.465 -10.211 -9.343 358 HB3 PHE 47 3HB PHE 47 -4.221 -10.950 -8.341 359 HD1 PHE 47 HD1 PHE 47 -4.839 -12.227 -6.336 360 HD2 PHE 47 HD2 PHE 47 -7.775 -10.668 -8.995 361 HE1 PHE 47 HE1 PHE 47 -6.521 -13.731 -5.356 362 HE2 PHE 47 HE2 PHE 47 -9.462 -12.169 -8.018 363 HZ PHE 47 HZ PHE 47 -8.836 -13.703 -6.196 364 H ARG 48 H ARG 48 -3.621 -10.003 -5.634 365 HA ARG 48 HA ARG 48 -5.701 -10.605 -3.808 366 HB2 ARG 48 2HB ARG 48 -2.908 -11.018 -3.971 367 HB3 ARG 48 3HB ARG 48 -3.205 -10.176 -2.456 368 HG2 ARG 48 2HG ARG 48 -4.646 -12.677 -3.304 369 HG3 ARG 48 3HG ARG 48 -3.213 -12.653 -2.274 370 HD2 ARG 48 2HD ARG 48 -5.476 -10.912 -1.485 371 HD3 ARG 48 3HD ARG 48 -5.700 -12.651 -1.301 372 HE ARG 48 HE ARG 48 -3.236 -11.647 -0.194 373 HH11 ARG 48 1HH1 ARG 48 -6.604 -12.308 0.389 374 HH12 ARG 48 2HH1 ARG 48 -6.418 -12.425 2.107 375 HH21 ARG 48 1HH2 ARG 48 -2.978 -11.798 2.067 376 HH22 ARG 48 2HH2 ARG 48 -4.355 -12.134 3.061 377 H ILE 49 H ILE 49 -4.345 -7.676 -4.726 378 HA ILE 49 HA ILE 49 -4.976 -6.391 -2.161 379 HB ILE 49 HB ILE 49 -3.590 -5.134 -4.527 380 HG12 ILE 49 2HG1 ILE 49 -2.278 -7.045 -3.723 381 HG13 ILE 49 3HG1 ILE 49 -1.484 -5.526 -3.322 382 HG21 ILE 49 1HG2 ILE 49 -2.728 -3.668 -2.573 383 HG22 ILE 49 2HG2 ILE 49 -4.356 -3.404 -3.194 384 HG23 ILE 49 3HG2 ILE 49 -4.119 -4.312 -1.701 385 HD11 ILE 49 3HD1 ILE 49 -3.131 -7.190 -1.432 386 HD12 ILE 49 1HD1 ILE 49 -1.370 -7.134 -1.493 387 HD13 ILE 49 2HD1 ILE 49 -2.282 -5.695 -1.038 388 H LEU 50 H LEU 50 -6.208 -6.898 -5.275 389 HA LEU 50 HA LEU 50 -7.800 -4.463 -5.314 390 HB2 LEU 50 2HB LEU 50 -7.173 -6.636 -7.217 391 HB3 LEU 50 3HB LEU 50 -8.758 -5.883 -7.381 392 HG LEU 50 HG LEU 50 -7.188 -3.687 -7.287 393 HD11 LEU 50 1HD1 LEU 50 -5.562 -5.724 -8.796 394 HD12 LEU 50 2HD1 LEU 50 -5.156 -5.128 -7.187 395 HD13 LEU 50 3HD1 LEU 50 -5.191 -4.016 -8.555 396 HD21 LEU 50 3HD2 LEU 50 -7.315 -3.759 -9.804 397 HD22 LEU 50 1HD2 LEU 50 -8.844 -3.986 -8.955 398 HD23 LEU 50 2HD2 LEU 50 -8.003 -5.375 -9.642 399 H ASP 51 H ASP 51 -8.090 -7.803 -4.453 400 HA ASP 51 HA ASP 51 -10.926 -7.982 -4.567 401 HB2 ASP 51 2HB ASP 51 -9.189 -9.891 -4.473 402 HB3 ASP 51 3HB ASP 51 -9.199 -9.628 -2.732 403 H ASN 52 H ASN 52 -12.331 -6.977 -3.304 404 HA ASN 52 HA ASN 52 -11.462 -6.096 -0.637 405 HB2 ASN 52 2HB ASN 52 -13.029 -4.854 -2.737 406 HB3 ASN 52 3HB ASN 52 -13.910 -4.872 -1.212 407 HD21 ASN 52 1HD2 ASN 52 -10.611 -4.265 -2.378 408 HD22 ASN 52 2HD2 ASN 52 -10.350 -2.854 -1.415 409 H ASP 53 H ASP 53 -12.854 -8.680 -1.839 410 HA ASP 53 HA ASP 53 -14.621 -9.012 0.477 411 HB2 ASP 53 2HB ASP 53 -15.519 -10.266 -2.063 412 HB3 ASP 53 3HB ASP 53 -16.468 -9.630 -0.723 413 H GLN 54 H GLN 54 -12.014 -10.057 -1.185 414 HA GLN 54 HA GLN 54 -10.807 -11.986 -1.287 415 HB2 GLN 54 2HB GLN 54 -12.311 -12.929 1.135 416 HB3 GLN 54 3HB GLN 54 -10.625 -13.194 0.714 417 HG2 GLN 54 2HG GLN 54 -11.742 -10.491 1.397 418 HG3 GLN 54 3HG GLN 54 -11.052 -11.586 2.593 419 HE21 GLN 54 1HE2 GLN 54 -10.425 -9.215 0.268 420 HE22 GLN 54 2HE2 GLN 54 -8.699 -9.289 0.300 421 H SER 55 H SER 55 -13.613 -11.891 -2.442 422 HA SER 55 HA SER 55 -14.700 -14.509 -2.240 423 HB2 SER 55 2HB SER 55 -15.789 -13.684 -4.523 424 HB3 SER 55 3HB SER 55 -16.311 -13.037 -2.968 425 HG SER 55 HG SER 55 -14.909 -11.822 -5.017 426 H GLY 56 H GLY 56 -12.196 -13.084 -4.161 427 HA2 GLY 56 2HA GLY 56 -10.582 -14.748 -5.051 428 HA3 GLY 56 3HA GLY 56 -11.977 -15.611 -5.681 429 H PHE 57 H PHE 57 -13.049 -12.726 -6.231 430 HA PHE 57 HA PHE 57 -11.457 -12.206 -8.645 431 HB2 PHE 57 2HB PHE 57 -14.480 -12.223 -8.589 432 HB3 PHE 57 3HB PHE 57 -13.449 -11.960 -9.992 433 HD1 PHE 57 HD1 PHE 57 -14.699 -14.450 -7.603 434 HD2 PHE 57 HD2 PHE 57 -12.430 -13.790 -11.143 435 HE1 PHE 57 HE1 PHE 57 -14.737 -16.865 -8.073 436 HE2 PHE 57 HE2 PHE 57 -12.465 -16.203 -11.619 437 HZ PHE 57 HZ PHE 57 -13.620 -17.744 -10.084 438 H ILE 58 H ILE 58 -12.040 -10.056 -9.639 439 HA ILE 58 HA ILE 58 -12.647 -8.110 -7.509 440 HB ILE 58 HB ILE 58 -10.809 -7.719 -9.874 441 HG12 ILE 58 2HG1 ILE 58 -9.813 -7.582 -7.083 442 HG13 ILE 58 3HG1 ILE 58 -10.215 -9.184 -7.692 443 HG21 ILE 58 1HG2 ILE 58 -11.893 -5.656 -9.259 444 HG22 ILE 58 2HG2 ILE 58 -11.498 -5.914 -7.560 445 HG23 ILE 58 3HG2 ILE 58 -10.212 -5.609 -8.728 446 HD11 ILE 58 3HD1 ILE 58 -7.844 -8.586 -7.983 447 HD12 ILE 58 1HD1 ILE 58 -8.662 -8.936 -9.505 448 HD13 ILE 58 2HD1 ILE 58 -8.335 -7.265 -9.043 449 H GLU 59 H GLU 59 -14.793 -7.769 -7.930 450 HA GLU 59 HA GLU 59 -15.872 -7.455 -10.536 451 HB2 GLU 59 2HB GLU 59 -17.054 -6.431 -7.953 452 HB3 GLU 59 3HB GLU 59 -17.911 -6.809 -9.441 453 HG2 GLU 59 2HG GLU 59 -18.368 -8.737 -8.409 454 HG3 GLU 59 3HG GLU 59 -16.744 -9.188 -8.927 455 H GLU 60 H GLU 60 -17.239 -5.344 -10.942 456 HA GLU 60 HA GLU 60 -15.412 -3.291 -11.507 457 HB2 GLU 60 2HB GLU 60 -18.397 -3.511 -11.581 458 HB3 GLU 60 3HB GLU 60 -17.639 -1.943 -11.822 459 HG2 GLU 60 2HG GLU 60 -16.646 -2.578 -13.806 460 HG3 GLU 60 3HG GLU 60 -16.739 -4.296 -13.423 461 H ASP 61 H ASP 61 -17.577 -3.816 -8.806 462 HA ASP 61 HA ASP 61 -17.523 -1.246 -7.687 463 HB2 ASP 61 2HB ASP 61 -17.945 -3.986 -6.513 464 HB3 ASP 61 3HB ASP 61 -17.956 -2.544 -5.500 465 H GLU 62 H GLU 62 -15.083 -3.615 -7.937 466 HA GLU 62 HA GLU 62 -13.459 -2.208 -5.920 467 HB2 GLU 62 2HB GLU 62 -12.095 -4.507 -6.275 468 HB3 GLU 62 3HB GLU 62 -13.336 -4.294 -5.049 469 HG2 GLU 62 2HG GLU 62 -14.958 -5.138 -6.866 470 HG3 GLU 62 3HG GLU 62 -13.501 -5.725 -7.666 471 H LEU 63 H LEU 63 -13.794 -3.048 -9.216 472 HA LEU 63 HA LEU 63 -11.055 -2.847 -9.978 473 HB2 LEU 63 2HB LEU 63 -13.286 -3.756 -11.196 474 HB3 LEU 63 3HB LEU 63 -13.127 -2.178 -11.965 475 HG LEU 63 HG LEU 63 -11.163 -4.462 -12.028 476 HD11 LEU 63 1HD1 LEU 63 -13.156 -3.327 -13.871 477 HD12 LEU 63 2HD1 LEU 63 -12.505 -4.962 -13.763 478 HD13 LEU 63 3HD1 LEU 63 -11.584 -3.698 -14.579 479 HD21 LEU 63 3HD2 LEU 63 -9.943 -2.371 -11.740 480 HD22 LEU 63 1HD2 LEU 63 -10.831 -1.657 -13.087 481 HD23 LEU 63 2HD2 LEU 63 -9.731 -3.006 -13.373 482 H LYS 64 H LYS 64 -13.647 -0.572 -9.508 483 HA LYS 64 HA LYS 64 -12.633 1.596 -10.976 484 HB2 LYS 64 2HB LYS 64 -14.010 2.979 -9.345 485 HB3 LYS 64 3HB LYS 64 -14.877 1.745 -10.251 486 HG2 LYS 64 2HG LYS 64 -15.265 0.464 -8.409 487 HG3 LYS 64 3HG LYS 64 -13.804 1.011 -7.583 488 HD2 LYS 64 2HD LYS 64 -15.778 1.878 -6.465 489 HD3 LYS 64 3HD LYS 64 -14.863 3.198 -7.197 490 HE2 LYS 64 2HE LYS 64 -16.464 3.616 -8.771 491 HE3 LYS 64 3HE LYS 64 -17.019 1.943 -8.808 492 HZ1 LYS 64 3HZ LYS 64 -17.474 3.293 -6.299 493 HZ2 LYS 64 1HZ LYS 64 -18.519 2.327 -7.214 494 HZ3 LYS 64 2HZ LYS 64 -18.320 3.961 -7.602 495 H TYR 65 H TYR 65 -11.695 0.234 -7.944 496 HA TYR 65 HA TYR 65 -10.154 2.589 -7.185 497 HB2 TYR 65 2HB TYR 65 -10.637 -0.062 -5.822 498 HB3 TYR 65 3HB TYR 65 -9.554 1.169 -5.181 499 HD1 TYR 65 HD1 TYR 65 -10.993 3.648 -5.615 500 HD2 TYR 65 HD2 TYR 65 -12.483 -0.156 -4.426 501 HE1 TYR 65 HE1 TYR 65 -12.893 4.746 -4.505 502 HE2 TYR 65 HE2 TYR 65 -14.387 0.932 -3.313 503 HH TYR 65 HH TYR 65 -15.434 3.840 -3.881 504 H PHE 66 H PHE 66 -9.566 0.801 -9.554 505 HA PHE 66 HA PHE 66 -7.300 -0.755 -9.131 506 HB2 PHE 66 2HB PHE 66 -8.383 -0.909 -11.241 507 HB3 PHE 66 3HB PHE 66 -8.223 0.820 -11.531 508 HD1 PHE 66 HD1 PHE 66 -6.119 -2.203 -10.960 509 HD2 PHE 66 HD2 PHE 66 -6.534 1.561 -12.905 510 HE1 PHE 66 HE1 PHE 66 -4.024 -2.608 -12.185 511 HE2 PHE 66 HE2 PHE 66 -4.440 1.161 -14.133 512 HZ PHE 66 HZ PHE 66 -3.183 -0.926 -13.775 513 H LEU 67 H LEU 67 -7.665 2.687 -9.234 514 HA LEU 67 HA LEU 67 -4.813 3.165 -9.510 515 HB2 LEU 67 2HB LEU 67 -6.735 5.313 -8.774 516 HB3 LEU 67 3HB LEU 67 -5.318 5.381 -9.819 517 HG LEU 67 HG LEU 67 -8.086 4.415 -10.477 518 HD11 LEU 67 1HD1 LEU 67 -6.705 6.085 -12.388 519 HD12 LEU 67 2HD1 LEU 67 -6.781 6.842 -10.797 520 HD13 LEU 67 3HD1 LEU 67 -8.264 6.324 -11.598 521 HD21 LEU 67 3HD2 LEU 67 -6.836 2.711 -11.449 522 HD22 LEU 67 1HD2 LEU 67 -5.489 3.783 -11.832 523 HD23 LEU 67 2HD2 LEU 67 -6.991 3.892 -12.751 524 H GLN 68 H GLN 68 -6.984 2.491 -7.028 525 HA GLN 68 HA GLN 68 -5.570 4.000 -4.989 526 HB2 GLN 68 2HB GLN 68 -8.124 2.611 -5.200 527 HB3 GLN 68 3HB GLN 68 -7.295 2.263 -3.689 528 HG2 GLN 68 2HG GLN 68 -8.157 4.148 -2.912 529 HG3 GLN 68 3HG GLN 68 -7.035 4.999 -3.972 530 HE21 GLN 68 1HE2 GLN 68 -8.021 4.690 -6.416 531 HE22 GLN 68 2HE2 GLN 68 -9.610 5.356 -6.546 532 H ARG 69 H ARG 69 -4.563 1.546 -6.632 533 HA ARG 69 HA ARG 69 -3.670 -0.059 -4.332 534 HB2 ARG 69 2HB ARG 69 -3.075 -1.203 -6.933 535 HB3 ARG 69 3HB ARG 69 -3.940 -1.904 -5.572 536 HG2 ARG 69 2HG ARG 69 -5.373 0.124 -7.183 537 HG3 ARG 69 3HG ARG 69 -5.086 -1.452 -7.924 538 HD2 ARG 69 2HD ARG 69 -7.244 -1.388 -6.785 539 HD3 ARG 69 3HD ARG 69 -6.155 -2.548 -6.025 540 HE ARG 69 HE ARG 69 -5.746 -0.378 -4.527 541 HH11 ARG 69 1HH1 ARG 69 -8.686 -1.872 -5.641 542 HH12 ARG 69 2HH1 ARG 69 -9.616 -1.370 -4.268 543 HH21 ARG 69 1HH2 ARG 69 -6.959 0.289 -2.714 544 HH22 ARG 69 2HH2 ARG 69 -8.633 -0.140 -2.604 545 H PHE 70 H PHE 70 -2.637 1.822 -7.086 546 HA PHE 70 HA PHE 70 0.170 1.203 -6.571 547 HB2 PHE 70 2HB PHE 70 -1.214 2.750 -8.763 548 HB3 PHE 70 3HB PHE 70 0.537 2.674 -8.605 549 HD1 PHE 70 HD1 PHE 70 -2.502 0.732 -9.308 550 HD2 PHE 70 HD2 PHE 70 1.754 0.723 -9.227 551 HE1 PHE 70 HE1 PHE 70 -2.485 -1.374 -10.580 552 HE2 PHE 70 HE2 PHE 70 1.777 -1.382 -10.499 553 HZ PHE 70 HZ PHE 70 -0.344 -2.434 -11.178 554 H GLU 71 H GLU 71 -2.181 3.658 -6.001 555 HA GLU 71 HA GLU 71 -0.068 5.459 -5.013 556 HB2 GLU 71 2HB GLU 71 -1.557 6.264 -6.928 557 HB3 GLU 71 3HB GLU 71 -2.862 6.309 -5.751 558 HG2 GLU 71 2HG GLU 71 -2.146 8.470 -5.663 559 HG3 GLU 71 3HG GLU 71 -1.168 7.758 -4.381 560 H SER 72 H SER 72 -3.052 3.815 -4.302 561 HA SER 72 HA SER 72 -4.156 3.407 -2.355 562 HB2 SER 72 2HB SER 72 -1.796 2.904 -1.580 563 HB3 SER 72 3HB SER 72 -1.744 4.542 -0.928 564 HG SER 72 HG SER 72 -2.811 3.837 0.725 565 H GLY 73 H GLY 73 -5.151 5.515 -3.484 566 HA2 GLY 73 2HA GLY 73 -6.520 6.981 -1.720 567 HA3 GLY 73 3HA GLY 73 -4.992 7.849 -1.755 568 H ALA 74 H ALA 74 -4.821 6.932 -4.695 569 HA ALA 74 HA ALA 74 -5.600 9.321 -5.882 570 HB1 ALA 74 1HB ALA 74 -5.640 7.680 -8.005 571 HB2 ALA 74 2HB ALA 74 -4.153 8.263 -7.255 572 HB3 ALA 74 3HB ALA 74 -4.773 6.661 -6.855 573 H ARG 75 H ARG 75 -7.137 9.178 -7.952 574 HA ARG 75 HA ARG 75 -9.777 8.907 -6.890 575 HB2 ARG 75 2HB ARG 75 -10.527 9.720 -9.054 576 HB3 ARG 75 3HB ARG 75 -9.170 10.684 -8.487 577 HG2 ARG 75 2HG ARG 75 -7.673 9.381 -9.952 578 HG3 ARG 75 3HG ARG 75 -9.079 8.507 -10.563 579 HD2 ARG 75 2HD ARG 75 -8.372 11.404 -10.899 580 HD3 ARG 75 3HD ARG 75 -8.685 10.194 -12.143 581 HE ARG 75 HE ARG 75 -10.980 10.452 -11.794 582 HH11 ARG 75 1HH1 ARG 75 -9.113 12.433 -9.623 583 HH12 ARG 75 2HH1 ARG 75 -10.459 13.421 -9.160 584 HH21 ARG 75 1HH2 ARG 75 -12.759 11.746 -11.192 585 HH22 ARG 75 2HH2 ARG 75 -12.532 13.029 -10.052 586 H VAL 76 H VAL 76 -11.476 7.842 -8.447 587 HA VAL 76 HA VAL 76 -10.634 5.053 -8.753 588 HB VAL 76 HB VAL 76 -12.901 4.419 -8.587 589 HG11 VAL 76 1HG1 VAL 76 -13.515 5.192 -6.457 590 HG12 VAL 76 2HG1 VAL 76 -11.757 5.349 -6.506 591 HG13 VAL 76 3HG1 VAL 76 -12.778 6.772 -6.724 592 HG21 VAL 76 3HG2 VAL 76 -13.387 7.108 -9.612 593 HG22 VAL 76 1HG2 VAL 76 -14.350 5.640 -9.778 594 HG23 VAL 76 2HG2 VAL 76 -14.500 6.634 -8.329 595 H LEU 77 H LEU 77 -12.518 4.112 -10.501 596 HA LEU 77 HA LEU 77 -11.656 5.359 -13.017 597 HB2 LEU 77 2HB LEU 77 -12.816 2.613 -12.578 598 HB3 LEU 77 3HB LEU 77 -12.120 3.238 -14.072 599 HG LEU 77 HG LEU 77 -10.655 2.578 -11.520 600 HD11 LEU 77 1HD1 LEU 77 -10.637 1.370 -14.279 601 HD12 LEU 77 2HD1 LEU 77 -11.197 0.617 -12.787 602 HD13 LEU 77 3HD1 LEU 77 -9.484 0.971 -13.006 603 HD21 LEU 77 3HD2 LEU 77 -9.923 4.264 -13.818 604 HD22 LEU 77 1HD2 LEU 77 -8.725 3.058 -13.347 605 HD23 LEU 77 2HD2 LEU 77 -9.290 4.246 -12.172 606 H THR 78 H THR 78 -13.090 6.112 -14.486 607 HA THR 78 HA THR 78 -15.783 6.584 -13.617 608 HB THR 78 HB THR 78 -14.563 8.286 -14.899 609 HG1 THR 78 HG1 THR 78 -16.291 8.540 -16.563 610 HG21 THR 78 3HG2 THR 78 -14.891 7.201 -17.533 611 HG22 THR 78 1HG2 THR 78 -13.898 6.113 -16.564 612 HG23 THR 78 2HG2 THR 78 -13.428 7.802 -16.754 613 H ALA 79 H ALA 79 -17.462 6.375 -15.608 614 HA ALA 79 HA ALA 79 -17.974 3.588 -15.824 615 HB1 ALA 79 1HB ALA 79 -19.980 4.594 -15.885 616 HB2 ALA 79 2HB ALA 79 -19.329 6.078 -16.582 617 HB3 ALA 79 3HB ALA 79 -19.681 4.696 -17.620 618 H SER 80 H SER 80 -15.953 5.610 -17.567 619 HA SER 80 HA SER 80 -16.130 3.935 -19.980 620 HB2 SER 80 2HB SER 80 -16.365 6.148 -20.697 621 HB3 SER 80 3HB SER 80 -15.201 6.756 -19.520 622 HG SER 80 HG SER 80 -14.590 5.137 -21.772 623 H GLU 81 H GLU 81 -14.364 4.339 -17.189 624 HA GLU 81 HA GLU 81 -11.815 3.546 -18.379 625 HB2 GLU 81 2HB GLU 81 -12.628 4.456 -15.629 626 HB3 GLU 81 3HB GLU 81 -11.065 3.705 -15.919 627 HG2 GLU 81 2HG GLU 81 -11.565 5.796 -17.832 628 HG3 GLU 81 3HG GLU 81 -11.725 6.395 -16.182 629 H THR 82 H THR 82 -13.830 2.472 -15.635 630 HA THR 82 HA THR 82 -12.617 0.029 -15.191 631 HB THR 82 HB THR 82 -15.311 -0.477 -14.701 632 HG1 THR 82 HG1 THR 82 -16.270 1.392 -14.497 633 HG21 THR 82 3HG2 THR 82 -12.973 -0.357 -13.288 634 HG22 THR 82 1HG2 THR 82 -14.559 -0.688 -12.593 635 HG23 THR 82 2HG2 THR 82 -13.907 0.951 -12.562 636 H LYS 83 H LYS 83 -15.386 0.736 -17.310 637 HA LYS 83 HA LYS 83 -15.977 -1.794 -18.205 638 HB2 LYS 83 2HB LYS 83 -16.213 0.929 -19.364 639 HB3 LYS 83 3HB LYS 83 -16.391 -0.422 -20.476 640 HG2 LYS 83 2HG LYS 83 -18.115 -1.342 -18.869 641 HG3 LYS 83 3HG LYS 83 -18.056 0.228 -18.063 642 HD2 LYS 83 2HD LYS 83 -19.802 0.540 -19.533 643 HD3 LYS 83 3HD LYS 83 -18.442 1.153 -20.478 644 HE2 LYS 83 2HE LYS 83 -19.699 -0.239 -21.925 645 HE3 LYS 83 3HE LYS 83 -18.252 -1.146 -21.487 646 HZ1 LYS 83 3HZ LYS 83 -19.455 -2.539 -20.092 647 HZ2 LYS 83 1HZ LYS 83 -20.487 -2.346 -21.419 648 HZ3 LYS 83 2HZ LYS 83 -20.776 -1.486 -19.992 649 H THR 84 H THR 84 -13.550 0.438 -19.530 650 HA THR 84 HA THR 84 -12.663 -1.114 -21.655 651 HB THR 84 HB THR 84 -10.893 0.648 -19.954 652 HG1 THR 84 HG1 THR 84 -12.306 1.506 -22.251 653 HG21 THR 84 3HG2 THR 84 -10.053 -0.919 -21.907 654 HG22 THR 84 1HG2 THR 84 -9.427 0.718 -21.719 655 HG23 THR 84 2HG2 THR 84 -10.680 0.385 -22.915 656 H PHE 85 H PHE 85 -11.215 -0.908 -18.399 657 HA PHE 85 HA PHE 85 -9.272 -2.846 -18.692 658 HB2 PHE 85 2HB PHE 85 -9.726 -1.278 -16.704 659 HB3 PHE 85 3HB PHE 85 -10.830 -2.526 -16.135 660 HD1 PHE 85 HD2 PHE 85 -9.931 -4.813 -15.646 661 HD2 PHE 85 HD1 PHE 85 -7.408 -1.468 -16.395 662 HE1 PHE 85 HE2 PHE 85 -8.047 -6.004 -14.603 663 HE2 PHE 85 HE1 PHE 85 -5.520 -2.654 -15.355 664 HZ PHE 85 HZ PHE 85 -5.839 -4.925 -14.456 665 H LEU 86 H LEU 86 -12.635 -3.266 -17.632 666 HA LEU 86 HA LEU 86 -12.488 -6.046 -17.201 667 HB2 LEU 86 2HB LEU 86 -14.279 -4.530 -16.369 668 HB3 LEU 86 3HB LEU 86 -14.907 -4.443 -18.013 669 HG LEU 86 HG LEU 86 -15.369 -6.857 -17.947 670 HD11 LEU 86 1HD1 LEU 86 -14.361 -6.629 -15.117 671 HD12 LEU 86 2HD1 LEU 86 -13.691 -7.615 -16.416 672 HD13 LEU 86 3HD1 LEU 86 -15.274 -8.003 -15.743 673 HD21 LEU 86 3HD2 LEU 86 -17.391 -6.439 -17.101 674 HD22 LEU 86 1HD2 LEU 86 -16.783 -4.821 -16.750 675 HD23 LEU 86 2HD2 LEU 86 -16.741 -6.069 -15.504 676 H ALA 87 H ALA 87 -13.130 -4.120 -20.063 677 HA ALA 87 HA ALA 87 -13.763 -6.476 -21.649 678 HB1 ALA 87 1HB ALA 87 -15.102 -4.644 -22.221 679 HB2 ALA 87 2HB ALA 87 -13.733 -3.532 -22.231 680 HB3 ALA 87 3HB ALA 87 -13.903 -4.732 -23.512 681 H ALA 88 H ALA 88 -10.997 -5.362 -20.482 682 HA ALA 88 HA ALA 88 -9.477 -5.939 -22.942 683 HB1 ALA 88 1HB ALA 88 -9.085 -3.667 -22.306 684 HB2 ALA 88 2HB ALA 88 -8.757 -4.137 -20.638 685 HB3 ALA 88 3HB ALA 88 -7.639 -4.600 -21.921 686 H ALA 89 H ALA 89 -10.187 -6.909 -19.763 687 HA ALA 89 HA ALA 89 -7.889 -8.758 -19.774 688 HB1 ALA 89 1HB ALA 89 -8.932 -7.023 -17.687 689 HB2 ALA 89 2HB ALA 89 -8.775 -8.701 -17.166 690 HB3 ALA 89 3HB ALA 89 -7.374 -7.842 -17.807 691 H ASP 90 H ASP 90 -11.196 -8.429 -18.468 692 HA ASP 90 HA ASP 90 -11.600 -11.177 -18.036 693 HB2 ASP 90 2HB ASP 90 -13.184 -8.743 -17.919 694 HB3 ASP 90 3HB ASP 90 -14.125 -10.101 -18.528 695 H HIS 91 H HIS 91 -13.259 -9.216 -20.507 696 HA HIS 91 HA HIS 91 -14.024 -9.726 -22.588 697 HB2 HIS 91 2HB HIS 91 -11.434 -10.071 -22.756 698 HB3 HIS 91 3HB HIS 91 -11.856 -11.777 -22.877 699 HD1 HIS 91 HD1 HIS 91 -10.764 -11.509 -25.324 700 HD2 HIS 91 HD2 HIS 91 -14.379 -9.562 -24.697 701 HE1 HIS 91 HE1 HIS 91 -11.652 -10.985 -27.617 702 H ASP 92 H ASP 92 -14.597 -11.535 -20.146 703 HA ASP 92 HA ASP 92 -15.686 -13.807 -21.676 704 HB2 ASP 92 2HB ASP 92 -15.692 -15.035 -19.496 705 HB3 ASP 92 3HB ASP 92 -14.083 -14.610 -20.071 706 H GLY 93 H GLY 93 -16.453 -11.007 -19.983 707 HA2 GLY 93 2HA GLY 93 -18.498 -10.061 -19.502 708 HA3 GLY 93 3HA GLY 93 -19.257 -11.455 -20.255 709 H ASP 94 H ASP 94 -17.095 -11.259 -17.445 710 HA ASP 94 HA ASP 94 -19.166 -12.644 -15.882 711 HB2 ASP 94 2HB ASP 94 -16.205 -12.452 -15.295 712 HB3 ASP 94 3HB ASP 94 -17.383 -13.461 -14.459 713 H GLY 95 H GLY 95 -17.511 -9.688 -16.220 714 HA2 GLY 95 2HA GLY 95 -17.704 -7.709 -15.067 715 HA3 GLY 95 3HA GLY 95 -19.006 -8.451 -14.149 716 H LYS 96 H LYS 96 -16.184 -10.286 -14.023 717 HA LYS 96 HA LYS 96 -15.128 -8.909 -11.676 718 HB2 LYS 96 2HB LYS 96 -15.168 -10.976 -10.331 719 HB3 LYS 96 3HB LYS 96 -16.786 -10.420 -10.739 720 HG2 LYS 96 2HG LYS 96 -15.916 -12.218 -12.764 721 HG3 LYS 96 3HG LYS 96 -15.634 -12.959 -11.187 722 HD2 LYS 96 2HD LYS 96 -18.219 -11.615 -11.400 723 HD3 LYS 96 3HD LYS 96 -18.020 -12.944 -12.545 724 HE2 LYS 96 2HE LYS 96 -18.136 -14.492 -10.931 725 HE3 LYS 96 3HE LYS 96 -17.078 -13.579 -9.857 726 HZ1 LYS 96 3HZ LYS 96 -18.973 -13.397 -8.676 727 HZ2 LYS 96 1HZ LYS 96 -19.982 -13.606 -10.019 728 HZ3 LYS 96 2HZ LYS 96 -19.270 -12.100 -9.722 729 H ILE 97 H ILE 97 -12.988 -8.850 -11.799 730 HA ILE 97 HA ILE 97 -11.582 -10.390 -13.771 731 HB ILE 97 HB ILE 97 -10.538 -8.508 -11.652 732 HG12 ILE 97 2HG1 ILE 97 -12.071 -7.657 -13.554 733 HG13 ILE 97 3HG1 ILE 97 -10.548 -6.821 -13.277 734 HG21 ILE 97 1HG2 ILE 97 -9.191 -10.128 -13.744 735 HG22 ILE 97 2HG2 ILE 97 -8.587 -8.501 -13.436 736 HG23 ILE 97 3HG2 ILE 97 -8.642 -9.683 -12.128 737 HD11 ILE 97 3HD1 ILE 97 -11.431 -7.671 -15.687 738 HD12 ILE 97 1HD1 ILE 97 -9.738 -7.385 -15.282 739 HD13 ILE 97 2HD1 ILE 97 -10.400 -9.019 -15.205 740 H GLY 98 H GLY 98 -9.883 -11.871 -13.401 741 HA2 GLY 98 2HA GLY 98 -9.765 -13.008 -10.685 742 HA3 GLY 98 3HA GLY 98 -10.048 -14.053 -12.069 743 H ALA 99 H ALA 99 -8.142 -15.216 -11.482 744 HA ALA 99 HA ALA 99 -5.616 -13.782 -11.915 745 HB1 ALA 99 1HB ALA 99 -6.017 -16.553 -10.797 746 HB2 ALA 99 2HB ALA 99 -4.520 -15.619 -10.818 747 HB3 ALA 99 3HB ALA 99 -5.877 -15.089 -9.823 748 H GLU 100 H GLU 100 -7.782 -15.326 -13.744 749 HA GLU 100 HA GLU 100 -5.737 -16.611 -15.433 750 HB2 GLU 100 2HB GLU 100 -8.648 -17.271 -15.023 751 HB3 GLU 100 3HB GLU 100 -7.740 -17.867 -16.406 752 HG2 GLU 100 2HG GLU 100 -6.901 -18.336 -13.559 753 HG3 GLU 100 3HG GLU 100 -7.936 -19.441 -14.463 754 H GLU 101 H GLU 101 -7.592 -13.913 -15.159 755 HA GLU 101 HA GLU 101 -7.563 -13.488 -18.069 756 HB2 GLU 101 2HB GLU 101 -9.677 -12.337 -17.988 757 HB3 GLU 101 3HB GLU 101 -9.879 -13.933 -17.278 758 HG2 GLU 101 2HG GLU 101 -9.299 -12.483 -15.076 759 HG3 GLU 101 3HG GLU 101 -10.124 -11.274 -16.059 760 H PHE 102 H PHE 102 -6.159 -12.635 -15.338 761 HA PHE 102 HA PHE 102 -6.226 -9.741 -15.746 762 HB2 PHE 102 2HB PHE 102 -6.436 -10.600 -13.443 763 HB3 PHE 102 3HB PHE 102 -4.860 -11.369 -13.592 764 HD1 PHE 102 HD1 PHE 102 -2.820 -9.993 -13.740 765 HD2 PHE 102 HD2 PHE 102 -6.644 -8.277 -12.997 766 HE1 PHE 102 HE1 PHE 102 -1.737 -7.933 -12.943 767 HE2 PHE 102 HE2 PHE 102 -5.567 -6.214 -12.200 768 HZ PHE 102 HZ PHE 102 -3.111 -6.039 -12.173 769 H GLN 103 H GLN 103 -3.628 -12.085 -15.051 770 HA GLN 103 HA GLN 103 -1.509 -10.581 -15.965 771 HB2 GLN 103 2HB GLN 103 -0.327 -12.746 -16.304 772 HB3 GLN 103 3HB GLN 103 -1.135 -12.623 -14.747 773 HG2 GLN 103 2HG GLN 103 -3.043 -13.776 -16.362 774 HG3 GLN 103 3HG GLN 103 -1.537 -14.509 -16.914 775 HE21 GLN 103 1HE2 GLN 103 -2.554 -13.430 -13.701 776 HE22 GLN 103 2HE2 GLN 103 -2.369 -14.967 -12.934 777 H GLU 104 H GLU 104 -3.699 -12.641 -17.803 778 HA GLU 104 HA GLU 104 -2.355 -12.706 -20.235 779 HB2 GLU 104 2HB GLU 104 -4.427 -13.309 -21.235 780 HB3 GLU 104 3HB GLU 104 -4.438 -13.983 -19.612 781 HG2 GLU 104 2HG GLU 104 -5.896 -12.261 -18.832 782 HG3 GLU 104 3HG GLU 104 -5.757 -11.385 -20.355 783 H MET 105 H MET 105 -4.296 -10.178 -18.788 784 HA MET 105 HA MET 105 -4.410 -8.586 -21.183 785 HB2 MET 105 2HB MET 105 -5.763 -7.150 -20.005 786 HB3 MET 105 3HB MET 105 -6.022 -8.635 -19.099 787 HG2 MET 105 2HG MET 105 -5.547 -7.411 -17.305 788 HG3 MET 105 3HG MET 105 -3.868 -7.564 -17.819 789 HE1 MET 105 3HE MET 105 -6.632 -4.729 -19.556 790 HE2 MET 105 1HE MET 105 -7.079 -5.824 -18.247 791 HE3 MET 105 2HE MET 105 -6.718 -4.134 -17.897 792 H VAL 106 H VAL 106 -2.123 -9.126 -18.733 793 HA VAL 106 HA VAL 106 -0.857 -6.529 -18.922 794 HB VAL 106 HB VAL 106 0.292 -9.000 -17.633 795 HG11 VAL 106 1HG1 VAL 106 1.173 -6.301 -17.944 796 HG12 VAL 106 2HG1 VAL 106 0.895 -6.627 -16.232 797 HG13 VAL 106 3HG1 VAL 106 1.991 -7.652 -17.160 798 HG21 VAL 106 3HG2 VAL 106 -2.132 -7.924 -16.948 799 HG22 VAL 106 1HG2 VAL 106 -1.078 -8.838 -15.869 800 HG23 VAL 106 2HG2 VAL 106 -1.024 -7.075 -15.870 801 H GLN 107 H GLN 107 0.700 -9.703 -19.195 802 HA GLN 107 HA GLN 107 2.712 -8.807 -20.932 803 HB2 GLN 107 2HB GLN 107 1.689 -11.612 -20.459 804 HB3 GLN 107 3HB GLN 107 3.183 -11.217 -21.297 805 HG2 GLN 107 2HG GLN 107 4.299 -10.922 -19.397 806 HG3 GLN 107 3HG GLN 107 3.000 -9.969 -18.680 807 HE21 GLN 107 1HE2 GLN 107 1.021 -11.350 -18.108 808 HE22 GLN 107 2HE2 GLN 107 1.356 -12.827 -17.278 809 H SER 108 H SER 108 -0.437 -10.235 -21.540 810 HA SER 108 HA SER 108 0.024 -9.888 -24.431 811 HB2 SER 108 2HB SER 108 -0.502 -12.249 -23.331 812 HB3 SER 108 3HB SER 108 -2.162 -11.663 -23.434 813 HG SER 108 HG SER 108 -1.566 -11.177 -25.719 Start of MODEL 8 1 H1 SER 1 H SER 1 0.956 1.063 -0.747 2 HA SER 1 HA SER 1 1.160 -0.013 -3.244 3 HB2 SER 1 2HB SER 1 2.495 1.926 -2.045 4 HB3 SER 1 3HB SER 1 3.710 0.665 -1.834 5 HG SER 1 HG SER 1 4.253 1.233 -3.790 6 H LEU 2 H LEU 2 1.772 -1.889 -4.104 7 HA LEU 2 HA LEU 2 2.215 -4.191 -2.661 8 HB2 LEU 2 2HB LEU 2 3.399 -3.717 -5.382 9 HB3 LEU 2 3HB LEU 2 2.842 -5.239 -4.689 10 HG LEU 2 HG LEU 2 1.085 -4.849 -6.057 11 HD11 LEU 2 1HD1 LEU 2 0.434 -4.496 -3.544 12 HD12 LEU 2 2HD1 LEU 2 -0.744 -4.224 -4.827 13 HD13 LEU 2 3HD1 LEU 2 0.083 -2.855 -4.085 14 HD21 LEU 2 3HD2 LEU 2 0.328 -2.304 -6.334 15 HD22 LEU 2 1HD2 LEU 2 1.581 -3.043 -7.332 16 HD23 LEU 2 2HD2 LEU 2 2.031 -2.047 -5.948 17 H THR 3 H THR 3 4.743 -2.436 -4.469 18 HA THR 3 HA THR 3 7.003 -2.326 -4.198 19 HB THR 3 HB THR 3 7.392 -2.648 -1.435 20 HG1 THR 3 HG1 THR 3 5.532 -2.177 -0.562 21 HG21 THR 3 3HG2 THR 3 7.681 -0.669 -3.449 22 HG22 THR 3 1HG2 THR 3 8.452 -0.738 -1.865 23 HG23 THR 3 2HG2 THR 3 6.906 0.088 -2.058 24 H ASP 4 H ASP 4 5.643 -5.012 -4.348 25 HA ASP 4 HA ASP 4 7.887 -6.600 -3.286 26 HB2 ASP 4 2HB ASP 4 5.460 -6.856 -2.262 27 HB3 ASP 4 3HB ASP 4 5.207 -7.858 -3.689 28 H ILE 5 H ILE 5 6.387 -5.489 -6.006 29 HA ILE 5 HA ILE 5 7.513 -7.677 -7.614 30 HB ILE 5 HB ILE 5 4.905 -6.276 -8.212 31 HG12 ILE 5 2HG1 ILE 5 4.169 -8.814 -7.978 32 HG13 ILE 5 3HG1 ILE 5 5.578 -8.885 -6.925 33 HG21 ILE 5 1HG2 ILE 5 6.435 -7.045 -10.127 34 HG22 ILE 5 2HG2 ILE 5 5.997 -8.679 -9.631 35 HG23 ILE 5 3HG2 ILE 5 4.747 -7.552 -10.156 36 HD11 ILE 5 3HD1 ILE 5 4.142 -8.277 -5.332 37 HD12 ILE 5 1HD1 ILE 5 4.327 -6.658 -6.005 38 HD13 ILE 5 2HD1 ILE 5 2.962 -7.664 -6.490 39 H LEU 6 H LEU 6 5.979 -4.492 -8.111 40 HA LEU 6 HA LEU 6 8.073 -3.842 -10.048 41 HB2 LEU 6 2HB LEU 6 5.363 -2.714 -9.448 42 HB3 LEU 6 3HB LEU 6 6.536 -1.793 -10.387 43 HG LEU 6 HG LEU 6 5.718 -4.565 -11.199 44 HD11 LEU 6 1HD1 LEU 6 3.653 -3.854 -11.603 45 HD12 LEU 6 2HD1 LEU 6 4.339 -2.773 -12.815 46 HD13 LEU 6 3HD1 LEU 6 4.069 -2.196 -11.171 47 HD21 LEU 6 3HD2 LEU 6 7.627 -2.792 -12.129 48 HD22 LEU 6 1HD2 LEU 6 6.276 -2.586 -13.244 49 HD23 LEU 6 2HD2 LEU 6 6.978 -4.185 -12.996 50 H SER 7 H SER 7 9.085 -1.728 -10.000 51 HA SER 7 HA SER 7 9.958 -1.045 -7.352 52 HB2 SER 7 2HB SER 7 10.928 -0.694 -10.013 53 HB3 SER 7 3HB SER 7 10.848 0.891 -9.245 54 HG SER 7 HG SER 7 12.711 0.245 -8.466 55 HA PRO 8 HA PRO 8 7.389 2.383 -6.415 56 HB2 PRO 8 2HB PRO 8 9.131 4.145 -5.305 57 HB3 PRO 8 3HB PRO 8 8.616 2.662 -4.493 58 HG2 PRO 8 2HG PRO 8 11.131 3.209 -6.022 59 HG3 PRO 8 3HG PRO 8 10.921 2.349 -4.485 60 HD2 PRO 8 2HD PRO 8 11.244 1.060 -6.844 61 HD3 PRO 8 3HD PRO 8 10.259 0.400 -5.522 62 H SER 9 H SER 9 10.475 3.515 -7.810 63 HA SER 9 HA SER 9 9.618 5.978 -8.741 64 HB2 SER 9 2HB SER 9 11.487 5.818 -10.374 65 HB3 SER 9 3HB SER 9 11.971 5.358 -8.742 66 HG SER 9 HG SER 9 12.536 3.512 -9.542 67 H ASP 10 H ASP 10 9.558 2.842 -10.405 68 HA ASP 10 HA ASP 10 8.551 3.720 -12.856 69 HB2 ASP 10 2HB ASP 10 8.262 1.079 -11.420 70 HB3 ASP 10 3HB ASP 10 7.678 1.347 -13.060 71 H ILE 11 H ILE 11 6.924 2.971 -9.838 72 HA ILE 11 HA ILE 11 4.283 3.098 -10.951 73 HB ILE 11 HB ILE 11 5.249 3.138 -8.093 74 HG12 ILE 11 2HG1 ILE 11 3.632 0.938 -9.289 75 HG13 ILE 11 3HG1 ILE 11 5.325 1.057 -9.755 76 HG21 ILE 11 1HG2 ILE 11 3.238 4.128 -7.749 77 HG22 ILE 11 2HG2 ILE 11 2.553 3.512 -9.251 78 HG23 ILE 11 3HG2 ILE 11 2.682 2.457 -7.844 79 HD11 ILE 11 3HD1 ILE 11 4.192 0.647 -7.007 80 HD12 ILE 11 1HD1 ILE 11 5.210 -0.447 -7.942 81 HD13 ILE 11 2HD1 ILE 11 5.881 1.055 -7.306 82 H ALA 12 H ALA 12 6.156 5.226 -8.789 83 HA ALA 12 HA ALA 12 4.301 7.302 -8.627 84 HB1 ALA 12 1HB ALA 12 6.908 8.422 -8.573 85 HB2 ALA 12 2HB ALA 12 5.837 8.059 -7.220 86 HB3 ALA 12 3HB ALA 12 6.974 6.840 -7.795 87 H ALA 13 H ALA 13 6.386 6.367 -11.207 88 HA ALA 13 HA ALA 13 6.247 8.929 -12.557 89 HB1 ALA 13 1HB ALA 13 7.615 6.338 -13.055 90 HB2 ALA 13 2HB ALA 13 7.313 7.401 -14.430 91 HB3 ALA 13 3HB ALA 13 8.261 7.979 -13.059 92 H ALA 14 H ALA 14 4.612 5.855 -12.600 93 HA ALA 14 HA ALA 14 3.269 6.367 -15.110 94 HB1 ALA 14 1HB ALA 14 2.637 4.212 -13.106 95 HB2 ALA 14 2HB ALA 14 2.236 4.245 -14.823 96 HB3 ALA 14 3HB ALA 14 3.915 4.076 -14.313 97 H LEU 15 H LEU 15 2.674 6.831 -11.720 98 HA LEU 15 HA LEU 15 -0.150 7.106 -11.866 99 HB2 LEU 15 2HB LEU 15 1.961 7.756 -9.875 100 HB3 LEU 15 3HB LEU 15 0.378 8.508 -9.688 101 HG LEU 15 HG LEU 15 0.921 5.540 -9.752 102 HD11 LEU 15 1HD1 LEU 15 1.487 5.823 -7.619 103 HD12 LEU 15 2HD1 LEU 15 -0.202 6.230 -7.322 104 HD13 LEU 15 3HD1 LEU 15 0.973 7.510 -7.626 105 HD21 LEU 15 3HD2 LEU 15 -1.497 5.557 -8.862 106 HD22 LEU 15 1HD2 LEU 15 -1.235 5.776 -10.593 107 HD23 LEU 15 2HD2 LEU 15 -1.587 7.170 -9.572 108 H ARG 16 H ARG 16 2.444 9.538 -11.571 109 HA ARG 16 HA ARG 16 0.707 11.747 -11.979 110 HB2 ARG 16 2HB ARG 16 3.695 11.675 -12.418 111 HB3 ARG 16 3HB ARG 16 2.703 13.087 -12.081 112 HG2 ARG 16 2HG ARG 16 2.121 11.768 -9.891 113 HG3 ARG 16 3HG ARG 16 3.642 10.945 -10.245 114 HD2 ARG 16 2HD ARG 16 3.972 13.770 -10.579 115 HD3 ARG 16 3HD ARG 16 3.268 13.441 -8.997 116 HE ARG 16 HE ARG 16 5.249 12.486 -8.345 117 HH11 ARG 16 1HH1 ARG 16 5.240 12.890 -11.803 118 HH12 ARG 16 2HH1 ARG 16 6.912 12.475 -11.987 119 HH21 ARG 16 1HH2 ARG 16 7.451 11.938 -8.574 120 HH22 ARG 16 2HH2 ARG 16 8.169 11.933 -10.150 121 H ASP 17 H ASP 17 2.374 9.588 -14.103 122 HA ASP 17 HA ASP 17 2.666 11.088 -16.406 123 HB2 ASP 17 2HB ASP 17 3.566 8.928 -16.489 124 HB3 ASP 17 3HB ASP 17 2.068 8.181 -15.941 125 H CYS 18 H CYS 18 -0.176 9.176 -15.423 126 HA CYS 18 HA CYS 18 -1.837 10.965 -17.055 127 HB2 CYS 18 2HB CYS 18 -1.935 7.945 -17.028 128 HB3 CYS 18 3HB CYS 18 -3.223 8.951 -17.681 129 HG CYS 18 HG CYS 18 -0.365 8.017 -19.073 130 H GLN 19 H GLN 19 -1.409 11.140 -14.290 131 HA GLN 19 HA GLN 19 -3.173 9.818 -12.630 132 HB2 GLN 19 2HB GLN 19 -3.154 12.002 -11.289 133 HB3 GLN 19 3HB GLN 19 -1.607 11.218 -11.584 134 HG2 GLN 19 2HG GLN 19 -1.007 12.793 -13.227 135 HG3 GLN 19 3HG GLN 19 -2.649 13.427 -13.327 136 HE21 GLN 19 1HE2 GLN 19 0.386 13.782 -11.936 137 HE22 GLN 19 2HE2 GLN 19 -0.014 14.969 -10.746 138 H ALA 20 H ALA 20 -3.773 12.534 -14.784 139 HA ALA 20 HA ALA 20 -6.255 13.376 -13.925 140 HB1 ALA 20 1HB ALA 20 -6.621 14.222 -16.143 141 HB2 ALA 20 2HB ALA 20 -4.916 14.421 -15.736 142 HB3 ALA 20 3HB ALA 20 -5.420 13.116 -16.810 143 HA PRO 21 HA PRO 21 -9.071 10.070 -14.601 144 HB2 PRO 21 2HB PRO 21 -11.349 11.467 -15.079 145 HB3 PRO 21 3HB PRO 21 -10.619 11.339 -13.474 146 HG2 PRO 21 2HG PRO 21 -10.438 13.567 -15.466 147 HG3 PRO 21 3HG PRO 21 -10.677 13.652 -13.711 148 HD2 PRO 21 2HD PRO 21 -8.270 14.081 -14.876 149 HD3 PRO 21 3HD PRO 21 -8.435 13.354 -13.265 150 H ASP 22 H ASP 22 -9.904 8.851 -16.240 151 HA ASP 22 HA ASP 22 -10.144 8.098 -18.378 152 HB2 ASP 22 2HB ASP 22 -12.015 9.942 -18.005 153 HB3 ASP 22 3HB ASP 22 -11.104 10.784 -19.256 154 H SER 23 H SER 23 -7.610 9.410 -17.665 155 HA SER 23 HA SER 23 -6.772 10.296 -20.349 156 HB2 SER 23 2HB SER 23 -6.577 11.781 -18.098 157 HB3 SER 23 3HB SER 23 -5.033 10.931 -18.035 158 HG SER 23 HG SER 23 -4.528 12.579 -19.299 159 H PHE 24 H PHE 24 -6.825 7.637 -18.614 160 HA PHE 24 HA PHE 24 -4.194 6.749 -19.573 161 HB2 PHE 24 2HB PHE 24 -4.059 5.275 -17.534 162 HB3 PHE 24 3HB PHE 24 -3.894 6.998 -17.213 163 HD1 PHE 24 HD2 PHE 24 -5.820 8.254 -16.256 164 HD2 PHE 24 HD1 PHE 24 -5.806 4.011 -16.586 165 HE1 PHE 24 HE2 PHE 24 -7.648 8.124 -14.614 166 HE2 PHE 24 HE1 PHE 24 -7.634 3.874 -14.945 167 HZ PHE 24 HZ PHE 24 -8.556 5.932 -13.955 168 H SER 25 H SER 25 -4.237 4.140 -19.093 169 HA SER 25 HA SER 25 -6.788 2.984 -19.835 170 HB2 SER 25 2HB SER 25 -4.846 3.650 -21.832 171 HB3 SER 25 3HB SER 25 -4.960 1.894 -21.717 172 HG SER 25 HG SER 25 -6.492 2.800 -23.180 173 HA PRO 26 HA PRO 26 -5.277 -0.536 -17.699 174 HB2 PRO 26 2HB PRO 26 -6.353 -2.592 -19.107 175 HB3 PRO 26 3HB PRO 26 -7.315 -1.527 -18.076 176 HG2 PRO 26 2HG PRO 26 -6.945 -1.461 -21.046 177 HG3 PRO 26 3HG PRO 26 -8.428 -1.248 -20.099 178 HD2 PRO 26 2HD PRO 26 -7.046 0.840 -21.130 179 HD3 PRO 26 3HD PRO 26 -7.947 0.951 -19.604 180 H LYS 27 H LYS 27 -4.549 -0.189 -21.067 181 HA LYS 27 HA LYS 27 -2.329 -2.108 -20.788 182 HB2 LYS 27 2HB LYS 27 -2.455 -2.573 -23.114 183 HB3 LYS 27 3HB LYS 27 -4.103 -2.649 -22.506 184 HG2 LYS 27 2HG LYS 27 -3.973 -0.059 -23.261 185 HG3 LYS 27 3HG LYS 27 -2.878 -0.801 -24.430 186 HD2 LYS 27 2HD LYS 27 -5.078 -0.801 -25.372 187 HD3 LYS 27 3HD LYS 27 -4.672 -2.464 -24.940 188 HE2 LYS 27 2HE LYS 27 -6.066 -2.415 -23.040 189 HE3 LYS 27 3HE LYS 27 -6.218 -0.659 -23.099 190 HZ1 LYS 27 3HZ LYS 27 -7.148 -2.112 -25.440 191 HZ2 LYS 27 1HZ LYS 27 -7.810 -0.759 -24.671 192 HZ3 LYS 27 2HZ LYS 27 -8.068 -2.305 -24.034 193 H LYS 28 H LYS 28 -2.336 0.694 -19.984 194 HA LYS 28 HA LYS 28 -0.109 1.599 -21.670 195 HB2 LYS 28 2HB LYS 28 -2.562 3.133 -20.890 196 HB3 LYS 28 3HB LYS 28 -1.040 3.984 -21.114 197 HG2 LYS 28 2HG LYS 28 -2.187 2.172 -23.213 198 HG3 LYS 28 3HG LYS 28 -2.605 3.883 -23.102 199 HD2 LYS 28 2HD LYS 28 -0.256 4.485 -23.346 200 HD3 LYS 28 3HD LYS 28 0.187 2.778 -23.411 201 HE2 LYS 28 2HE LYS 28 0.142 3.538 -25.650 202 HE3 LYS 28 3HE LYS 28 -1.325 2.587 -25.422 203 HZ1 LYS 28 3HZ LYS 28 -2.517 4.703 -25.036 204 HZ2 LYS 28 1HZ LYS 28 -1.871 4.576 -26.595 205 HZ3 LYS 28 2HZ LYS 28 -1.108 5.547 -25.440 206 H PHE 29 H PHE 29 -0.654 0.375 -18.881 207 HA PHE 29 HA PHE 29 0.843 2.377 -17.324 208 HB2 PHE 29 2HB PHE 29 -1.461 0.791 -16.686 209 HB3 PHE 29 3HB PHE 29 -0.141 0.351 -15.608 210 HD1 PHE 29 HD1 PHE 29 1.042 2.226 -14.356 211 HD2 PHE 29 HD2 PHE 29 -2.701 2.723 -16.319 212 HE1 PHE 29 HE1 PHE 29 0.596 4.224 -12.991 213 HE2 PHE 29 HE2 PHE 29 -3.153 4.722 -14.959 214 HZ PHE 29 HZ PHE 29 -1.504 5.476 -13.293 215 H PHE 30 H PHE 30 0.958 -0.719 -18.749 216 HA PHE 30 HA PHE 30 2.955 -1.849 -17.033 217 HB2 PHE 30 2HB PHE 30 2.982 -3.691 -18.520 218 HB3 PHE 30 3HB PHE 30 1.312 -3.134 -18.502 219 HD1 PHE 30 HD1 PHE 30 4.407 -3.293 -20.465 220 HD2 PHE 30 HD2 PHE 30 0.296 -2.190 -20.449 221 HE1 PHE 30 HE1 PHE 30 4.457 -3.083 -22.916 222 HE2 PHE 30 HE2 PHE 30 0.339 -1.980 -22.900 223 HZ PHE 30 HZ PHE 30 2.421 -2.427 -24.137 224 H GLN 31 H GLN 31 2.981 0.419 -19.563 225 HA GLN 31 HA GLN 31 5.663 -0.120 -20.469 226 HB2 GLN 31 2HB GLN 31 4.266 2.478 -20.966 227 HB3 GLN 31 3HB GLN 31 5.343 1.573 -22.022 228 HG2 GLN 31 2HG GLN 31 3.548 -0.138 -22.266 229 HG3 GLN 31 3HG GLN 31 2.479 0.935 -21.363 230 HE21 GLN 31 1HE2 GLN 31 2.959 3.361 -22.332 231 HE22 GLN 31 2HE2 GLN 31 2.619 3.444 -24.024 232 H ILE 32 H ILE 32 4.086 2.119 -18.261 233 HA ILE 32 HA ILE 32 6.603 3.470 -17.695 234 HB ILE 32 HB ILE 32 3.921 3.942 -16.396 235 HG12 ILE 32 2HG1 ILE 32 4.335 6.044 -18.111 236 HG13 ILE 32 3HG1 ILE 32 4.952 4.687 -19.046 237 HG21 ILE 32 1HG2 ILE 32 5.556 4.926 -15.054 238 HG22 ILE 32 2HG2 ILE 32 6.525 5.426 -16.440 239 HG23 ILE 32 3HG2 ILE 32 5.005 6.247 -16.085 240 HD11 ILE 32 3HD1 ILE 32 2.533 3.807 -17.977 241 HD12 ILE 32 1HD1 ILE 32 2.242 5.461 -18.514 242 HD13 ILE 32 2HD1 ILE 32 2.868 4.263 -19.647 243 H SER 33 H SER 33 4.412 1.157 -16.258 244 HA SER 33 HA SER 33 5.805 1.197 -13.710 245 HB2 SER 33 2HB SER 33 3.263 0.826 -14.073 246 HB3 SER 33 3HB SER 33 3.719 -0.825 -14.495 247 HG SER 33 HG SER 33 4.571 0.407 -12.097 248 H GLY 34 H GLY 34 4.881 -1.516 -15.834 249 HA2 GLY 34 2HA GLY 34 6.771 -2.785 -16.866 250 HA3 GLY 34 3HA GLY 34 7.540 -2.686 -15.289 251 H MET 35 H MET 35 4.110 -3.227 -15.621 252 HA MET 35 HA MET 35 4.154 -5.538 -14.013 253 HB2 MET 35 2HB MET 35 1.964 -4.732 -15.930 254 HB3 MET 35 3HB MET 35 1.804 -5.731 -14.492 255 HG2 MET 35 2HG MET 35 2.260 -3.858 -13.069 256 HG3 MET 35 3HG MET 35 2.629 -2.840 -14.459 257 HE1 MET 35 3HE MET 35 -1.593 -4.590 -13.855 258 HE2 MET 35 1HE MET 35 -0.186 -5.494 -14.417 259 HE3 MET 35 2HE MET 35 -0.279 -4.960 -12.739 260 H SER 36 H SER 36 3.711 -5.147 -17.522 261 HA SER 36 HA SER 36 3.351 -7.804 -18.210 262 HB2 SER 36 2HB SER 36 4.035 -7.190 -20.446 263 HB3 SER 36 3HB SER 36 3.127 -5.846 -19.755 264 HG SER 36 HG SER 36 5.354 -5.084 -19.119 265 H LYS 37 H LYS 37 6.316 -6.052 -17.522 266 HA LYS 37 HA LYS 37 8.140 -7.991 -18.446 267 HB2 LYS 37 2HB LYS 37 8.635 -6.124 -16.131 268 HB3 LYS 37 3HB LYS 37 9.810 -6.782 -17.262 269 HG2 LYS 37 2HG LYS 37 7.699 -4.716 -17.828 270 HG3 LYS 37 3HG LYS 37 9.448 -4.485 -17.794 271 HD2 LYS 37 2HD LYS 37 7.925 -6.210 -19.748 272 HD3 LYS 37 3HD LYS 37 8.615 -4.622 -20.088 273 HE2 LYS 37 2HE LYS 37 10.835 -5.714 -19.284 274 HE3 LYS 37 3HE LYS 37 9.998 -7.231 -19.612 275 HZ1 LYS 37 3HZ LYS 37 11.305 -5.603 -21.430 276 HZ2 LYS 37 1HZ LYS 37 9.656 -5.450 -21.777 277 HZ3 LYS 37 2HZ LYS 37 10.378 -6.979 -21.765 278 H LYS 38 H LYS 38 6.033 -7.996 -15.789 279 HA LYS 38 HA LYS 38 7.635 -9.852 -14.217 280 HB2 LYS 38 2HB LYS 38 4.814 -8.926 -13.671 281 HB3 LYS 38 3HB LYS 38 5.938 -9.659 -12.534 282 HG2 LYS 38 2HG LYS 38 6.300 -6.967 -13.835 283 HG3 LYS 38 3HG LYS 38 5.689 -7.240 -12.201 284 HD2 LYS 38 2HD LYS 38 7.822 -7.077 -11.548 285 HD3 LYS 38 3HD LYS 38 8.027 -8.690 -12.235 286 HE2 LYS 38 2HE LYS 38 8.295 -7.144 -14.447 287 HE3 LYS 38 3HE LYS 38 8.963 -6.078 -13.212 288 HZ1 LYS 38 3HZ LYS 38 9.854 -8.831 -13.869 289 HZ2 LYS 38 1HZ LYS 38 10.404 -7.961 -12.526 290 HZ3 LYS 38 2HZ LYS 38 10.721 -7.394 -14.088 291 H SER 39 H SER 39 6.810 -11.933 -13.571 292 HA SER 39 HA SER 39 5.704 -13.382 -15.774 293 HB2 SER 39 2HB SER 39 7.428 -14.298 -14.197 294 HB3 SER 39 3HB SER 39 6.179 -14.374 -12.955 295 HG SER 39 HG SER 39 6.663 -16.064 -15.024 296 H SER 40 H SER 40 3.854 -14.893 -15.510 297 HA SER 40 HA SER 40 1.511 -13.488 -14.847 298 HB2 SER 40 2HB SER 40 0.424 -15.223 -15.831 299 HB3 SER 40 3HB SER 40 2.045 -15.704 -16.330 300 HG SER 40 HG SER 40 1.500 -17.479 -15.317 301 H SER 41 H SER 41 3.683 -15.241 -12.909 302 HA SER 41 HA SER 41 1.729 -15.853 -10.843 303 HB2 SER 41 2HB SER 41 4.653 -16.429 -11.216 304 HB3 SER 41 3HB SER 41 3.910 -16.602 -9.626 305 HG SER 41 HG SER 41 3.953 -18.444 -11.327 306 H GLN 42 H GLN 42 4.020 -13.405 -11.645 307 HA GLN 42 HA GLN 42 4.234 -12.342 -8.974 308 HB2 GLN 42 2HB GLN 42 5.230 -11.518 -11.675 309 HB3 GLN 42 3HB GLN 42 5.252 -10.360 -10.352 310 HG2 GLN 42 2HG GLN 42 6.525 -12.102 -9.030 311 HG3 GLN 42 3HG GLN 42 6.706 -12.977 -10.550 312 HE21 GLN 42 1HE2 GLN 42 7.360 -9.910 -8.950 313 HE22 GLN 42 2HE2 GLN 42 8.750 -9.505 -9.892 314 H LEU 43 H LEU 43 2.374 -11.677 -11.878 315 HA LEU 43 HA LEU 43 1.270 -9.216 -10.948 316 HB2 LEU 43 2HB LEU 43 0.117 -11.056 -13.032 317 HB3 LEU 43 3HB LEU 43 -0.170 -9.327 -12.851 318 HG LEU 43 HG LEU 43 2.613 -10.238 -13.378 319 HD11 LEU 43 1HD1 LEU 43 0.386 -10.250 -15.399 320 HD12 LEU 43 2HD1 LEU 43 1.505 -11.554 -15.002 321 HD13 LEU 43 3HD1 LEU 43 2.089 -10.115 -15.838 322 HD21 LEU 43 3HD2 LEU 43 0.923 -7.828 -13.826 323 HD22 LEU 43 1HD2 LEU 43 2.284 -8.123 -14.908 324 HD23 LEU 43 2HD2 LEU 43 2.557 -7.958 -13.173 325 H LYS 44 H LYS 44 0.602 -12.513 -10.336 326 HA LYS 44 HA LYS 44 -2.164 -12.271 -9.695 327 HB2 LYS 44 2HB LYS 44 -0.050 -14.333 -9.329 328 HB3 LYS 44 3HB LYS 44 -1.473 -14.442 -8.302 329 HG2 LYS 44 2HG LYS 44 -2.776 -14.215 -10.540 330 HG3 LYS 44 3HG LYS 44 -1.249 -14.727 -11.263 331 HD2 LYS 44 2HD LYS 44 -2.391 -16.266 -8.970 332 HD3 LYS 44 3HD LYS 44 -3.048 -16.501 -10.592 333 HE2 LYS 44 2HE LYS 44 -1.265 -17.678 -11.249 334 HE3 LYS 44 3HE LYS 44 -0.139 -16.521 -10.541 335 HZ1 LYS 44 3HZ LYS 44 0.284 -18.094 -9.049 336 HZ2 LYS 44 1HZ LYS 44 -1.045 -19.030 -9.517 337 HZ3 LYS 44 2HZ LYS 44 -1.243 -17.783 -8.391 338 H GLU 45 H GLU 45 0.804 -11.715 -7.969 339 HA GLU 45 HA GLU 45 -0.160 -11.842 -5.334 340 HB2 GLU 45 2HB GLU 45 2.087 -10.221 -6.537 341 HB3 GLU 45 3HB GLU 45 1.783 -10.335 -4.809 342 HG2 GLU 45 2HG GLU 45 2.254 -12.753 -6.521 343 HG3 GLU 45 3HG GLU 45 3.567 -11.853 -5.764 344 H ILE 46 H ILE 46 0.120 -9.094 -7.570 345 HA ILE 46 HA ILE 46 -0.878 -7.133 -5.828 346 HB ILE 46 HB ILE 46 -1.173 -7.161 -8.831 347 HG12 ILE 46 2HG1 ILE 46 1.019 -5.565 -8.005 348 HG13 ILE 46 3HG1 ILE 46 1.194 -7.127 -7.212 349 HG21 ILE 46 1HG2 ILE 46 -2.488 -5.440 -7.742 350 HG22 ILE 46 2HG2 ILE 46 -1.074 -4.903 -6.836 351 HG23 ILE 46 3HG2 ILE 46 -1.122 -4.714 -8.589 352 HD11 ILE 46 3HD1 ILE 46 0.497 -7.672 -9.872 353 HD12 ILE 46 1HD1 ILE 46 1.719 -6.402 -9.924 354 HD13 ILE 46 2HD1 ILE 46 2.056 -7.917 -9.085 355 H PHE 47 H PHE 47 -2.473 -9.543 -7.761 356 HA PHE 47 HA PHE 47 -5.045 -8.401 -7.857 357 HB2 PHE 47 2HB PHE 47 -5.002 -10.159 -9.297 358 HB3 PHE 47 3HB PHE 47 -3.870 -11.074 -8.308 359 HD1 PHE 47 HD1 PHE 47 -4.703 -12.389 -6.381 360 HD2 PHE 47 HD2 PHE 47 -7.336 -10.508 -9.146 361 HE1 PHE 47 HE1 PHE 47 -6.544 -13.822 -5.598 362 HE2 PHE 47 HE2 PHE 47 -9.181 -11.937 -8.366 363 HZ PHE 47 HZ PHE 47 -8.787 -13.596 -6.590 364 H ARG 48 H ARG 48 -3.293 -9.944 -5.325 365 HA ARG 48 HA ARG 48 -5.583 -10.662 -3.747 366 HB2 ARG 48 2HB ARG 48 -2.787 -11.151 -3.671 367 HB3 ARG 48 3HB ARG 48 -3.228 -10.394 -2.147 368 HG2 ARG 48 2HG ARG 48 -4.634 -12.794 -3.291 369 HG3 ARG 48 3HG ARG 48 -3.300 -12.884 -2.139 370 HD2 ARG 48 2HD ARG 48 -5.402 -11.055 -1.298 371 HD3 ARG 48 3HD ARG 48 -5.983 -12.704 -1.520 372 HE ARG 48 HE ARG 48 -3.738 -13.047 -0.062 373 HH11 ARG 48 1HH1 ARG 48 -6.533 -11.006 0.319 374 HH12 ARG 48 2HH1 ARG 48 -6.456 -11.002 2.050 375 HH21 ARG 48 1HH2 ARG 48 -3.626 -13.050 2.216 376 HH22 ARG 48 2HH2 ARG 48 -4.801 -12.164 3.128 377 H ILE 49 H ILE 49 -4.431 -7.745 -4.588 378 HA ILE 49 HA ILE 49 -5.054 -6.518 -1.983 379 HB ILE 49 HB ILE 49 -3.596 -5.174 -4.252 380 HG12 ILE 49 2HG1 ILE 49 -2.291 -7.117 -3.551 381 HG13 ILE 49 3HG1 ILE 49 -1.516 -5.633 -3.007 382 HG21 ILE 49 1HG2 ILE 49 -2.758 -3.859 -2.152 383 HG22 ILE 49 2HG2 ILE 49 -4.327 -3.493 -2.867 384 HG23 ILE 49 3HG2 ILE 49 -4.231 -4.496 -1.419 385 HD11 ILE 49 3HD1 ILE 49 -3.035 -7.642 -1.385 386 HD12 ILE 49 1HD1 ILE 49 -1.356 -7.133 -1.216 387 HD13 ILE 49 2HD1 ILE 49 -2.661 -6.028 -0.783 388 H LEU 50 H LEU 50 -6.291 -7.088 -5.025 389 HA LEU 50 HA LEU 50 -7.847 -4.613 -5.123 390 HB2 LEU 50 2HB LEU 50 -7.367 -6.854 -7.052 391 HB3 LEU 50 3HB LEU 50 -8.710 -5.735 -7.282 392 HG LEU 50 HG LEU 50 -6.675 -3.986 -7.000 393 HD11 LEU 50 1HD1 LEU 50 -5.233 -5.696 -8.817 394 HD12 LEU 50 2HD1 LEU 50 -5.356 -6.428 -7.217 395 HD13 LEU 50 3HD1 LEU 50 -4.657 -4.819 -7.398 396 HD21 LEU 50 3HD2 LEU 50 -6.899 -5.065 -9.721 397 HD22 LEU 50 1HD2 LEU 50 -7.201 -3.437 -9.114 398 HD23 LEU 50 2HD2 LEU 50 -8.436 -4.685 -8.942 399 H ASP 51 H ASP 51 -8.138 -7.985 -4.373 400 HA ASP 51 HA ASP 51 -10.971 -8.165 -4.569 401 HB2 ASP 51 2HB ASP 51 -9.247 -10.078 -4.517 402 HB3 ASP 51 3HB ASP 51 -9.271 -9.878 -2.767 403 H ASN 52 H ASN 52 -12.389 -7.163 -3.318 404 HA ASN 52 HA ASN 52 -11.595 -6.408 -0.591 405 HB2 ASN 52 2HB ASN 52 -13.125 -5.090 -2.682 406 HB3 ASN 52 3HB ASN 52 -14.016 -5.146 -1.164 407 HD21 ASN 52 1HD2 ASN 52 -10.708 -4.524 -2.294 408 HD22 ASN 52 2HD2 ASN 52 -10.443 -3.147 -1.286 409 H ASP 53 H ASP 53 -12.872 -8.979 -1.842 410 HA ASP 53 HA ASP 53 -14.701 -9.399 0.396 411 HB2 ASP 53 2HB ASP 53 -15.615 -10.500 -2.205 412 HB3 ASP 53 3HB ASP 53 -16.556 -9.917 -0.835 413 H GLN 54 H GLN 54 -12.067 -10.353 -1.209 414 HA GLN 54 HA GLN 54 -10.881 -12.287 -1.438 415 HB2 GLN 54 2HB GLN 54 -12.433 -13.416 0.865 416 HB3 GLN 54 3HB GLN 54 -10.723 -13.587 0.491 417 HG2 GLN 54 2HG GLN 54 -12.000 -11.009 1.365 418 HG3 GLN 54 3HG GLN 54 -11.227 -12.152 2.461 419 HE21 GLN 54 1HE2 GLN 54 -10.783 -9.538 0.376 420 HE22 GLN 54 2HE2 GLN 54 -9.056 -9.499 0.390 421 H SER 55 H SER 55 -13.633 -12.093 -2.677 422 HA SER 55 HA SER 55 -14.738 -14.721 -2.665 423 HB2 SER 55 2HB SER 55 -15.817 -13.742 -4.878 424 HB3 SER 55 3HB SER 55 -16.332 -13.175 -3.290 425 HG SER 55 HG SER 55 -14.280 -11.919 -4.784 426 H GLY 56 H GLY 56 -12.062 -13.306 -4.224 427 HA2 GLY 56 2HA GLY 56 -10.469 -14.758 -5.309 428 HA3 GLY 56 3HA GLY 56 -11.819 -15.693 -5.935 429 H PHE 57 H PHE 57 -12.997 -12.790 -6.368 430 HA PHE 57 HA PHE 57 -11.529 -12.219 -8.849 431 HB2 PHE 57 2HB PHE 57 -14.541 -12.149 -8.668 432 HB3 PHE 57 3HB PHE 57 -13.544 -12.009 -10.113 433 HD1 PHE 57 HD1 PHE 57 -14.831 -14.315 -7.561 434 HD2 PHE 57 HD2 PHE 57 -12.678 -13.940 -11.214 435 HE1 PHE 57 HE1 PHE 57 -15.013 -16.744 -7.914 436 HE2 PHE 57 HE2 PHE 57 -12.857 -16.367 -11.573 437 HZ PHE 57 HZ PHE 57 -14.026 -17.772 -9.923 438 H ILE 58 H ILE 58 -12.072 -10.047 -9.748 439 HA ILE 58 HA ILE 58 -12.640 -8.142 -7.571 440 HB ILE 58 HB ILE 58 -10.781 -7.739 -9.917 441 HG12 ILE 58 2HG1 ILE 58 -9.814 -7.649 -7.113 442 HG13 ILE 58 3HG1 ILE 58 -10.227 -9.237 -7.749 443 HG21 ILE 58 1HG2 ILE 58 -11.826 -5.664 -9.304 444 HG22 ILE 58 2HG2 ILE 58 -11.487 -5.950 -7.598 445 HG23 ILE 58 3HG2 ILE 58 -10.161 -5.654 -8.722 446 HD11 ILE 58 3HD1 ILE 58 -7.865 -8.744 -8.032 447 HD12 ILE 58 1HD1 ILE 58 -8.672 -8.913 -9.590 448 HD13 ILE 58 2HD1 ILE 58 -8.269 -7.310 -8.974 449 H GLU 59 H GLU 59 -14.786 -7.780 -7.999 450 HA GLU 59 HA GLU 59 -15.855 -7.386 -10.591 451 HB2 GLU 59 2HB GLU 59 -17.015 -6.370 -7.996 452 HB3 GLU 59 3HB GLU 59 -17.880 -6.718 -9.486 453 HG2 GLU 59 2HG GLU 59 -18.372 -8.643 -8.460 454 HG3 GLU 59 3HG GLU 59 -16.765 -9.123 -9.002 455 H GLU 60 H GLU 60 -17.154 -5.252 -11.003 456 HA GLU 60 HA GLU 60 -15.290 -3.228 -11.525 457 HB2 GLU 60 2HB GLU 60 -18.272 -3.410 -11.630 458 HB3 GLU 60 3HB GLU 60 -17.510 -1.834 -11.801 459 HG2 GLU 60 2HG GLU 60 -16.372 -2.482 -13.757 460 HG3 GLU 60 3HG GLU 60 -16.734 -4.187 -13.493 461 H ASP 61 H ASP 61 -17.484 -3.731 -8.840 462 HA ASP 61 HA ASP 61 -17.367 -1.178 -7.689 463 HB2 ASP 61 2HB ASP 61 -18.910 -3.119 -7.077 464 HB3 ASP 61 3HB ASP 61 -17.572 -3.742 -6.115 465 H GLU 62 H GLU 62 -14.994 -3.617 -7.945 466 HA GLU 62 HA GLU 62 -13.339 -2.264 -5.915 467 HB2 GLU 62 2HB GLU 62 -12.048 -4.604 -6.245 468 HB3 GLU 62 3HB GLU 62 -13.303 -4.353 -5.039 469 HG2 GLU 62 2HG GLU 62 -14.919 -5.152 -6.882 470 HG3 GLU 62 3HG GLU 62 -13.467 -5.782 -7.659 471 H LEU 63 H LEU 63 -13.718 -2.985 -9.209 472 HA LEU 63 HA LEU 63 -10.950 -2.902 -9.951 473 HB2 LEU 63 2HB LEU 63 -13.218 -3.750 -11.179 474 HB3 LEU 63 3HB LEU 63 -12.956 -2.203 -11.981 475 HG LEU 63 HG LEU 63 -11.091 -4.571 -11.926 476 HD11 LEU 63 1HD1 LEU 63 -13.095 -3.556 -13.780 477 HD12 LEU 63 2HD1 LEU 63 -12.316 -5.136 -13.702 478 HD13 LEU 63 3HD1 LEU 63 -11.514 -3.798 -14.525 479 HD21 LEU 63 3HD2 LEU 63 -9.697 -2.657 -11.765 480 HD22 LEU 63 1HD2 LEU 63 -10.671 -1.766 -12.934 481 HD23 LEU 63 2HD2 LEU 63 -9.700 -3.141 -13.462 482 H LYS 64 H LYS 64 -13.515 -0.578 -9.547 483 HA LYS 64 HA LYS 64 -12.428 1.558 -11.012 484 HB2 LYS 64 2HB LYS 64 -13.816 2.973 -9.394 485 HB3 LYS 64 3HB LYS 64 -14.677 1.786 -10.365 486 HG2 LYS 64 2HG LYS 64 -15.266 0.550 -8.577 487 HG3 LYS 64 3HG LYS 64 -13.749 0.856 -7.728 488 HD2 LYS 64 2HD LYS 64 -15.542 1.901 -6.512 489 HD3 LYS 64 3HD LYS 64 -14.548 3.160 -7.249 490 HE2 LYS 64 2HE LYS 64 -16.254 3.919 -8.472 491 HE3 LYS 64 3HE LYS 64 -16.701 2.296 -8.993 492 HZ1 LYS 64 3HZ LYS 64 -17.629 2.136 -6.586 493 HZ2 LYS 64 1HZ LYS 64 -18.530 2.914 -7.789 494 HZ3 LYS 64 2HZ LYS 64 -17.646 3.826 -6.672 495 H TYR 65 H TYR 65 -11.684 0.277 -7.867 496 HA TYR 65 HA TYR 65 -10.232 2.576 -6.956 497 HB2 TYR 65 2HB TYR 65 -10.398 -0.271 -5.967 498 HB3 TYR 65 3HB TYR 65 -9.402 0.954 -5.189 499 HD1 TYR 65 HD1 TYR 65 -11.190 3.318 -5.397 500 HD2 TYR 65 HD2 TYR 65 -12.049 -0.722 -4.374 501 HE1 TYR 65 HE1 TYR 65 -13.132 4.069 -4.088 502 HE2 TYR 65 HE2 TYR 65 -13.994 0.018 -3.063 503 HH TYR 65 HH TYR 65 -14.932 1.880 -2.053 504 H PHE 66 H PHE 66 -9.522 1.243 -9.563 505 HA PHE 66 HA PHE 66 -7.119 -0.127 -9.450 506 HB2 PHE 66 2HB PHE 66 -8.382 0.162 -11.524 507 HB3 PHE 66 3HB PHE 66 -8.022 1.885 -11.522 508 HD1 PHE 66 HD2 PHE 66 -5.475 2.492 -11.489 509 HD2 PHE 66 HD1 PHE 66 -7.050 -1.258 -12.746 510 HE1 PHE 66 HE2 PHE 66 -3.422 2.065 -12.776 511 HE2 PHE 66 HE1 PHE 66 -4.998 -1.691 -14.034 512 HZ PHE 66 HZ PHE 66 -3.182 -0.028 -14.051 513 H LEU 67 H LEU 67 -7.706 3.357 -9.380 514 HA LEU 67 HA LEU 67 -4.907 4.013 -9.330 515 HB2 LEU 67 2HB LEU 67 -7.053 5.903 -8.474 516 HB3 LEU 67 3HB LEU 67 -5.554 6.232 -9.341 517 HG LEU 67 HG LEU 67 -8.191 5.310 -10.385 518 HD11 LEU 67 1HD1 LEU 67 -6.393 7.036 -11.939 519 HD12 LEU 67 2HD1 LEU 67 -6.924 7.700 -10.394 520 HD13 LEU 67 3HD1 LEU 67 -8.115 7.200 -11.595 521 HD21 LEU 67 3HD2 LEU 67 -7.059 3.619 -11.416 522 HD22 LEU 67 1HD2 LEU 67 -5.517 4.474 -11.373 523 HD23 LEU 67 2HD2 LEU 67 -6.740 4.922 -12.563 524 H GLN 68 H GLN 68 -7.106 2.900 -7.047 525 HA GLN 68 HA GLN 68 -5.937 4.271 -4.779 526 HB2 GLN 68 2HB GLN 68 -8.310 2.687 -5.290 527 HB3 GLN 68 3HB GLN 68 -7.490 2.152 -3.829 528 HG2 GLN 68 2HG GLN 68 -8.583 3.775 -2.786 529 HG3 GLN 68 3HG GLN 68 -7.476 4.891 -3.586 530 HE21 GLN 68 1HE2 GLN 68 -8.316 4.921 -6.131 531 HE22 GLN 68 2HE2 GLN 68 -9.936 5.511 -6.239 532 H ARG 69 H ARG 69 -4.777 1.969 -6.690 533 HA ARG 69 HA ARG 69 -3.707 0.283 -4.540 534 HB2 ARG 69 2HB ARG 69 -3.494 -0.129 -7.526 535 HB3 ARG 69 3HB ARG 69 -3.069 -1.283 -6.268 536 HG2 ARG 69 2HG ARG 69 -5.221 -1.880 -5.892 537 HG3 ARG 69 3HG ARG 69 -5.849 -0.277 -6.280 538 HD2 ARG 69 2HD ARG 69 -6.540 -1.890 -7.958 539 HD3 ARG 69 3HD ARG 69 -5.441 -0.703 -8.659 540 HE ARG 69 HE ARG 69 -4.049 -3.017 -7.764 541 HH11 ARG 69 1HH1 ARG 69 -6.042 -1.788 -10.340 542 HH12 ARG 69 2HH1 ARG 69 -5.400 -2.871 -11.530 543 HH21 ARG 69 1HH2 ARG 69 -3.196 -4.449 -9.321 544 HH22 ARG 69 2HH2 ARG 69 -3.781 -4.385 -10.949 545 H PHE 70 H PHE 70 -2.703 2.289 -7.279 546 HA PHE 70 HA PHE 70 0.093 2.047 -6.507 547 HB2 PHE 70 2HB PHE 70 -1.172 3.595 -8.778 548 HB3 PHE 70 3HB PHE 70 0.554 3.343 -8.539 549 HD1 PHE 70 HD1 PHE 70 -2.637 1.613 -9.247 550 HD2 PHE 70 HD2 PHE 70 1.614 1.399 -9.313 551 HE1 PHE 70 HE1 PHE 70 -2.765 -0.467 -10.555 552 HE2 PHE 70 HE2 PHE 70 1.492 -0.680 -10.623 553 HZ PHE 70 HZ PHE 70 -0.699 -1.615 -11.246 554 H GLU 71 H GLU 71 -2.555 4.271 -6.259 555 HA GLU 71 HA GLU 71 -0.766 6.372 -5.254 556 HB2 GLU 71 2HB GLU 71 -2.719 6.651 -7.051 557 HB3 GLU 71 3HB GLU 71 -3.682 6.852 -5.595 558 HG2 GLU 71 2HG GLU 71 -1.176 8.430 -6.024 559 HG3 GLU 71 3HG GLU 71 -2.714 8.938 -6.720 560 H SER 72 H SER 72 -3.338 4.207 -4.343 561 HA SER 72 HA SER 72 -4.290 3.686 -2.343 562 HB2 SER 72 2HB SER 72 -1.747 3.544 -1.828 563 HB3 SER 72 3HB SER 72 -2.003 5.048 -0.943 564 HG SER 72 HG SER 72 -2.484 3.663 0.592 565 H GLY 73 H GLY 73 -5.684 5.605 -3.232 566 HA2 GLY 73 2HA GLY 73 -7.082 6.889 -1.451 567 HA3 GLY 73 3HA GLY 73 -5.627 7.872 -1.366 568 H ALA 74 H ALA 74 -5.479 7.113 -4.422 569 HA ALA 74 HA ALA 74 -6.346 9.589 -5.397 570 HB1 ALA 74 1HB ALA 74 -6.204 8.366 -7.666 571 HB2 ALA 74 2HB ALA 74 -4.737 8.542 -6.701 572 HB3 ALA 74 3HB ALA 74 -5.604 7.006 -6.716 573 H ARG 75 H ARG 75 -7.848 9.395 -7.561 574 HA ARG 75 HA ARG 75 -10.482 8.998 -6.508 575 HB2 ARG 75 2HB ARG 75 -11.270 9.900 -8.589 576 HB3 ARG 75 3HB ARG 75 -9.870 10.837 -8.083 577 HG2 ARG 75 2HG ARG 75 -8.474 9.527 -9.641 578 HG3 ARG 75 3HG ARG 75 -9.926 8.688 -10.190 579 HD2 ARG 75 2HD ARG 75 -9.266 11.613 -10.457 580 HD3 ARG 75 3HD ARG 75 -9.481 10.431 -11.748 581 HE ARG 75 HE ARG 75 -11.547 11.843 -10.320 582 HH11 ARG 75 1HH1 ARG 75 -10.768 9.058 -12.258 583 HH12 ARG 75 2HH1 ARG 75 -12.395 8.821 -12.804 584 HH21 ARG 75 1HH2 ARG 75 -13.692 11.541 -11.033 585 HH22 ARG 75 2HH2 ARG 75 -14.057 10.235 -12.108 586 H VAL 76 H VAL 76 -12.123 7.911 -8.122 587 HA VAL 76 HA VAL 76 -11.114 5.189 -8.583 588 HB VAL 76 HB VAL 76 -13.240 4.347 -8.181 589 HG11 VAL 76 1HG1 VAL 76 -14.006 5.332 -6.098 590 HG12 VAL 76 2HG1 VAL 76 -12.242 5.306 -6.149 591 HG13 VAL 76 3HG1 VAL 76 -13.112 6.811 -6.446 592 HG21 VAL 76 3HG2 VAL 76 -14.174 7.033 -9.060 593 HG22 VAL 76 1HG2 VAL 76 -14.718 5.430 -9.554 594 HG23 VAL 76 2HG2 VAL 76 -15.211 6.087 -7.994 595 H LEU 77 H LEU 77 -11.701 4.050 -10.478 596 HA LEU 77 HA LEU 77 -11.465 5.453 -12.863 597 HB2 LEU 77 2HB LEU 77 -12.716 2.742 -12.446 598 HB3 LEU 77 3HB LEU 77 -12.113 3.378 -13.975 599 HG LEU 77 HG LEU 77 -10.463 2.683 -11.546 600 HD11 LEU 77 1HD1 LEU 77 -10.639 1.407 -14.271 601 HD12 LEU 77 2HD1 LEU 77 -11.279 0.738 -12.770 602 HD13 LEU 77 3HD1 LEU 77 -9.539 0.937 -12.975 603 HD21 LEU 77 3HD2 LEU 77 -9.578 3.697 -14.246 604 HD22 LEU 77 1HD2 LEU 77 -8.532 3.228 -12.905 605 HD23 LEU 77 2HD2 LEU 77 -9.581 4.637 -12.752 606 H THR 78 H THR 78 -12.878 6.232 -14.366 607 HA THR 78 HA THR 78 -15.520 6.886 -13.453 608 HB THR 78 HB THR 78 -14.233 8.499 -14.774 609 HG1 THR 78 HG1 THR 78 -15.966 8.775 -16.464 610 HG21 THR 78 3HG2 THR 78 -14.632 7.413 -17.392 611 HG22 THR 78 1HG2 THR 78 -13.713 6.265 -16.420 612 HG23 THR 78 2HG2 THR 78 -13.129 7.918 -16.619 613 H ALA 79 H ALA 79 -17.199 6.777 -15.499 614 HA ALA 79 HA ALA 79 -17.878 4.004 -15.656 615 HB1 ALA 79 1HB ALA 79 -19.744 5.357 -15.504 616 HB2 ALA 79 2HB ALA 79 -19.113 6.535 -16.657 617 HB3 ALA 79 3HB ALA 79 -19.705 4.974 -17.226 618 H SER 80 H SER 80 -15.726 5.829 -17.380 619 HA SER 80 HA SER 80 -16.085 4.211 -19.817 620 HB2 SER 80 2HB SER 80 -16.289 6.580 -20.299 621 HB3 SER 80 3HB SER 80 -14.770 6.916 -19.468 622 HG SER 80 HG SER 80 -15.163 5.494 -21.885 623 H GLU 81 H GLU 81 -14.241 4.517 -17.075 624 HA GLU 81 HA GLU 81 -11.747 3.650 -18.329 625 HB2 GLU 81 2HB GLU 81 -12.493 4.621 -15.593 626 HB3 GLU 81 3HB GLU 81 -11.013 3.699 -15.819 627 HG2 GLU 81 2HG GLU 81 -11.734 6.303 -17.141 628 HG3 GLU 81 3HG GLU 81 -10.523 6.049 -15.886 629 H THR 82 H THR 82 -13.663 2.604 -15.505 630 HA THR 82 HA THR 82 -12.564 0.123 -15.126 631 HB THR 82 HB THR 82 -15.263 -0.336 -14.647 632 HG1 THR 82 HG1 THR 82 -16.191 1.539 -14.208 633 HG21 THR 82 3HG2 THR 82 -12.951 -0.291 -13.221 634 HG22 THR 82 1HG2 THR 82 -14.550 -0.521 -12.515 635 HG23 THR 82 2HG2 THR 82 -13.809 1.080 -12.517 636 H LYS 83 H LYS 83 -15.284 0.934 -17.268 637 HA LYS 83 HA LYS 83 -15.954 -1.565 -18.191 638 HB2 LYS 83 2HB LYS 83 -16.172 1.179 -19.212 639 HB3 LYS 83 3HB LYS 83 -16.167 -0.050 -20.470 640 HG2 LYS 83 2HG LYS 83 -18.072 -1.130 -19.523 641 HG3 LYS 83 3HG LYS 83 -18.007 -0.101 -18.090 642 HD2 LYS 83 2HD LYS 83 -19.637 0.980 -19.275 643 HD3 LYS 83 3HD LYS 83 -18.213 1.820 -19.893 644 HE2 LYS 83 2HE LYS 83 -19.225 -0.640 -21.262 645 HE3 LYS 83 3HE LYS 83 -20.002 0.916 -21.550 646 HZ1 LYS 83 3HZ LYS 83 -17.706 -0.068 -22.746 647 HZ2 LYS 83 1HZ LYS 83 -17.199 1.192 -21.737 648 HZ3 LYS 83 2HZ LYS 83 -18.374 1.476 -22.920 649 H THR 84 H THR 84 -13.406 0.574 -19.433 650 HA THR 84 HA THR 84 -12.547 -0.978 -21.570 651 HB THR 84 HB THR 84 -10.757 0.687 -19.792 652 HG1 THR 84 HG1 THR 84 -12.509 1.398 -21.914 653 HG21 THR 84 3HG2 THR 84 -9.798 -0.884 -21.606 654 HG22 THR 84 1HG2 THR 84 -9.260 0.795 -21.579 655 HG23 THR 84 2HG2 THR 84 -10.472 0.276 -22.750 656 H PHE 85 H PHE 85 -11.131 -0.887 -18.293 657 HA PHE 85 HA PHE 85 -9.299 -2.934 -18.600 658 HB2 PHE 85 2HB PHE 85 -9.532 -1.388 -16.621 659 HB3 PHE 85 3HB PHE 85 -10.858 -2.404 -16.067 660 HD1 PHE 85 HD2 PHE 85 -10.311 -4.936 -15.809 661 HD2 PHE 85 HD1 PHE 85 -7.384 -1.848 -15.928 662 HE1 PHE 85 HE2 PHE 85 -8.705 -6.420 -14.682 663 HE2 PHE 85 HE1 PHE 85 -5.773 -3.328 -14.802 664 HZ PHE 85 HZ PHE 85 -6.432 -5.616 -14.177 665 H LEU 86 H LEU 86 -12.699 -3.140 -17.622 666 HA LEU 86 HA LEU 86 -12.744 -5.909 -17.126 667 HB2 LEU 86 2HB LEU 86 -14.474 -4.247 -16.427 668 HB3 LEU 86 3HB LEU 86 -15.030 -4.204 -18.099 669 HG LEU 86 HG LEU 86 -15.586 -6.613 -17.931 670 HD11 LEU 86 1HD1 LEU 86 -14.616 -6.198 -15.125 671 HD12 LEU 86 2HD1 LEU 86 -14.184 -7.465 -16.272 672 HD13 LEU 86 3HD1 LEU 86 -15.781 -7.462 -15.523 673 HD21 LEU 86 3HD2 LEU 86 -17.557 -5.616 -17.588 674 HD22 LEU 86 1HD2 LEU 86 -16.868 -4.427 -16.483 675 HD23 LEU 86 2HD2 LEU 86 -17.317 -6.026 -15.889 676 H ALA 87 H ALA 87 -12.860 -4.064 -20.059 677 HA ALA 87 HA ALA 87 -13.697 -6.380 -21.630 678 HB1 ALA 87 1HB ALA 87 -14.767 -4.363 -22.277 679 HB2 ALA 87 2HB ALA 87 -13.233 -3.496 -22.356 680 HB3 ALA 87 3HB ALA 87 -13.599 -4.749 -23.541 681 H ALA 88 H ALA 88 -10.906 -5.433 -20.307 682 HA ALA 88 HA ALA 88 -9.286 -6.290 -22.617 683 HB1 ALA 88 1HB ALA 88 -8.598 -4.108 -22.127 684 HB2 ALA 88 2HB ALA 88 -8.669 -4.381 -20.386 685 HB3 ALA 88 3HB ALA 88 -7.394 -5.133 -21.345 686 H ALA 89 H ALA 89 -10.294 -7.032 -19.448 687 HA ALA 89 HA ALA 89 -8.197 -9.092 -19.220 688 HB1 ALA 89 1HB ALA 89 -9.332 -7.239 -17.258 689 HB2 ALA 89 2HB ALA 89 -9.229 -8.911 -16.705 690 HB3 ALA 89 3HB ALA 89 -7.780 -8.078 -17.266 691 H ASP 90 H ASP 90 -11.579 -8.420 -18.304 692 HA ASP 90 HA ASP 90 -12.311 -11.048 -17.722 693 HB2 ASP 90 2HB ASP 90 -13.584 -8.566 -17.783 694 HB3 ASP 90 3HB ASP 90 -14.485 -9.550 -18.933 695 H HIS 91 H HIS 91 -13.266 -9.269 -20.663 696 HA HIS 91 HA HIS 91 -13.743 -9.977 -22.774 697 HB2 HIS 91 2HB HIS 91 -11.213 -10.505 -22.469 698 HB3 HIS 91 3HB HIS 91 -11.738 -12.185 -22.415 699 HD1 HIS 91 HD1 HIS 91 -9.938 -11.438 -24.680 700 HD2 HIS 91 HD2 HIS 91 -14.070 -11.070 -24.908 701 HE1 HIS 91 HE1 HIS 91 -10.481 -11.461 -27.135 702 H ASP 92 H ASP 92 -14.877 -11.442 -20.290 703 HA ASP 92 HA ASP 92 -16.026 -13.691 -21.807 704 HB2 ASP 92 2HB ASP 92 -16.301 -14.806 -19.527 705 HB3 ASP 92 3HB ASP 92 -14.664 -14.726 -20.173 706 H GLY 93 H GLY 93 -16.543 -10.877 -19.945 707 HA2 GLY 93 2HA GLY 93 -18.498 -9.699 -19.591 708 HA3 GLY 93 3HA GLY 93 -19.366 -10.970 -20.439 709 H ASP 94 H ASP 94 -17.354 -11.151 -17.522 710 HA ASP 94 HA ASP 94 -19.621 -12.400 -16.141 711 HB2 ASP 94 2HB ASP 94 -16.762 -12.334 -15.184 712 HB3 ASP 94 3HB ASP 94 -18.051 -13.424 -14.681 713 H GLY 95 H GLY 95 -17.496 -9.645 -16.067 714 HA2 GLY 95 2HA GLY 95 -17.948 -7.614 -14.994 715 HA3 GLY 95 3HA GLY 95 -19.184 -8.419 -14.039 716 H LYS 96 H LYS 96 -16.305 -10.166 -14.078 717 HA LYS 96 HA LYS 96 -15.135 -8.795 -11.795 718 HB2 LYS 96 2HB LYS 96 -15.136 -10.846 -10.413 719 HB3 LYS 96 3HB LYS 96 -16.758 -10.239 -10.722 720 HG2 LYS 96 2HG LYS 96 -16.014 -12.123 -12.752 721 HG3 LYS 96 3HG LYS 96 -15.782 -12.827 -11.150 722 HD2 LYS 96 2HD LYS 96 -18.288 -11.322 -11.531 723 HD3 LYS 96 3HD LYS 96 -18.141 -12.810 -12.471 724 HE2 LYS 96 2HE LYS 96 -18.429 -14.088 -10.663 725 HE3 LYS 96 3HE LYS 96 -17.270 -13.151 -9.722 726 HZ1 LYS 96 3HZ LYS 96 -19.248 -12.822 -8.605 727 HZ2 LYS 96 1HZ LYS 96 -20.173 -12.736 -10.020 728 HZ3 LYS 96 2HZ LYS 96 -19.169 -11.446 -9.585 729 H ILE 97 H ILE 97 -12.983 -8.879 -11.889 730 HA ILE 97 HA ILE 97 -11.722 -10.482 -13.937 731 HB ILE 97 HB ILE 97 -10.484 -8.574 -11.949 732 HG12 ILE 97 2HG1 ILE 97 -12.091 -7.490 -13.478 733 HG13 ILE 97 3HG1 ILE 97 -10.437 -6.977 -13.797 734 HG21 ILE 97 1HG2 ILE 97 -9.370 -10.346 -13.996 735 HG22 ILE 97 2HG2 ILE 97 -8.815 -8.676 -14.100 736 HG23 ILE 97 3HG2 ILE 97 -8.595 -9.586 -12.606 737 HD11 ILE 97 3HD1 ILE 97 -12.338 -8.260 -15.538 738 HD12 ILE 97 1HD1 ILE 97 -10.815 -7.458 -15.923 739 HD13 ILE 97 2HD1 ILE 97 -10.824 -9.161 -15.462 740 H GLY 98 H GLY 98 -10.151 -12.063 -13.623 741 HA2 GLY 98 2HA GLY 98 -9.916 -13.084 -10.861 742 HA3 GLY 98 3HA GLY 98 -10.210 -14.157 -12.221 743 H ALA 99 H ALA 99 -8.129 -14.848 -10.795 744 HA ALA 99 HA ALA 99 -5.698 -13.558 -11.646 745 HB1 ALA 99 1HB ALA 99 -6.028 -16.192 -10.217 746 HB2 ALA 99 2HB ALA 99 -4.558 -15.223 -10.335 747 HB3 ALA 99 3HB ALA 99 -5.941 -14.621 -9.420 748 H GLU 100 H GLU 100 -7.790 -15.415 -13.282 749 HA GLU 100 HA GLU 100 -5.704 -16.889 -14.742 750 HB2 GLU 100 2HB GLU 100 -7.758 -18.081 -13.714 751 HB3 GLU 100 3HB GLU 100 -8.656 -17.364 -15.044 752 HG2 GLU 100 2HG GLU 100 -8.093 -19.512 -15.769 753 HG3 GLU 100 3HG GLU 100 -6.958 -18.439 -16.585 754 H GLU 101 H GLU 101 -7.621 -14.155 -14.889 755 HA GLU 101 HA GLU 101 -7.233 -13.980 -17.799 756 HB2 GLU 101 2HB GLU 101 -9.358 -12.876 -18.071 757 HB3 GLU 101 3HB GLU 101 -9.619 -14.414 -17.260 758 HG2 GLU 101 2HG GLU 101 -9.346 -12.793 -15.129 759 HG3 GLU 101 3HG GLU 101 -10.037 -11.669 -16.297 760 H PHE 102 H PHE 102 -6.105 -12.880 -15.064 761 HA PHE 102 HA PHE 102 -6.256 -10.022 -15.611 762 HB2 PHE 102 2HB PHE 102 -6.469 -10.751 -13.287 763 HB3 PHE 102 3HB PHE 102 -4.899 -11.542 -13.374 764 HD1 PHE 102 HD1 PHE 102 -2.843 -10.207 -13.500 765 HD2 PHE 102 HD2 PHE 102 -6.660 -8.397 -12.977 766 HE1 PHE 102 HE1 PHE 102 -1.753 -8.126 -12.767 767 HE2 PHE 102 HE2 PHE 102 -5.576 -6.314 -12.244 768 HZ PHE 102 HZ PHE 102 -3.119 -6.176 -12.139 769 H GLN 103 H GLN 103 -3.603 -12.302 -14.899 770 HA GLN 103 HA GLN 103 -1.505 -10.730 -15.755 771 HB2 GLN 103 2HB GLN 103 -0.272 -12.862 -16.118 772 HB3 GLN 103 3HB GLN 103 -1.097 -12.782 -14.567 773 HG2 GLN 103 2HG GLN 103 -2.972 -13.953 -16.188 774 HG3 GLN 103 3HG GLN 103 -1.457 -14.625 -16.789 775 HE21 GLN 103 1HE2 GLN 103 -2.553 -13.703 -13.546 776 HE22 GLN 103 2HE2 GLN 103 -2.269 -15.247 -12.823 777 H GLU 104 H GLU 104 -3.626 -12.810 -17.652 778 HA GLU 104 HA GLU 104 -2.247 -12.786 -20.071 779 HB2 GLU 104 2HB GLU 104 -4.285 -13.449 -21.105 780 HB3 GLU 104 3HB GLU 104 -4.284 -14.156 -19.495 781 HG2 GLU 104 2HG GLU 104 -5.804 -12.485 -18.695 782 HG3 GLU 104 3HG GLU 104 -5.709 -11.609 -20.222 783 H MET 105 H MET 105 -4.273 -10.355 -18.586 784 HA MET 105 HA MET 105 -4.399 -8.722 -20.965 785 HB2 MET 105 2HB MET 105 -5.874 -7.387 -19.817 786 HB3 MET 105 3HB MET 105 -6.094 -8.903 -18.952 787 HG2 MET 105 2HG MET 105 -5.766 -7.681 -17.120 788 HG3 MET 105 3HG MET 105 -4.059 -7.765 -17.552 789 HE1 MET 105 3HE MET 105 -6.857 -4.883 -19.293 790 HE2 MET 105 1HE MET 105 -7.299 -6.162 -18.162 791 HE3 MET 105 2HE MET 105 -7.045 -4.517 -17.577 792 H VAL 106 H VAL 106 -2.135 -9.271 -18.537 793 HA VAL 106 HA VAL 106 -1.009 -6.592 -18.567 794 HB VAL 106 HB VAL 106 0.185 -9.055 -17.300 795 HG11 VAL 106 1HG1 VAL 106 1.001 -6.323 -17.528 796 HG12 VAL 106 2HG1 VAL 106 0.698 -6.707 -15.833 797 HG13 VAL 106 3HG1 VAL 106 1.840 -7.674 -16.767 798 HG21 VAL 106 3HG2 VAL 106 -2.281 -8.005 -16.664 799 HG22 VAL 106 1HG2 VAL 106 -1.265 -8.980 -15.602 800 HG23 VAL 106 2HG2 VAL 106 -1.199 -7.219 -15.514 801 H GLN 107 H GLN 107 0.671 -9.701 -18.900 802 HA GLN 107 HA GLN 107 2.703 -8.651 -20.539 803 HB2 GLN 107 2HB GLN 107 1.815 -11.510 -20.126 804 HB3 GLN 107 3HB GLN 107 3.294 -11.037 -20.950 805 HG2 GLN 107 2HG GLN 107 4.382 -10.756 -19.037 806 HG3 GLN 107 3HG GLN 107 3.072 -9.803 -18.343 807 HE21 GLN 107 1HE2 GLN 107 1.029 -11.389 -18.052 808 HE22 GLN 107 2HE2 GLN 107 1.395 -12.778 -17.092 809 H SER 108 H SER 108 -0.350 -10.219 -21.270 810 HA SER 108 HA SER 108 0.173 -9.777 -24.137 811 HB2 SER 108 2HB SER 108 -0.092 -12.190 -23.364 812 HB3 SER 108 3HB SER 108 -1.776 -11.797 -23.021 813 HG SER 108 HG SER 108 -2.198 -11.768 -25.094 Start of MODEL 9 1 H1 SER 1 H SER 1 -0.201 0.290 -0.579 2 HA SER 1 HA SER 1 2.055 0.511 -2.259 3 HB2 SER 1 2HB SER 1 1.998 1.153 0.159 4 HB3 SER 1 3HB SER 1 1.980 -0.562 0.571 5 HG SER 1 HG SER 1 4.019 -0.771 -0.126 6 H LEU 2 H LEU 2 2.750 -0.976 -3.635 7 HA LEU 2 HA LEU 2 2.247 -3.803 -3.096 8 HB2 LEU 2 2HB LEU 2 1.656 -2.822 -5.295 9 HB3 LEU 2 3HB LEU 2 3.365 -2.491 -5.569 10 HG LEU 2 HG LEU 2 3.456 -5.150 -5.100 11 HD11 LEU 2 1HD1 LEU 2 1.143 -5.192 -6.882 12 HD12 LEU 2 2HD1 LEU 2 0.758 -4.739 -5.222 13 HD13 LEU 2 3HD1 LEU 2 1.575 -6.267 -5.552 14 HD21 LEU 2 3HD2 LEU 2 4.343 -5.090 -7.137 15 HD22 LEU 2 1HD2 LEU 2 3.825 -3.407 -7.246 16 HD23 LEU 2 2HD2 LEU 2 2.787 -4.691 -7.867 17 H THR 3 H THR 3 4.980 -2.246 -4.742 18 HA THR 3 HA THR 3 7.220 -2.681 -4.664 19 HB THR 3 HB THR 3 7.940 -3.029 -2.079 20 HG1 THR 3 HG1 THR 3 6.269 -2.717 -0.831 21 HG21 THR 3 3HG2 THR 3 7.938 -0.962 -3.943 22 HG22 THR 3 1HG2 THR 3 8.810 -0.999 -2.411 23 HG23 THR 3 2HG2 THR 3 7.211 -0.258 -2.499 24 H ASP 4 H ASP 4 5.372 -5.004 -4.831 25 HA ASP 4 HA ASP 4 7.207 -7.061 -3.788 26 HB2 ASP 4 2HB ASP 4 4.244 -6.887 -3.753 27 HB3 ASP 4 3HB ASP 4 4.938 -8.470 -4.096 28 H ILE 5 H ILE 5 6.113 -5.564 -6.517 29 HA ILE 5 HA ILE 5 6.984 -7.806 -8.183 30 HB ILE 5 HB ILE 5 4.479 -6.222 -8.764 31 HG12 ILE 5 2HG1 ILE 5 3.632 -8.766 -8.598 32 HG13 ILE 5 3HG1 ILE 5 4.967 -8.844 -7.453 33 HG21 ILE 5 1HG2 ILE 5 6.053 -7.157 -10.641 34 HG22 ILE 5 2HG2 ILE 5 5.286 -8.689 -10.226 35 HG23 ILE 5 3HG2 ILE 5 4.302 -7.329 -10.767 36 HD11 ILE 5 3HD1 ILE 5 3.024 -8.356 -6.212 37 HD12 ILE 5 1HD1 ILE 5 3.947 -6.856 -6.304 38 HD13 ILE 5 2HD1 ILE 5 2.536 -7.088 -7.337 39 H LEU 6 H LEU 6 6.107 -4.379 -8.018 40 HA LEU 6 HA LEU 6 8.241 -3.827 -9.968 41 HB2 LEU 6 2HB LEU 6 5.454 -2.730 -9.858 42 HB3 LEU 6 3HB LEU 6 6.759 -1.824 -10.622 43 HG LEU 6 HG LEU 6 6.364 -4.620 -11.521 44 HD11 LEU 6 1HD1 LEU 6 4.307 -4.413 -12.335 45 HD12 LEU 6 2HD1 LEU 6 4.652 -2.815 -12.994 46 HD13 LEU 6 3HD1 LEU 6 4.134 -2.983 -11.317 47 HD21 LEU 6 3HD2 LEU 6 7.568 -2.151 -12.439 48 HD22 LEU 6 1HD2 LEU 6 6.526 -2.872 -13.666 49 HD23 LEU 6 2HD2 LEU 6 7.847 -3.811 -12.970 50 H SER 7 H SER 7 9.151 -1.655 -9.809 51 HA SER 7 HA SER 7 9.618 -0.937 -7.078 52 HB2 SER 7 2HB SER 7 10.904 -0.510 -9.586 53 HB3 SER 7 3HB SER 7 10.628 1.066 -8.843 54 HG SER 7 HG SER 7 12.438 0.502 -7.867 55 HA PRO 8 HA PRO 8 6.755 2.329 -6.464 56 HB2 PRO 8 2HB PRO 8 8.234 4.165 -5.118 57 HB3 PRO 8 3HB PRO 8 7.700 2.644 -4.394 58 HG2 PRO 8 2HG PRO 8 10.361 3.350 -5.570 59 HG3 PRO 8 3HG PRO 8 9.997 2.457 -4.082 60 HD2 PRO 8 2HD PRO 8 10.701 1.223 -6.387 61 HD3 PRO 8 3HD PRO 8 9.588 0.490 -5.213 62 H SER 9 H SER 9 9.931 3.649 -7.426 63 HA SER 9 HA SER 9 9.073 6.075 -8.442 64 HB2 SER 9 2HB SER 9 11.142 5.998 -9.857 65 HB3 SER 9 3HB SER 9 11.428 5.630 -8.157 66 HG SER 9 HG SER 9 11.464 3.924 -10.384 67 H ASP 10 H ASP 10 9.388 2.965 -10.122 68 HA ASP 10 HA ASP 10 8.654 3.838 -12.676 69 HB2 ASP 10 2HB ASP 10 8.346 1.151 -11.331 70 HB3 ASP 10 3HB ASP 10 7.976 1.424 -13.031 71 H ILE 11 H ILE 11 6.713 2.917 -9.901 72 HA ILE 11 HA ILE 11 4.229 2.898 -11.332 73 HB ILE 11 HB ILE 11 4.778 3.017 -8.365 74 HG12 ILE 11 2HG1 ILE 11 3.686 0.640 -9.820 75 HG13 ILE 11 3HG1 ILE 11 5.415 0.963 -9.886 76 HG21 ILE 11 1HG2 ILE 11 2.604 3.913 -8.725 77 HG22 ILE 11 2HG2 ILE 11 2.210 2.651 -9.891 78 HG23 ILE 11 3HG2 ILE 11 2.395 2.247 -8.185 79 HD11 ILE 11 3HD1 ILE 11 3.718 0.211 -7.555 80 HD12 ILE 11 1HD1 ILE 11 5.247 -0.477 -8.103 81 HD13 ILE 11 2HD1 ILE 11 5.223 1.096 -7.305 82 H ALA 12 H ALA 12 5.685 5.118 -8.954 83 HA ALA 12 HA ALA 12 3.698 7.066 -8.983 84 HB1 ALA 12 1HB ALA 12 6.199 8.368 -8.681 85 HB2 ALA 12 2HB ALA 12 5.040 7.909 -7.433 86 HB3 ALA 12 3HB ALA 12 6.313 6.786 -7.910 87 H ALA 13 H ALA 13 6.086 6.299 -11.350 88 HA ALA 13 HA ALA 13 5.960 8.848 -12.698 89 HB1 ALA 13 1HB ALA 13 7.482 6.355 -12.987 90 HB2 ALA 13 2HB ALA 13 7.109 7.179 -14.502 91 HB3 ALA 13 3HB ALA 13 7.983 8.029 -13.228 92 H ALA 14 H ALA 14 4.261 5.844 -12.785 93 HA ALA 14 HA ALA 14 3.077 6.414 -15.391 94 HB1 ALA 14 1HB ALA 14 2.192 4.104 -13.746 95 HB2 ALA 14 2HB ALA 14 2.439 4.226 -15.488 96 HB3 ALA 14 3HB ALA 14 3.826 4.077 -14.409 97 H LEU 15 H LEU 15 2.329 6.568 -12.002 98 HA LEU 15 HA LEU 15 -0.498 6.713 -12.245 99 HB2 LEU 15 2HB LEU 15 1.434 7.536 -10.097 100 HB3 LEU 15 3HB LEU 15 -0.303 7.794 -9.943 101 HG LEU 15 HG LEU 15 1.092 5.131 -10.206 102 HD11 LEU 15 1HD1 LEU 15 1.326 5.264 -8.006 103 HD12 LEU 15 2HD1 LEU 15 -0.431 5.287 -7.865 104 HD13 LEU 15 3HD1 LEU 15 0.465 6.803 -7.956 105 HD21 LEU 15 3HD2 LEU 15 -1.162 4.202 -9.759 106 HD22 LEU 15 1HD2 LEU 15 -1.043 5.031 -11.311 107 HD23 LEU 15 2HD2 LEU 15 -1.832 5.824 -9.947 108 H ARG 16 H ARG 16 1.991 9.218 -11.773 109 HA ARG 16 HA ARG 16 0.160 11.382 -12.006 110 HB2 ARG 16 2HB ARG 16 3.156 11.422 -12.407 111 HB3 ARG 16 3HB ARG 16 2.126 12.803 -12.055 112 HG2 ARG 16 2HG ARG 16 1.520 11.551 -9.900 113 HG3 ARG 16 3HG ARG 16 2.934 10.556 -10.250 114 HD2 ARG 16 2HD ARG 16 3.526 12.372 -8.751 115 HD3 ARG 16 3HD ARG 16 4.326 12.575 -10.309 116 HE ARG 16 HE ARG 16 3.171 14.524 -10.601 117 HH11 ARG 16 1HH1 ARG 16 1.622 12.656 -8.105 118 HH12 ARG 16 2HH1 ARG 16 0.513 13.914 -7.669 119 HH21 ARG 16 1HH2 ARG 16 1.717 16.189 -10.037 120 HH22 ARG 16 2HH2 ARG 16 0.568 15.923 -8.769 121 H ASP 17 H ASP 17 1.939 9.465 -14.275 122 HA ASP 17 HA ASP 17 2.069 11.197 -16.459 123 HB2 ASP 17 2HB ASP 17 3.281 9.227 -16.732 124 HB3 ASP 17 3HB ASP 17 1.949 8.214 -16.182 125 H CYS 18 H CYS 18 -0.490 8.912 -15.530 126 HA CYS 18 HA CYS 18 -2.344 10.445 -17.223 127 HB2 CYS 18 2HB CYS 18 -2.035 7.457 -17.011 128 HB3 CYS 18 3HB CYS 18 -3.539 8.190 -17.555 129 HG CYS 18 HG CYS 18 -1.154 7.297 -19.411 130 H GLN 19 H GLN 19 -1.987 10.988 -14.547 131 HA GLN 19 HA GLN 19 -3.718 9.577 -12.823 132 HB2 GLN 19 2HB GLN 19 -3.591 11.672 -11.421 133 HB3 GLN 19 3HB GLN 19 -2.044 10.948 -11.838 134 HG2 GLN 19 2HG GLN 19 -1.515 12.634 -13.342 135 HG3 GLN 19 3HG GLN 19 -3.193 13.152 -13.499 136 HE21 GLN 19 1HE2 GLN 19 -0.906 12.670 -10.823 137 HE22 GLN 19 2HE2 GLN 19 -1.179 14.209 -10.088 138 H ALA 20 H ALA 20 -4.224 12.201 -15.078 139 HA ALA 20 HA ALA 20 -6.625 13.254 -14.237 140 HB1 ALA 20 1HB ALA 20 -7.000 13.953 -16.493 141 HB2 ALA 20 2HB ALA 20 -5.267 14.038 -16.176 142 HB3 ALA 20 3HB ALA 20 -5.927 12.699 -17.115 143 HA PRO 21 HA PRO 21 -9.682 10.119 -14.579 144 HB2 PRO 21 2HB PRO 21 -11.859 11.603 -15.234 145 HB3 PRO 21 3HB PRO 21 -11.140 11.614 -13.620 146 HG2 PRO 21 2HG PRO 21 -10.805 13.576 -15.856 147 HG3 PRO 21 3HG PRO 21 -11.037 13.881 -14.125 148 HD2 PRO 21 2HD PRO 21 -8.608 14.005 -15.313 149 HD3 PRO 21 3HD PRO 21 -8.821 13.485 -13.630 150 H ASP 22 H ASP 22 -10.534 8.757 -16.076 151 HA ASP 22 HA ASP 22 -10.915 7.798 -18.104 152 HB2 ASP 22 2HB ASP 22 -12.563 9.842 -18.042 153 HB3 ASP 22 3HB ASP 22 -11.499 10.485 -19.290 154 H SER 23 H SER 23 -8.258 9.081 -17.457 155 HA SER 23 HA SER 23 -7.257 9.454 -20.199 156 HB2 SER 23 2HB SER 23 -6.896 11.143 -18.155 157 HB3 SER 23 3HB SER 23 -5.529 10.071 -17.854 158 HG SER 23 HG SER 23 -6.076 11.330 -20.338 159 H PHE 24 H PHE 24 -6.782 7.671 -17.204 160 HA PHE 24 HA PHE 24 -4.448 6.284 -17.962 161 HB2 PHE 24 2HB PHE 24 -5.746 6.498 -15.647 162 HB3 PHE 24 3HB PHE 24 -6.432 4.964 -16.173 163 HD1 PHE 24 HD2 PHE 24 -3.277 6.708 -15.379 164 HD2 PHE 24 HD1 PHE 24 -5.188 2.968 -16.062 165 HE1 PHE 24 HE2 PHE 24 -1.272 5.539 -14.563 166 HE2 PHE 24 HE1 PHE 24 -3.187 1.792 -15.247 167 HZ PHE 24 HZ PHE 24 -1.224 3.077 -14.497 168 H SER 25 H SER 25 -4.380 3.866 -18.253 169 HA SER 25 HA SER 25 -6.663 2.708 -19.621 170 HB2 SER 25 2HB SER 25 -5.874 3.494 -21.616 171 HB3 SER 25 3HB SER 25 -4.222 3.655 -21.020 172 HG SER 25 HG SER 25 -3.792 1.733 -21.750 173 HA PRO 26 HA PRO 26 -5.107 -0.993 -17.840 174 HB2 PRO 26 2HB PRO 26 -6.117 -2.835 -19.560 175 HB3 PRO 26 3HB PRO 26 -7.118 -1.952 -18.401 176 HG2 PRO 26 2HG PRO 26 -6.698 -1.438 -21.320 177 HG3 PRO 26 3HG PRO 26 -8.202 -1.395 -20.382 178 HD2 PRO 26 2HD PRO 26 -6.846 0.847 -21.064 179 HD3 PRO 26 3HD PRO 26 -7.774 0.714 -19.556 180 H LYS 27 H LYS 27 -4.219 -0.005 -20.998 181 HA LYS 27 HA LYS 27 -2.006 -1.953 -21.002 182 HB2 LYS 27 2HB LYS 27 -2.032 -1.955 -23.410 183 HB3 LYS 27 3HB LYS 27 -3.653 -2.319 -22.833 184 HG2 LYS 27 2HG LYS 27 -3.282 0.519 -23.235 185 HG3 LYS 27 3HG LYS 27 -2.942 -0.403 -24.701 186 HD2 LYS 27 2HD LYS 27 -5.439 -0.729 -23.043 187 HD3 LYS 27 3HD LYS 27 -5.324 0.319 -24.459 188 HE2 LYS 27 2HE LYS 27 -4.438 -2.487 -24.786 189 HE3 LYS 27 3HE LYS 27 -6.168 -2.217 -24.582 190 HZ1 LYS 27 3HZ LYS 27 -5.706 -0.397 -26.396 191 HZ2 LYS 27 1HZ LYS 27 -5.988 -2.009 -26.825 192 HZ3 LYS 27 2HZ LYS 27 -4.406 -1.412 -26.775 193 H LYS 28 H LYS 28 -2.312 0.854 -19.922 194 HA LYS 28 HA LYS 28 -0.009 2.019 -21.343 195 HB2 LYS 28 2HB LYS 28 -2.466 3.363 -20.246 196 HB3 LYS 28 3HB LYS 28 -0.970 4.255 -20.491 197 HG2 LYS 28 2HG LYS 28 -2.075 2.653 -22.744 198 HG3 LYS 28 3HG LYS 28 -2.825 4.198 -22.335 199 HD2 LYS 28 2HD LYS 28 0.058 4.410 -22.398 200 HD3 LYS 28 3HD LYS 28 -0.573 3.792 -23.926 201 HE2 LYS 28 2HE LYS 28 -1.874 6.151 -22.639 202 HE3 LYS 28 3HE LYS 28 -0.363 6.369 -23.520 203 HZ1 LYS 28 3HZ LYS 28 -1.718 6.594 -25.271 204 HZ2 LYS 28 1HZ LYS 28 -3.018 5.815 -24.520 205 HZ3 LYS 28 2HZ LYS 28 -1.792 4.904 -25.247 206 H PHE 29 H PHE 29 -0.470 0.310 -18.825 207 HA PHE 29 HA PHE 29 1.023 2.053 -16.976 208 HB2 PHE 29 2HB PHE 29 -1.208 1.449 -16.117 209 HB3 PHE 29 3HB PHE 29 -0.804 -0.257 -16.281 210 HD1 PHE 29 HD1 PHE 29 1.509 2.351 -15.084 211 HD2 PHE 29 HD2 PHE 29 -1.040 -0.885 -14.014 212 HE1 PHE 29 HE1 PHE 29 2.456 2.361 -12.813 213 HE2 PHE 29 HE2 PHE 29 -0.098 -0.880 -11.741 214 HZ PHE 29 HZ PHE 29 1.651 0.746 -11.137 215 H PHE 30 H PHE 30 1.044 -0.795 -18.828 216 HA PHE 30 HA PHE 30 3.079 -2.133 -17.255 217 HB2 PHE 30 2HB PHE 30 2.834 -3.952 -18.709 218 HB3 PHE 30 3HB PHE 30 1.215 -3.263 -18.647 219 HD1 PHE 30 HD2 PHE 30 0.278 -2.109 -20.559 220 HD2 PHE 30 HD1 PHE 30 4.179 -3.806 -20.704 221 HE1 PHE 30 HE2 PHE 30 0.272 -1.907 -23.011 222 HE2 PHE 30 HE1 PHE 30 4.179 -3.606 -23.157 223 HZ PHE 30 HZ PHE 30 2.223 -2.656 -24.313 224 H GLN 31 H GLN 31 3.009 0.322 -19.524 225 HA GLN 31 HA GLN 31 5.594 -0.323 -20.704 226 HB2 GLN 31 2HB GLN 31 4.216 2.271 -21.215 227 HB3 GLN 31 3HB GLN 31 5.151 1.264 -22.312 228 HG2 GLN 31 2HG GLN 31 3.294 -0.349 -22.375 229 HG3 GLN 31 3HG GLN 31 2.356 0.725 -21.339 230 HE21 GLN 31 1HE2 GLN 31 2.480 3.107 -22.259 231 HE22 GLN 31 2HE2 GLN 31 2.043 3.232 -23.925 232 H ILE 32 H ILE 32 4.149 1.875 -18.393 233 HA ILE 32 HA ILE 32 6.661 3.318 -18.052 234 HB ILE 32 HB ILE 32 3.995 3.712 -16.687 235 HG12 ILE 32 2HG1 ILE 32 4.617 5.942 -18.242 236 HG13 ILE 32 3HG1 ILE 32 5.065 4.570 -19.251 237 HG21 ILE 32 1HG2 ILE 32 5.595 4.554 -15.203 238 HG22 ILE 32 2HG2 ILE 32 6.603 5.181 -16.506 239 HG23 ILE 32 3HG2 ILE 32 5.070 5.964 -16.123 240 HD11 ILE 32 3HD1 ILE 32 2.483 4.221 -17.974 241 HD12 ILE 32 1HD1 ILE 32 2.556 5.654 -18.999 242 HD13 ILE 32 2HD1 ILE 32 2.943 4.068 -19.669 243 H SER 33 H SER 33 4.763 0.847 -16.533 244 HA SER 33 HA SER 33 6.369 0.965 -14.092 245 HB2 SER 33 2HB SER 33 3.818 0.665 -14.096 246 HB3 SER 33 3HB SER 33 4.134 -0.982 -14.643 247 HG SER 33 HG SER 33 5.025 0.230 -12.237 248 H GLY 34 H GLY 34 5.168 -1.725 -16.106 249 HA2 GLY 34 2HA GLY 34 6.955 -3.015 -17.314 250 HA3 GLY 34 3HA GLY 34 7.822 -2.985 -15.785 251 H MET 35 H MET 35 4.354 -3.431 -16.032 252 HA MET 35 HA MET 35 4.357 -5.729 -14.414 253 HB2 MET 35 2HB MET 35 2.183 -4.939 -16.353 254 HB3 MET 35 3HB MET 35 2.010 -5.885 -14.881 255 HG2 MET 35 2HG MET 35 2.605 -3.927 -13.550 256 HG3 MET 35 3HG MET 35 2.778 -2.980 -15.025 257 HE1 MET 35 3HE MET 35 -1.235 -4.800 -13.657 258 HE2 MET 35 1HE MET 35 0.136 -5.744 -14.241 259 HE3 MET 35 2HE MET 35 0.235 -4.912 -12.689 260 H SER 36 H SER 36 3.871 -5.388 -17.926 261 HA SER 36 HA SER 36 3.525 -8.063 -18.558 262 HB2 SER 36 2HB SER 36 4.117 -7.482 -20.819 263 HB3 SER 36 3HB SER 36 3.243 -6.118 -20.123 264 HG SER 36 HG SER 36 5.426 -5.280 -19.616 265 H LYS 37 H LYS 37 6.467 -6.275 -17.914 266 HA LYS 37 HA LYS 37 8.307 -8.185 -18.877 267 HB2 LYS 37 2HB LYS 37 8.833 -6.323 -16.569 268 HB3 LYS 37 3HB LYS 37 9.978 -6.938 -17.753 269 HG2 LYS 37 2HG LYS 37 7.803 -4.909 -18.203 270 HG3 LYS 37 3HG LYS 37 9.548 -4.643 -18.238 271 HD2 LYS 37 2HD LYS 37 7.991 -6.383 -20.151 272 HD3 LYS 37 3HD LYS 37 8.607 -4.766 -20.497 273 HE2 LYS 37 2HE LYS 37 10.295 -7.157 -19.765 274 HE3 LYS 37 3HE LYS 37 10.051 -6.549 -21.402 275 HZ1 LYS 37 3HZ LYS 37 10.889 -4.443 -19.725 276 HZ2 LYS 37 1HZ LYS 37 11.659 -5.081 -21.090 277 HZ3 LYS 37 2HZ LYS 37 11.964 -5.739 -19.562 278 H LYS 38 H LYS 38 6.234 -8.232 -16.202 279 HA LYS 38 HA LYS 38 7.891 -10.011 -14.609 280 HB2 LYS 38 2HB LYS 38 5.008 -9.280 -14.108 281 HB3 LYS 38 3HB LYS 38 6.186 -9.881 -12.948 282 HG2 LYS 38 2HG LYS 38 6.396 -7.220 -14.338 283 HG3 LYS 38 3HG LYS 38 5.680 -7.457 -12.742 284 HD2 LYS 38 2HD LYS 38 7.713 -7.246 -11.865 285 HD3 LYS 38 3HD LYS 38 8.166 -8.752 -12.667 286 HE2 LYS 38 2HE LYS 38 8.505 -7.161 -14.734 287 HE3 LYS 38 3HE LYS 38 8.671 -5.930 -13.484 288 HZ1 LYS 38 3HZ LYS 38 10.450 -8.118 -14.178 289 HZ2 LYS 38 1HZ LYS 38 10.271 -7.818 -12.522 290 HZ3 LYS 38 2HZ LYS 38 10.807 -6.588 -13.551 291 H SER 39 H SER 39 5.922 -11.704 -13.575 292 HA SER 39 HA SER 39 5.228 -13.337 -15.929 293 HB2 SER 39 2HB SER 39 7.094 -14.322 -14.659 294 HB3 SER 39 3HB SER 39 6.105 -14.314 -13.199 295 HG SER 39 HG SER 39 6.154 -16.348 -14.366 296 H SER 40 H SER 40 3.408 -14.815 -15.614 297 HA SER 40 HA SER 40 1.097 -13.566 -14.798 298 HB2 SER 40 2HB SER 40 0.540 -16.273 -14.445 299 HB3 SER 40 3HB SER 40 0.363 -15.356 -15.941 300 HG SER 40 HG SER 40 2.291 -16.096 -16.639 301 H SER 41 H SER 41 3.023 -15.932 -12.974 302 HA SER 41 HA SER 41 1.412 -16.053 -10.697 303 HB2 SER 41 2HB SER 41 3.728 -16.591 -9.569 304 HB3 SER 41 3HB SER 41 3.032 -17.710 -10.741 305 HG SER 41 HG SER 41 4.871 -17.452 -11.726 306 H GLN 42 H GLN 42 3.892 -13.756 -11.642 307 HA GLN 42 HA GLN 42 4.029 -12.438 -9.113 308 HB2 GLN 42 2HB GLN 42 5.126 -11.999 -11.830 309 HB3 GLN 42 3HB GLN 42 4.970 -10.572 -10.814 310 HG2 GLN 42 2HG GLN 42 6.240 -11.832 -9.045 311 HG3 GLN 42 3HG GLN 42 6.567 -13.057 -10.271 312 HE21 GLN 42 1HE2 GLN 42 6.889 -9.601 -9.610 313 HE22 GLN 42 2HE2 GLN 42 8.354 -9.387 -10.500 314 H LEU 43 H LEU 43 2.456 -11.662 -12.207 315 HA LEU 43 HA LEU 43 1.280 -9.249 -11.373 316 HB2 LEU 43 2HB LEU 43 0.148 -11.139 -13.422 317 HB3 LEU 43 3HB LEU 43 -0.077 -9.394 -13.326 318 HG LEU 43 HG LEU 43 2.680 -10.454 -13.719 319 HD11 LEU 43 1HD1 LEU 43 0.486 -10.478 -15.763 320 HD12 LEU 43 2HD1 LEU 43 1.654 -11.740 -15.375 321 HD13 LEU 43 3HD1 LEU 43 2.178 -10.285 -16.223 322 HD21 LEU 43 3HD2 LEU 43 1.143 -7.967 -14.274 323 HD22 LEU 43 1HD2 LEU 43 2.516 -8.362 -15.309 324 HD23 LEU 43 2HD2 LEU 43 2.748 -8.172 -13.571 325 H LYS 44 H LYS 44 0.533 -12.491 -10.620 326 HA LYS 44 HA LYS 44 -2.254 -12.204 -10.130 327 HB2 LYS 44 2HB LYS 44 -0.164 -14.224 -9.453 328 HB3 LYS 44 3HB LYS 44 -1.686 -14.272 -8.573 329 HG2 LYS 44 2HG LYS 44 -2.915 -14.539 -10.632 330 HG3 LYS 44 3HG LYS 44 -1.430 -14.370 -11.572 331 HD2 LYS 44 2HD LYS 44 -2.076 -16.716 -11.358 332 HD3 LYS 44 3HD LYS 44 -0.543 -16.403 -10.541 333 HE2 LYS 44 2HE LYS 44 -2.946 -16.101 -8.871 334 HE3 LYS 44 3HE LYS 44 -2.627 -17.739 -9.437 335 HZ1 LYS 44 3HZ LYS 44 -1.504 -16.608 -7.263 336 HZ2 LYS 44 1HZ LYS 44 -0.298 -16.379 -8.428 337 HZ3 LYS 44 2HZ LYS 44 -0.870 -17.936 -8.097 338 H GLU 45 H GLU 45 0.603 -11.427 -8.337 339 HA GLU 45 HA GLU 45 -0.431 -11.418 -5.730 340 HB2 GLU 45 2HB GLU 45 1.761 -9.785 -7.010 341 HB3 GLU 45 3HB GLU 45 1.396 -9.721 -5.292 342 HG2 GLU 45 2HG GLU 45 1.721 -12.270 -5.343 343 HG3 GLU 45 3HG GLU 45 2.511 -11.987 -6.893 344 H ILE 46 H ILE 46 -0.293 -8.847 -8.173 345 HA ILE 46 HA ILE 46 -1.326 -6.751 -6.689 346 HB ILE 46 HB ILE 46 -1.826 -7.332 -9.611 347 HG12 ILE 46 2HG1 ILE 46 0.082 -5.258 -9.135 348 HG13 ILE 46 3HG1 ILE 46 0.554 -6.671 -8.199 349 HG21 ILE 46 1HG2 ILE 46 -3.320 -5.656 -9.277 350 HG22 ILE 46 2HG2 ILE 46 -2.473 -5.032 -7.863 351 HG23 ILE 46 3HG2 ILE 46 -1.870 -4.673 -9.481 352 HD11 ILE 46 3HD1 ILE 46 -0.234 -7.331 -10.916 353 HD12 ILE 46 1HD1 ILE 46 1.129 -6.214 -10.838 354 HD13 ILE 46 2HD1 ILE 46 1.216 -7.770 -10.013 355 H PHE 47 H PHE 47 -3.025 -9.352 -8.363 356 HA PHE 47 HA PHE 47 -5.631 -8.407 -8.170 357 HB2 PHE 47 2HB PHE 47 -5.597 -10.301 -9.441 358 HB3 PHE 47 3HB PHE 47 -4.368 -11.074 -8.445 359 HD1 PHE 47 HD1 PHE 47 -5.002 -12.248 -6.382 360 HD2 PHE 47 HD2 PHE 47 -7.917 -10.629 -9.027 361 HE1 PHE 47 HE1 PHE 47 -6.735 -13.630 -5.313 362 HE2 PHE 47 HE2 PHE 47 -9.654 -12.007 -7.962 363 HZ PHE 47 HZ PHE 47 -9.065 -13.510 -6.102 364 H ARG 48 H ARG 48 -3.608 -9.977 -5.773 365 HA ARG 48 HA ARG 48 -5.665 -10.460 -3.875 366 HB2 ARG 48 2HB ARG 48 -2.905 -11.000 -4.100 367 HB3 ARG 48 3HB ARG 48 -3.105 -10.067 -2.623 368 HG2 ARG 48 2HG ARG 48 -4.661 -12.556 -3.291 369 HG3 ARG 48 3HG ARG 48 -3.214 -12.513 -2.281 370 HD2 ARG 48 2HD ARG 48 -5.447 -10.678 -1.595 371 HD3 ARG 48 3HD ARG 48 -5.660 -12.395 -1.256 372 HE ARG 48 HE ARG 48 -3.235 -11.850 -0.189 373 HH11 ARG 48 1HH1 ARG 48 -6.377 -10.388 0.138 374 HH12 ARG 48 2HH1 ARG 48 -6.106 -9.859 1.765 375 HH21 ARG 48 1HH2 ARG 48 -2.866 -11.159 1.953 376 HH22 ARG 48 2HH2 ARG 48 -4.108 -10.297 2.796 377 H ILE 49 H ILE 49 -4.289 -7.618 -4.963 378 HA ILE 49 HA ILE 49 -4.742 -6.211 -2.426 379 HB ILE 49 HB ILE 49 -3.516 -5.032 -4.911 380 HG12 ILE 49 2HG1 ILE 49 -2.172 -6.965 -4.285 381 HG13 ILE 49 3HG1 ILE 49 -1.315 -5.484 -3.873 382 HG21 ILE 49 1HG2 ILE 49 -2.403 -3.759 -2.809 383 HG22 ILE 49 2HG2 ILE 49 -3.862 -3.211 -3.633 384 HG23 ILE 49 3HG2 ILE 49 -3.990 -4.149 -2.145 385 HD11 ILE 49 3HD1 ILE 49 -2.201 -7.655 -2.176 386 HD12 ILE 49 1HD1 ILE 49 -1.004 -6.395 -1.875 387 HD13 ILE 49 2HD1 ILE 49 -2.713 -6.078 -1.576 388 H LEU 50 H LEU 50 -6.104 -6.754 -5.508 389 HA LEU 50 HA LEU 50 -7.700 -4.322 -5.479 390 HB2 LEU 50 2HB LEU 50 -7.179 -6.512 -7.408 391 HB3 LEU 50 3HB LEU 50 -8.733 -5.688 -7.522 392 HG LEU 50 HG LEU 50 -7.021 -3.577 -7.448 393 HD11 LEU 50 1HD1 LEU 50 -5.638 -5.574 -9.209 394 HD12 LEU 50 2HD1 LEU 50 -5.139 -5.300 -7.541 395 HD13 LEU 50 3HD1 LEU 50 -5.089 -3.976 -8.705 396 HD21 LEU 50 3HD2 LEU 50 -7.234 -3.786 -10.047 397 HD22 LEU 50 1HD2 LEU 50 -8.665 -3.515 -9.053 398 HD23 LEU 50 2HD2 LEU 50 -8.300 -5.134 -9.648 399 H ASP 51 H ASP 51 -7.958 -7.666 -4.620 400 HA ASP 51 HA ASP 51 -10.773 -7.910 -4.666 401 HB2 ASP 51 2HB ASP 51 -8.833 -9.699 -4.374 402 HB3 ASP 51 3HB ASP 51 -9.163 -9.430 -2.665 403 H ASN 52 H ASN 52 -12.202 -6.866 -3.463 404 HA ASN 52 HA ASN 52 -11.359 -5.798 -0.859 405 HB2 ASN 52 2HB ASN 52 -13.021 -4.783 -3.009 406 HB3 ASN 52 3HB ASN 52 -13.876 -4.746 -1.470 407 HD21 ASN 52 1HD2 ASN 52 -10.595 -4.090 -2.664 408 HD22 ASN 52 2HD2 ASN 52 -10.410 -2.589 -1.828 409 H ASP 53 H ASP 53 -12.932 -8.401 -2.111 410 HA ASP 53 HA ASP 53 -14.465 -8.775 0.369 411 HB2 ASP 53 2HB ASP 53 -15.809 -10.219 -1.643 412 HB3 ASP 53 3HB ASP 53 -16.387 -8.803 -0.770 413 H GLN 54 H GLN 54 -11.989 -9.815 -1.483 414 HA GLN 54 HA GLN 54 -10.813 -11.753 -1.707 415 HB2 GLN 54 2HB GLN 54 -12.108 -12.679 0.842 416 HB3 GLN 54 3HB GLN 54 -10.471 -12.975 0.271 417 HG2 GLN 54 2HG GLN 54 -11.448 -10.234 1.004 418 HG3 GLN 54 3HG GLN 54 -10.745 -11.341 2.182 419 HE21 GLN 54 1HE2 GLN 54 -10.115 -8.922 -0.014 420 HE22 GLN 54 2HE2 GLN 54 -8.404 -9.118 -0.149 421 H SER 55 H SER 55 -13.681 -11.645 -2.648 422 HA SER 55 HA SER 55 -14.806 -14.230 -2.333 423 HB2 SER 55 2HB SER 55 -15.990 -13.425 -4.584 424 HB3 SER 55 3HB SER 55 -16.426 -12.752 -3.014 425 HG SER 55 HG SER 55 -15.066 -11.593 -5.134 426 H GLY 56 H GLY 56 -12.207 -13.068 -4.187 427 HA2 GLY 56 2HA GLY 56 -10.772 -14.808 -5.162 428 HA3 GLY 56 3HA GLY 56 -12.236 -15.553 -5.786 429 H PHE 57 H PHE 57 -13.198 -12.701 -6.381 430 HA PHE 57 HA PHE 57 -11.525 -12.192 -8.744 431 HB2 PHE 57 2HB PHE 57 -14.545 -12.122 -8.783 432 HB3 PHE 57 3HB PHE 57 -13.456 -11.937 -10.154 433 HD1 PHE 57 HD1 PHE 57 -14.857 -14.318 -7.731 434 HD2 PHE 57 HD2 PHE 57 -12.504 -13.829 -11.244 435 HE1 PHE 57 HE1 PHE 57 -14.976 -16.741 -8.144 436 HE2 PHE 57 HE2 PHE 57 -12.621 -16.250 -11.663 437 HZ PHE 57 HZ PHE 57 -13.858 -17.709 -10.113 438 H ILE 58 H ILE 58 -12.140 -10.031 -9.773 439 HA ILE 58 HA ILE 58 -12.700 -8.078 -7.636 440 HB ILE 58 HB ILE 58 -10.859 -7.745 -10.008 441 HG12 ILE 58 2HG1 ILE 58 -9.922 -7.508 -7.196 442 HG13 ILE 58 3HG1 ILE 58 -10.272 -9.128 -7.787 443 HG21 ILE 58 1HG2 ILE 58 -12.019 -5.673 -9.429 444 HG22 ILE 58 2HG2 ILE 58 -11.487 -5.840 -7.757 445 HG23 ILE 58 3HG2 ILE 58 -10.302 -5.578 -9.037 446 HD11 ILE 58 3HD1 ILE 58 -7.908 -8.478 -8.026 447 HD12 ILE 58 1HD1 ILE 58 -8.677 -8.877 -9.562 448 HD13 ILE 58 2HD1 ILE 58 -8.402 -7.191 -9.125 449 H GLU 59 H GLU 59 -14.756 -7.464 -7.968 450 HA GLU 59 HA GLU 59 -15.885 -7.212 -10.597 451 HB2 GLU 59 2HB GLU 59 -17.086 -6.158 -8.043 452 HB3 GLU 59 3HB GLU 59 -17.919 -6.651 -9.510 453 HG2 GLU 59 2HG GLU 59 -18.327 -8.492 -8.278 454 HG3 GLU 59 3HG GLU 59 -16.753 -8.967 -8.913 455 H GLU 60 H GLU 60 -16.936 -5.200 -11.340 456 HA GLU 60 HA GLU 60 -15.145 -3.123 -11.667 457 HB2 GLU 60 2HB GLU 60 -18.143 -3.227 -11.915 458 HB3 GLU 60 3HB GLU 60 -17.240 -1.761 -12.271 459 HG2 GLU 60 2HG GLU 60 -16.253 -2.655 -14.141 460 HG3 GLU 60 3HG GLU 60 -16.441 -4.315 -13.579 461 H ASP 61 H ASP 61 -17.442 -3.675 -9.105 462 HA ASP 61 HA ASP 61 -17.531 -1.086 -8.015 463 HB2 ASP 61 2HB ASP 61 -18.111 -3.832 -7.013 464 HB3 ASP 61 3HB ASP 61 -17.934 -2.546 -5.822 465 H GLU 62 H GLU 62 -15.123 -3.573 -7.882 466 HA GLU 62 HA GLU 62 -13.614 -2.019 -5.887 467 HB2 GLU 62 2HB GLU 62 -12.243 -4.295 -5.913 468 HB3 GLU 62 3HB GLU 62 -13.675 -4.085 -4.915 469 HG2 GLU 62 2HG GLU 62 -14.995 -5.098 -6.808 470 HG3 GLU 62 3HG GLU 62 -13.449 -5.523 -7.540 471 H LEU 63 H LEU 63 -13.761 -2.901 -9.152 472 HA LEU 63 HA LEU 63 -10.960 -2.836 -9.731 473 HB2 LEU 63 2HB LEU 63 -13.122 -3.739 -11.065 474 HB3 LEU 63 3HB LEU 63 -12.882 -2.191 -11.873 475 HG LEU 63 HG LEU 63 -10.942 -4.493 -11.720 476 HD11 LEU 63 1HD1 LEU 63 -12.959 -3.682 -13.596 477 HD12 LEU 63 2HD1 LEU 63 -11.936 -5.118 -13.600 478 HD13 LEU 63 3HD1 LEU 63 -11.363 -3.626 -14.345 479 HD21 LEU 63 3HD2 LEU 63 -9.637 -2.512 -11.512 480 HD22 LEU 63 1HD2 LEU 63 -10.572 -1.691 -12.762 481 HD23 LEU 63 2HD2 LEU 63 -9.522 -3.042 -13.190 482 H LYS 64 H LYS 64 -13.522 -0.484 -9.539 483 HA LYS 64 HA LYS 64 -12.344 1.603 -11.001 484 HB2 LYS 64 2HB LYS 64 -13.803 3.080 -9.540 485 HB3 LYS 64 3HB LYS 64 -14.634 1.823 -10.447 486 HG2 LYS 64 2HG LYS 64 -15.153 0.618 -8.576 487 HG3 LYS 64 3HG LYS 64 -13.768 1.226 -7.666 488 HD2 LYS 64 2HD LYS 64 -15.858 2.126 -6.785 489 HD3 LYS 64 3HD LYS 64 -14.857 3.410 -7.468 490 HE2 LYS 64 2HE LYS 64 -16.462 3.971 -8.901 491 HE3 LYS 64 3HE LYS 64 -16.579 2.314 -9.489 492 HZ1 LYS 64 3HZ LYS 64 -18.537 2.173 -8.496 493 HZ2 LYS 64 1HZ LYS 64 -18.374 3.726 -7.844 494 HZ3 LYS 64 2HZ LYS 64 -17.794 2.386 -6.991 495 H TYR 65 H TYR 65 -11.840 0.465 -7.737 496 HA TYR 65 HA TYR 65 -10.297 2.767 -6.942 497 HB2 TYR 65 2HB TYR 65 -10.847 0.100 -5.645 498 HB3 TYR 65 3HB TYR 65 -9.774 1.298 -4.929 499 HD1 TYR 65 HD1 TYR 65 -11.215 3.803 -5.507 500 HD2 TYR 65 HD2 TYR 65 -12.687 0.025 -4.217 501 HE1 TYR 65 HE1 TYR 65 -13.147 4.917 -4.468 502 HE2 TYR 65 HE2 TYR 65 -14.623 1.128 -3.176 503 HH TYR 65 HH TYR 65 -15.840 3.120 -3.199 504 H PHE 66 H PHE 66 -9.554 0.869 -9.249 505 HA PHE 66 HA PHE 66 -7.248 -0.557 -8.664 506 HB2 PHE 66 2HB PHE 66 -8.245 -0.819 -10.815 507 HB3 PHE 66 3HB PHE 66 -8.088 0.898 -11.171 508 HD1 PHE 66 HD1 PHE 66 -5.937 -2.019 -10.286 509 HD2 PHE 66 HD2 PHE 66 -6.387 1.549 -12.562 510 HE1 PHE 66 HE1 PHE 66 -3.777 -2.450 -11.382 511 HE2 PHE 66 HE2 PHE 66 -4.227 1.124 -13.662 512 HZ PHE 66 HZ PHE 66 -2.920 -0.878 -13.073 513 H LEU 67 H LEU 67 -7.708 2.877 -9.134 514 HA LEU 67 HA LEU 67 -4.882 3.451 -9.237 515 HB2 LEU 67 2HB LEU 67 -6.968 5.514 -8.684 516 HB3 LEU 67 3HB LEU 67 -5.466 5.660 -9.593 517 HG LEU 67 HG LEU 67 -8.113 4.573 -10.479 518 HD11 LEU 67 1HD1 LEU 67 -6.567 6.122 -12.356 519 HD12 LEU 67 2HD1 LEU 67 -6.759 6.980 -10.827 520 HD13 LEU 67 3HD1 LEU 67 -8.180 6.420 -11.708 521 HD21 LEU 67 3HD2 LEU 67 -6.815 2.822 -11.247 522 HD22 LEU 67 1HD2 LEU 67 -5.395 3.840 -11.486 523 HD23 LEU 67 2HD2 LEU 67 -6.755 3.948 -12.604 524 H GLN 68 H GLN 68 -7.051 2.715 -6.803 525 HA GLN 68 HA GLN 68 -5.759 4.375 -4.783 526 HB2 GLN 68 2HB GLN 68 -8.289 2.927 -5.011 527 HB3 GLN 68 3HB GLN 68 -7.508 2.708 -3.450 528 HG2 GLN 68 2HG GLN 68 -8.383 4.638 -2.824 529 HG3 GLN 68 3HG GLN 68 -7.312 5.434 -3.977 530 HE21 GLN 68 1HE2 GLN 68 -8.295 4.931 -6.362 531 HE22 GLN 68 2HE2 GLN 68 -9.921 5.490 -6.525 532 H ARG 69 H ARG 69 -4.892 1.685 -6.292 533 HA ARG 69 HA ARG 69 -3.966 0.278 -3.884 534 HB2 ARG 69 2HB ARG 69 -3.551 -0.914 -6.568 535 HB3 ARG 69 3HB ARG 69 -4.009 -1.681 -5.054 536 HG2 ARG 69 2HG ARG 69 -5.818 -0.057 -6.832 537 HG3 ARG 69 3HG ARG 69 -5.802 -1.816 -6.685 538 HD2 ARG 69 2HD ARG 69 -6.639 0.231 -4.655 539 HD3 ARG 69 3HD ARG 69 -7.579 -1.102 -5.325 540 HE ARG 69 HE ARG 69 -5.565 -2.374 -4.069 541 HH11 ARG 69 1HH1 ARG 69 -7.773 0.121 -3.061 542 HH12 ARG 69 2HH1 ARG 69 -7.773 -0.368 -1.399 543 HH21 ARG 69 1HH2 ARG 69 -5.557 -3.029 -1.883 544 HH22 ARG 69 2HH2 ARG 69 -6.511 -2.160 -0.730 545 H PHE 70 H PHE 70 -2.905 1.951 -6.757 546 HA PHE 70 HA PHE 70 -0.102 1.406 -6.071 547 HB2 PHE 70 2HB PHE 70 -1.398 2.421 -8.602 548 HB3 PHE 70 3HB PHE 70 0.344 2.424 -8.352 549 HD1 PHE 70 HD1 PHE 70 -2.617 0.192 -8.441 550 HD2 PHE 70 HD2 PHE 70 1.610 0.526 -8.811 551 HE1 PHE 70 HE1 PHE 70 -2.506 -2.135 -9.234 552 HE2 PHE 70 HE2 PHE 70 1.727 -1.800 -9.605 553 HZ PHE 70 HZ PHE 70 -0.332 -3.133 -9.818 554 H GLU 71 H GLU 71 -2.509 3.788 -5.879 555 HA GLU 71 HA GLU 71 -0.478 5.869 -5.397 556 HB2 GLU 71 2HB GLU 71 -2.114 6.206 -7.332 557 HB3 GLU 71 3HB GLU 71 -3.358 6.401 -6.105 558 HG2 GLU 71 2HG GLU 71 -2.838 8.543 -5.991 559 HG3 GLU 71 3HG GLU 71 -1.266 8.089 -5.336 560 H SER 72 H SER 72 -3.281 4.201 -4.196 561 HA SER 72 HA SER 72 -4.391 4.247 -2.205 562 HB2 SER 72 2HB SER 72 -1.896 5.314 -0.919 563 HB3 SER 72 3HB SER 72 -3.039 4.119 -0.305 564 HG SER 72 HG SER 72 -0.875 3.419 -1.212 565 H GLY 73 H GLY 73 -5.405 6.231 -3.362 566 HA2 GLY 73 2HA GLY 73 -6.401 8.042 -1.709 567 HA3 GLY 73 3HA GLY 73 -4.818 8.747 -2.002 568 H ALA 74 H ALA 74 -5.112 7.432 -4.807 569 HA ALA 74 HA ALA 74 -5.898 9.784 -6.155 570 HB1 ALA 74 1HB ALA 74 -6.014 7.994 -8.128 571 HB2 ALA 74 2HB ALA 74 -4.489 8.598 -7.479 572 HB3 ALA 74 3HB ALA 74 -5.119 7.040 -6.945 573 H ARG 75 H ARG 75 -7.541 9.387 -8.130 574 HA ARG 75 HA ARG 75 -10.113 9.101 -6.859 575 HB2 ARG 75 2HB ARG 75 -11.013 9.818 -9.039 576 HB3 ARG 75 3HB ARG 75 -9.765 10.907 -8.449 577 HG2 ARG 75 2HG ARG 75 -8.144 9.886 -9.951 578 HG3 ARG 75 3HG ARG 75 -9.378 8.764 -10.528 579 HD2 ARG 75 2HD ARG 75 -9.303 11.756 -10.862 580 HD3 ARG 75 3HD ARG 75 -9.202 10.528 -12.123 581 HE ARG 75 HE ARG 75 -11.504 10.189 -11.955 582 HH11 ARG 75 1HH1 ARG 75 -10.377 12.517 -9.626 583 HH12 ARG 75 2HH1 ARG 75 -11.963 13.112 -9.259 584 HH21 ARG 75 1HH2 ARG 75 -13.596 10.963 -11.482 585 HH22 ARG 75 2HH2 ARG 75 -13.793 12.227 -10.315 586 H VAL 76 H VAL 76 -11.841 8.009 -8.447 587 HA VAL 76 HA VAL 76 -10.919 5.240 -8.764 588 HB VAL 76 HB VAL 76 -13.091 4.499 -8.382 589 HG11 VAL 76 1HG1 VAL 76 -13.786 5.497 -6.331 590 HG12 VAL 76 2HG1 VAL 76 -12.026 5.602 -6.401 591 HG13 VAL 76 3HG1 VAL 76 -13.010 7.025 -6.744 592 HG21 VAL 76 3HG2 VAL 76 -13.914 7.217 -9.315 593 HG22 VAL 76 1HG2 VAL 76 -14.443 5.631 -9.875 594 HG23 VAL 76 2HG2 VAL 76 -15.013 6.255 -8.327 595 H LEU 77 H LEU 77 -11.471 4.026 -10.612 596 HA LEU 77 HA LEU 77 -11.152 5.297 -13.061 597 HB2 LEU 77 2HB LEU 77 -12.496 2.644 -12.570 598 HB3 LEU 77 3HB LEU 77 -11.771 3.188 -14.082 599 HG LEU 77 HG LEU 77 -10.281 2.613 -11.521 600 HD11 LEU 77 1HD1 LEU 77 -10.471 1.069 -14.104 601 HD12 LEU 77 2HD1 LEU 77 -11.114 0.580 -12.537 602 HD13 LEU 77 3HD1 LEU 77 -9.371 0.703 -12.774 603 HD21 LEU 77 3HD2 LEU 77 -9.455 3.683 -14.189 604 HD22 LEU 77 1HD2 LEU 77 -8.333 2.716 -13.231 605 HD23 LEU 77 2HD2 LEU 77 -8.988 4.216 -12.574 606 H THR 78 H THR 78 -12.495 6.150 -14.553 607 HA THR 78 HA THR 78 -15.172 6.801 -13.757 608 HB THR 78 HB THR 78 -13.794 8.405 -15.019 609 HG1 THR 78 HG1 THR 78 -15.610 9.149 -15.806 610 HG21 THR 78 3HG2 THR 78 -14.173 7.346 -17.656 611 HG22 THR 78 1HG2 THR 78 -13.287 6.179 -16.675 612 HG23 THR 78 2HG2 THR 78 -12.675 7.824 -16.856 613 H ALA 79 H ALA 79 -16.821 6.687 -15.772 614 HA ALA 79 HA ALA 79 -17.527 3.952 -15.984 615 HB1 ALA 79 1HB ALA 79 -19.155 5.819 -15.963 616 HB2 ALA 79 2HB ALA 79 -18.617 6.264 -17.583 617 HB3 ALA 79 3HB ALA 79 -19.391 4.703 -17.308 618 H SER 80 H SER 80 -15.310 5.802 -17.699 619 HA SER 80 HA SER 80 -15.502 4.066 -20.068 620 HB2 SER 80 2HB SER 80 -15.633 6.367 -20.713 621 HB3 SER 80 3HB SER 80 -14.260 6.796 -19.692 622 HG SER 80 HG SER 80 -12.923 6.085 -21.174 623 H GLU 81 H GLU 81 -13.857 4.371 -17.223 624 HA GLU 81 HA GLU 81 -11.308 3.412 -18.308 625 HB2 GLU 81 2HB GLU 81 -12.116 4.472 -15.606 626 HB3 GLU 81 3HB GLU 81 -10.577 3.664 -15.869 627 HG2 GLU 81 2HG GLU 81 -11.074 5.747 -17.824 628 HG3 GLU 81 3HG GLU 81 -11.091 6.353 -16.169 629 H THR 82 H THR 82 -13.474 2.609 -15.587 630 HA THR 82 HA THR 82 -12.434 0.126 -14.968 631 HB THR 82 HB THR 82 -15.190 -0.169 -14.592 632 HG1 THR 82 HG1 THR 82 -15.662 1.932 -15.095 633 HG21 THR 82 3HG2 THR 82 -12.886 -0.156 -13.081 634 HG22 THR 82 1HG2 THR 82 -14.517 -0.425 -12.469 635 HG23 THR 82 2HG2 THR 82 -13.809 1.189 -12.411 636 H LYS 83 H LYS 83 -15.071 0.878 -17.236 637 HA LYS 83 HA LYS 83 -15.699 -1.706 -18.025 638 HB2 LYS 83 2HB LYS 83 -15.983 0.992 -19.220 639 HB3 LYS 83 3HB LYS 83 -16.126 -0.369 -20.325 640 HG2 LYS 83 2HG LYS 83 -17.875 -1.320 -18.847 641 HG3 LYS 83 3HG LYS 83 -17.783 0.143 -17.864 642 HD2 LYS 83 2HD LYS 83 -18.427 1.491 -19.793 643 HD3 LYS 83 3HD LYS 83 -18.481 0.043 -20.800 644 HE2 LYS 83 2HE LYS 83 -20.419 -0.718 -19.838 645 HE3 LYS 83 3HE LYS 83 -20.110 0.105 -18.309 646 HZ1 LYS 83 3HZ LYS 83 -20.385 2.133 -20.106 647 HZ2 LYS 83 1HZ LYS 83 -21.569 1.605 -19.019 648 HZ3 LYS 83 2HZ LYS 83 -21.554 1.017 -20.605 649 H THR 84 H THR 84 -13.281 0.509 -19.387 650 HA THR 84 HA THR 84 -12.404 -1.103 -21.488 651 HB THR 84 HB THR 84 -10.686 0.793 -19.878 652 HG1 THR 84 HG1 THR 84 -12.385 2.006 -20.568 653 HG21 THR 84 3HG2 THR 84 -9.682 -0.832 -21.632 654 HG22 THR 84 1HG2 THR 84 -9.239 0.873 -21.699 655 HG23 THR 84 2HG2 THR 84 -10.447 0.231 -22.812 656 H PHE 85 H PHE 85 -10.989 -0.759 -18.231 657 HA PHE 85 HA PHE 85 -8.983 -2.657 -18.477 658 HB2 PHE 85 2HB PHE 85 -9.472 -1.005 -16.552 659 HB3 PHE 85 3HB PHE 85 -10.504 -2.279 -15.910 660 HD1 PHE 85 HD2 PHE 85 -9.461 -4.540 -15.442 661 HD2 PHE 85 HD1 PHE 85 -7.168 -1.035 -16.199 662 HE1 PHE 85 HE2 PHE 85 -7.502 -5.600 -14.397 663 HE2 PHE 85 HE1 PHE 85 -5.205 -2.090 -15.156 664 HZ PHE 85 HZ PHE 85 -5.371 -4.375 -14.252 665 H LEU 86 H LEU 86 -12.323 -3.092 -17.350 666 HA LEU 86 HA LEU 86 -12.115 -5.848 -16.806 667 HB2 LEU 86 2HB LEU 86 -13.924 -4.623 -15.874 668 HB3 LEU 86 3HB LEU 86 -14.460 -4.084 -17.464 669 HG LEU 86 HG LEU 86 -14.962 -6.539 -17.944 670 HD11 LEU 86 1HD1 LEU 86 -14.358 -6.637 -15.017 671 HD12 LEU 86 2HD1 LEU 86 -13.874 -7.748 -16.298 672 HD13 LEU 86 3HD1 LEU 86 -15.542 -7.735 -15.726 673 HD21 LEU 86 3HD2 LEU 86 -17.096 -6.045 -17.496 674 HD22 LEU 86 1HD2 LEU 86 -16.475 -4.505 -16.903 675 HD23 LEU 86 2HD2 LEU 86 -16.781 -5.826 -15.774 676 H ALA 87 H ALA 87 -12.959 -4.060 -19.721 677 HA ALA 87 HA ALA 87 -13.612 -6.445 -21.207 678 HB1 ALA 87 1HB ALA 87 -14.831 -4.559 -21.871 679 HB2 ALA 87 2HB ALA 87 -13.392 -3.540 -21.931 680 HB3 ALA 87 3HB ALA 87 -13.639 -4.789 -23.151 681 H ALA 88 H ALA 88 -10.766 -5.200 -20.162 682 HA ALA 88 HA ALA 88 -9.272 -5.959 -22.576 683 HB1 ALA 88 1HB ALA 88 -8.728 -3.759 -21.761 684 HB2 ALA 88 2HB ALA 88 -8.408 -4.396 -20.147 685 HB3 ALA 88 3HB ALA 88 -7.353 -4.831 -21.492 686 H ALA 89 H ALA 89 -10.078 -7.007 -19.427 687 HA ALA 89 HA ALA 89 -7.972 -9.069 -19.543 688 HB1 ALA 89 1HB ALA 89 -8.847 -7.347 -17.374 689 HB2 ALA 89 2HB ALA 89 -8.873 -9.056 -16.935 690 HB3 ALA 89 3HB ALA 89 -7.384 -8.320 -17.528 691 H ASP 90 H ASP 90 -11.239 -8.502 -18.219 692 HA ASP 90 HA ASP 90 -11.913 -11.200 -17.894 693 HB2 ASP 90 2HB ASP 90 -13.205 -9.479 -16.800 694 HB3 ASP 90 3HB ASP 90 -13.670 -8.781 -18.349 695 H HIS 91 H HIS 91 -13.374 -9.066 -20.342 696 HA HIS 91 HA HIS 91 -14.282 -9.552 -22.384 697 HB2 HIS 91 2HB HIS 91 -11.638 -9.661 -22.590 698 HB3 HIS 91 3HB HIS 91 -11.972 -11.350 -22.964 699 HD1 HIS 91 HD1 HIS 91 -10.832 -9.210 -25.003 700 HD2 HIS 91 HD2 HIS 91 -14.779 -10.481 -24.738 701 HE1 HIS 91 HE1 HIS 91 -11.835 -8.762 -27.265 702 H ASP 92 H ASP 92 -14.828 -11.463 -20.143 703 HA ASP 92 HA ASP 92 -15.600 -13.777 -21.799 704 HB2 ASP 92 2HB ASP 92 -15.379 -15.207 -19.850 705 HB3 ASP 92 3HB ASP 92 -13.865 -14.346 -20.118 706 H GLY 93 H GLY 93 -16.647 -11.180 -19.929 707 HA2 GLY 93 2HA GLY 93 -18.828 -10.472 -19.572 708 HA3 GLY 93 3HA GLY 93 -19.398 -12.017 -20.186 709 H ASP 94 H ASP 94 -17.367 -11.017 -17.430 710 HA ASP 94 HA ASP 94 -19.214 -12.494 -15.673 711 HB2 ASP 94 2HB ASP 94 -16.198 -12.370 -15.449 712 HB3 ASP 94 3HB ASP 94 -17.275 -13.158 -14.300 713 H GLY 95 H GLY 95 -17.578 -9.598 -16.355 714 HA2 GLY 95 2HA GLY 95 -17.578 -7.553 -15.312 715 HA3 GLY 95 3HA GLY 95 -18.880 -8.167 -14.304 716 H LYS 96 H LYS 96 -16.094 -10.088 -14.184 717 HA LYS 96 HA LYS 96 -14.941 -8.630 -11.933 718 HB2 LYS 96 2HB LYS 96 -14.942 -10.692 -10.536 719 HB3 LYS 96 3HB LYS 96 -16.550 -10.047 -10.837 720 HG2 LYS 96 2HG LYS 96 -16.053 -11.876 -12.903 721 HG3 LYS 96 3HG LYS 96 -15.497 -12.646 -11.415 722 HD2 LYS 96 2HD LYS 96 -18.041 -11.284 -11.073 723 HD3 LYS 96 3HD LYS 96 -18.107 -12.524 -12.327 724 HE2 LYS 96 2HE LYS 96 -17.912 -14.199 -10.845 725 HE3 LYS 96 3HE LYS 96 -16.691 -13.348 -9.901 726 HZ1 LYS 96 3HZ LYS 96 -19.250 -12.125 -9.645 727 HZ2 LYS 96 1HZ LYS 96 -18.215 -12.710 -8.441 728 HZ3 LYS 96 2HZ LYS 96 -19.308 -13.755 -9.197 729 H ILE 97 H ILE 97 -12.774 -8.866 -11.768 730 HA ILE 97 HA ILE 97 -11.445 -10.390 -13.851 731 HB ILE 97 HB ILE 97 -10.317 -8.524 -11.761 732 HG12 ILE 97 2HG1 ILE 97 -11.780 -7.475 -13.488 733 HG13 ILE 97 3HG1 ILE 97 -10.110 -6.922 -13.561 734 HG21 ILE 97 1HG2 ILE 97 -9.052 -10.289 -13.753 735 HG22 ILE 97 2HG2 ILE 97 -8.425 -8.644 -13.672 736 HG23 ILE 97 3HG2 ILE 97 -8.424 -9.659 -12.230 737 HD11 ILE 97 3HD1 ILE 97 -11.680 -8.004 -15.625 738 HD12 ILE 97 1HD1 ILE 97 -9.986 -7.517 -15.682 739 HD13 ILE 97 2HD1 ILE 97 -10.414 -9.179 -15.271 740 H GLY 98 H GLY 98 -9.905 -12.000 -13.506 741 HA2 GLY 98 2HA GLY 98 -9.812 -13.101 -10.767 742 HA3 GLY 98 3HA GLY 98 -10.082 -14.134 -12.163 743 H ALA 99 H ALA 99 -8.103 -15.030 -10.832 744 HA ALA 99 HA ALA 99 -5.597 -13.745 -11.535 745 HB1 ALA 99 1HB ALA 99 -6.165 -16.303 -10.042 746 HB2 ALA 99 2HB ALA 99 -4.565 -15.597 -10.274 747 HB3 ALA 99 3HB ALA 99 -5.783 -14.732 -9.336 748 H GLU 100 H GLU 100 -7.662 -15.384 -13.328 749 HA GLU 100 HA GLU 100 -5.565 -16.876 -14.763 750 HB2 GLU 100 2HB GLU 100 -8.448 -17.525 -14.266 751 HB3 GLU 100 3HB GLU 100 -7.646 -18.150 -15.700 752 HG2 GLU 100 2HG GLU 100 -5.921 -19.155 -14.223 753 HG3 GLU 100 3HG GLU 100 -6.876 -18.641 -12.834 754 H GLU 101 H GLU 101 -7.521 -14.206 -14.848 755 HA GLU 101 HA GLU 101 -7.336 -14.071 -17.782 756 HB2 GLU 101 2HB GLU 101 -9.453 -12.698 -17.713 757 HB3 GLU 101 3HB GLU 101 -9.651 -14.408 -17.357 758 HG2 GLU 101 2HG GLU 101 -9.674 -13.880 -14.953 759 HG3 GLU 101 3HG GLU 101 -9.557 -12.166 -15.351 760 H PHE 102 H PHE 102 -6.165 -12.883 -15.019 761 HA PHE 102 HA PHE 102 -6.252 -10.058 -15.668 762 HB2 PHE 102 2HB PHE 102 -6.357 -10.710 -13.323 763 HB3 PHE 102 3HB PHE 102 -4.819 -11.555 -13.465 764 HD1 PHE 102 HD2 PHE 102 -6.357 -8.188 -13.766 765 HD2 PHE 102 HD1 PHE 102 -2.829 -10.449 -13.022 766 HE1 PHE 102 HE2 PHE 102 -5.172 -6.126 -13.141 767 HE2 PHE 102 HE1 PHE 102 -1.637 -8.390 -12.395 768 HZ PHE 102 HZ PHE 102 -2.808 -6.224 -12.455 769 H GLN 103 H GLN 103 -3.606 -12.378 -15.069 770 HA GLN 103 HA GLN 103 -1.519 -10.857 -16.032 771 HB2 GLN 103 2HB GLN 103 -0.362 -13.021 -16.470 772 HB3 GLN 103 3HB GLN 103 -1.097 -12.923 -14.875 773 HG2 GLN 103 2HG GLN 103 -3.085 -14.039 -16.413 774 HG3 GLN 103 3HG GLN 103 -1.614 -14.762 -17.061 775 HE21 GLN 103 1HE2 GLN 103 -2.492 -13.763 -13.780 776 HE22 GLN 103 2HE2 GLN 103 -2.257 -15.314 -13.057 777 H GLU 104 H GLU 104 -3.803 -12.852 -17.823 778 HA GLU 104 HA GLU 104 -2.559 -12.885 -20.308 779 HB2 GLU 104 2HB GLU 104 -4.649 -13.486 -21.224 780 HB3 GLU 104 3HB GLU 104 -4.665 -14.116 -19.582 781 HG2 GLU 104 2HG GLU 104 -6.700 -13.169 -19.541 782 HG3 GLU 104 3HG GLU 104 -5.778 -11.719 -19.147 783 H MET 105 H MET 105 -4.319 -10.339 -18.701 784 HA MET 105 HA MET 105 -4.505 -8.698 -21.074 785 HB2 MET 105 2HB MET 105 -5.813 -7.268 -19.832 786 HB3 MET 105 3HB MET 105 -6.090 -8.779 -18.976 787 HG2 MET 105 2HG MET 105 -5.571 -7.630 -17.145 788 HG3 MET 105 3HG MET 105 -3.902 -7.791 -17.685 789 HE1 MET 105 3HE MET 105 -6.475 -4.795 -19.477 790 HE2 MET 105 1HE MET 105 -7.061 -6.030 -18.362 791 HE3 MET 105 2HE MET 105 -6.774 -4.388 -17.786 792 H VAL 106 H VAL 106 -2.193 -9.319 -18.660 793 HA VAL 106 HA VAL 106 -0.899 -6.737 -18.795 794 HB VAL 106 HB VAL 106 0.242 -9.270 -17.622 795 HG11 VAL 106 1HG1 VAL 106 1.166 -6.575 -17.864 796 HG12 VAL 106 2HG1 VAL 106 0.936 -6.966 -16.158 797 HG13 VAL 106 3HG1 VAL 106 1.982 -7.972 -17.161 798 HG21 VAL 106 3HG2 VAL 106 -2.140 -8.183 -16.840 799 HG22 VAL 106 1HG2 VAL 106 -1.068 -9.131 -15.809 800 HG23 VAL 106 2HG2 VAL 106 -0.996 -7.369 -15.774 801 H GLN 107 H GLN 107 0.632 -9.906 -19.215 802 HA GLN 107 HA GLN 107 2.590 -8.941 -20.991 803 HB2 GLN 107 2HB GLN 107 1.641 -11.780 -20.566 804 HB3 GLN 107 3HB GLN 107 3.130 -11.314 -21.376 805 HG2 GLN 107 2HG GLN 107 4.218 -11.044 -19.456 806 HG3 GLN 107 3HG GLN 107 2.885 -10.153 -18.725 807 HE21 GLN 107 1HE2 GLN 107 0.950 -11.595 -18.192 808 HE22 GLN 107 2HE2 GLN 107 1.319 -13.092 -17.412 809 H SER 108 H SER 108 -0.550 -10.424 -21.512 810 HA SER 108 HA SER 108 -1.785 -10.811 -23.389 811 HB2 SER 108 2HB SER 108 -1.716 -8.346 -23.441 812 HB3 SER 108 3HB SER 108 -0.240 -8.411 -24.404 813 HG SER 108 HG SER 108 -1.402 -8.776 -26.112 Start of MODEL 10 1 H1 SER 1 H SER 1 2.353 1.264 -2.554 2 HA SER 1 HA SER 1 3.055 0.185 -0.673 3 HB2 SER 1 2HB SER 1 0.163 -0.656 -0.356 4 HB3 SER 1 3HB SER 1 1.412 -0.726 0.886 5 HG SER 1 HG SER 1 -0.138 1.352 0.143 6 H LEU 2 H LEU 2 3.086 -1.061 -3.266 7 HA LEU 2 HA LEU 2 2.604 -3.887 -2.683 8 HB2 LEU 2 2HB LEU 2 1.855 -2.793 -4.836 9 HB3 LEU 2 3HB LEU 2 3.560 -2.688 -5.271 10 HG LEU 2 HG LEU 2 3.729 -5.122 -5.238 11 HD11 LEU 2 1HD1 LEU 2 1.684 -6.483 -5.027 12 HD12 LEU 2 2HD1 LEU 2 0.793 -5.036 -4.558 13 HD13 LEU 2 3HD1 LEU 2 2.098 -5.638 -3.535 14 HD21 LEU 2 3HD2 LEU 2 1.785 -5.446 -7.052 15 HD22 LEU 2 1HD2 LEU 2 3.284 -4.580 -7.389 16 HD23 LEU 2 2HD2 LEU 2 1.821 -3.684 -6.978 17 H THR 3 H THR 3 5.180 -2.249 -4.510 18 HA THR 3 HA THR 3 7.419 -2.687 -4.655 19 HB THR 3 HB THR 3 8.435 -3.049 -2.221 20 HG1 THR 3 HG1 THR 3 6.956 -2.951 -0.722 21 HG21 THR 3 3HG2 THR 3 8.024 -0.892 -3.905 22 HG22 THR 3 1HG2 THR 3 9.041 -0.909 -2.464 23 HG23 THR 3 2HG2 THR 3 7.372 -0.346 -2.360 24 H ASP 4 H ASP 4 5.612 -5.009 -4.802 25 HA ASP 4 HA ASP 4 7.511 -7.091 -3.935 26 HB2 ASP 4 2HB ASP 4 5.020 -6.885 -2.956 27 HB3 ASP 4 3HB ASP 4 4.673 -7.832 -4.400 28 H ILE 5 H ILE 5 6.275 -5.497 -6.541 29 HA ILE 5 HA ILE 5 7.037 -7.684 -8.333 30 HB ILE 5 HB ILE 5 4.533 -6.036 -8.703 31 HG12 ILE 5 2HG1 ILE 5 3.620 -8.534 -8.651 32 HG13 ILE 5 3HG1 ILE 5 5.052 -8.782 -7.658 33 HG21 ILE 5 1HG2 ILE 5 6.086 -7.003 -10.677 34 HG22 ILE 5 2HG2 ILE 5 5.057 -8.402 -10.379 35 HG23 ILE 5 3HG2 ILE 5 4.334 -6.850 -10.798 36 HD11 ILE 5 3HD1 ILE 5 3.597 -8.264 -6.017 37 HD12 ILE 5 1HD1 ILE 5 4.071 -6.621 -6.446 38 HD13 ILE 5 2HD1 ILE 5 2.570 -7.300 -7.077 39 H LEU 6 H LEU 6 6.113 -4.257 -8.120 40 HA LEU 6 HA LEU 6 8.230 -3.664 -10.079 41 HB2 LEU 6 2HB LEU 6 5.453 -2.550 -9.865 42 HB3 LEU 6 3HB LEU 6 6.743 -1.652 -10.664 43 HG LEU 6 HG LEU 6 6.113 -4.445 -11.531 44 HD11 LEU 6 1HD1 LEU 6 4.159 -3.936 -12.459 45 HD12 LEU 6 2HD1 LEU 6 4.784 -2.424 -13.118 46 HD13 LEU 6 3HD1 LEU 6 4.163 -2.477 -11.468 47 HD21 LEU 6 3HD2 LEU 6 7.726 -2.210 -12.434 48 HD22 LEU 6 1HD2 LEU 6 6.655 -2.815 -13.698 49 HD23 LEU 6 2HD2 LEU 6 7.785 -3.910 -12.902 50 H SER 7 H SER 7 9.155 -1.504 -9.896 51 HA SER 7 HA SER 7 9.685 -0.839 -7.161 52 HB2 SER 7 2HB SER 7 10.926 -0.380 -9.686 53 HB3 SER 7 3HB SER 7 10.675 1.185 -8.914 54 HG SER 7 HG SER 7 12.460 -0.748 -8.314 55 HA PRO 8 HA PRO 8 6.861 2.437 -6.435 56 HB2 PRO 8 2HB PRO 8 8.381 4.238 -5.087 57 HB3 PRO 8 3HB PRO 8 7.849 2.709 -4.378 58 HG2 PRO 8 2HG PRO 8 10.492 3.415 -5.595 59 HG3 PRO 8 3HG PRO 8 10.151 2.499 -4.116 60 HD2 PRO 8 2HD PRO 8 10.799 1.300 -6.456 61 HD3 PRO 8 3HD PRO 8 9.704 0.556 -5.272 62 H SER 9 H SER 9 10.027 3.743 -7.443 63 HA SER 9 HA SER 9 9.168 6.196 -8.399 64 HB2 SER 9 2HB SER 9 11.208 6.127 -9.856 65 HB3 SER 9 3HB SER 9 11.525 5.730 -8.167 66 HG SER 9 HG SER 9 11.664 4.132 -10.428 67 H ASP 10 H ASP 10 9.430 3.112 -10.138 68 HA ASP 10 HA ASP 10 8.649 4.036 -12.661 69 HB2 ASP 10 2HB ASP 10 8.369 1.327 -11.356 70 HB3 ASP 10 3HB ASP 10 7.949 1.629 -13.040 71 H ILE 11 H ILE 11 6.762 3.070 -9.864 72 HA ILE 11 HA ILE 11 4.249 3.082 -11.242 73 HB ILE 11 HB ILE 11 4.881 3.135 -8.290 74 HG12 ILE 11 2HG1 ILE 11 3.671 0.823 -9.753 75 HG13 ILE 11 3HG1 ILE 11 5.404 1.102 -9.886 76 HG21 ILE 11 1HG2 ILE 11 2.716 4.110 -8.601 77 HG22 ILE 11 2HG2 ILE 11 2.246 2.828 -9.717 78 HG23 ILE 11 3HG2 ILE 11 2.500 2.462 -8.011 79 HD11 ILE 11 3HD1 ILE 11 3.843 0.618 -7.362 80 HD12 ILE 11 1HD1 ILE 11 4.977 -0.485 -8.142 81 HD13 ILE 11 2HD1 ILE 11 5.559 1.017 -7.423 82 H ALA 12 H ALA 12 5.751 5.261 -8.853 83 HA ALA 12 HA ALA 12 3.771 7.215 -8.824 84 HB1 ALA 12 1HB ALA 12 6.279 8.504 -8.534 85 HB2 ALA 12 2HB ALA 12 5.136 8.028 -7.278 86 HB3 ALA 12 3HB ALA 12 6.399 6.909 -7.791 87 H ALA 13 H ALA 13 6.112 6.471 -11.240 88 HA ALA 13 HA ALA 13 5.986 9.044 -12.543 89 HB1 ALA 13 1HB ALA 13 7.505 6.565 -12.868 90 HB2 ALA 13 2HB ALA 13 7.083 7.358 -14.386 91 HB3 ALA 13 3HB ALA 13 7.985 8.238 -13.152 92 H ALA 14 H ALA 14 4.261 6.057 -12.650 93 HA ALA 14 HA ALA 14 3.035 6.689 -15.225 94 HB1 ALA 14 1HB ALA 14 2.185 4.335 -13.622 95 HB2 ALA 14 2HB ALA 14 2.390 4.504 -15.366 96 HB3 ALA 14 3HB ALA 14 3.803 4.327 -14.325 97 H LEU 15 H LEU 15 2.354 6.759 -11.819 98 HA LEU 15 HA LEU 15 -0.477 6.905 -12.002 99 HB2 LEU 15 2HB LEU 15 1.506 7.653 -9.877 100 HB3 LEU 15 3HB LEU 15 -0.220 7.948 -9.678 101 HG LEU 15 HG LEU 15 1.113 5.263 -10.022 102 HD11 LEU 15 1HD1 LEU 15 1.393 5.383 -7.823 103 HD12 LEU 15 2HD1 LEU 15 -0.363 5.355 -7.666 104 HD13 LEU 15 3HD1 LEU 15 0.492 6.897 -7.727 105 HD21 LEU 15 3HD2 LEU 15 -1.172 4.385 -9.541 106 HD22 LEU 15 1HD2 LEU 15 -1.020 5.188 -11.104 107 HD23 LEU 15 2HD2 LEU 15 -1.792 6.023 -9.755 108 H ARG 16 H ARG 16 2.018 9.402 -11.507 109 HA ARG 16 HA ARG 16 0.161 11.560 -11.687 110 HB2 ARG 16 2HB ARG 16 3.160 11.656 -12.043 111 HB3 ARG 16 3HB ARG 16 2.103 13.000 -11.637 112 HG2 ARG 16 2HG ARG 16 1.502 11.635 -9.549 113 HG3 ARG 16 3HG ARG 16 2.943 10.691 -9.931 114 HD2 ARG 16 2HD ARG 16 4.349 12.592 -9.722 115 HD3 ARG 16 3HD ARG 16 2.968 13.688 -9.671 116 HE ARG 16 HE ARG 16 2.711 13.221 -7.436 117 HH11 ARG 16 1HH1 ARG 16 4.921 10.939 -8.861 118 HH12 ARG 16 2HH1 ARG 16 5.414 10.269 -7.341 119 HH21 ARG 16 1HH2 ARG 16 3.352 12.347 -5.429 120 HH22 ARG 16 2HH2 ARG 16 4.520 11.070 -5.390 121 H ASP 17 H ASP 17 2.007 9.728 -13.973 122 HA ASP 17 HA ASP 17 2.202 11.493 -16.106 123 HB2 ASP 17 2HB ASP 17 3.339 9.468 -16.382 124 HB3 ASP 17 3HB ASP 17 1.929 8.507 -15.942 125 H CYS 18 H CYS 18 -0.448 9.253 -15.325 126 HA CYS 18 HA CYS 18 -2.232 10.948 -16.933 127 HB2 CYS 18 2HB CYS 18 -2.162 7.925 -16.901 128 HB3 CYS 18 3HB CYS 18 -3.440 8.880 -17.642 129 HG CYS 18 HG CYS 18 -0.621 7.893 -18.943 130 H GLN 19 H GLN 19 -1.823 11.085 -14.141 131 HA GLN 19 HA GLN 19 -3.528 9.630 -12.535 132 HB2 GLN 19 2HB GLN 19 -3.649 11.778 -11.143 133 HB3 GLN 19 3HB GLN 19 -2.056 11.093 -11.439 134 HG2 GLN 19 2HG GLN 19 -1.522 12.742 -13.022 135 HG3 GLN 19 3HG GLN 19 -3.199 13.270 -13.155 136 HE21 GLN 19 1HE2 GLN 19 -1.025 12.693 -10.411 137 HE22 GLN 19 2HE2 GLN 19 -1.225 14.256 -9.704 138 H ALA 20 H ALA 20 -4.260 12.348 -14.642 139 HA ALA 20 HA ALA 20 -6.796 13.030 -13.792 140 HB1 ALA 20 1HB ALA 20 -7.203 13.836 -16.051 141 HB2 ALA 20 2HB ALA 20 -5.567 14.241 -15.530 142 HB3 ALA 20 3HB ALA 20 -5.831 12.901 -16.647 143 HA PRO 21 HA PRO 21 -9.451 9.629 -14.610 144 HB2 PRO 21 2HB PRO 21 -11.757 10.915 -15.240 145 HB3 PRO 21 3HB PRO 21 -11.115 10.844 -13.594 146 HG2 PRO 21 2HG PRO 21 -10.917 13.047 -15.611 147 HG3 PRO 21 3HG PRO 21 -11.259 13.148 -13.874 148 HD2 PRO 21 2HD PRO 21 -8.812 13.666 -14.909 149 HD3 PRO 21 3HD PRO 21 -9.036 12.957 -13.297 150 H ASP 22 H ASP 22 -10.316 8.394 -16.266 151 HA ASP 22 HA ASP 22 -10.283 7.584 -18.411 152 HB2 ASP 22 2HB ASP 22 -11.793 8.733 -19.889 153 HB3 ASP 22 3HB ASP 22 -12.415 8.889 -18.248 154 H SER 23 H SER 23 -7.868 8.955 -17.679 155 HA SER 23 HA SER 23 -7.076 10.115 -20.269 156 HB2 SER 23 2HB SER 23 -6.011 10.592 -17.483 157 HB3 SER 23 3HB SER 23 -5.154 11.113 -18.933 158 HG SER 23 HG SER 23 -7.155 12.246 -19.481 159 H PHE 24 H PHE 24 -6.482 7.632 -17.938 160 HA PHE 24 HA PHE 24 -4.085 6.759 -19.395 161 HB2 PHE 24 2HB PHE 24 -3.365 5.668 -17.476 162 HB3 PHE 24 3HB PHE 24 -4.187 7.072 -16.803 163 HD1 PHE 24 HD2 PHE 24 -6.339 6.840 -15.691 164 HD2 PHE 24 HD1 PHE 24 -4.257 3.455 -17.215 165 HE1 PHE 24 HE2 PHE 24 -7.780 5.358 -14.357 166 HE2 PHE 24 HE1 PHE 24 -5.695 1.967 -15.884 167 HZ PHE 24 HZ PHE 24 -7.459 2.918 -14.452 168 H SER 25 H SER 25 -3.857 4.283 -19.445 169 HA SER 25 HA SER 25 -6.441 3.008 -20.023 170 HB2 SER 25 2HB SER 25 -4.402 3.709 -21.938 171 HB3 SER 25 3HB SER 25 -4.599 1.957 -21.880 172 HG SER 25 HG SER 25 -6.579 3.917 -22.391 173 HA PRO 26 HA PRO 26 -4.923 -0.529 -17.921 174 HB2 PRO 26 2HB PRO 26 -5.879 -2.580 -19.422 175 HB3 PRO 26 3HB PRO 26 -6.914 -1.567 -18.409 176 HG2 PRO 26 2HG PRO 26 -6.420 -1.418 -21.357 177 HG3 PRO 26 3HG PRO 26 -7.948 -1.269 -20.470 178 HD2 PRO 26 2HD PRO 26 -6.584 0.880 -21.393 179 HD3 PRO 26 3HD PRO 26 -7.551 0.930 -19.905 180 H LYS 27 H LYS 27 -3.898 0.133 -21.098 181 HA LYS 27 HA LYS 27 -1.751 -1.874 -20.871 182 HB2 LYS 27 2HB LYS 27 -2.314 -0.722 -23.533 183 HB3 LYS 27 3HB LYS 27 -1.892 -2.369 -23.084 184 HG2 LYS 27 2HG LYS 27 -4.605 -1.112 -22.729 185 HG3 LYS 27 3HG LYS 27 -4.143 -2.203 -24.037 186 HD2 LYS 27 2HD LYS 27 -3.393 -3.600 -21.797 187 HD3 LYS 27 3HD LYS 27 -4.868 -2.789 -21.267 188 HE2 LYS 27 2HE LYS 27 -5.387 -4.967 -22.208 189 HE3 LYS 27 3HE LYS 27 -6.050 -3.686 -23.221 190 HZ1 LYS 27 3HZ LYS 27 -4.738 -4.250 -24.927 191 HZ2 LYS 27 1HZ LYS 27 -4.580 -5.734 -24.131 192 HZ3 LYS 27 2HZ LYS 27 -3.390 -4.546 -23.949 193 H LYS 28 H LYS 28 -2.350 1.279 -20.445 194 HA LYS 28 HA LYS 28 0.167 2.209 -21.638 195 HB2 LYS 28 2HB LYS 28 -2.257 3.668 -20.598 196 HB3 LYS 28 3HB LYS 28 -0.746 4.496 -20.952 197 HG2 LYS 28 2HG LYS 28 -2.250 2.840 -22.963 198 HG3 LYS 28 3HG LYS 28 -2.455 4.583 -22.770 199 HD2 LYS 28 2HD LYS 28 0.012 4.820 -23.160 200 HD3 LYS 28 3HD LYS 28 0.047 3.104 -23.571 201 HE2 LYS 28 2HE LYS 28 -0.106 4.345 -25.607 202 HE3 LYS 28 3HE LYS 28 -1.664 3.568 -25.328 203 HZ1 LYS 28 3HZ LYS 28 -1.756 5.948 -26.053 204 HZ2 LYS 28 1HZ LYS 28 -1.101 6.372 -24.552 205 HZ3 LYS 28 2HZ LYS 28 -2.605 5.602 -24.632 206 H PHE 29 H PHE 29 -0.650 0.751 -18.927 207 HA PHE 29 HA PHE 29 0.906 2.512 -17.159 208 HB2 PHE 29 2HB PHE 29 -1.280 1.983 -16.266 209 HB3 PHE 29 3HB PHE 29 -1.007 0.261 -16.513 210 HD1 PHE 29 HD1 PHE 29 1.429 2.685 -15.152 211 HD2 PHE 29 HD2 PHE 29 -1.243 -0.519 -14.310 212 HE1 PHE 29 HE1 PHE 29 2.358 2.512 -12.880 213 HE2 PHE 29 HE2 PHE 29 -0.319 -0.697 -12.037 214 HZ PHE 29 HZ PHE 29 1.483 0.821 -11.319 215 H PHE 30 H PHE 30 0.799 -0.629 -18.643 216 HA PHE 30 HA PHE 30 2.862 -1.798 -17.042 217 HB2 PHE 30 2HB PHE 30 2.574 -3.701 -18.314 218 HB3 PHE 30 3HB PHE 30 1.012 -2.923 -18.547 219 HD1 PHE 30 HD1 PHE 30 4.260 -3.665 -20.094 220 HD2 PHE 30 HD2 PHE 30 0.353 -2.080 -20.678 221 HE1 PHE 30 HE1 PHE 30 4.609 -3.710 -22.529 222 HE2 PHE 30 HE2 PHE 30 0.695 -2.123 -23.114 223 HZ PHE 30 HZ PHE 30 2.825 -2.940 -24.043 224 H GLN 31 H GLN 31 2.899 0.567 -19.387 225 HA GLN 31 HA GLN 31 5.465 -0.156 -20.540 226 HB2 GLN 31 2HB GLN 31 4.177 2.506 -20.973 227 HB3 GLN 31 3HB GLN 31 5.122 1.529 -22.089 228 HG2 GLN 31 2HG GLN 31 3.232 -0.059 -22.231 229 HG3 GLN 31 3HG GLN 31 2.289 1.024 -21.208 230 HE21 GLN 31 1HE2 GLN 31 2.534 3.422 -22.089 231 HE22 GLN 31 2HE2 GLN 31 2.146 3.583 -23.764 232 H ILE 32 H ILE 32 4.118 2.236 -18.320 233 HA ILE 32 HA ILE 32 6.710 3.471 -17.903 234 HB ILE 32 HB ILE 32 4.073 3.993 -16.525 235 HG12 ILE 32 2HG1 ILE 32 4.812 6.188 -18.094 236 HG13 ILE 32 3HG1 ILE 32 5.140 4.784 -19.104 237 HG21 ILE 32 1HG2 ILE 32 5.722 4.757 -15.055 238 HG22 ILE 32 2HG2 ILE 32 6.754 5.327 -16.366 239 HG23 ILE 32 3HG2 ILE 32 5.268 6.191 -15.975 240 HD11 ILE 32 3HD1 ILE 32 2.542 4.832 -17.704 241 HD12 ILE 32 1HD1 ILE 32 2.771 5.993 -19.012 242 HD13 ILE 32 2HD1 ILE 32 2.955 4.266 -19.322 243 H SER 33 H SER 33 4.724 1.047 -16.452 244 HA SER 33 HA SER 33 6.289 1.079 -13.980 245 HB2 SER 33 2HB SER 33 4.638 -0.442 -13.087 246 HB3 SER 33 3HB SER 33 3.792 0.884 -13.883 247 HG SER 33 HG SER 33 2.811 -0.687 -14.886 248 H GLY 34 H GLY 34 5.107 -1.461 -16.199 249 HA2 GLY 34 2HA GLY 34 6.807 -2.826 -17.359 250 HA3 GLY 34 3HA GLY 34 7.722 -2.796 -15.859 251 H MET 35 H MET 35 4.251 -3.338 -16.327 252 HA MET 35 HA MET 35 4.284 -5.604 -14.591 253 HB2 MET 35 2HB MET 35 2.040 -4.852 -16.455 254 HB3 MET 35 3HB MET 35 1.936 -5.704 -14.920 255 HG2 MET 35 2HG MET 35 2.702 -3.624 -13.790 256 HG3 MET 35 3HG MET 35 2.594 -2.802 -15.345 257 HE1 MET 35 3HE MET 35 -1.017 -4.627 -13.126 258 HE2 MET 35 1HE MET 35 0.307 -5.581 -13.795 259 HE3 MET 35 2HE MET 35 0.595 -4.517 -12.418 260 H SER 36 H SER 36 3.695 -5.214 -18.082 261 HA SER 36 HA SER 36 3.310 -7.876 -18.740 262 HB2 SER 36 2HB SER 36 3.752 -7.268 -20.996 263 HB3 SER 36 3HB SER 36 3.057 -5.833 -20.243 264 HG SER 36 HG SER 36 5.348 -6.010 -21.500 265 H LYS 37 H LYS 37 6.282 -6.127 -18.137 266 HA LYS 37 HA LYS 37 8.080 -8.037 -19.182 267 HB2 LYS 37 2HB LYS 37 8.701 -6.234 -16.853 268 HB3 LYS 37 3HB LYS 37 9.789 -6.814 -18.107 269 HG2 LYS 37 2HG LYS 37 7.622 -4.748 -18.370 270 HG3 LYS 37 3HG LYS 37 9.365 -4.516 -18.525 271 HD2 LYS 37 2HD LYS 37 8.756 -6.503 -20.373 272 HD3 LYS 37 3HD LYS 37 7.425 -5.351 -20.507 273 HE2 LYS 37 2HE LYS 37 9.067 -4.621 -22.035 274 HE3 LYS 37 3HE LYS 37 9.185 -3.539 -20.648 275 HZ1 LYS 37 3HZ LYS 37 11.297 -4.662 -21.719 276 HZ2 LYS 37 1HZ LYS 37 10.887 -5.914 -20.657 277 HZ3 LYS 37 2HZ LYS 37 11.199 -4.363 -20.057 278 H LYS 38 H LYS 38 6.081 -8.101 -16.449 279 HA LYS 38 HA LYS 38 7.759 -9.910 -14.920 280 HB2 LYS 38 2HB LYS 38 4.887 -9.169 -14.370 281 HB3 LYS 38 3HB LYS 38 6.062 -9.822 -13.237 282 HG2 LYS 38 2HG LYS 38 6.235 -7.111 -14.537 283 HG3 LYS 38 3HG LYS 38 5.645 -7.425 -12.903 284 HD2 LYS 38 2HD LYS 38 7.734 -7.297 -12.156 285 HD3 LYS 38 3HD LYS 38 8.149 -8.707 -13.133 286 HE2 LYS 38 2HE LYS 38 8.460 -7.101 -15.067 287 HE3 LYS 38 3HE LYS 38 8.353 -5.799 -13.882 288 HZ1 LYS 38 3HZ LYS 38 10.361 -6.315 -12.994 289 HZ2 LYS 38 1HZ LYS 38 10.644 -6.862 -14.570 290 HZ3 LYS 38 2HZ LYS 38 10.243 -7.964 -13.352 291 H SER 39 H SER 39 5.839 -11.635 -13.877 292 HA SER 39 HA SER 39 5.084 -13.224 -16.243 293 HB2 SER 39 2HB SER 39 7.042 -14.050 -14.754 294 HB3 SER 39 3HB SER 39 5.781 -14.469 -13.595 295 HG SER 39 HG SER 39 6.545 -15.785 -15.805 296 H SER 40 H SER 40 3.239 -14.617 -15.997 297 HA SER 40 HA SER 40 0.976 -13.417 -15.021 298 HB2 SER 40 2HB SER 40 0.424 -16.149 -14.803 299 HB3 SER 40 3HB SER 40 0.168 -15.133 -16.222 300 HG SER 40 HG SER 40 1.945 -17.122 -15.857 301 H SER 41 H SER 41 3.267 -15.416 -13.308 302 HA SER 41 HA SER 41 1.650 -15.892 -11.015 303 HB2 SER 41 2HB SER 41 3.849 -16.500 -9.939 304 HB3 SER 41 3HB SER 41 3.493 -17.373 -11.429 305 HG SER 41 HG SER 41 5.345 -16.650 -12.086 306 H GLN 42 H GLN 42 4.147 -13.506 -11.804 307 HA GLN 42 HA GLN 42 4.073 -12.228 -9.259 308 HB2 GLN 42 2HB GLN 42 5.397 -11.783 -11.854 309 HB3 GLN 42 3HB GLN 42 5.086 -10.325 -10.921 310 HG2 GLN 42 2HG GLN 42 6.243 -11.378 -8.995 311 HG3 GLN 42 3HG GLN 42 6.656 -12.735 -10.041 312 HE21 GLN 42 1HE2 GLN 42 6.925 -9.213 -9.823 313 HE22 GLN 42 2HE2 GLN 42 8.474 -9.109 -10.580 314 H LEU 43 H LEU 43 2.377 -11.790 -12.291 315 HA LEU 43 HA LEU 43 1.249 -9.252 -11.641 316 HB2 LEU 43 2HB LEU 43 0.228 -11.296 -13.606 317 HB3 LEU 43 3HB LEU 43 -0.151 -9.575 -13.575 318 HG LEU 43 HG LEU 43 2.670 -10.500 -13.974 319 HD11 LEU 43 1HD1 LEU 43 0.417 -10.610 -15.916 320 HD12 LEU 43 2HD1 LEU 43 1.800 -11.687 -15.727 321 HD13 LEU 43 3HD1 LEU 43 2.009 -10.108 -16.484 322 HD21 LEU 43 3HD2 LEU 43 1.080 -8.018 -14.413 323 HD22 LEU 43 1HD2 LEU 43 2.471 -8.340 -15.448 324 HD23 LEU 43 2HD2 LEU 43 2.681 -8.223 -13.700 325 H LYS 44 H LYS 44 0.567 -12.448 -10.690 326 HA LYS 44 HA LYS 44 -2.234 -12.172 -10.228 327 HB2 LYS 44 2HB LYS 44 -0.127 -14.149 -9.482 328 HB3 LYS 44 3HB LYS 44 -1.639 -14.168 -8.584 329 HG2 LYS 44 2HG LYS 44 -2.896 -14.670 -10.509 330 HG3 LYS 44 3HG LYS 44 -1.551 -14.278 -11.583 331 HD2 LYS 44 2HD LYS 44 -1.853 -16.694 -11.396 332 HD3 LYS 44 3HD LYS 44 -0.301 -16.196 -10.720 333 HE2 LYS 44 2HE LYS 44 -2.527 -16.253 -8.805 334 HE3 LYS 44 3HE LYS 44 -2.087 -17.823 -9.473 335 HZ1 LYS 44 3HZ LYS 44 -0.249 -17.872 -8.252 336 HZ2 LYS 44 1HZ LYS 44 -0.845 -16.533 -7.407 337 HZ3 LYS 44 2HZ LYS 44 0.208 -16.309 -8.711 338 H GLU 45 H GLU 45 0.657 -11.520 -8.364 339 HA GLU 45 HA GLU 45 -0.399 -11.338 -5.804 340 HB2 GLU 45 2HB GLU 45 1.905 -10.069 -7.206 341 HB3 GLU 45 3HB GLU 45 1.433 -9.422 -5.641 342 HG2 GLU 45 2HG GLU 45 2.078 -12.315 -6.155 343 HG3 GLU 45 3HG GLU 45 3.228 -11.129 -5.540 344 H ILE 46 H ILE 46 -0.179 -8.816 -8.299 345 HA ILE 46 HA ILE 46 -1.228 -6.687 -6.877 346 HB ILE 46 HB ILE 46 -1.697 -7.289 -9.799 347 HG12 ILE 46 2HG1 ILE 46 0.326 -5.309 -9.239 348 HG13 ILE 46 3HG1 ILE 46 0.714 -6.820 -8.423 349 HG21 ILE 46 1HG2 ILE 46 -3.077 -5.521 -9.556 350 HG22 ILE 46 2HG2 ILE 46 -2.296 -4.980 -8.071 351 HG23 ILE 46 3HG2 ILE 46 -1.570 -4.607 -9.634 352 HD11 ILE 46 3HD1 ILE 46 -0.138 -7.293 -11.134 353 HD12 ILE 46 1HD1 ILE 46 1.215 -6.165 -11.070 354 HD13 ILE 46 2HD1 ILE 46 1.357 -7.756 -10.322 355 H PHE 47 H PHE 47 -2.943 -9.207 -8.687 356 HA PHE 47 HA PHE 47 -5.529 -8.228 -8.491 357 HB2 PHE 47 2HB PHE 47 -5.581 -10.074 -9.806 358 HB3 PHE 47 3HB PHE 47 -4.294 -10.873 -8.908 359 HD1 PHE 47 HD1 PHE 47 -4.797 -12.234 -6.958 360 HD2 PHE 47 HD2 PHE 47 -7.890 -10.390 -9.227 361 HE1 PHE 47 HE1 PHE 47 -6.455 -13.700 -5.882 362 HE2 PHE 47 HE2 PHE 47 -9.553 -11.852 -8.154 363 HZ PHE 47 HZ PHE 47 -8.837 -13.509 -6.479 364 H ARG 48 H ARG 48 -3.630 -10.042 -6.142 365 HA ARG 48 HA ARG 48 -5.716 -10.521 -4.300 366 HB2 ARG 48 2HB ARG 48 -2.941 -11.059 -4.478 367 HB3 ARG 48 3HB ARG 48 -3.204 -10.228 -2.951 368 HG2 ARG 48 2HG ARG 48 -4.714 -12.671 -3.852 369 HG3 ARG 48 3HG ARG 48 -3.321 -12.686 -2.769 370 HD2 ARG 48 2HD ARG 48 -5.506 -10.857 -2.021 371 HD3 ARG 48 3HD ARG 48 -5.887 -12.576 -1.936 372 HE ARG 48 HE ARG 48 -3.432 -12.177 -0.673 373 HH11 ARG 48 1HH1 ARG 48 -6.780 -11.323 -0.246 374 HH12 ARG 48 2HH1 ARG 48 -6.673 -11.238 1.481 375 HH21 ARG 48 1HH2 ARG 48 -3.279 -12.068 1.600 376 HH22 ARG 48 2HH2 ARG 48 -4.681 -11.661 2.530 377 H ILE 49 H ILE 49 -4.119 -7.673 -5.175 378 HA ILE 49 HA ILE 49 -4.687 -6.364 -2.615 379 HB ILE 49 HB ILE 49 -3.300 -5.152 -5.002 380 HG12 ILE 49 2HG1 ILE 49 -2.042 -7.117 -4.301 381 HG13 ILE 49 3HG1 ILE 49 -1.183 -5.656 -3.826 382 HG21 ILE 49 1HG2 ILE 49 -2.306 -3.912 -2.826 383 HG22 ILE 49 2HG2 ILE 49 -3.703 -3.335 -3.732 384 HG23 ILE 49 3HG2 ILE 49 -3.936 -4.281 -2.263 385 HD11 ILE 49 3HD1 ILE 49 -2.767 -7.511 -2.075 386 HD12 ILE 49 1HD1 ILE 49 -1.035 -7.182 -2.026 387 HD13 ILE 49 2HD1 ILE 49 -2.184 -5.933 -1.546 388 H LEU 50 H LEU 50 -6.006 -6.795 -5.705 389 HA LEU 50 HA LEU 50 -7.497 -4.291 -5.672 390 HB2 LEU 50 2HB LEU 50 -6.972 -6.433 -7.644 391 HB3 LEU 50 3HB LEU 50 -8.520 -5.600 -7.773 392 HG LEU 50 HG LEU 50 -6.807 -3.497 -7.608 393 HD11 LEU 50 1HD1 LEU 50 -5.384 -5.509 -9.330 394 HD12 LEU 50 2HD1 LEU 50 -4.903 -5.152 -7.672 395 HD13 LEU 50 3HD1 LEU 50 -4.864 -3.881 -8.893 396 HD21 LEU 50 3HD2 LEU 50 -6.930 -3.988 -10.314 397 HD22 LEU 50 1HD2 LEU 50 -8.156 -3.160 -9.353 398 HD23 LEU 50 2HD2 LEU 50 -8.308 -4.887 -9.678 399 H ASP 51 H ASP 51 -7.892 -7.636 -4.890 400 HA ASP 51 HA ASP 51 -10.735 -7.720 -4.993 401 HB2 ASP 51 2HB ASP 51 -9.223 -9.727 -5.035 402 HB3 ASP 51 3HB ASP 51 -8.908 -9.457 -3.324 403 H ASN 52 H ASN 52 -11.749 -6.150 -3.848 404 HA ASN 52 HA ASN 52 -10.965 -5.648 -1.083 405 HB2 ASN 52 2HB ASN 52 -12.366 -4.156 -3.169 406 HB3 ASN 52 3HB ASN 52 -13.164 -4.053 -1.603 407 HD21 ASN 52 1HD2 ASN 52 -9.806 -4.087 -2.761 408 HD22 ASN 52 2HD2 ASN 52 -9.310 -2.691 -1.872 409 H ASP 53 H ASP 53 -12.671 -7.963 -2.439 410 HA ASP 53 HA ASP 53 -14.689 -8.006 -0.293 411 HB2 ASP 53 2HB ASP 53 -15.143 -9.417 -2.900 412 HB3 ASP 53 3HB ASP 53 -16.323 -8.858 -1.718 413 H GLN 54 H GLN 54 -12.036 -9.506 -1.731 414 HA GLN 54 HA GLN 54 -10.946 -11.468 -1.366 415 HB2 GLN 54 2HB GLN 54 -12.727 -11.852 1.034 416 HB3 GLN 54 3HB GLN 54 -11.091 -12.449 0.793 417 HG2 GLN 54 2HG GLN 54 -11.724 -9.520 0.927 418 HG3 GLN 54 3HG GLN 54 -11.388 -10.485 2.364 419 HE21 GLN 54 1HE2 GLN 54 -10.052 -8.504 0.110 420 HE22 GLN 54 2HE2 GLN 54 -8.397 -8.980 0.250 421 H SER 55 H SER 55 -13.745 -11.330 -2.661 422 HA SER 55 HA SER 55 -14.888 -13.915 -2.234 423 HB2 SER 55 2HB SER 55 -16.003 -13.194 -4.557 424 HB3 SER 55 3HB SER 55 -16.519 -12.509 -3.017 425 HG SER 55 HG SER 55 -16.145 -10.782 -4.300 426 H GLY 56 H GLY 56 -12.482 -12.589 -4.370 427 HA2 GLY 56 2HA GLY 56 -10.909 -14.412 -5.141 428 HA3 GLY 56 3HA GLY 56 -12.352 -15.174 -5.793 429 H PHE 57 H PHE 57 -13.297 -12.314 -6.431 430 HA PHE 57 HA PHE 57 -11.601 -11.879 -8.795 431 HB2 PHE 57 2HB PHE 57 -14.619 -11.699 -8.783 432 HB3 PHE 57 3HB PHE 57 -13.555 -11.506 -10.172 433 HD1 PHE 57 HD1 PHE 57 -14.910 -13.921 -7.746 434 HD2 PHE 57 HD2 PHE 57 -12.718 -13.383 -11.355 435 HE1 PHE 57 HE1 PHE 57 -15.094 -16.330 -8.213 436 HE2 PHE 57 HE2 PHE 57 -12.899 -15.791 -11.828 437 HZ PHE 57 HZ PHE 57 -14.089 -17.268 -10.256 438 H ILE 58 H ILE 58 -12.169 -9.698 -9.846 439 HA ILE 58 HA ILE 58 -12.516 -7.704 -7.703 440 HB ILE 58 HB ILE 58 -10.914 -7.394 -10.244 441 HG12 ILE 58 2HG1 ILE 58 -9.701 -7.428 -7.512 442 HG13 ILE 58 3HG1 ILE 58 -10.114 -8.961 -8.271 443 HG21 ILE 58 1HG2 ILE 58 -11.997 -5.345 -9.209 444 HG22 ILE 58 2HG2 ILE 58 -10.914 -5.592 -7.840 445 HG23 ILE 58 3HG2 ILE 58 -10.251 -5.280 -9.444 446 HD11 ILE 58 3HD1 ILE 58 -7.763 -8.245 -8.605 447 HD12 ILE 58 1HD1 ILE 58 -8.652 -8.523 -10.103 448 HD13 ILE 58 2HD1 ILE 58 -8.362 -6.876 -9.541 449 H GLU 59 H GLU 59 -14.830 -7.840 -8.168 450 HA GLU 59 HA GLU 59 -16.054 -7.318 -10.585 451 HB2 GLU 59 2HB GLU 59 -17.061 -6.206 -7.972 452 HB3 GLU 59 3HB GLU 59 -18.003 -6.726 -9.361 453 HG2 GLU 59 2HG GLU 59 -18.260 -8.679 -8.360 454 HG3 GLU 59 3HG GLU 59 -16.540 -8.970 -8.612 455 H GLU 60 H GLU 60 -17.298 -5.272 -11.133 456 HA GLU 60 HA GLU 60 -15.470 -3.189 -11.627 457 HB2 GLU 60 2HB GLU 60 -18.452 -3.435 -11.909 458 HB3 GLU 60 3HB GLU 60 -17.637 -1.914 -12.243 459 HG2 GLU 60 2HG GLU 60 -16.554 -2.741 -14.096 460 HG3 GLU 60 3HG GLU 60 -16.676 -4.413 -13.551 461 H ASP 61 H ASP 61 -17.725 -3.769 -9.043 462 HA ASP 61 HA ASP 61 -17.918 -1.151 -8.025 463 HB2 ASP 61 2HB ASP 61 -19.356 -3.144 -7.403 464 HB3 ASP 61 3HB ASP 61 -18.024 -3.682 -6.383 465 H GLU 62 H GLU 62 -15.387 -3.481 -7.923 466 HA GLU 62 HA GLU 62 -13.964 -1.889 -5.895 467 HB2 GLU 62 2HB GLU 62 -12.467 -4.005 -5.831 468 HB3 GLU 62 3HB GLU 62 -14.032 -4.045 -5.031 469 HG2 GLU 62 2HG GLU 62 -14.942 -5.086 -7.143 470 HG3 GLU 62 3HG GLU 62 -13.268 -5.270 -7.662 471 H LEU 63 H LEU 63 -13.858 -3.179 -9.129 472 HA LEU 63 HA LEU 63 -11.154 -2.796 -9.726 473 HB2 LEU 63 2HB LEU 63 -13.339 -3.703 -11.079 474 HB3 LEU 63 3HB LEU 63 -13.027 -2.173 -11.895 475 HG LEU 63 HG LEU 63 -11.128 -4.502 -11.634 476 HD11 LEU 63 1HD1 LEU 63 -13.045 -3.625 -13.657 477 HD12 LEU 63 2HD1 LEU 63 -12.278 -5.195 -13.422 478 HD13 LEU 63 3HD1 LEU 63 -11.422 -3.916 -14.284 479 HD21 LEU 63 3HD2 LEU 63 -9.881 -2.438 -11.486 480 HD22 LEU 63 1HD2 LEU 63 -10.729 -1.789 -12.890 481 HD23 LEU 63 2HD2 LEU 63 -9.639 -3.163 -13.076 482 H LYS 64 H LYS 64 -13.790 -0.537 -9.483 483 HA LYS 64 HA LYS 64 -12.726 1.611 -10.931 484 HB2 LYS 64 2HB LYS 64 -14.174 3.017 -9.388 485 HB3 LYS 64 3HB LYS 64 -14.998 1.752 -10.290 486 HG2 LYS 64 2HG LYS 64 -15.417 0.499 -8.427 487 HG3 LYS 64 3HG LYS 64 -14.014 1.123 -7.557 488 HD2 LYS 64 2HD LYS 64 -16.105 1.943 -6.587 489 HD3 LYS 64 3HD LYS 64 -15.144 3.265 -7.253 490 HE2 LYS 64 2HE LYS 64 -16.631 3.686 -8.922 491 HE3 LYS 64 3HE LYS 64 -17.130 2.000 -9.050 492 HZ1 LYS 64 3HZ LYS 64 -17.876 3.108 -6.540 493 HZ2 LYS 64 1HZ LYS 64 -18.846 2.378 -7.719 494 HZ3 LYS 64 2HZ LYS 64 -18.502 4.032 -7.811 495 H TYR 65 H TYR 65 -11.927 0.338 -7.812 496 HA TYR 65 HA TYR 65 -10.362 2.707 -7.117 497 HB2 TYR 65 2HB TYR 65 -10.958 0.184 -5.558 498 HB3 TYR 65 3HB TYR 65 -9.995 1.528 -4.955 499 HD1 TYR 65 HD1 TYR 65 -11.132 3.823 -4.808 500 HD2 TYR 65 HD2 TYR 65 -13.281 0.183 -5.298 501 HE1 TYR 65 HE1 TYR 65 -13.174 4.925 -3.992 502 HE2 TYR 65 HE2 TYR 65 -15.328 1.276 -4.485 503 HH TYR 65 HH TYR 65 -15.357 4.721 -3.627 504 H PHE 66 H PHE 66 -9.341 1.551 -9.328 505 HA PHE 66 HA PHE 66 -7.271 -0.341 -8.631 506 HB2 PHE 66 2HB PHE 66 -8.181 -0.652 -10.794 507 HB3 PHE 66 3HB PHE 66 -8.042 1.059 -11.185 508 HD1 PHE 66 HD1 PHE 66 -5.952 -1.907 -10.354 509 HD2 PHE 66 HD2 PHE 66 -6.244 1.800 -12.427 510 HE1 PHE 66 HE1 PHE 66 -3.773 -2.332 -11.415 511 HE2 PHE 66 HE2 PHE 66 -4.066 1.380 -13.491 512 HZ PHE 66 HZ PHE 66 -2.828 -0.689 -12.987 513 H LEU 67 H LEU 67 -7.616 3.081 -8.922 514 HA LEU 67 HA LEU 67 -4.754 3.554 -9.081 515 HB2 LEU 67 2HB LEU 67 -6.825 5.659 -8.585 516 HB3 LEU 67 3HB LEU 67 -5.257 5.812 -9.376 517 HG LEU 67 HG LEU 67 -7.817 4.700 -10.487 518 HD11 LEU 67 1HD1 LEU 67 -6.263 6.430 -12.178 519 HD12 LEU 67 2HD1 LEU 67 -6.555 7.189 -10.614 520 HD13 LEU 67 3HD1 LEU 67 -7.914 6.623 -11.586 521 HD21 LEU 67 3HD2 LEU 67 -6.026 3.113 -11.016 522 HD22 LEU 67 1HD2 LEU 67 -5.058 4.430 -11.678 523 HD23 LEU 67 2HD2 LEU 67 -6.576 3.977 -12.452 524 H GLN 68 H GLN 68 -6.854 2.746 -6.679 525 HA GLN 68 HA GLN 68 -5.633 4.433 -4.631 526 HB2 GLN 68 2HB GLN 68 -8.133 2.971 -4.904 527 HB3 GLN 68 3HB GLN 68 -7.351 2.654 -3.361 528 HG2 GLN 68 2HG GLN 68 -8.319 4.515 -2.643 529 HG3 GLN 68 3HG GLN 68 -7.138 5.384 -3.623 530 HE21 GLN 68 1HE2 GLN 68 -8.050 4.854 -6.152 531 HE22 GLN 68 2HE2 GLN 68 -9.597 5.588 -6.377 532 H ARG 69 H ARG 69 -4.820 1.680 -6.164 533 HA ARG 69 HA ARG 69 -3.806 0.315 -3.774 534 HB2 ARG 69 2HB ARG 69 -3.389 -0.869 -6.458 535 HB3 ARG 69 3HB ARG 69 -3.845 -1.640 -4.945 536 HG2 ARG 69 2HG ARG 69 -5.666 -0.022 -6.716 537 HG3 ARG 69 3HG ARG 69 -5.629 -1.782 -6.593 538 HD2 ARG 69 2HD ARG 69 -6.498 0.229 -4.541 539 HD3 ARG 69 3HD ARG 69 -7.416 -1.112 -5.225 540 HE ARG 69 HE ARG 69 -5.384 -2.365 -3.978 541 HH11 ARG 69 1HH1 ARG 69 -7.633 0.085 -2.950 542 HH12 ARG 69 2HH1 ARG 69 -7.629 -0.421 -1.293 543 HH21 ARG 69 1HH2 ARG 69 -5.370 -3.041 -1.800 544 HH22 ARG 69 2HH2 ARG 69 -6.340 -2.199 -0.640 545 H PHE 70 H PHE 70 -2.798 2.011 -6.653 546 HA PHE 70 HA PHE 70 0.018 1.457 -6.063 547 HB2 PHE 70 2HB PHE 70 -1.371 2.645 -8.463 548 HB3 PHE 70 3HB PHE 70 0.379 2.672 -8.274 549 HD1 PHE 70 HD1 PHE 70 -2.558 0.484 -8.669 550 HD2 PHE 70 HD2 PHE 70 1.691 0.742 -8.674 551 HE1 PHE 70 HE1 PHE 70 -2.425 -1.775 -9.636 552 HE2 PHE 70 HE2 PHE 70 1.830 -1.515 -9.642 553 HZ PHE 70 HZ PHE 70 -0.229 -2.777 -10.125 554 H GLU 71 H GLU 71 -2.372 3.957 -5.934 555 HA GLU 71 HA GLU 71 -0.310 5.942 -5.255 556 HB2 GLU 71 2HB GLU 71 -1.943 6.457 -7.110 557 HB3 GLU 71 3HB GLU 71 -3.213 6.472 -5.894 558 HG2 GLU 71 2HG GLU 71 -2.324 8.715 -6.533 559 HG3 GLU 71 3HG GLU 71 -2.279 8.355 -4.808 560 H SER 72 H SER 72 -3.234 4.369 -4.121 561 HA SER 72 HA SER 72 -4.179 4.193 -2.059 562 HB2 SER 72 2HB SER 72 -1.761 3.664 -1.466 563 HB3 SER 72 3HB SER 72 -1.620 5.340 -0.936 564 HG SER 72 HG SER 72 -3.496 4.844 0.437 565 H GLY 73 H GLY 73 -5.276 6.184 -3.205 566 HA2 GLY 73 2HA GLY 73 -6.388 7.872 -1.491 567 HA3 GLY 73 3HA GLY 73 -4.841 8.668 -1.736 568 H ALA 74 H ALA 74 -5.010 7.471 -4.592 569 HA ALA 74 HA ALA 74 -5.890 9.820 -5.865 570 HB1 ALA 74 1HB ALA 74 -5.890 8.207 -7.928 571 HB2 ALA 74 2HB ALA 74 -4.377 8.655 -7.139 572 HB3 ALA 74 3HB ALA 74 -5.122 7.094 -6.795 573 H ARG 75 H ARG 75 -7.493 9.361 -7.899 574 HA ARG 75 HA ARG 75 -10.068 8.962 -6.643 575 HB2 ARG 75 2HB ARG 75 -10.975 9.719 -8.817 576 HB3 ARG 75 3HB ARG 75 -9.805 10.845 -8.142 577 HG2 ARG 75 2HG ARG 75 -8.094 9.988 -9.650 578 HG3 ARG 75 3HG ARG 75 -9.253 8.835 -10.315 579 HD2 ARG 75 2HD ARG 75 -9.366 11.842 -10.473 580 HD3 ARG 75 3HD ARG 75 -9.100 10.713 -11.800 581 HE ARG 75 HE ARG 75 -11.372 10.185 -11.786 582 HH11 ARG 75 1HH1 ARG 75 -10.562 12.429 -9.250 583 HH12 ARG 75 2HH1 ARG 75 -12.207 12.870 -8.937 584 HH21 ARG 75 1HH2 ARG 75 -13.542 10.757 -11.382 585 HH22 ARG 75 2HH2 ARG 75 -13.902 11.918 -10.149 586 H VAL 76 H VAL 76 -11.735 7.886 -8.326 587 HA VAL 76 HA VAL 76 -10.770 5.141 -8.631 588 HB VAL 76 HB VAL 76 -13.034 4.435 -8.648 589 HG11 VAL 76 1HG1 VAL 76 -13.785 5.112 -6.528 590 HG12 VAL 76 2HG1 VAL 76 -12.031 5.300 -6.470 591 HG13 VAL 76 3HG1 VAL 76 -13.064 6.713 -6.690 592 HG21 VAL 76 3HG2 VAL 76 -13.518 7.123 -9.638 593 HG22 VAL 76 1HG2 VAL 76 -14.478 5.656 -9.832 594 HG23 VAL 76 2HG2 VAL 76 -14.667 6.649 -8.386 595 H LEU 77 H LEU 77 -12.530 4.169 -10.504 596 HA LEU 77 HA LEU 77 -11.543 5.464 -12.949 597 HB2 LEU 77 2HB LEU 77 -12.644 2.679 -12.618 598 HB3 LEU 77 3HB LEU 77 -11.860 3.343 -14.049 599 HG LEU 77 HG LEU 77 -10.527 2.797 -11.397 600 HD11 LEU 77 1HD1 LEU 77 -10.388 1.366 -14.046 601 HD12 LEU 77 2HD1 LEU 77 -11.056 0.742 -12.538 602 HD13 LEU 77 3HD1 LEU 77 -9.326 1.056 -12.672 603 HD21 LEU 77 3HD2 LEU 77 -9.385 3.766 -14.015 604 HD22 LEU 77 1HD2 LEU 77 -8.454 3.324 -12.584 605 HD23 LEU 77 2HD2 LEU 77 -9.541 4.711 -12.534 606 H THR 78 H THR 78 -12.958 5.554 -14.810 607 HA THR 78 HA THR 78 -15.752 6.002 -14.016 608 HB THR 78 HB THR 78 -14.558 7.951 -14.966 609 HG1 THR 78 HG1 THR 78 -16.229 8.476 -16.409 610 HG21 THR 78 3HG2 THR 78 -14.618 7.197 -17.725 611 HG22 THR 78 1HG2 THR 78 -13.626 6.046 -16.832 612 HG23 THR 78 2HG2 THR 78 -13.255 7.769 -16.763 613 H ALA 79 H ALA 79 -17.206 5.842 -16.156 614 HA ALA 79 HA ALA 79 -17.427 3.092 -16.722 615 HB1 ALA 79 1HB ALA 79 -19.460 4.053 -16.966 616 HB2 ALA 79 2HB ALA 79 -18.796 5.559 -17.600 617 HB3 ALA 79 3HB ALA 79 -18.948 4.151 -18.651 618 H SER 80 H SER 80 -15.391 5.448 -18.031 619 HA SER 80 HA SER 80 -15.070 3.995 -20.559 620 HB2 SER 80 2HB SER 80 -15.362 6.429 -20.736 621 HB3 SER 80 3HB SER 80 -13.955 6.678 -19.702 622 HG SER 80 HG SER 80 -14.097 5.871 -22.365 623 H GLU 81 H GLU 81 -13.849 3.932 -17.515 624 HA GLU 81 HA GLU 81 -11.158 3.160 -18.433 625 HB2 GLU 81 2HB GLU 81 -12.086 4.210 -15.758 626 HB3 GLU 81 3HB GLU 81 -10.487 3.532 -16.030 627 HG2 GLU 81 2HG GLU 81 -10.345 5.296 -17.926 628 HG3 GLU 81 3HG GLU 81 -11.659 6.078 -17.050 629 H THR 82 H THR 82 -13.344 2.426 -15.708 630 HA THR 82 HA THR 82 -12.323 -0.047 -15.041 631 HB THR 82 HB THR 82 -15.141 -0.230 -14.730 632 HG1 THR 82 HG1 THR 82 -15.571 1.868 -14.933 633 HG21 THR 82 3HG2 THR 82 -12.856 -0.525 -13.211 634 HG22 THR 82 1HG2 THR 82 -14.512 -0.703 -12.632 635 HG23 THR 82 2HG2 THR 82 -13.675 0.839 -12.450 636 H LYS 83 H LYS 83 -14.940 0.669 -17.341 637 HA LYS 83 HA LYS 83 -15.560 -1.947 -18.066 638 HB2 LYS 83 2HB LYS 83 -15.844 0.717 -19.378 639 HB3 LYS 83 3HB LYS 83 -16.108 -0.720 -20.357 640 HG2 LYS 83 2HG LYS 83 -17.767 -1.475 -18.638 641 HG3 LYS 83 3HG LYS 83 -17.598 0.110 -17.880 642 HD2 LYS 83 2HD LYS 83 -19.486 0.287 -19.275 643 HD3 LYS 83 3HD LYS 83 -18.183 1.088 -20.156 644 HE2 LYS 83 2HE LYS 83 -19.246 -0.238 -21.764 645 HE3 LYS 83 3HE LYS 83 -17.819 -1.166 -21.304 646 HZ1 LYS 83 3HZ LYS 83 -19.191 -2.840 -20.887 647 HZ2 LYS 83 1HZ LYS 83 -20.563 -1.868 -21.083 648 HZ3 LYS 83 2HZ LYS 83 -19.802 -1.964 -19.575 649 H THR 84 H THR 84 -13.182 0.282 -19.471 650 HA THR 84 HA THR 84 -12.311 -1.368 -21.558 651 HB THR 84 HB THR 84 -10.645 0.646 -20.037 652 HG1 THR 84 HG1 THR 84 -12.002 1.182 -22.453 653 HG21 THR 84 3HG2 THR 84 -9.818 -1.118 -21.951 654 HG22 THR 84 1HG2 THR 84 -9.065 0.444 -21.628 655 HG23 THR 84 2HG2 THR 84 -10.253 0.288 -22.922 656 H PHE 85 H PHE 85 -10.807 -0.851 -18.362 657 HA PHE 85 HA PHE 85 -8.754 -2.680 -18.561 658 HB2 PHE 85 2HB PHE 85 -9.297 -1.025 -16.664 659 HB3 PHE 85 3HB PHE 85 -10.301 -2.311 -16.004 660 HD1 PHE 85 HD2 PHE 85 -9.186 -4.561 -15.545 661 HD2 PHE 85 HD1 PHE 85 -7.016 -0.965 -16.234 662 HE1 PHE 85 HE2 PHE 85 -7.209 -5.551 -14.466 663 HE2 PHE 85 HE1 PHE 85 -5.035 -1.949 -15.156 664 HZ PHE 85 HZ PHE 85 -5.130 -4.245 -14.269 665 H LEU 86 H LEU 86 -12.057 -3.254 -17.378 666 HA LEU 86 HA LEU 86 -11.692 -6.009 -16.858 667 HB2 LEU 86 2HB LEU 86 -13.497 -4.942 -15.789 668 HB3 LEU 86 3HB LEU 86 -14.115 -4.294 -17.307 669 HG LEU 86 HG LEU 86 -14.358 -6.934 -17.792 670 HD11 LEU 86 1HD1 LEU 86 -14.487 -6.572 -14.819 671 HD12 LEU 86 2HD1 LEU 86 -13.662 -7.820 -15.752 672 HD13 LEU 86 3HD1 LEU 86 -15.421 -7.824 -15.637 673 HD21 LEU 86 3HD2 LEU 86 -16.121 -5.337 -18.107 674 HD22 LEU 86 1HD2 LEU 86 -16.299 -5.121 -16.365 675 HD23 LEU 86 2HD2 LEU 86 -16.733 -6.659 -17.112 676 H ALA 87 H ALA 87 -12.721 -4.213 -19.701 677 HA ALA 87 HA ALA 87 -13.492 -6.530 -21.196 678 HB1 ALA 87 1HB ALA 87 -14.512 -4.438 -21.745 679 HB2 ALA 87 2HB ALA 87 -12.941 -3.690 -22.037 680 HB3 ALA 87 3HB ALA 87 -13.534 -4.947 -23.122 681 H ALA 88 H ALA 88 -10.553 -5.603 -20.145 682 HA ALA 88 HA ALA 88 -9.164 -6.554 -22.563 683 HB1 ALA 88 1HB ALA 88 -8.196 -4.516 -22.225 684 HB2 ALA 88 2HB ALA 88 -8.435 -4.567 -20.478 685 HB3 ALA 88 3HB ALA 88 -7.143 -5.511 -21.218 686 H ALA 89 H ALA 89 -9.980 -7.310 -19.352 687 HA ALA 89 HA ALA 89 -7.966 -9.463 -19.307 688 HB1 ALA 89 1HB ALA 89 -8.798 -7.559 -17.248 689 HB2 ALA 89 2HB ALA 89 -8.756 -9.237 -16.705 690 HB3 ALA 89 3HB ALA 89 -7.312 -8.498 -17.395 691 H ASP 90 H ASP 90 -11.187 -8.626 -18.015 692 HA ASP 90 HA ASP 90 -11.988 -11.245 -17.442 693 HB2 ASP 90 2HB ASP 90 -13.301 -9.586 -16.452 694 HB3 ASP 90 3HB ASP 90 -13.476 -8.689 -17.958 695 H HIS 91 H HIS 91 -13.318 -9.274 -20.096 696 HA HIS 91 HA HIS 91 -14.112 -9.839 -22.153 697 HB2 HIS 91 2HB HIS 91 -11.558 -10.513 -22.192 698 HB3 HIS 91 3HB HIS 91 -12.214 -12.144 -22.302 699 HD1 HIS 91 HD1 HIS 91 -10.780 -11.680 -24.694 700 HD2 HIS 91 HD2 HIS 91 -14.572 -10.037 -24.261 701 HE1 HIS 91 HE1 HIS 91 -11.569 -11.186 -27.030 702 H ASP 92 H ASP 92 -14.870 -11.454 -19.598 703 HA ASP 92 HA ASP 92 -16.070 -13.771 -20.951 704 HB2 ASP 92 2HB ASP 92 -16.018 -13.324 -17.972 705 HB3 ASP 92 3HB ASP 92 -16.226 -14.837 -18.850 706 H GLY 93 H GLY 93 -16.786 -10.718 -19.584 707 HA2 GLY 93 2HA GLY 93 -18.795 -9.557 -19.706 708 HA3 GLY 93 3HA GLY 93 -19.581 -11.031 -20.254 709 H ASP 94 H ASP 94 -17.655 -11.103 -17.377 710 HA ASP 94 HA ASP 94 -20.092 -11.551 -15.811 711 HB2 ASP 94 2HB ASP 94 -17.431 -12.019 -14.590 712 HB3 ASP 94 3HB ASP 94 -18.902 -12.984 -14.495 713 H GLY 95 H GLY 95 -17.679 -9.223 -16.355 714 HA2 GLY 95 2HA GLY 95 -17.515 -7.086 -15.481 715 HA3 GLY 95 3HA GLY 95 -18.810 -7.483 -14.361 716 H LYS 96 H LYS 96 -16.762 -9.941 -13.955 717 HA LYS 96 HA LYS 96 -15.232 -8.536 -11.864 718 HB2 LYS 96 2HB LYS 96 -15.372 -10.499 -10.490 719 HB3 LYS 96 3HB LYS 96 -16.997 -10.089 -11.020 720 HG2 LYS 96 2HG LYS 96 -16.272 -11.812 -12.965 721 HG3 LYS 96 3HG LYS 96 -15.356 -12.456 -11.601 722 HD2 LYS 96 2HD LYS 96 -18.102 -11.749 -10.913 723 HD3 LYS 96 3HD LYS 96 -17.996 -12.988 -12.165 724 HE2 LYS 96 2HE LYS 96 -16.572 -14.341 -10.741 725 HE3 LYS 96 3HE LYS 96 -16.575 -13.083 -9.505 726 HZ1 LYS 96 3HZ LYS 96 -18.634 -15.020 -10.184 727 HZ2 LYS 96 1HZ LYS 96 -19.179 -13.468 -9.789 728 HZ3 LYS 96 2HZ LYS 96 -18.238 -14.339 -8.687 729 H ILE 97 H ILE 97 -13.073 -8.779 -11.828 730 HA ILE 97 HA ILE 97 -11.840 -10.253 -14.004 731 HB ILE 97 HB ILE 97 -10.755 -8.336 -11.952 732 HG12 ILE 97 2HG1 ILE 97 -11.979 -7.412 -13.897 733 HG13 ILE 97 3HG1 ILE 97 -10.281 -6.948 -13.894 734 HG21 ILE 97 1HG2 ILE 97 -9.293 -10.180 -13.792 735 HG22 ILE 97 2HG2 ILE 97 -8.615 -8.598 -13.410 736 HG23 ILE 97 3HG2 ILE 97 -8.940 -9.753 -12.118 737 HD11 ILE 97 3HD1 ILE 97 -11.791 -8.595 -15.794 738 HD12 ILE 97 1HD1 ILE 97 -10.389 -7.556 -16.047 739 HD13 ILE 97 2HD1 ILE 97 -10.176 -9.182 -15.397 740 H GLY 98 H GLY 98 -10.387 -11.938 -13.786 741 HA2 GLY 98 2HA GLY 98 -10.317 -13.189 -11.109 742 HA3 GLY 98 3HA GLY 98 -10.410 -14.104 -12.606 743 H ALA 99 H ALA 99 -8.447 -14.441 -10.569 744 HA ALA 99 HA ALA 99 -6.014 -13.150 -11.246 745 HB1 ALA 99 1HB ALA 99 -6.468 -15.749 -9.786 746 HB2 ALA 99 2HB ALA 99 -4.953 -14.848 -9.837 747 HB3 ALA 99 3HB ALA 99 -6.370 -14.147 -9.054 748 H GLU 100 H GLU 100 -7.802 -15.417 -12.910 749 HA GLU 100 HA GLU 100 -5.427 -16.546 -14.230 750 HB2 GLU 100 2HB GLU 100 -7.380 -17.980 -13.186 751 HB3 GLU 100 3HB GLU 100 -8.182 -17.603 -14.705 752 HG2 GLU 100 2HG GLU 100 -6.256 -18.553 -15.919 753 HG3 GLU 100 3HG GLU 100 -5.542 -19.008 -14.372 754 H GLU 101 H GLU 101 -7.542 -14.082 -14.573 755 HA GLU 101 HA GLU 101 -7.363 -14.175 -17.512 756 HB2 GLU 101 2HB GLU 101 -9.492 -12.513 -17.037 757 HB3 GLU 101 3HB GLU 101 -9.609 -14.205 -17.502 758 HG2 GLU 101 2HG GLU 101 -9.872 -14.883 -15.227 759 HG3 GLU 101 3HG GLU 101 -9.533 -13.252 -14.651 760 H PHE 102 H PHE 102 -6.328 -12.671 -14.775 761 HA PHE 102 HA PHE 102 -6.393 -9.943 -15.687 762 HB2 PHE 102 2HB PHE 102 -6.425 -10.473 -13.286 763 HB3 PHE 102 3HB PHE 102 -4.833 -11.214 -13.426 764 HD1 PHE 102 HD1 PHE 102 -2.859 -9.806 -13.922 765 HD2 PHE 102 HD2 PHE 102 -6.684 -8.129 -13.102 766 HE1 PHE 102 HE1 PHE 102 -1.804 -7.628 -13.476 767 HE2 PHE 102 HE2 PHE 102 -5.636 -5.948 -12.656 768 HZ PHE 102 HZ PHE 102 -3.193 -5.695 -12.843 769 H GLN 103 H GLN 103 -3.747 -12.257 -15.074 770 HA GLN 103 HA GLN 103 -1.663 -10.787 -16.125 771 HB2 GLN 103 2HB GLN 103 -0.548 -12.975 -16.542 772 HB3 GLN 103 3HB GLN 103 -1.243 -12.834 -14.932 773 HG2 GLN 103 2HG GLN 103 -3.290 -13.956 -16.354 774 HG3 GLN 103 3HG GLN 103 -1.866 -14.689 -17.090 775 HE21 GLN 103 1HE2 GLN 103 -2.623 -13.704 -13.769 776 HE22 GLN 103 2HE2 GLN 103 -2.323 -15.250 -13.059 777 H GLU 104 H GLU 104 -4.046 -12.758 -17.802 778 HA GLU 104 HA GLU 104 -2.875 -12.891 -20.320 779 HB2 GLU 104 2HB GLU 104 -5.832 -12.535 -19.847 780 HB3 GLU 104 3HB GLU 104 -5.048 -13.374 -21.178 781 HG2 GLU 104 2HG GLU 104 -4.158 -15.003 -19.482 782 HG3 GLU 104 3HG GLU 104 -5.226 -14.237 -18.307 783 H MET 105 H MET 105 -4.435 -10.238 -18.706 784 HA MET 105 HA MET 105 -4.649 -8.652 -21.125 785 HB2 MET 105 2HB MET 105 -5.895 -7.157 -19.897 786 HB3 MET 105 3HB MET 105 -6.208 -8.641 -19.007 787 HG2 MET 105 2HG MET 105 -5.640 -7.455 -17.211 788 HG3 MET 105 3HG MET 105 -3.982 -7.709 -17.752 789 HE1 MET 105 3HE MET 105 -6.407 -4.496 -19.536 790 HE2 MET 105 1HE MET 105 -7.036 -5.848 -18.593 791 HE3 MET 105 2HE MET 105 -6.746 -4.291 -17.817 792 H VAL 106 H VAL 106 -2.341 -9.266 -18.691 793 HA VAL 106 HA VAL 106 -0.971 -6.737 -18.893 794 HB VAL 106 HB VAL 106 0.121 -9.294 -17.727 795 HG11 VAL 106 1HG1 VAL 106 1.121 -6.629 -18.007 796 HG12 VAL 106 2HG1 VAL 106 0.923 -7.008 -16.295 797 HG13 VAL 106 3HG1 VAL 106 1.912 -8.048 -17.321 798 HG21 VAL 106 3HG2 VAL 106 -2.209 -8.131 -16.903 799 HG22 VAL 106 1HG2 VAL 106 -1.141 -9.096 -15.884 800 HG23 VAL 106 2HG2 VAL 106 -1.019 -7.337 -15.872 801 H GLN 107 H GLN 107 0.466 -9.948 -19.328 802 HA GLN 107 HA GLN 107 2.426 -9.054 -21.131 803 HB2 GLN 107 2HB GLN 107 1.360 -11.846 -20.673 804 HB3 GLN 107 3HB GLN 107 2.825 -11.464 -21.568 805 HG2 GLN 107 2HG GLN 107 4.027 -11.273 -19.712 806 HG3 GLN 107 3HG GLN 107 2.813 -10.258 -18.935 807 HE21 GLN 107 1HE2 GLN 107 0.716 -11.675 -18.490 808 HE22 GLN 107 2HE2 GLN 107 1.040 -13.120 -17.600 809 H SER 108 H SER 108 -0.780 -10.401 -21.624 810 HA SER 108 HA SER 108 -0.457 -9.951 -24.519 811 HB2 SER 108 2HB SER 108 -0.784 -12.367 -23.719 812 HB3 SER 108 3HB SER 108 -2.433 -11.887 -23.317 813 HG SER 108 HG SER 108 -1.837 -12.788 -25.548 Start of MODEL 11 1 H1 SER 1 H SER 1 -0.856 -0.500 -0.894 2 HA SER 1 HA SER 1 -0.095 -0.593 -3.733 3 HB2 SER 1 2HB SER 1 2.240 -0.072 -3.097 4 HB3 SER 1 3HB SER 1 1.140 1.251 -2.711 5 HG SER 1 HG SER 1 2.683 0.637 -1.026 6 H LEU 2 H LEU 2 2.138 -1.978 -3.747 7 HA LEU 2 HA LEU 2 1.693 -4.372 -2.101 8 HB2 LEU 2 2HB LEU 2 2.331 -5.719 -4.134 9 HB3 LEU 2 3HB LEU 2 0.734 -4.974 -4.161 10 HG LEU 2 HG LEU 2 3.112 -3.743 -5.533 11 HD11 LEU 2 1HD1 LEU 2 2.887 -5.906 -6.518 12 HD12 LEU 2 2HD1 LEU 2 2.163 -4.734 -7.618 13 HD13 LEU 2 3HD1 LEU 2 1.133 -5.745 -6.604 14 HD21 LEU 2 3HD2 LEU 2 0.237 -3.166 -5.290 15 HD22 LEU 2 1HD2 LEU 2 0.902 -3.036 -6.918 16 HD23 LEU 2 2HD2 LEU 2 1.594 -2.083 -5.606 17 H THR 3 H THR 3 3.929 -2.690 -4.288 18 HA THR 3 HA THR 3 6.213 -2.682 -4.415 19 HB THR 3 HB THR 3 7.220 -2.665 -1.930 20 HG1 THR 3 HG1 THR 3 5.708 -2.091 -0.440 21 HG21 THR 3 3HG2 THR 3 6.506 -0.773 -3.827 22 HG22 THR 3 1HG2 THR 3 7.474 -0.490 -2.381 23 HG23 THR 3 2HG2 THR 3 5.734 -0.205 -2.346 24 H ASP 4 H ASP 4 4.906 -5.340 -4.332 25 HA ASP 4 HA ASP 4 7.142 -6.917 -3.238 26 HB2 ASP 4 2HB ASP 4 4.301 -7.219 -2.963 27 HB3 ASP 4 3HB ASP 4 4.953 -8.621 -3.808 28 H ILE 5 H ILE 5 5.642 -5.869 -6.059 29 HA ILE 5 HA ILE 5 7.037 -7.944 -7.615 30 HB ILE 5 HB ILE 5 4.366 -6.698 -8.274 31 HG12 ILE 5 2HG1 ILE 5 3.912 -9.335 -8.319 32 HG13 ILE 5 3HG1 ILE 5 5.235 -9.317 -7.158 33 HG21 ILE 5 1HG2 ILE 5 6.327 -7.561 -10.039 34 HG22 ILE 5 2HG2 ILE 5 5.194 -8.908 -9.943 35 HG23 ILE 5 3HG2 ILE 5 4.620 -7.304 -10.400 36 HD11 ILE 5 3HD1 ILE 5 3.311 -9.202 -5.858 37 HD12 ILE 5 1HD1 ILE 5 3.883 -7.535 -5.928 38 HD13 ILE 5 2HD1 ILE 5 2.534 -8.049 -6.943 39 H LEU 6 H LEU 6 5.410 -4.802 -8.101 40 HA LEU 6 HA LEU 6 7.546 -4.036 -9.948 41 HB2 LEU 6 2HB LEU 6 4.755 -3.115 -9.459 42 HB3 LEU 6 3HB LEU 6 5.906 -1.993 -10.181 43 HG LEU 6 HG LEU 6 5.366 -4.708 -11.354 44 HD11 LEU 6 1HD1 LEU 6 3.351 -4.050 -12.000 45 HD12 LEU 6 2HD1 LEU 6 4.099 -2.726 -12.892 46 HD13 LEU 6 3HD1 LEU 6 3.575 -2.481 -11.226 47 HD21 LEU 6 3HD2 LEU 6 7.272 -2.768 -11.887 48 HD22 LEU 6 1HD2 LEU 6 6.043 -2.521 -13.128 49 HD23 LEU 6 2HD2 LEU 6 6.803 -4.102 -12.942 50 H SER 7 H SER 7 8.538 -1.938 -9.792 51 HA SER 7 HA SER 7 9.216 -1.271 -7.075 52 HB2 SER 7 2HB SER 7 10.414 -0.950 -9.643 53 HB3 SER 7 3HB SER 7 10.282 0.644 -8.900 54 HG SER 7 HG SER 7 12.203 -0.808 -8.427 55 HA PRO 8 HA PRO 8 6.592 2.174 -6.379 56 HB2 PRO 8 2HB PRO 8 8.235 3.901 -5.079 57 HB3 PRO 8 3HB PRO 8 7.619 2.419 -4.338 58 HG2 PRO 8 2HG PRO 8 10.285 2.941 -5.594 59 HG3 PRO 8 3HG PRO 8 9.905 2.073 -4.095 60 HD2 PRO 8 2HD PRO 8 10.452 0.797 -6.420 61 HD3 PRO 8 3HD PRO 8 9.328 0.141 -5.213 62 H SER 9 H SER 9 9.821 3.275 -7.433 63 HA SER 9 HA SER 9 9.041 5.746 -8.455 64 HB2 SER 9 2HB SER 9 11.140 5.707 -9.720 65 HB3 SER 9 3HB SER 9 11.394 5.098 -8.085 66 HG SER 9 HG SER 9 12.396 3.682 -9.450 67 H ASP 10 H ASP 10 8.860 2.549 -9.847 68 HA ASP 10 HA ASP 10 8.339 3.408 -12.521 69 HB2 ASP 10 2HB ASP 10 7.868 0.767 -11.127 70 HB3 ASP 10 3HB ASP 10 7.600 1.031 -12.848 71 H ILE 11 H ILE 11 6.364 2.636 -9.723 72 HA ILE 11 HA ILE 11 3.881 2.710 -11.164 73 HB ILE 11 HB ILE 11 4.463 2.773 -8.203 74 HG12 ILE 11 2HG1 ILE 11 3.094 0.507 -9.558 75 HG13 ILE 11 3HG1 ILE 11 4.818 0.696 -9.859 76 HG21 ILE 11 1HG2 ILE 11 2.380 3.813 -8.371 77 HG22 ILE 11 2HG2 ILE 11 1.872 2.786 -9.710 78 HG23 ILE 11 3HG2 ILE 11 1.986 2.119 -8.082 79 HD11 ILE 11 3HD1 ILE 11 3.452 0.276 -7.217 80 HD12 ILE 11 1HD1 ILE 11 4.560 -0.813 -8.050 81 HD13 ILE 11 2HD1 ILE 11 5.154 0.707 -7.382 82 H ALA 12 H ALA 12 5.465 4.876 -8.820 83 HA ALA 12 HA ALA 12 3.563 6.910 -8.832 84 HB1 ALA 12 1HB ALA 12 6.104 8.117 -8.563 85 HB2 ALA 12 2HB ALA 12 4.962 7.677 -7.293 86 HB3 ALA 12 3HB ALA 12 6.193 6.525 -7.809 87 H ALA 13 H ALA 13 6.036 6.115 -11.150 88 HA ALA 13 HA ALA 13 5.914 8.632 -12.538 89 HB1 ALA 13 1HB ALA 13 7.265 6.011 -13.043 90 HB2 ALA 13 2HB ALA 13 7.181 7.233 -14.313 91 HB3 ALA 13 3HB ALA 13 7.975 7.605 -12.783 92 H ALA 14 H ALA 14 4.233 5.604 -12.663 93 HA ALA 14 HA ALA 14 3.111 6.108 -15.291 94 HB1 ALA 14 1HB ALA 14 2.463 3.923 -13.316 95 HB2 ALA 14 2HB ALA 14 1.967 3.991 -15.007 96 HB3 ALA 14 3HB ALA 14 3.673 3.817 -14.595 97 H LEU 15 H LEU 15 1.998 6.005 -11.924 98 HA LEU 15 HA LEU 15 -0.710 6.515 -12.395 99 HB2 LEU 15 2HB LEU 15 1.131 6.885 -10.086 100 HB3 LEU 15 3HB LEU 15 -0.461 7.638 -10.020 101 HG LEU 15 HG LEU 15 -0.007 4.689 -10.456 102 HD11 LEU 15 1HD1 LEU 15 0.562 4.635 -8.299 103 HD12 LEU 15 2HD1 LEU 15 -1.136 4.988 -7.976 104 HD13 LEU 15 3HD1 LEU 15 0.043 6.299 -8.026 105 HD21 LEU 15 3HD2 LEU 15 -2.346 4.464 -10.042 106 HD22 LEU 15 1HD2 LEU 15 -2.139 5.696 -11.288 107 HD23 LEU 15 2HD2 LEU 15 -2.495 6.172 -9.628 108 H ARG 16 H ARG 16 1.947 8.778 -11.708 109 HA ARG 16 HA ARG 16 0.317 11.103 -11.936 110 HB2 ARG 16 2HB ARG 16 3.318 10.760 -12.056 111 HB3 ARG 16 3HB ARG 16 2.497 12.314 -11.998 112 HG2 ARG 16 2HG ARG 16 1.402 11.284 -9.841 113 HG3 ARG 16 3HG ARG 16 2.848 10.271 -9.870 114 HD2 ARG 16 2HD ARG 16 4.252 12.267 -9.905 115 HD3 ARG 16 3HD ARG 16 2.814 13.287 -9.909 116 HE ARG 16 HE ARG 16 4.026 12.064 -7.649 117 HH11 ARG 16 1HH1 ARG 16 0.947 12.980 -8.989 118 HH12 ARG 16 2HH1 ARG 16 0.179 13.153 -7.446 119 HH21 ARG 16 1HH2 ARG 16 3.027 12.288 -5.610 120 HH22 ARG 16 2HH2 ARG 16 1.364 12.760 -5.524 121 H ASP 17 H ASP 17 2.219 9.203 -14.168 122 HA ASP 17 HA ASP 17 2.564 10.945 -16.276 123 HB2 ASP 17 2HB ASP 17 3.576 8.859 -16.548 124 HB3 ASP 17 3HB ASP 17 2.101 7.983 -16.146 125 H CYS 18 H CYS 18 -0.291 8.996 -15.494 126 HA CYS 18 HA CYS 18 -1.885 10.789 -17.180 127 HB2 CYS 18 2HB CYS 18 -1.775 7.791 -17.331 128 HB3 CYS 18 3HB CYS 18 -3.240 8.654 -17.783 129 HG CYS 18 HG CYS 18 -0.974 7.867 -19.773 130 H GLN 19 H GLN 19 -1.635 10.970 -14.431 131 HA GLN 19 HA GLN 19 -3.499 9.546 -12.918 132 HB2 GLN 19 2HB GLN 19 -3.456 11.610 -11.424 133 HB3 GLN 19 3HB GLN 19 -1.914 10.823 -11.730 134 HG2 GLN 19 2HG GLN 19 -1.153 12.531 -13.074 135 HG3 GLN 19 3HG GLN 19 -2.779 13.095 -13.455 136 HE21 GLN 19 1HE2 GLN 19 -0.483 12.793 -10.784 137 HE22 GLN 19 2HE2 GLN 19 -0.974 14.232 -9.965 138 H ALA 20 H ALA 20 -3.874 12.389 -14.948 139 HA ALA 20 HA ALA 20 -6.358 13.300 -14.163 140 HB1 ALA 20 1HB ALA 20 -6.519 14.380 -16.245 141 HB2 ALA 20 2HB ALA 20 -4.790 14.274 -15.911 142 HB3 ALA 20 3HB ALA 20 -5.538 13.155 -17.049 143 HA PRO 21 HA PRO 21 -9.226 10.104 -15.121 144 HB2 PRO 21 2HB PRO 21 -11.468 11.600 -15.446 145 HB3 PRO 21 3HB PRO 21 -10.742 11.289 -13.865 146 HG2 PRO 21 2HG PRO 21 -10.503 13.704 -15.619 147 HG3 PRO 21 3HG PRO 21 -10.740 13.615 -13.863 148 HD2 PRO 21 2HD PRO 21 -8.323 14.099 -14.985 149 HD3 PRO 21 3HD PRO 21 -8.506 13.216 -13.457 150 H ASP 22 H ASP 22 -10.400 9.190 -16.835 151 HA ASP 22 HA ASP 22 -10.890 8.722 -19.006 152 HB2 ASP 22 2HB ASP 22 -12.160 10.930 -18.681 153 HB3 ASP 22 3HB ASP 22 -10.835 11.681 -19.565 154 H SER 23 H SER 23 -8.058 9.424 -18.034 155 HA SER 23 HA SER 23 -6.864 9.567 -20.723 156 HB2 SER 23 2HB SER 23 -6.213 11.112 -18.264 157 HB3 SER 23 3HB SER 23 -4.859 10.578 -19.261 158 HG SER 23 HG SER 23 -5.567 11.796 -20.909 159 H PHE 24 H PHE 24 -7.434 7.622 -18.194 160 HA PHE 24 HA PHE 24 -4.809 6.347 -18.122 161 HB2 PHE 24 2HB PHE 24 -7.165 6.398 -16.381 162 HB3 PHE 24 3HB PHE 24 -6.471 4.791 -16.573 163 HD1 PHE 24 HD1 PHE 24 -3.665 5.131 -16.652 164 HD2 PHE 24 HD2 PHE 24 -6.527 7.321 -14.386 165 HE1 PHE 24 HE1 PHE 24 -1.929 5.683 -14.999 166 HE2 PHE 24 HE2 PHE 24 -4.795 7.877 -12.730 167 HZ PHE 24 HZ PHE 24 -2.492 7.058 -13.035 168 H SER 25 H SER 25 -4.769 3.922 -18.254 169 HA SER 25 HA SER 25 -6.810 2.587 -19.744 170 HB2 SER 25 2HB SER 25 -5.072 4.086 -21.294 171 HB3 SER 25 3HB SER 25 -4.382 2.465 -21.364 172 HG SER 25 HG SER 25 -6.623 3.436 -22.540 173 HA PRO 26 HA PRO 26 -4.867 -0.863 -17.837 174 HB2 PRO 26 2HB PRO 26 -5.799 -2.859 -19.424 175 HB3 PRO 26 3HB PRO 26 -6.814 -2.010 -18.252 176 HG2 PRO 26 2HG PRO 26 -6.581 -1.596 -21.208 177 HG3 PRO 26 3HG PRO 26 -8.036 -1.634 -20.195 178 HD2 PRO 26 2HD PRO 26 -6.908 0.678 -21.039 179 HD3 PRO 26 3HD PRO 26 -7.748 0.538 -19.481 180 H LYS 27 H LYS 27 -4.542 -0.469 -21.329 181 HA LYS 27 HA LYS 27 -2.141 -2.138 -21.344 182 HB2 LYS 27 2HB LYS 27 -2.321 -2.201 -23.690 183 HB3 LYS 27 3HB LYS 27 -3.979 -2.303 -23.112 184 HG2 LYS 27 2HG LYS 27 -3.591 0.403 -23.408 185 HG3 LYS 27 3HG LYS 27 -2.697 -0.287 -24.765 186 HD2 LYS 27 2HD LYS 27 -4.859 0.017 -25.602 187 HD3 LYS 27 3HD LYS 27 -4.800 -1.696 -25.181 188 HE2 LYS 27 2HE LYS 27 -6.121 -1.398 -23.285 189 HE3 LYS 27 3HE LYS 27 -5.801 0.335 -23.218 190 HZ1 LYS 27 3HZ LYS 27 -7.154 0.649 -25.172 191 HZ2 LYS 27 1HZ LYS 27 -8.050 -0.173 -23.996 192 HZ3 LYS 27 2HZ LYS 27 -7.412 -1.016 -25.316 193 H LYS 28 H LYS 28 -2.324 0.574 -20.098 194 HA LYS 28 HA LYS 28 -0.017 1.735 -21.495 195 HB2 LYS 28 2HB LYS 28 -2.466 3.215 -20.531 196 HB3 LYS 28 3HB LYS 28 -0.950 4.015 -20.926 197 HG2 LYS 28 2HG LYS 28 -2.419 2.276 -22.885 198 HG3 LYS 28 3HG LYS 28 -2.725 4.006 -22.721 199 HD2 LYS 28 2HD LYS 28 -0.338 4.438 -23.185 200 HD3 LYS 28 3HD LYS 28 -0.093 2.707 -23.424 201 HE2 LYS 28 2HE LYS 28 -0.357 3.583 -25.584 202 HE3 LYS 28 3HE LYS 28 -1.918 2.862 -25.195 203 HZ1 LYS 28 3HZ LYS 28 -1.408 5.726 -24.697 204 HZ2 LYS 28 1HZ LYS 28 -2.888 4.930 -24.893 205 HZ3 LYS 28 2HZ LYS 28 -1.882 5.184 -26.228 206 H PHE 29 H PHE 29 -0.625 0.127 -18.962 207 HA PHE 29 HA PHE 29 0.716 1.949 -17.073 208 HB2 PHE 29 2HB PHE 29 -1.709 0.648 -16.729 209 HB3 PHE 29 3HB PHE 29 -0.568 -0.370 -15.856 210 HD1 PHE 29 HD1 PHE 29 1.192 1.115 -14.423 211 HD2 PHE 29 HD2 PHE 29 -2.772 2.241 -15.487 212 HE1 PHE 29 HE1 PHE 29 1.127 2.673 -12.519 213 HE2 PHE 29 HE2 PHE 29 -2.843 3.801 -13.586 214 HZ PHE 29 HZ PHE 29 -0.892 4.019 -12.099 215 H PHE 30 H PHE 30 1.198 -0.641 -19.037 216 HA PHE 30 HA PHE 30 3.056 -2.007 -17.231 217 HB2 PHE 30 2HB PHE 30 3.033 -3.831 -18.739 218 HB3 PHE 30 3HB PHE 30 1.364 -3.275 -18.660 219 HD1 PHE 30 HD1 PHE 30 4.359 -3.524 -20.735 220 HD2 PHE 30 HD2 PHE 30 0.320 -2.195 -20.551 221 HE1 PHE 30 HE1 PHE 30 4.330 -3.286 -23.184 222 HE2 PHE 30 HE2 PHE 30 0.283 -1.956 -23.000 223 HZ PHE 30 HZ PHE 30 2.290 -2.503 -24.320 224 H GLN 31 H GLN 31 3.025 0.370 -19.613 225 HA GLN 31 HA GLN 31 5.696 -0.178 -20.609 226 HB2 GLN 31 2HB GLN 31 4.299 2.392 -21.175 227 HB3 GLN 31 3HB GLN 31 5.296 1.402 -22.232 228 HG2 GLN 31 2HG GLN 31 3.450 -0.250 -22.338 229 HG3 GLN 31 3HG GLN 31 2.455 0.866 -21.405 230 HE21 GLN 31 1HE2 GLN 31 2.670 3.216 -22.405 231 HE22 GLN 31 2HE2 GLN 31 2.335 3.279 -24.099 232 H ILE 32 H ILE 32 4.117 1.849 -18.265 233 HA ILE 32 HA ILE 32 6.588 3.356 -17.802 234 HB ILE 32 HB ILE 32 3.864 3.776 -16.566 235 HG12 ILE 32 2HG1 ILE 32 4.347 5.935 -18.182 236 HG13 ILE 32 3HG1 ILE 32 5.040 4.620 -19.126 237 HG21 ILE 32 1HG2 ILE 32 5.404 4.730 -15.102 238 HG22 ILE 32 2HG2 ILE 32 6.461 5.261 -16.409 239 HG23 ILE 32 3HG2 ILE 32 4.924 6.079 -16.132 240 HD11 ILE 32 3HD1 ILE 32 2.519 3.768 -18.152 241 HD12 ILE 32 1HD1 ILE 32 2.328 5.370 -18.863 242 HD13 ILE 32 2HD1 ILE 32 3.022 4.059 -19.818 243 H SER 33 H SER 33 4.470 0.994 -16.344 244 HA SER 33 HA SER 33 5.871 1.098 -13.799 245 HB2 SER 33 2HB SER 33 3.330 0.676 -14.148 246 HB3 SER 33 3HB SER 33 3.819 -0.973 -14.536 247 HG SER 33 HG SER 33 5.078 -0.627 -12.402 248 H GLY 34 H GLY 34 4.995 -1.628 -15.929 249 HA2 GLY 34 2HA GLY 34 6.931 -2.859 -16.939 250 HA3 GLY 34 3HA GLY 34 7.652 -2.780 -15.338 251 H MET 35 H MET 35 4.280 -3.469 -16.155 252 HA MET 35 HA MET 35 4.245 -5.753 -14.445 253 HB2 MET 35 2HB MET 35 2.161 -5.047 -16.505 254 HB3 MET 35 3HB MET 35 1.943 -5.956 -15.016 255 HG2 MET 35 2HG MET 35 2.296 -3.982 -13.696 256 HG3 MET 35 3HG MET 35 2.698 -3.048 -15.136 257 HE1 MET 35 3HE MET 35 -1.506 -4.700 -14.190 258 HE2 MET 35 1HE MET 35 -0.165 -5.736 -14.681 259 HE3 MET 35 2HE MET 35 -0.105 -4.890 -13.134 260 H SER 36 H SER 36 3.924 -5.360 -17.973 261 HA SER 36 HA SER 36 3.742 -8.035 -18.667 262 HB2 SER 36 2HB SER 36 4.210 -7.379 -20.871 263 HB3 SER 36 3HB SER 36 3.547 -5.916 -20.144 264 HG SER 36 HG SER 36 5.993 -6.338 -21.205 265 H LYS 37 H LYS 37 6.559 -6.120 -17.850 266 HA LYS 37 HA LYS 37 8.546 -7.888 -18.766 267 HB2 LYS 37 2HB LYS 37 8.829 -6.117 -16.345 268 HB3 LYS 37 3HB LYS 37 10.079 -6.620 -17.475 269 HG2 LYS 37 2HG LYS 37 7.847 -4.664 -17.958 270 HG3 LYS 37 3HG LYS 37 9.582 -4.340 -17.912 271 HD2 LYS 37 2HD LYS 37 9.597 -6.143 -19.853 272 HD3 LYS 37 3HD LYS 37 7.931 -5.592 -20.047 273 HE2 LYS 37 2HE LYS 37 10.297 -3.730 -19.946 274 HE3 LYS 37 3HE LYS 37 9.648 -4.392 -21.446 275 HZ1 LYS 37 3HZ LYS 37 7.452 -3.418 -20.697 276 HZ2 LYS 37 1HZ LYS 37 8.636 -2.316 -21.193 277 HZ3 LYS 37 2HZ LYS 37 8.334 -2.547 -19.545 278 H LYS 38 H LYS 38 6.358 -8.129 -16.172 279 HA LYS 38 HA LYS 38 8.009 -9.926 -14.600 280 HB2 LYS 38 2HB LYS 38 5.078 -9.331 -14.207 281 HB3 LYS 38 3HB LYS 38 6.218 -9.954 -13.022 282 HG2 LYS 38 2HG LYS 38 6.393 -7.215 -14.256 283 HG3 LYS 38 3HG LYS 38 5.618 -7.566 -12.709 284 HD2 LYS 38 2HD LYS 38 7.603 -7.332 -11.731 285 HD3 LYS 38 3HD LYS 38 8.147 -8.774 -12.593 286 HE2 LYS 38 2HE LYS 38 8.568 -7.121 -14.553 287 HE3 LYS 38 3HE LYS 38 8.523 -5.888 -13.293 288 HZ1 LYS 38 3HZ LYS 38 10.512 -7.960 -13.795 289 HZ2 LYS 38 1HZ LYS 38 10.188 -7.595 -12.175 290 HZ3 LYS 38 2HZ LYS 38 10.714 -6.379 -13.227 291 H SER 39 H SER 39 6.103 -11.761 -13.739 292 HA SER 39 HA SER 39 5.554 -13.290 -16.199 293 HB2 SER 39 2HB SER 39 6.737 -14.165 -13.580 294 HB3 SER 39 3HB SER 39 5.871 -15.320 -14.593 295 HG SER 39 HG SER 39 7.349 -14.464 -16.318 296 H SER 40 H SER 40 3.799 -14.860 -16.028 297 HA SER 40 HA SER 40 1.425 -13.756 -15.126 298 HB2 SER 40 2HB SER 40 0.829 -16.424 -15.156 299 HB3 SER 40 3HB SER 40 0.875 -15.395 -16.588 300 HG SER 40 HG SER 40 2.818 -16.193 -17.123 301 H SER 41 H SER 41 3.747 -15.718 -13.436 302 HA SER 41 HA SER 41 2.014 -16.373 -11.243 303 HB2 SER 41 2HB SER 41 5.002 -16.594 -11.633 304 HB3 SER 41 3HB SER 41 4.188 -17.093 -10.151 305 HG SER 41 HG SER 41 4.396 -18.863 -11.520 306 H GLN 42 H GLN 42 4.194 -13.785 -12.041 307 HA GLN 42 HA GLN 42 4.246 -12.739 -9.341 308 HB2 GLN 42 2HB GLN 42 5.575 -12.106 -11.908 309 HB3 GLN 42 3HB GLN 42 5.303 -10.747 -10.825 310 HG2 GLN 42 2HG GLN 42 6.436 -12.073 -9.028 311 HG3 GLN 42 3HG GLN 42 6.865 -13.252 -10.266 312 HE21 GLN 42 1HE2 GLN 42 7.045 -9.772 -9.618 313 HE22 GLN 42 2HE2 GLN 42 8.613 -9.549 -10.308 314 H LEU 43 H LEU 43 2.618 -12.102 -12.381 315 HA LEU 43 HA LEU 43 1.467 -9.618 -11.582 316 HB2 LEU 43 2HB LEU 43 0.475 -11.505 -13.709 317 HB3 LEU 43 3HB LEU 43 0.144 -9.779 -13.575 318 HG LEU 43 HG LEU 43 2.981 -10.594 -13.863 319 HD11 LEU 43 1HD1 LEU 43 0.883 -11.029 -15.937 320 HD12 LEU 43 2HD1 LEU 43 2.299 -12.004 -15.546 321 HD13 LEU 43 3HD1 LEU 43 2.489 -10.486 -16.423 322 HD21 LEU 43 3HD2 LEU 43 1.221 -8.299 -14.527 323 HD22 LEU 43 1HD2 LEU 43 2.625 -8.584 -15.557 324 HD23 LEU 43 2HD2 LEU 43 2.840 -8.323 -13.826 325 H LYS 44 H LYS 44 0.363 -12.975 -11.591 326 HA LYS 44 HA LYS 44 -2.301 -12.546 -10.871 327 HB2 LYS 44 2HB LYS 44 -2.423 -14.827 -10.450 328 HB3 LYS 44 3HB LYS 44 -1.069 -14.724 -11.567 329 HG2 LYS 44 2HG LYS 44 0.507 -14.967 -9.792 330 HG3 LYS 44 3HG LYS 44 -0.765 -14.828 -8.576 331 HD2 LYS 44 2HD LYS 44 -0.047 -17.159 -8.923 332 HD3 LYS 44 3HD LYS 44 -1.749 -16.914 -9.323 333 HE2 LYS 44 2HE LYS 44 -1.419 -17.590 -11.416 334 HE3 LYS 44 3HE LYS 44 -0.089 -16.454 -11.629 335 HZ1 LYS 44 3HZ LYS 44 0.757 -18.630 -11.960 336 HZ2 LYS 44 1HZ LYS 44 0.057 -19.205 -10.531 337 HZ3 LYS 44 2HZ LYS 44 1.340 -18.106 -10.461 338 H GLU 45 H GLU 45 0.574 -12.149 -9.057 339 HA GLU 45 HA GLU 45 -0.504 -12.556 -6.455 340 HB2 GLU 45 2HB GLU 45 1.908 -10.975 -7.362 341 HB3 GLU 45 3HB GLU 45 1.524 -11.341 -5.686 342 HG2 GLU 45 2HG GLU 45 1.665 -13.640 -7.528 343 HG3 GLU 45 3HG GLU 45 3.182 -12.813 -7.178 344 H ILE 46 H ILE 46 0.050 -9.670 -8.445 345 HA ILE 46 HA ILE 46 -0.663 -7.688 -6.681 346 HB ILE 46 HB ILE 46 -1.304 -7.831 -9.629 347 HG12 ILE 46 2HG1 ILE 46 0.827 -6.043 -8.761 348 HG13 ILE 46 3HG1 ILE 46 1.152 -7.719 -8.333 349 HG21 ILE 46 1HG2 ILE 46 -2.516 -5.994 -9.274 350 HG22 ILE 46 2HG2 ILE 46 -1.939 -5.839 -7.615 351 HG23 ILE 46 3HG2 ILE 46 -0.989 -5.176 -8.945 352 HD11 ILE 46 3HD1 ILE 46 0.229 -7.758 -10.977 353 HD12 ILE 46 1HD1 ILE 46 1.371 -6.419 -10.868 354 HD13 ILE 46 2HD1 ILE 46 1.869 -8.044 -10.396 355 H PHE 47 H PHE 47 -2.751 -9.886 -8.451 356 HA PHE 47 HA PHE 47 -5.207 -8.644 -8.123 357 HB2 PHE 47 2HB PHE 47 -5.528 -10.479 -9.414 358 HB3 PHE 47 3HB PHE 47 -4.276 -11.401 -8.589 359 HD1 PHE 47 HD1 PHE 47 -4.795 -12.694 -6.592 360 HD2 PHE 47 HD2 PHE 47 -7.817 -10.567 -8.703 361 HE1 PHE 47 HE1 PHE 47 -6.524 -13.983 -5.408 362 HE2 PHE 47 HE2 PHE 47 -9.551 -11.851 -7.521 363 HZ PHE 47 HZ PHE 47 -8.906 -13.562 -5.871 364 H ARG 48 H ARG 48 -3.416 -10.702 -5.880 365 HA ARG 48 HA ARG 48 -5.423 -10.932 -3.920 366 HB2 ARG 48 2HB ARG 48 -2.727 -11.752 -4.242 367 HB3 ARG 48 3HB ARG 48 -2.833 -10.911 -2.701 368 HG2 ARG 48 2HG ARG 48 -4.624 -13.181 -3.537 369 HG3 ARG 48 3HG ARG 48 -3.189 -13.346 -2.523 370 HD2 ARG 48 2HD ARG 48 -4.869 -11.265 -1.494 371 HD3 ARG 48 3HD ARG 48 -5.818 -12.734 -1.723 372 HE ARG 48 HE ARG 48 -3.596 -13.622 -0.461 373 HH11 ARG 48 1HH1 ARG 48 -5.881 -11.083 0.211 374 HH12 ARG 48 2HH1 ARG 48 -5.695 -11.193 1.931 375 HH21 ARG 48 1HH2 ARG 48 -3.343 -13.776 1.801 376 HH22 ARG 48 2HH2 ARG 48 -4.251 -12.724 2.833 377 H ILE 49 H ILE 49 -3.571 -8.272 -4.890 378 HA ILE 49 HA ILE 49 -3.864 -6.910 -2.312 379 HB ILE 49 HB ILE 49 -2.466 -5.893 -4.785 380 HG12 ILE 49 2HG1 ILE 49 -1.386 -7.948 -4.032 381 HG13 ILE 49 3HG1 ILE 49 -0.370 -6.560 -3.658 382 HG21 ILE 49 1HG2 ILE 49 -1.283 -4.517 -2.958 383 HG22 ILE 49 2HG2 ILE 49 -2.915 -4.053 -3.436 384 HG23 ILE 49 3HG2 ILE 49 -2.657 -4.959 -1.946 385 HD11 ILE 49 3HD1 ILE 49 -2.169 -7.973 -1.704 386 HD12 ILE 49 1HD1 ILE 49 -0.426 -8.198 -1.843 387 HD13 ILE 49 2HD1 ILE 49 -1.077 -6.636 -1.346 388 H LEU 50 H LEU 50 -5.458 -7.251 -5.249 389 HA LEU 50 HA LEU 50 -6.659 -4.587 -5.156 390 HB2 LEU 50 2HB LEU 50 -6.417 -6.726 -7.181 391 HB3 LEU 50 3HB LEU 50 -7.895 -5.767 -7.224 392 HG LEU 50 HG LEU 50 -5.974 -3.829 -7.098 393 HD11 LEU 50 1HD1 LEU 50 -4.897 -5.916 -8.978 394 HD12 LEU 50 2HD1 LEU 50 -4.257 -5.656 -7.355 395 HD13 LEU 50 3HD1 LEU 50 -4.184 -4.361 -8.550 396 HD21 LEU 50 3HD2 LEU 50 -6.356 -4.253 -9.810 397 HD22 LEU 50 1HD2 LEU 50 -7.362 -3.270 -8.746 398 HD23 LEU 50 2HD2 LEU 50 -7.789 -4.954 -9.056 399 H ASP 51 H ASP 51 -7.352 -7.914 -4.461 400 HA ASP 51 HA ASP 51 -10.172 -7.774 -4.442 401 HB2 ASP 51 2HB ASP 51 -8.618 -9.849 -4.370 402 HB3 ASP 51 3HB ASP 51 -8.602 -9.587 -2.628 403 H ASN 52 H ASN 52 -11.446 -6.650 -3.141 404 HA ASN 52 HA ASN 52 -10.422 -5.851 -0.502 405 HB2 ASN 52 2HB ASN 52 -11.976 -4.480 -2.560 406 HB3 ASN 52 3HB ASN 52 -12.704 -4.352 -0.962 407 HD21 ASN 52 1HD2 ASN 52 -9.470 -4.200 -2.421 408 HD22 ASN 52 2HD2 ASN 52 -8.958 -2.801 -1.546 409 H ASP 53 H ASP 53 -11.869 -8.385 -1.428 410 HA ASP 53 HA ASP 53 -13.604 -8.553 0.884 411 HB2 ASP 53 2HB ASP 53 -15.398 -9.634 -0.708 412 HB3 ASP 53 3HB ASP 53 -15.353 -7.889 -0.469 413 H GLN 54 H GLN 54 -11.224 -9.790 -0.840 414 HA GLN 54 HA GLN 54 -10.311 -11.853 -1.199 415 HB2 GLN 54 2HB GLN 54 -11.764 -12.921 1.172 416 HB3 GLN 54 3HB GLN 54 -10.071 -13.086 0.726 417 HG2 GLN 54 2HG GLN 54 -11.353 -10.585 1.803 418 HG3 GLN 54 3HG GLN 54 -10.383 -11.724 2.735 419 HE21 GLN 54 1HE2 GLN 54 -10.362 -9.003 0.727 420 HE22 GLN 54 2HE2 GLN 54 -8.651 -8.840 0.553 421 H SER 55 H SER 55 -13.058 -11.334 -2.278 422 HA SER 55 HA SER 55 -14.517 -13.775 -2.149 423 HB2 SER 55 2HB SER 55 -15.892 -12.829 -3.924 424 HB3 SER 55 3HB SER 55 -15.558 -11.592 -2.712 425 HG SER 55 HG SER 55 -15.260 -11.127 -5.105 426 H GLY 56 H GLY 56 -11.714 -12.845 -3.808 427 HA2 GLY 56 2HA GLY 56 -10.394 -14.489 -4.943 428 HA3 GLY 56 3HA GLY 56 -11.879 -15.284 -5.443 429 H PHE 57 H PHE 57 -12.711 -12.265 -5.954 430 HA PHE 57 HA PHE 57 -11.269 -11.873 -8.465 431 HB2 PHE 57 2HB PHE 57 -14.289 -11.931 -8.342 432 HB3 PHE 57 3HB PHE 57 -13.296 -11.673 -9.773 433 HD1 PHE 57 HD1 PHE 57 -14.544 -14.135 -7.378 434 HD2 PHE 57 HD2 PHE 57 -12.174 -13.513 -10.858 435 HE1 PHE 57 HE1 PHE 57 -14.550 -16.557 -7.810 436 HE2 PHE 57 HE2 PHE 57 -12.177 -15.934 -11.297 437 HZ PHE 57 HZ PHE 57 -13.366 -17.460 -9.772 438 H ILE 58 H ILE 58 -11.922 -9.755 -9.503 439 HA ILE 58 HA ILE 58 -12.493 -7.765 -7.404 440 HB ILE 58 HB ILE 58 -10.716 -7.421 -9.823 441 HG12 ILE 58 2HG1 ILE 58 -9.678 -7.170 -7.053 442 HG13 ILE 58 3HG1 ILE 58 -10.050 -8.798 -7.610 443 HG21 ILE 58 1HG2 ILE 58 -11.908 -5.374 -9.172 444 HG22 ILE 58 2HG2 ILE 58 -11.267 -5.534 -7.537 445 HG23 ILE 58 3HG2 ILE 58 -10.172 -5.247 -8.889 446 HD11 ILE 58 3HD1 ILE 58 -7.689 -8.094 -7.941 447 HD12 ILE 58 1HD1 ILE 58 -8.510 -8.606 -9.415 448 HD13 ILE 58 2HD1 ILE 58 -8.264 -6.889 -9.093 449 H GLU 59 H GLU 59 -14.582 -7.241 -7.722 450 HA GLU 59 HA GLU 59 -15.740 -7.047 -10.344 451 HB2 GLU 59 2HB GLU 59 -16.983 -5.979 -7.822 452 HB3 GLU 59 3HB GLU 59 -17.782 -6.603 -9.258 453 HG2 GLU 59 2HG GLU 59 -18.075 -8.391 -7.915 454 HG3 GLU 59 3HG GLU 59 -16.482 -8.807 -8.545 455 H GLU 60 H GLU 60 -16.919 -5.059 -11.035 456 HA GLU 60 HA GLU 60 -15.195 -2.933 -11.434 457 HB2 GLU 60 2HB GLU 60 -18.177 -3.200 -11.630 458 HB3 GLU 60 3HB GLU 60 -17.410 -1.643 -11.904 459 HG2 GLU 60 2HG GLU 60 -16.240 -2.425 -13.780 460 HG3 GLU 60 3HG GLU 60 -16.565 -4.111 -13.381 461 H ASP 61 H ASP 61 -17.385 -3.548 -8.794 462 HA ASP 61 HA ASP 61 -17.542 -0.970 -7.703 463 HB2 ASP 61 2HB ASP 61 -17.924 -3.736 -6.661 464 HB3 ASP 61 3HB ASP 61 -17.764 -2.432 -5.488 465 H GLU 62 H GLU 62 -14.973 -3.266 -7.754 466 HA GLU 62 HA GLU 62 -13.468 -1.653 -5.802 467 HB2 GLU 62 2HB GLU 62 -11.971 -3.882 -6.006 468 HB3 GLU 62 3HB GLU 62 -13.265 -3.690 -4.831 469 HG2 GLU 62 2HG GLU 62 -14.787 -4.732 -6.589 470 HG3 GLU 62 3HG GLU 62 -13.304 -5.196 -7.421 471 H LEU 63 H LEU 63 -13.694 -2.616 -9.063 472 HA LEU 63 HA LEU 63 -10.949 -2.334 -9.782 473 HB2 LEU 63 2HB LEU 63 -13.209 -3.286 -11.013 474 HB3 LEU 63 3HB LEU 63 -12.904 -1.783 -11.882 475 HG LEU 63 HG LEU 63 -11.044 -4.142 -11.625 476 HD11 LEU 63 1HD1 LEU 63 -13.085 -3.455 -13.484 477 HD12 LEU 63 2HD1 LEU 63 -11.997 -4.841 -13.498 478 HD13 LEU 63 3HD1 LEU 63 -11.522 -3.341 -14.292 479 HD21 LEU 63 3HD2 LEU 63 -9.635 -2.257 -11.561 480 HD22 LEU 63 1HD2 LEU 63 -10.610 -1.388 -12.747 481 HD23 LEU 63 2HD2 LEU 63 -9.647 -2.778 -13.247 482 H LYS 64 H LYS 64 -13.661 -0.154 -9.497 483 HA LYS 64 HA LYS 64 -12.636 2.006 -10.983 484 HB2 LYS 64 2HB LYS 64 -14.198 3.381 -9.539 485 HB3 LYS 64 3HB LYS 64 -14.940 2.055 -10.425 486 HG2 LYS 64 2HG LYS 64 -15.362 0.842 -8.535 487 HG3 LYS 64 3HG LYS 64 -14.022 1.563 -7.640 488 HD2 LYS 64 2HD LYS 64 -16.190 2.310 -6.776 489 HD3 LYS 64 3HD LYS 64 -15.261 3.654 -7.445 490 HE2 LYS 64 2HE LYS 64 -16.723 3.994 -9.136 491 HE3 LYS 64 3HE LYS 64 -17.072 2.276 -9.321 492 HZ1 LYS 64 3HZ LYS 64 -18.886 3.847 -8.413 493 HZ2 LYS 64 1HZ LYS 64 -18.046 3.722 -6.950 494 HZ3 LYS 64 2HZ LYS 64 -18.672 2.335 -7.686 495 H TYR 65 H TYR 65 -11.946 0.831 -7.792 496 HA TYR 65 HA TYR 65 -10.507 3.262 -7.066 497 HB2 TYR 65 2HB TYR 65 -11.269 0.761 -5.583 498 HB3 TYR 65 3HB TYR 65 -10.054 1.857 -4.936 499 HD1 TYR 65 HD1 TYR 65 -11.081 4.490 -5.508 500 HD2 TYR 65 HD2 TYR 65 -13.195 0.992 -4.327 501 HE1 TYR 65 HE1 TYR 65 -12.857 5.895 -4.547 502 HE2 TYR 65 HE2 TYR 65 -14.978 2.387 -3.364 503 HH TYR 65 HH TYR 65 -14.951 4.999 -2.401 504 H PHE 66 H PHE 66 -9.522 1.752 -9.283 505 HA PHE 66 HA PHE 66 -7.341 0.104 -8.509 506 HB2 PHE 66 2HB PHE 66 -8.161 -0.226 -10.702 507 HB3 PHE 66 3HB PHE 66 -8.079 1.492 -11.078 508 HD1 PHE 66 HD1 PHE 66 -5.820 -1.297 -10.059 509 HD2 PHE 66 HD2 PHE 66 -6.352 2.216 -12.402 510 HE1 PHE 66 HE1 PHE 66 -3.594 -1.627 -11.053 511 HE2 PHE 66 HE2 PHE 66 -4.128 1.891 -13.401 512 HZ PHE 66 HZ PHE 66 -2.746 -0.033 -12.728 513 H LEU 67 H LEU 67 -7.752 3.530 -8.952 514 HA LEU 67 HA LEU 67 -4.910 4.075 -8.950 515 HB2 LEU 67 2HB LEU 67 -6.966 6.184 -8.504 516 HB3 LEU 67 3HB LEU 67 -5.445 6.269 -9.391 517 HG LEU 67 HG LEU 67 -8.077 5.138 -10.305 518 HD11 LEU 67 1HD1 LEU 67 -6.648 6.825 -12.139 519 HD12 LEU 67 2HD1 LEU 67 -6.837 7.628 -10.581 520 HD13 LEU 67 3HD1 LEU 67 -8.255 7.032 -11.443 521 HD21 LEU 67 3HD2 LEU 67 -6.485 3.505 -10.987 522 HD22 LEU 67 1HD2 LEU 67 -5.337 4.746 -11.493 523 HD23 LEU 67 2HD2 LEU 67 -6.836 4.511 -12.393 524 H GLN 68 H GLN 68 -7.189 3.354 -6.627 525 HA GLN 68 HA GLN 68 -5.987 5.021 -4.553 526 HB2 GLN 68 2HB GLN 68 -8.542 3.697 -4.931 527 HB3 GLN 68 3HB GLN 68 -7.854 3.330 -3.355 528 HG2 GLN 68 2HG GLN 68 -8.737 5.243 -2.668 529 HG3 GLN 68 3HG GLN 68 -7.472 6.046 -3.597 530 HE21 GLN 68 1HE2 GLN 68 -8.340 5.513 -6.166 531 HE22 GLN 68 2HE2 GLN 68 -9.822 6.354 -6.448 532 H ARG 69 H ARG 69 -5.269 2.174 -5.987 533 HA ARG 69 HA ARG 69 -4.366 0.876 -3.512 534 HB2 ARG 69 2HB ARG 69 -4.680 -0.198 -6.319 535 HB3 ARG 69 3HB ARG 69 -3.991 -1.114 -4.985 536 HG2 ARG 69 2HG ARG 69 -5.994 -1.547 -4.077 537 HG3 ARG 69 3HG ARG 69 -6.621 0.063 -4.439 538 HD2 ARG 69 2HD ARG 69 -7.283 -0.536 -6.577 539 HD3 ARG 69 3HD ARG 69 -6.169 -1.901 -6.647 540 HE ARG 69 HE ARG 69 -7.832 -3.201 -5.800 541 HH11 ARG 69 1HH1 ARG 69 -8.461 0.104 -4.905 542 HH12 ARG 69 2HH1 ARG 69 -9.978 -0.253 -4.147 543 HH21 ARG 69 1HH2 ARG 69 -9.827 -3.684 -4.805 544 HH22 ARG 69 2HH2 ARG 69 -10.753 -2.408 -4.090 545 H PHE 70 H PHE 70 -3.275 2.321 -6.490 546 HA PHE 70 HA PHE 70 -0.499 1.600 -5.890 547 HB2 PHE 70 2HB PHE 70 -1.800 2.761 -8.355 548 HB3 PHE 70 3HB PHE 70 -0.057 2.593 -8.174 549 HD1 PHE 70 HD1 PHE 70 -3.156 0.541 -7.860 550 HD2 PHE 70 HD2 PHE 70 0.935 0.706 -9.021 551 HE1 PHE 70 HE1 PHE 70 -3.300 -1.773 -8.685 552 HE2 PHE 70 HE2 PHE 70 0.798 -1.607 -9.848 553 HZ PHE 70 HZ PHE 70 -1.322 -2.849 -9.681 554 H GLU 71 H GLU 71 -2.702 4.150 -5.556 555 HA GLU 71 HA GLU 71 -0.492 6.033 -5.052 556 HB2 GLU 71 2HB GLU 71 -2.108 6.473 -7.052 557 HB3 GLU 71 3HB GLU 71 -3.241 6.967 -5.802 558 HG2 GLU 71 2HG GLU 71 -2.105 8.894 -6.674 559 HG3 GLU 71 3HG GLU 71 -1.612 8.622 -5.004 560 H SER 72 H SER 72 -3.642 4.838 -4.070 561 HA SER 72 HA SER 72 -4.759 4.902 -2.089 562 HB2 SER 72 2HB SER 72 -1.914 5.206 -1.298 563 HB3 SER 72 3HB SER 72 -3.118 5.633 -0.082 564 HG SER 72 HG SER 72 -2.689 3.464 0.130 565 H GLY 73 H GLY 73 -5.730 6.840 -3.227 566 HA2 GLY 73 2HA GLY 73 -6.641 8.770 -1.701 567 HA3 GLY 73 3HA GLY 73 -5.020 9.390 -1.972 568 H ALA 74 H ALA 74 -5.393 7.936 -4.737 569 HA ALA 74 HA ALA 74 -6.060 10.312 -6.164 570 HB1 ALA 74 1HB ALA 74 -5.955 8.699 -8.162 571 HB2 ALA 74 2HB ALA 74 -4.482 8.970 -7.230 572 HB3 ALA 74 3HB ALA 74 -5.423 7.500 -6.983 573 H ARG 75 H ARG 75 -7.594 9.801 -8.228 574 HA ARG 75 HA ARG 75 -10.224 9.544 -7.069 575 HB2 ARG 75 2HB ARG 75 -11.056 10.377 -9.125 576 HB3 ARG 75 3HB ARG 75 -9.564 11.256 -8.818 577 HG2 ARG 75 2HG ARG 75 -8.395 9.673 -10.344 578 HG3 ARG 75 3HG ARG 75 -9.968 8.977 -10.738 579 HD2 ARG 75 2HD ARG 75 -8.936 11.736 -11.313 580 HD3 ARG 75 3HD ARG 75 -9.549 10.531 -12.445 581 HE ARG 75 HE ARG 75 -11.073 12.468 -11.032 582 HH11 ARG 75 1HH1 ARG 75 -11.174 9.207 -12.248 583 HH12 ARG 75 2HH1 ARG 75 -12.898 9.184 -12.414 584 HH21 ARG 75 1HH2 ARG 75 -13.344 12.449 -11.247 585 HH22 ARG 75 2HH2 ARG 75 -14.131 11.029 -11.845 586 H VAL 76 H VAL 76 -11.849 8.393 -8.757 587 HA VAL 76 HA VAL 76 -10.947 5.607 -8.821 588 HB VAL 76 HB VAL 76 -13.199 4.938 -8.778 589 HG11 VAL 76 1HG1 VAL 76 -13.985 5.827 -6.775 590 HG12 VAL 76 2HG1 VAL 76 -12.251 6.144 -6.708 591 HG13 VAL 76 3HG1 VAL 76 -13.369 7.439 -7.137 592 HG21 VAL 76 3HG2 VAL 76 -13.655 7.528 -10.061 593 HG22 VAL 76 1HG2 VAL 76 -14.538 6.009 -10.221 594 HG23 VAL 76 2HG2 VAL 76 -14.881 7.091 -8.871 595 H LEU 77 H LEU 77 -12.606 4.496 -10.659 596 HA LEU 77 HA LEU 77 -11.601 5.647 -13.168 597 HB2 LEU 77 2HB LEU 77 -12.636 2.862 -12.670 598 HB3 LEU 77 3HB LEU 77 -11.832 3.449 -14.125 599 HG LEU 77 HG LEU 77 -10.598 2.988 -11.414 600 HD11 LEU 77 1HD1 LEU 77 -10.159 1.720 -14.112 601 HD12 LEU 77 2HD1 LEU 77 -10.905 0.969 -12.703 602 HD13 LEU 77 3HD1 LEU 77 -9.195 1.401 -12.670 603 HD21 LEU 77 3HD2 LEU 77 -9.748 4.673 -13.663 604 HD22 LEU 77 1HD2 LEU 77 -8.527 3.546 -13.072 605 HD23 LEU 77 2HD2 LEU 77 -9.263 4.707 -11.967 606 H THR 78 H THR 78 -12.953 6.318 -14.729 607 HA THR 78 HA THR 78 -15.747 6.571 -14.121 608 HB THR 78 HB THR 78 -14.518 8.361 -15.296 609 HG1 THR 78 HG1 THR 78 -16.279 8.872 -16.422 610 HG21 THR 78 3HG2 THR 78 -14.589 7.312 -17.950 611 HG22 THR 78 1HG2 THR 78 -13.644 6.225 -16.934 612 HG23 THR 78 2HG2 THR 78 -13.209 7.930 -17.044 613 H ALA 79 H ALA 79 -17.208 6.231 -16.259 614 HA ALA 79 HA ALA 79 -17.499 3.425 -16.501 615 HB1 ALA 79 1HB ALA 79 -19.401 4.950 -16.617 616 HB2 ALA 79 2HB ALA 79 -18.779 5.619 -18.126 617 HB3 ALA 79 3HB ALA 79 -19.307 3.938 -18.059 618 H SER 80 H SER 80 -15.459 5.590 -18.075 619 HA SER 80 HA SER 80 -15.254 3.907 -20.471 620 HB2 SER 80 2HB SER 80 -15.518 6.408 -20.711 621 HB3 SER 80 3HB SER 80 -13.920 6.578 -19.986 622 HG SER 80 HG SER 80 -14.582 5.957 -22.525 623 H GLU 81 H GLU 81 -13.840 4.332 -17.475 624 HA GLU 81 HA GLU 81 -11.181 3.491 -18.374 625 HB2 GLU 81 2HB GLU 81 -12.210 4.514 -15.731 626 HB3 GLU 81 3HB GLU 81 -10.599 3.837 -15.923 627 HG2 GLU 81 2HG GLU 81 -10.088 5.556 -17.595 628 HG3 GLU 81 3HG GLU 81 -11.692 6.248 -17.355 629 H THR 82 H THR 82 -13.428 2.622 -15.740 630 HA THR 82 HA THR 82 -12.285 0.172 -15.100 631 HB THR 82 HB THR 82 -15.001 -0.220 -14.656 632 HG1 THR 82 HG1 THR 82 -15.659 1.802 -15.172 633 HG21 THR 82 3HG2 THR 82 -12.643 0.100 -13.184 634 HG22 THR 82 1HG2 THR 82 -14.209 -0.444 -12.583 635 HG23 THR 82 2HG2 THR 82 -13.780 1.265 -12.507 636 H LYS 83 H LYS 83 -14.982 0.847 -17.322 637 HA LYS 83 HA LYS 83 -15.598 -1.726 -18.097 638 HB2 LYS 83 2HB LYS 83 -15.815 0.947 -19.375 639 HB3 LYS 83 3HB LYS 83 -16.005 -0.453 -20.422 640 HG2 LYS 83 2HG LYS 83 -17.737 -1.285 -18.781 641 HG3 LYS 83 3HG LYS 83 -17.661 0.314 -18.037 642 HD2 LYS 83 2HD LYS 83 -19.386 0.632 -19.511 643 HD3 LYS 83 3HD LYS 83 -18.022 1.116 -20.521 644 HE2 LYS 83 2HE LYS 83 -17.959 -1.125 -21.502 645 HE3 LYS 83 3HE LYS 83 -19.319 -1.608 -20.490 646 HZ1 LYS 83 3HZ LYS 83 -19.650 0.744 -22.198 647 HZ2 LYS 83 1HZ LYS 83 -20.787 -0.418 -21.728 648 HZ3 LYS 83 2HZ LYS 83 -19.663 -0.777 -22.941 649 H THR 84 H THR 84 -13.126 0.429 -19.453 650 HA THR 84 HA THR 84 -12.244 -1.182 -21.537 651 HB THR 84 HB THR 84 -10.514 0.623 -19.836 652 HG1 THR 84 HG1 THR 84 -11.066 2.087 -21.699 653 HG21 THR 84 3HG2 THR 84 -9.419 -0.995 -21.482 654 HG22 THR 84 1HG2 THR 84 -9.016 0.713 -21.652 655 HG23 THR 84 2HG2 THR 84 -10.175 -0.033 -22.752 656 H PHE 85 H PHE 85 -10.915 -0.976 -18.233 657 HA PHE 85 HA PHE 85 -8.966 -2.923 -18.451 658 HB2 PHE 85 2HB PHE 85 -9.481 -1.348 -16.486 659 HB3 PHE 85 3HB PHE 85 -10.619 -2.582 -15.957 660 HD1 PHE 85 HD2 PHE 85 -9.802 -4.814 -15.296 661 HD2 PHE 85 HD1 PHE 85 -7.141 -1.622 -16.216 662 HE1 PHE 85 HE2 PHE 85 -7.973 -6.020 -14.177 663 HE2 PHE 85 HE1 PHE 85 -5.307 -2.824 -15.099 664 HZ PHE 85 HZ PHE 85 -5.722 -5.025 -14.076 665 H LEU 86 H LEU 86 -12.340 -3.337 -17.396 666 HA LEU 86 HA LEU 86 -12.202 -6.127 -17.042 667 HB2 LEU 86 2HB LEU 86 -13.974 -4.846 -16.049 668 HB3 LEU 86 3HB LEU 86 -14.534 -4.314 -17.633 669 HG LEU 86 HG LEU 86 -14.987 -6.812 -18.076 670 HD11 LEU 86 1HD1 LEU 86 -14.966 -6.862 -15.064 671 HD12 LEU 86 2HD1 LEU 86 -13.726 -7.591 -16.084 672 HD13 LEU 86 3HD1 LEU 86 -15.385 -8.185 -16.152 673 HD21 LEU 86 3HD2 LEU 86 -17.118 -6.240 -17.779 674 HD22 LEU 86 1HD2 LEU 86 -16.527 -4.728 -17.090 675 HD23 LEU 86 2HD2 LEU 86 -16.910 -6.087 -16.034 676 H ALA 87 H ALA 87 -12.922 -4.124 -19.838 677 HA ALA 87 HA ALA 87 -13.621 -6.411 -21.477 678 HB1 ALA 87 1HB ALA 87 -14.871 -4.485 -21.976 679 HB2 ALA 87 2HB ALA 87 -13.435 -3.461 -22.014 680 HB3 ALA 87 3HB ALA 87 -13.713 -4.638 -23.298 681 H ALA 88 H ALA 88 -10.794 -5.409 -20.313 682 HA ALA 88 HA ALA 88 -9.322 -6.044 -22.788 683 HB1 ALA 88 1HB ALA 88 -8.851 -3.782 -22.149 684 HB2 ALA 88 2HB ALA 88 -8.499 -4.274 -20.492 685 HB3 ALA 88 3HB ALA 88 -7.429 -4.766 -21.805 686 H ALA 89 H ALA 89 -10.040 -6.987 -19.605 687 HA ALA 89 HA ALA 89 -7.827 -8.936 -19.649 688 HB1 ALA 89 1HB ALA 89 -8.695 -7.116 -17.559 689 HB2 ALA 89 2HB ALA 89 -8.633 -8.793 -17.013 690 HB3 ALA 89 3HB ALA 89 -7.199 -8.038 -17.708 691 H ASP 90 H ASP 90 -11.072 -8.412 -18.256 692 HA ASP 90 HA ASP 90 -11.603 -11.134 -17.772 693 HB2 ASP 90 2HB ASP 90 -13.075 -8.614 -17.666 694 HB3 ASP 90 3HB ASP 90 -14.087 -9.971 -18.151 695 H HIS 91 H HIS 91 -13.265 -9.111 -20.189 696 HA HIS 91 HA HIS 91 -14.141 -9.599 -22.232 697 HB2 HIS 91 2HB HIS 91 -11.574 -10.047 -22.505 698 HB3 HIS 91 3HB HIS 91 -12.070 -11.733 -22.607 699 HD1 HIS 91 HD1 HIS 91 -10.774 -10.297 -25.010 700 HD2 HIS 91 HD2 HIS 91 -14.872 -10.632 -24.410 701 HE1 HIS 91 HE1 HIS 91 -11.810 -10.043 -27.287 702 H ASP 92 H ASP 92 -14.668 -11.385 -19.758 703 HA ASP 92 HA ASP 92 -15.837 -13.666 -21.207 704 HB2 ASP 92 2HB ASP 92 -16.004 -14.652 -18.835 705 HB3 ASP 92 3HB ASP 92 -14.407 -14.558 -19.572 706 H GLY 93 H GLY 93 -16.583 -10.754 -19.717 707 HA2 GLY 93 2HA GLY 93 -18.637 -9.739 -19.422 708 HA3 GLY 93 3HA GLY 93 -19.401 -11.216 -19.990 709 H ASP 94 H ASP 94 -17.155 -11.509 -17.404 710 HA ASP 94 HA ASP 94 -19.260 -12.392 -15.636 711 HB2 ASP 94 2HB ASP 94 -16.318 -12.138 -15.003 712 HB3 ASP 94 3HB ASP 94 -17.509 -13.146 -14.186 713 H GLY 95 H GLY 95 -16.978 -9.704 -15.826 714 HA2 GLY 95 2HA GLY 95 -17.344 -7.550 -14.977 715 HA3 GLY 95 3HA GLY 95 -18.677 -8.177 -14.020 716 H LYS 96 H LYS 96 -15.830 -10.025 -13.815 717 HA LYS 96 HA LYS 96 -14.770 -8.555 -11.539 718 HB2 LYS 96 2HB LYS 96 -14.861 -10.547 -10.070 719 HB3 LYS 96 3HB LYS 96 -16.457 -9.935 -10.485 720 HG2 LYS 96 2HG LYS 96 -15.672 -11.900 -12.405 721 HG3 LYS 96 3HG LYS 96 -15.471 -12.550 -10.776 722 HD2 LYS 96 2HD LYS 96 -17.959 -11.061 -11.146 723 HD3 LYS 96 3HD LYS 96 -17.822 -12.479 -12.188 724 HE2 LYS 96 2HE LYS 96 -18.069 -13.897 -10.471 725 HE3 LYS 96 3HE LYS 96 -16.982 -12.972 -9.436 726 HZ1 LYS 96 3HZ LYS 96 -19.864 -12.456 -9.918 727 HZ2 LYS 96 1HZ LYS 96 -18.845 -11.391 -9.086 728 HZ3 LYS 96 2HZ LYS 96 -19.138 -12.938 -8.468 729 H ILE 97 H ILE 97 -12.642 -8.514 -11.767 730 HA ILE 97 HA ILE 97 -11.271 -10.194 -13.611 731 HB ILE 97 HB ILE 97 -10.206 -8.285 -11.529 732 HG12 ILE 97 2HG1 ILE 97 -11.608 -7.424 -13.493 733 HG13 ILE 97 3HG1 ILE 97 -10.021 -6.697 -13.265 734 HG21 ILE 97 1HG2 ILE 97 -8.839 -10.046 -13.498 735 HG22 ILE 97 2HG2 ILE 97 -8.172 -8.442 -13.195 736 HG23 ILE 97 3HG2 ILE 97 -8.355 -9.586 -11.866 737 HD11 ILE 97 3HD1 ILE 97 -10.989 -7.658 -15.615 738 HD12 ILE 97 1HD1 ILE 97 -9.282 -7.426 -15.238 739 HD13 ILE 97 2HD1 ILE 97 -10.021 -9.015 -15.040 740 H GLY 98 H GLY 98 -9.675 -11.761 -13.207 741 HA2 GLY 98 2HA GLY 98 -9.631 -12.846 -10.464 742 HA3 GLY 98 3HA GLY 98 -9.926 -13.900 -11.839 743 H ALA 99 H ALA 99 -8.072 -15.117 -11.170 744 HA ALA 99 HA ALA 99 -5.491 -13.785 -11.612 745 HB1 ALA 99 1HB ALA 99 -5.996 -16.492 -10.385 746 HB2 ALA 99 2HB ALA 99 -4.474 -15.600 -10.414 747 HB3 ALA 99 3HB ALA 99 -5.834 -14.993 -9.469 748 H GLU 100 H GLU 100 -7.669 -15.287 -13.433 749 HA GLU 100 HA GLU 100 -5.648 -16.727 -15.023 750 HB2 GLU 100 2HB GLU 100 -7.708 -17.967 -13.954 751 HB3 GLU 100 3HB GLU 100 -8.574 -17.273 -15.317 752 HG2 GLU 100 2HG GLU 100 -6.649 -18.303 -16.724 753 HG3 GLU 100 3HG GLU 100 -6.396 -19.310 -15.300 754 H GLU 101 H GLU 101 -7.605 -14.029 -14.893 755 HA GLU 101 HA GLU 101 -7.493 -13.721 -17.821 756 HB2 GLU 101 2HB GLU 101 -9.540 -12.424 -17.747 757 HB3 GLU 101 3HB GLU 101 -9.814 -14.003 -17.025 758 HG2 GLU 101 2HG GLU 101 -9.148 -12.572 -14.837 759 HG3 GLU 101 3HG GLU 101 -9.915 -11.327 -15.821 760 H PHE 102 H PHE 102 -6.138 -12.743 -15.046 761 HA PHE 102 HA PHE 102 -6.052 -9.893 -15.594 762 HB2 PHE 102 2HB PHE 102 -6.165 -10.654 -13.266 763 HB3 PHE 102 3HB PHE 102 -4.656 -11.538 -13.472 764 HD1 PHE 102 HD2 PHE 102 -6.169 -8.191 -13.265 765 HD2 PHE 102 HD1 PHE 102 -2.554 -10.435 -13.377 766 HE1 PHE 102 HE2 PHE 102 -4.910 -6.190 -12.585 767 HE2 PHE 102 HE1 PHE 102 -1.289 -8.437 -12.696 768 HZ PHE 102 HZ PHE 102 -2.466 -6.311 -12.301 769 H GLN 103 H GLN 103 -3.477 -12.277 -14.959 770 HA GLN 103 HA GLN 103 -1.379 -10.859 -16.039 771 HB2 GLN 103 2HB GLN 103 -0.232 -13.021 -16.305 772 HB3 GLN 103 3HB GLN 103 -1.050 -12.898 -14.753 773 HG2 GLN 103 2HG GLN 103 -2.958 -14.057 -16.337 774 HG3 GLN 103 3HG GLN 103 -1.464 -14.763 -16.952 775 HE21 GLN 103 1HE2 GLN 103 -2.518 -13.794 -13.708 776 HE22 GLN 103 2HE2 GLN 103 -2.245 -15.333 -12.972 777 H GLU 104 H GLU 104 -3.731 -12.898 -17.681 778 HA GLU 104 HA GLU 104 -2.521 -13.108 -20.176 779 HB2 GLU 104 2HB GLU 104 -5.488 -12.767 -19.739 780 HB3 GLU 104 3HB GLU 104 -4.689 -13.620 -21.052 781 HG2 GLU 104 2HG GLU 104 -4.764 -14.436 -18.158 782 HG3 GLU 104 3HG GLU 104 -5.616 -15.201 -19.498 783 H MET 105 H MET 105 -4.240 -10.440 -18.713 784 HA MET 105 HA MET 105 -4.408 -8.934 -21.170 785 HB2 MET 105 2HB MET 105 -5.669 -7.408 -19.999 786 HB3 MET 105 3HB MET 105 -5.960 -8.857 -19.045 787 HG2 MET 105 2HG MET 105 -5.359 -7.648 -17.286 788 HG3 MET 105 3HG MET 105 -3.709 -7.796 -17.885 789 HE1 MET 105 3HE MET 105 -6.396 -4.750 -19.630 790 HE2 MET 105 1HE MET 105 -6.900 -6.178 -18.726 791 HE3 MET 105 2HE MET 105 -6.729 -4.628 -17.902 792 H VAL 106 H VAL 106 -2.064 -9.478 -18.778 793 HA VAL 106 HA VAL 106 -0.720 -6.934 -19.063 794 HB VAL 106 HB VAL 106 0.385 -9.435 -17.791 795 HG11 VAL 106 1HG1 VAL 106 1.375 -6.779 -18.188 796 HG12 VAL 106 2HG1 VAL 106 1.184 -7.087 -16.461 797 HG13 VAL 106 3HG1 VAL 106 2.174 -8.165 -17.447 798 HG21 VAL 106 3HG2 VAL 106 -1.946 -8.259 -17.011 799 HG22 VAL 106 1HG2 VAL 106 -0.862 -9.155 -15.947 800 HG23 VAL 106 2HG2 VAL 106 -0.764 -7.396 -16.027 801 H GLN 107 H GLN 107 0.740 -10.149 -19.360 802 HA GLN 107 HA GLN 107 2.695 -9.332 -21.195 803 HB2 GLN 107 2HB GLN 107 1.620 -12.109 -20.675 804 HB3 GLN 107 3HB GLN 107 3.110 -11.743 -21.535 805 HG2 GLN 107 2HG GLN 107 4.255 -11.515 -19.649 806 HG3 GLN 107 3HG GLN 107 3.024 -10.473 -18.937 807 HE21 GLN 107 1HE2 GLN 107 0.906 -11.866 -18.515 808 HE22 GLN 107 2HE2 GLN 107 1.195 -13.286 -17.575 809 H SER 108 H SER 108 -0.519 -10.666 -21.647 810 HA SER 108 HA SER 108 -0.187 -10.326 -24.557 811 HB2 SER 108 2HB SER 108 -0.595 -12.708 -23.528 812 HB3 SER 108 3HB SER 108 -2.266 -12.157 -23.411 813 HG SER 108 HG SER 108 -2.117 -11.673 -25.689 Start of MODEL 12 1 H1 SER 1 H SER 1 0.461 -0.399 -5.003 2 HA SER 1 HA SER 1 2.728 0.555 -3.459 3 HB2 SER 1 2HB SER 1 0.408 1.215 -2.857 4 HB3 SER 1 3HB SER 1 0.047 -0.473 -2.498 5 HG SER 1 HG SER 1 1.176 1.348 -0.920 6 H LEU 2 H LEU 2 1.894 -2.321 -4.816 7 HA LEU 2 HA LEU 2 2.225 -4.254 -2.860 8 HB2 LEU 2 2HB LEU 2 3.447 -4.615 -5.561 9 HB3 LEU 2 3HB LEU 2 2.572 -5.778 -4.568 10 HG LEU 2 HG LEU 2 1.047 -5.405 -6.231 11 HD11 LEU 2 1HD1 LEU 2 0.355 -4.479 -3.821 12 HD12 LEU 2 2HD1 LEU 2 -0.742 -4.481 -5.202 13 HD13 LEU 2 3HD1 LEU 2 0.127 -3.008 -4.768 14 HD21 LEU 2 3HD2 LEU 2 2.643 -3.218 -6.832 15 HD22 LEU 2 1HD2 LEU 2 1.054 -2.524 -6.508 16 HD23 LEU 2 2HD2 LEU 2 1.235 -3.777 -7.737 17 H THR 3 H THR 3 4.700 -2.597 -4.787 18 HA THR 3 HA THR 3 6.953 -2.387 -4.533 19 HB THR 3 HB THR 3 7.450 -2.955 -1.834 20 HG1 THR 3 HG1 THR 3 5.739 -1.926 -0.770 21 HG21 THR 3 3HG2 THR 3 7.565 -0.775 -3.639 22 HG22 THR 3 1HG2 THR 3 8.372 -0.943 -2.080 23 HG23 THR 3 2HG2 THR 3 6.774 -0.202 -2.171 24 H ASP 4 H ASP 4 5.617 -5.137 -4.782 25 HA ASP 4 HA ASP 4 7.995 -6.706 -4.029 26 HB2 ASP 4 2HB ASP 4 5.120 -7.243 -3.615 27 HB3 ASP 4 3HB ASP 4 6.064 -8.606 -4.210 28 H ILE 5 H ILE 5 6.081 -5.552 -6.525 29 HA ILE 5 HA ILE 5 7.133 -7.597 -8.369 30 HB ILE 5 HB ILE 5 4.610 -5.981 -8.748 31 HG12 ILE 5 2HG1 ILE 5 3.728 -8.504 -8.596 32 HG13 ILE 5 3HG1 ILE 5 5.136 -8.654 -7.550 33 HG21 ILE 5 1HG2 ILE 5 6.091 -6.915 -10.720 34 HG22 ILE 5 2HG2 ILE 5 5.269 -8.420 -10.314 35 HG23 ILE 5 3HG2 ILE 5 4.331 -7.000 -10.774 36 HD11 ILE 5 3HD1 ILE 5 3.625 -8.068 -5.985 37 HD12 ILE 5 1HD1 ILE 5 4.074 -6.444 -6.507 38 HD13 ILE 5 2HD1 ILE 5 2.607 -7.198 -7.132 39 H LEU 6 H LEU 6 6.377 -4.184 -7.894 40 HA LEU 6 HA LEU 6 8.401 -3.524 -9.912 41 HB2 LEU 6 2HB LEU 6 5.610 -2.426 -9.728 42 HB3 LEU 6 3HB LEU 6 6.906 -1.573 -10.565 43 HG LEU 6 HG LEU 6 6.382 -4.381 -11.369 44 HD11 LEU 6 1HD1 LEU 6 4.304 -4.104 -12.096 45 HD12 LEU 6 2HD1 LEU 6 4.717 -2.576 -12.872 46 HD13 LEU 6 3HD1 LEU 6 4.245 -2.602 -11.173 47 HD21 LEU 6 3HD2 LEU 6 7.739 -2.055 -12.358 48 HD22 LEU 6 1HD2 LEU 6 6.558 -2.617 -13.541 49 HD23 LEU 6 2HD2 LEU 6 7.800 -3.718 -12.942 50 H SER 7 H SER 7 9.284 -1.359 -9.686 51 HA SER 7 HA SER 7 9.707 -0.691 -6.930 52 HB2 SER 7 2HB SER 7 11.053 -0.240 -9.393 53 HB3 SER 7 3HB SER 7 10.737 1.336 -8.668 54 HG SER 7 HG SER 7 11.881 -0.828 -7.241 55 HA PRO 8 HA PRO 8 6.800 2.537 -6.326 56 HB2 PRO 8 2HB PRO 8 8.224 4.326 -4.862 57 HB3 PRO 8 3HB PRO 8 7.662 2.782 -4.210 58 HG2 PRO 8 2HG PRO 8 10.367 3.524 -5.256 59 HG3 PRO 8 3HG PRO 8 9.944 2.582 -3.814 60 HD2 PRO 8 2HD PRO 8 10.740 1.425 -6.129 61 HD3 PRO 8 3HD PRO 8 9.582 0.655 -5.026 62 H SER 9 H SER 9 9.942 3.466 -7.613 63 HA SER 9 HA SER 9 9.184 6.085 -8.424 64 HB2 SER 9 2HB SER 9 11.259 5.918 -9.869 65 HB3 SER 9 3HB SER 9 11.517 5.645 -8.146 66 HG SER 9 HG SER 9 12.487 3.920 -8.923 67 H ASP 10 H ASP 10 9.463 2.993 -10.149 68 HA ASP 10 HA ASP 10 8.733 3.936 -12.687 69 HB2 ASP 10 2HB ASP 10 8.543 1.222 -11.392 70 HB3 ASP 10 3HB ASP 10 8.024 1.498 -13.052 71 H ILE 11 H ILE 11 6.825 3.045 -9.903 72 HA ILE 11 HA ILE 11 4.329 3.000 -11.344 73 HB ILE 11 HB ILE 11 4.924 2.986 -8.384 74 HG12 ILE 11 2HG1 ILE 11 3.672 0.716 -9.861 75 HG13 ILE 11 3HG1 ILE 11 5.398 0.989 -10.078 76 HG21 ILE 11 1HG2 ILE 11 2.796 3.919 -8.476 77 HG22 ILE 11 2HG2 ILE 11 2.331 2.961 -9.881 78 HG23 ILE 11 3HG2 ILE 11 2.473 2.194 -8.300 79 HD11 ILE 11 3HD1 ILE 11 3.905 0.044 -7.714 80 HD12 ILE 11 1HD1 ILE 11 5.493 -0.424 -8.321 81 HD13 ILE 11 2HD1 ILE 11 5.300 1.081 -7.421 82 H ALA 12 H ALA 12 5.793 5.153 -8.911 83 HA ALA 12 HA ALA 12 3.807 7.086 -8.824 84 HB1 ALA 12 1HB ALA 12 6.117 8.543 -8.504 85 HB2 ALA 12 2HB ALA 12 5.256 7.675 -7.231 86 HB3 ALA 12 3HB ALA 12 6.611 6.908 -8.060 87 H ALA 13 H ALA 13 6.291 6.538 -11.216 88 HA ALA 13 HA ALA 13 5.994 9.071 -12.522 89 HB1 ALA 13 1HB ALA 13 7.390 6.512 -13.213 90 HB2 ALA 13 2HB ALA 13 7.251 7.820 -14.388 91 HB3 ALA 13 3HB ALA 13 8.080 8.095 -12.856 92 H ALA 14 H ALA 14 4.460 5.958 -12.742 93 HA ALA 14 HA ALA 14 3.199 6.534 -15.286 94 HB1 ALA 14 1HB ALA 14 2.618 4.253 -13.405 95 HB2 ALA 14 2HB ALA 14 2.221 4.361 -15.121 96 HB3 ALA 14 3HB ALA 14 3.905 4.235 -14.612 97 H LEU 15 H LEU 15 2.204 6.208 -11.892 98 HA LEU 15 HA LEU 15 -0.528 6.623 -12.222 99 HB2 LEU 15 2HB LEU 15 1.400 7.014 -9.993 100 HB3 LEU 15 3HB LEU 15 -0.209 7.714 -9.831 101 HG LEU 15 HG LEU 15 0.315 4.792 -10.361 102 HD11 LEU 15 1HD1 LEU 15 0.969 4.686 -8.234 103 HD12 LEU 15 2HD1 LEU 15 -0.711 5.022 -7.819 104 HD13 LEU 15 3HD1 LEU 15 0.456 6.341 -7.904 105 HD21 LEU 15 3HD2 LEU 15 -1.991 4.477 -9.863 106 HD22 LEU 15 1HD2 LEU 15 -1.887 5.767 -11.061 107 HD23 LEU 15 2HD2 LEU 15 -2.178 6.159 -9.366 108 H ARG 16 H ARG 16 2.029 9.009 -11.561 109 HA ARG 16 HA ARG 16 0.267 11.244 -11.687 110 HB2 ARG 16 2HB ARG 16 3.279 11.100 -11.913 111 HB3 ARG 16 3HB ARG 16 2.354 12.584 -11.735 112 HG2 ARG 16 2HG ARG 16 1.425 11.349 -9.602 113 HG3 ARG 16 3HG ARG 16 2.945 10.464 -9.744 114 HD2 ARG 16 2HD ARG 16 3.476 13.235 -10.112 115 HD3 ARG 16 3HD ARG 16 2.496 13.045 -8.658 116 HE ARG 16 HE ARG 16 4.282 12.050 -7.626 117 HH11 ARG 16 1HH1 ARG 16 4.846 12.134 -11.061 118 HH12 ARG 16 2HH1 ARG 16 6.486 11.590 -10.936 119 HH21 ARG 16 1HH2 ARG 16 6.440 11.334 -7.449 120 HH22 ARG 16 2HH2 ARG 16 7.392 11.134 -8.881 121 H ASP 17 H ASP 17 2.217 9.512 -14.012 122 HA ASP 17 HA ASP 17 2.379 11.345 -16.078 123 HB2 ASP 17 2HB ASP 17 3.578 9.386 -16.447 124 HB3 ASP 17 3HB ASP 17 2.223 8.354 -15.996 125 H CYS 18 H CYS 18 -0.287 9.195 -15.211 126 HA CYS 18 HA CYS 18 -2.059 10.829 -16.877 127 HB2 CYS 18 2HB CYS 18 -1.984 7.805 -16.891 128 HB3 CYS 18 3HB CYS 18 -3.227 8.783 -17.663 129 HG CYS 18 HG CYS 18 -1.940 8.422 -19.887 130 H GLN 19 H GLN 19 -1.773 11.081 -14.152 131 HA GLN 19 HA GLN 19 -3.510 9.507 -12.605 132 HB2 GLN 19 2HB GLN 19 -3.510 11.528 -11.062 133 HB3 GLN 19 3HB GLN 19 -1.940 10.830 -11.438 134 HG2 GLN 19 2HG GLN 19 -1.318 12.606 -12.772 135 HG3 GLN 19 3HG GLN 19 -2.984 13.105 -13.062 136 HE21 GLN 19 1HE2 GLN 19 -0.466 12.931 -10.606 137 HE22 GLN 19 2HE2 GLN 19 -1.020 14.281 -9.681 138 H ALA 20 H ALA 20 -4.053 12.353 -14.586 139 HA ALA 20 HA ALA 20 -6.544 13.165 -13.722 140 HB1 ALA 20 1HB ALA 20 -6.877 14.102 -15.931 141 HB2 ALA 20 2HB ALA 20 -5.206 14.342 -15.418 142 HB3 ALA 20 3HB ALA 20 -5.598 13.078 -16.584 143 HA PRO 21 HA PRO 21 -9.403 9.970 -14.674 144 HB2 PRO 21 2HB PRO 21 -11.624 11.425 -15.240 145 HB3 PRO 21 3HB PRO 21 -10.988 11.241 -13.601 146 HG2 PRO 21 2HG PRO 21 -10.653 13.515 -15.519 147 HG3 PRO 21 3HG PRO 21 -10.987 13.560 -13.779 148 HD2 PRO 21 2HD PRO 21 -8.512 13.969 -14.797 149 HD3 PRO 21 3HD PRO 21 -8.780 13.205 -13.217 150 H ASP 22 H ASP 22 -10.112 8.797 -16.392 151 HA ASP 22 HA ASP 22 -10.241 8.106 -18.560 152 HB2 ASP 22 2HB ASP 22 -12.219 9.696 -18.324 153 HB3 ASP 22 3HB ASP 22 -11.232 10.891 -19.161 154 H SER 23 H SER 23 -7.753 9.404 -17.677 155 HA SER 23 HA SER 23 -6.781 10.383 -20.282 156 HB2 SER 23 2HB SER 23 -6.200 11.224 -17.491 157 HB3 SER 23 3HB SER 23 -4.848 11.231 -18.624 158 HG SER 23 HG SER 23 -5.678 12.909 -19.579 159 H PHE 24 H PHE 24 -6.848 7.712 -18.439 160 HA PHE 24 HA PHE 24 -4.188 6.840 -19.357 161 HB2 PHE 24 2HB PHE 24 -4.228 5.259 -17.376 162 HB3 PHE 24 3HB PHE 24 -4.031 6.964 -16.985 163 HD1 PHE 24 HD2 PHE 24 -5.937 8.244 -16.060 164 HD2 PHE 24 HD1 PHE 24 -6.109 4.030 -16.634 165 HE1 PHE 24 HE2 PHE 24 -7.870 8.119 -14.543 166 HE2 PHE 24 HE1 PHE 24 -8.042 3.899 -15.118 167 HZ PHE 24 HZ PHE 24 -8.924 5.945 -14.069 168 H SER 25 H SER 25 -4.223 4.230 -19.063 169 HA SER 25 HA SER 25 -6.723 3.111 -20.037 170 HB2 SER 25 2HB SER 25 -4.481 3.739 -21.783 171 HB3 SER 25 3HB SER 25 -4.882 2.022 -21.823 172 HG SER 25 HG SER 25 -6.124 3.964 -23.063 173 HA PRO 26 HA PRO 26 -5.427 -0.501 -17.913 174 HB2 PRO 26 2HB PRO 26 -6.379 -2.492 -19.493 175 HB3 PRO 26 3HB PRO 26 -7.426 -1.460 -18.512 176 HG2 PRO 26 2HG PRO 26 -6.787 -1.281 -21.431 177 HG3 PRO 26 3HG PRO 26 -8.350 -1.094 -20.615 178 HD2 PRO 26 2HD PRO 26 -6.871 1.021 -21.433 179 HD3 PRO 26 3HD PRO 26 -7.906 1.080 -19.992 180 H LYS 27 H LYS 27 -4.437 -0.087 -21.219 181 HA LYS 27 HA LYS 27 -2.230 -1.993 -20.790 182 HB2 LYS 27 2HB LYS 27 -2.144 -2.359 -23.162 183 HB3 LYS 27 3HB LYS 27 -3.808 -2.577 -22.636 184 HG2 LYS 27 2HG LYS 27 -3.328 0.155 -23.414 185 HG3 LYS 27 3HG LYS 27 -2.890 -0.963 -24.708 186 HD2 LYS 27 2HD LYS 27 -5.523 -1.010 -23.237 187 HD3 LYS 27 3HD LYS 27 -5.261 -0.200 -24.784 188 HE2 LYS 27 2HE LYS 27 -4.415 -3.028 -24.609 189 HE3 LYS 27 3HE LYS 27 -6.151 -2.724 -24.565 190 HZ1 LYS 27 3HZ LYS 27 -6.028 -1.596 -26.645 191 HZ2 LYS 27 1HZ LYS 27 -5.238 -3.081 -26.825 192 HZ3 LYS 27 2HZ LYS 27 -4.338 -1.660 -26.659 193 H LYS 28 H LYS 28 -2.263 0.756 -19.908 194 HA LYS 28 HA LYS 28 0.029 1.737 -21.464 195 HB2 LYS 28 2HB LYS 28 -2.384 3.301 -20.568 196 HB3 LYS 28 3HB LYS 28 -0.851 4.086 -20.925 197 HG2 LYS 28 2HG LYS 28 -2.259 2.312 -22.897 198 HG3 LYS 28 3HG LYS 28 -2.559 4.048 -22.782 199 HD2 LYS 28 2HD LYS 28 -0.087 4.389 -23.094 200 HD3 LYS 28 3HD LYS 28 0.033 2.666 -23.456 201 HE2 LYS 28 2HE LYS 28 -1.731 4.608 -24.942 202 HE3 LYS 28 3HE LYS 28 -0.125 4.112 -25.473 203 HZ1 LYS 28 3HZ LYS 28 -1.226 1.743 -25.141 204 HZ2 LYS 28 1HZ LYS 28 -1.352 2.599 -26.594 205 HZ3 LYS 28 2HZ LYS 28 -2.630 2.621 -25.487 206 H PHE 29 H PHE 29 -0.544 0.335 -18.790 207 HA PHE 29 HA PHE 29 0.913 2.242 -17.081 208 HB2 PHE 29 2HB PHE 29 -1.496 0.957 -16.564 209 HB3 PHE 29 3HB PHE 29 -0.313 0.007 -15.671 210 HD1 PHE 29 HD1 PHE 29 1.200 1.199 -14.039 211 HD2 PHE 29 HD2 PHE 29 -2.239 3.021 -15.762 212 HE1 PHE 29 HE1 PHE 29 1.195 2.880 -12.242 213 HE2 PHE 29 HE2 PHE 29 -2.249 4.705 -13.969 214 HZ PHE 29 HZ PHE 29 -0.531 4.637 -12.206 215 H PHE 30 H PHE 30 1.176 -0.599 -18.818 216 HA PHE 30 HA PHE 30 3.110 -1.856 -17.045 217 HB2 PHE 30 2HB PHE 30 3.039 -3.722 -18.485 218 HB3 PHE 30 3HB PHE 30 1.385 -3.120 -18.456 219 HD1 PHE 30 HD1 PHE 30 4.414 -3.505 -20.463 220 HD2 PHE 30 HD2 PHE 30 0.401 -2.088 -20.403 221 HE1 PHE 30 HE1 PHE 30 4.436 -3.348 -22.919 222 HE2 PHE 30 HE2 PHE 30 0.416 -1.930 -22.858 223 HZ PHE 30 HZ PHE 30 2.434 -2.561 -24.119 224 H GLN 31 H GLN 31 3.063 0.376 -19.609 225 HA GLN 31 HA GLN 31 5.710 -0.204 -20.595 226 HB2 GLN 31 2HB GLN 31 4.310 2.388 -21.112 227 HB3 GLN 31 3HB GLN 31 5.346 1.450 -22.179 228 HG2 GLN 31 2HG GLN 31 3.533 -0.256 -22.315 229 HG3 GLN 31 3HG GLN 31 2.501 0.853 -21.413 230 HE21 GLN 31 1HE2 GLN 31 2.918 3.237 -22.457 231 HE22 GLN 31 2HE2 GLN 31 2.547 3.275 -24.144 232 H ILE 32 H ILE 32 4.211 2.125 -18.418 233 HA ILE 32 HA ILE 32 6.724 3.510 -17.981 234 HB ILE 32 HB ILE 32 4.083 3.894 -16.568 235 HG12 ILE 32 2HG1 ILE 32 4.540 6.062 -18.251 236 HG13 ILE 32 3HG1 ILE 32 4.998 4.668 -19.222 237 HG21 ILE 32 1HG2 ILE 32 5.778 4.827 -15.230 238 HG22 ILE 32 2HG2 ILE 32 6.639 5.469 -16.627 239 HG23 ILE 32 3HG2 ILE 32 5.102 6.181 -16.136 240 HD11 ILE 32 3HD1 ILE 32 2.482 4.318 -17.793 241 HD12 ILE 32 1HD1 ILE 32 2.472 5.651 -18.947 242 HD13 ILE 32 2HD1 ILE 32 2.883 4.023 -19.485 243 H SER 33 H SER 33 4.720 1.118 -16.414 244 HA SER 33 HA SER 33 6.308 1.205 -13.974 245 HB2 SER 33 2HB SER 33 3.752 0.849 -14.081 246 HB3 SER 33 3HB SER 33 4.141 -0.799 -14.572 247 HG SER 33 HG SER 33 4.918 0.499 -12.170 248 H GLY 34 H GLY 34 5.198 -1.515 -15.998 249 HA2 GLY 34 2HA GLY 34 7.002 -2.790 -17.176 250 HA3 GLY 34 3HA GLY 34 7.884 -2.701 -15.658 251 H MET 35 H MET 35 4.444 -3.375 -16.177 252 HA MET 35 HA MET 35 4.536 -5.619 -14.411 253 HB2 MET 35 2HB MET 35 2.280 -4.977 -16.299 254 HB3 MET 35 3HB MET 35 2.199 -5.791 -14.742 255 HG2 MET 35 2HG MET 35 2.796 -3.699 -13.624 256 HG3 MET 35 3HG MET 35 2.853 -2.888 -15.187 257 HE1 MET 35 3HE MET 35 -1.011 -4.716 -13.446 258 HE2 MET 35 1HE MET 35 0.319 -5.671 -14.105 259 HE3 MET 35 2HE MET 35 0.540 -4.768 -12.606 260 H SER 36 H SER 36 3.986 -5.276 -17.912 261 HA SER 36 HA SER 36 3.674 -7.948 -18.560 262 HB2 SER 36 2HB SER 36 3.301 -6.783 -20.462 263 HB3 SER 36 3HB SER 36 4.413 -5.496 -19.999 264 HG SER 36 HG SER 36 4.874 -7.130 -21.857 265 H LYS 37 H LYS 37 6.601 -6.136 -17.915 266 HA LYS 37 HA LYS 37 8.485 -7.951 -18.919 267 HB2 LYS 37 2HB LYS 37 8.889 -6.237 -16.470 268 HB3 LYS 37 3HB LYS 37 10.105 -6.786 -17.616 269 HG2 LYS 37 2HG LYS 37 7.948 -4.742 -18.081 270 HG3 LYS 37 3HG LYS 37 9.692 -4.475 -18.015 271 HD2 LYS 37 2HD LYS 37 9.505 -6.364 -19.966 272 HD3 LYS 37 3HD LYS 37 8.009 -5.459 -20.211 273 HE2 LYS 37 2HE LYS 37 9.522 -4.319 -21.547 274 HE3 LYS 37 3HE LYS 37 9.528 -3.372 -20.060 275 HZ1 LYS 37 3HZ LYS 37 11.729 -4.300 -21.280 276 HZ2 LYS 37 1HZ LYS 37 11.466 -5.512 -20.130 277 HZ3 LYS 37 2HZ LYS 37 11.646 -3.904 -19.638 278 H LYS 38 H LYS 38 6.427 -8.144 -16.194 279 HA LYS 38 HA LYS 38 8.061 -10.067 -14.770 280 HB2 LYS 38 2HB LYS 38 5.180 -9.387 -14.203 281 HB3 LYS 38 3HB LYS 38 6.376 -10.043 -13.094 282 HG2 LYS 38 2HG LYS 38 6.546 -7.299 -14.316 283 HG3 LYS 38 3HG LYS 38 5.838 -7.642 -12.736 284 HD2 LYS 38 2HD LYS 38 7.869 -7.480 -11.846 285 HD3 LYS 38 3HD LYS 38 8.347 -8.909 -12.766 286 HE2 LYS 38 2HE LYS 38 8.610 -7.109 -14.696 287 HE3 LYS 38 3HE LYS 38 8.836 -6.031 -13.320 288 HZ1 LYS 38 3HZ LYS 38 10.808 -6.956 -12.805 289 HZ2 LYS 38 1HZ LYS 38 10.811 -7.405 -14.436 290 HZ3 LYS 38 2HZ LYS 38 10.338 -8.518 -13.254 291 H SER 39 H SER 39 6.007 -11.785 -13.862 292 HA SER 39 HA SER 39 5.376 -13.273 -16.328 293 HB2 SER 39 2HB SER 39 7.192 -14.176 -14.662 294 HB3 SER 39 3HB SER 39 5.793 -14.670 -13.707 295 HG SER 39 HG SER 39 6.833 -15.815 -15.908 296 H SER 40 H SER 40 3.700 -15.119 -15.662 297 HA SER 40 HA SER 40 1.314 -13.713 -14.943 298 HB2 SER 40 2HB SER 40 0.883 -16.541 -14.977 299 HB3 SER 40 3HB SER 40 0.384 -15.340 -16.168 300 HG SER 40 HG SER 40 2.715 -16.916 -16.100 301 H SER 41 H SER 41 3.716 -15.081 -13.118 302 HA SER 41 HA SER 41 1.923 -15.917 -10.955 303 HB2 SER 41 2HB SER 41 3.994 -17.275 -11.798 304 HB3 SER 41 3HB SER 41 4.914 -16.132 -10.820 305 HG SER 41 HG SER 41 3.672 -18.286 -9.994 306 H GLN 42 H GLN 42 3.797 -13.284 -11.969 307 HA GLN 42 HA GLN 42 4.117 -12.236 -9.256 308 HB2 GLN 42 2HB GLN 42 5.391 -11.720 -11.870 309 HB3 GLN 42 3HB GLN 42 5.154 -10.306 -10.852 310 HG2 GLN 42 2HG GLN 42 6.316 -11.532 -9.015 311 HG3 GLN 42 3HG GLN 42 6.691 -12.801 -10.180 312 HE21 GLN 42 1HE2 GLN 42 6.936 -9.281 -9.815 313 HE22 GLN 42 2HE2 GLN 42 8.498 -9.142 -10.539 314 H LEU 43 H LEU 43 2.444 -11.601 -12.282 315 HA LEU 43 HA LEU 43 1.346 -9.096 -11.471 316 HB2 LEU 43 2HB LEU 43 0.245 -10.938 -13.578 317 HB3 LEU 43 3HB LEU 43 0.052 -9.190 -13.461 318 HG LEU 43 HG LEU 43 2.803 -10.271 -13.792 319 HD11 LEU 43 1HD1 LEU 43 0.705 -10.226 -15.947 320 HD12 LEU 43 2HD1 LEU 43 1.715 -11.579 -15.439 321 HD13 LEU 43 3HD1 LEU 43 2.437 -10.208 -16.280 322 HD21 LEU 43 3HD2 LEU 43 1.288 -7.784 -14.365 323 HD22 LEU 43 1HD2 LEU 43 2.640 -8.189 -15.423 324 HD23 LEU 43 2HD2 LEU 43 2.903 -7.999 -13.690 325 H LYS 44 H LYS 44 0.528 -12.382 -10.900 326 HA LYS 44 HA LYS 44 -2.253 -12.040 -10.406 327 HB2 LYS 44 2HB LYS 44 -2.242 -14.260 -9.619 328 HB3 LYS 44 3HB LYS 44 -1.010 -14.221 -10.874 329 HG2 LYS 44 2HG LYS 44 0.706 -13.954 -9.097 330 HG3 LYS 44 3HG LYS 44 -0.570 -14.177 -7.897 331 HD2 LYS 44 2HD LYS 44 -0.074 -16.186 -10.075 332 HD3 LYS 44 3HD LYS 44 0.816 -16.227 -8.552 333 HE2 LYS 44 2HE LYS 44 -2.178 -16.116 -8.587 334 HE3 LYS 44 3HE LYS 44 -1.329 -17.648 -8.786 335 HZ1 LYS 44 3HZ LYS 44 -1.534 -17.626 -6.544 336 HZ2 LYS 44 1HZ LYS 44 -1.549 -15.938 -6.431 337 HZ3 LYS 44 2HZ LYS 44 -0.087 -16.757 -6.652 338 H GLU 45 H GLU 45 0.618 -11.498 -8.543 339 HA GLU 45 HA GLU 45 -0.443 -11.626 -5.951 340 HB2 GLU 45 2HB GLU 45 1.860 -10.105 -7.148 341 HB3 GLU 45 3HB GLU 45 1.442 -9.942 -5.448 342 HG2 GLU 45 2HG GLU 45 1.860 -12.654 -6.616 343 HG3 GLU 45 3HG GLU 45 3.247 -11.652 -6.194 344 H ILE 46 H ILE 46 -0.154 -8.890 -8.197 345 HA ILE 46 HA ILE 46 -1.142 -6.876 -6.568 346 HB ILE 46 HB ILE 46 -1.561 -7.192 -9.542 347 HG12 ILE 46 2HG1 ILE 46 0.401 -5.245 -8.891 348 HG13 ILE 46 3HG1 ILE 46 0.783 -6.698 -7.974 349 HG21 ILE 46 1HG2 ILE 46 -2.956 -5.458 -9.208 350 HG22 ILE 46 2HG2 ILE 46 -2.271 -5.075 -7.630 351 HG23 ILE 46 3HG2 ILE 46 -1.463 -4.528 -9.099 352 HD11 ILE 46 3HD1 ILE 46 0.119 -7.424 -10.651 353 HD12 ILE 46 1HD1 ILE 46 1.337 -6.150 -10.670 354 HD13 ILE 46 2HD1 ILE 46 1.635 -7.642 -9.778 355 H PHE 47 H PHE 47 -2.888 -9.250 -8.511 356 HA PHE 47 HA PHE 47 -5.457 -8.216 -8.326 357 HB2 PHE 47 2HB PHE 47 -5.549 -10.008 -9.706 358 HB3 PHE 47 3HB PHE 47 -4.268 -10.857 -8.847 359 HD1 PHE 47 HD1 PHE 47 -4.779 -12.293 -6.952 360 HD2 PHE 47 HD2 PHE 47 -7.859 -10.328 -9.136 361 HE1 PHE 47 HE1 PHE 47 -6.449 -13.787 -5.935 362 HE2 PHE 47 HE2 PHE 47 -9.534 -11.818 -8.122 363 HZ PHE 47 HZ PHE 47 -8.830 -13.550 -6.519 364 H ARG 48 H ARG 48 -3.636 -10.164 -6.023 365 HA ARG 48 HA ARG 48 -5.758 -10.671 -4.233 366 HB2 ARG 48 2HB ARG 48 -2.977 -11.230 -4.380 367 HB3 ARG 48 3HB ARG 48 -3.281 -10.483 -2.818 368 HG2 ARG 48 2HG ARG 48 -4.715 -12.892 -3.915 369 HG3 ARG 48 3HG ARG 48 -3.426 -12.916 -2.711 370 HD2 ARG 48 2HD ARG 48 -5.524 -11.089 -1.950 371 HD3 ARG 48 3HD ARG 48 -6.170 -12.702 -2.249 372 HE ARG 48 HE ARG 48 -3.815 -12.657 -0.590 373 HH11 ARG 48 1HH1 ARG 48 -7.291 -12.479 -0.666 374 HH12 ARG 48 2HH1 ARG 48 -7.484 -12.996 0.976 375 HH21 ARG 48 1HH2 ARG 48 -4.056 -13.339 1.574 376 HH22 ARG 48 2HH2 ARG 48 -5.643 -13.485 2.250 377 H ILE 49 H ILE 49 -4.097 -7.820 -4.971 378 HA ILE 49 HA ILE 49 -4.677 -6.600 -2.372 379 HB ILE 49 HB ILE 49 -3.264 -5.305 -4.698 380 HG12 ILE 49 2HG1 ILE 49 -2.022 -7.307 -4.111 381 HG13 ILE 49 3HG1 ILE 49 -1.156 -5.892 -3.526 382 HG21 ILE 49 1HG2 ILE 49 -2.249 -4.178 -2.479 383 HG22 ILE 49 2HG2 ILE 49 -3.657 -3.551 -3.334 384 HG23 ILE 49 3HG2 ILE 49 -3.871 -4.568 -1.909 385 HD11 ILE 49 3HD1 ILE 49 -2.879 -7.721 -1.872 386 HD12 ILE 49 1HD1 ILE 49 -1.116 -7.680 -1.893 387 HD13 ILE 49 2HD1 ILE 49 -2.023 -6.297 -1.280 388 H LEU 50 H LEU 50 -5.978 -6.897 -5.484 389 HA LEU 50 HA LEU 50 -7.450 -4.382 -5.349 390 HB2 LEU 50 2HB LEU 50 -6.892 -6.410 -7.428 391 HB3 LEU 50 3HB LEU 50 -8.440 -5.574 -7.536 392 HG LEU 50 HG LEU 50 -6.717 -3.487 -7.219 393 HD11 LEU 50 1HD1 LEU 50 -5.306 -5.364 -9.091 394 HD12 LEU 50 2HD1 LEU 50 -4.839 -5.187 -7.400 395 HD13 LEU 50 3HD1 LEU 50 -4.764 -3.799 -8.485 396 HD21 LEU 50 3HD2 LEU 50 -7.262 -2.939 -9.413 397 HD22 LEU 50 1HD2 LEU 50 -8.582 -4.000 -8.921 398 HD23 LEU 50 2HD2 LEU 50 -7.280 -4.624 -9.934 399 H ASP 51 H ASP 51 -7.873 -7.770 -4.778 400 HA ASP 51 HA ASP 51 -10.697 -7.876 -4.952 401 HB2 ASP 51 2HB ASP 51 -9.187 -9.869 -4.976 402 HB3 ASP 51 3HB ASP 51 -8.887 -9.611 -3.260 403 H ASN 52 H ASN 52 -11.636 -6.183 -3.846 404 HA ASN 52 HA ASN 52 -11.007 -5.731 -1.056 405 HB2 ASN 52 2HB ASN 52 -12.472 -4.320 -3.170 406 HB3 ASN 52 3HB ASN 52 -13.241 -4.217 -1.589 407 HD21 ASN 52 1HD2 ASN 52 -9.819 -4.378 -2.458 408 HD22 ASN 52 2HD2 ASN 52 -9.386 -2.867 -1.741 409 H ASP 53 H ASP 53 -12.624 -8.099 -2.466 410 HA ASP 53 HA ASP 53 -14.677 -8.219 -0.355 411 HB2 ASP 53 2HB ASP 53 -14.954 -9.628 -2.999 412 HB3 ASP 53 3HB ASP 53 -16.206 -9.244 -1.820 413 H GLN 54 H GLN 54 -11.927 -9.627 -1.716 414 HA GLN 54 HA GLN 54 -10.761 -11.532 -1.292 415 HB2 GLN 54 2HB GLN 54 -12.539 -12.066 1.066 416 HB3 GLN 54 3HB GLN 54 -10.822 -12.395 0.881 417 HG2 GLN 54 2HG GLN 54 -10.566 -10.578 2.152 418 HG3 GLN 54 3HG GLN 54 -10.855 -9.699 0.651 419 HE21 GLN 54 1HE2 GLN 54 -12.218 -8.095 0.893 420 HE22 GLN 54 2HE2 GLN 54 -13.584 -8.061 1.951 421 H SER 55 H SER 55 -13.535 -11.537 -2.645 422 HA SER 55 HA SER 55 -14.560 -14.172 -2.194 423 HB2 SER 55 2HB SER 55 -15.682 -13.516 -4.541 424 HB3 SER 55 3HB SER 55 -16.260 -12.872 -3.004 425 HG SER 55 HG SER 55 -15.572 -11.443 -4.982 426 H GLY 56 H GLY 56 -12.425 -12.671 -4.563 427 HA2 GLY 56 2HA GLY 56 -10.672 -14.434 -5.243 428 HA3 GLY 56 3HA GLY 56 -12.076 -15.284 -5.873 429 H PHE 57 H PHE 57 -13.052 -12.339 -6.423 430 HA PHE 57 HA PHE 57 -11.482 -11.926 -8.874 431 HB2 PHE 57 2HB PHE 57 -14.498 -11.757 -8.739 432 HB3 PHE 57 3HB PHE 57 -13.492 -11.558 -10.170 433 HD1 PHE 57 HD1 PHE 57 -14.752 -13.979 -7.702 434 HD2 PHE 57 HD2 PHE 57 -12.684 -13.433 -11.381 435 HE1 PHE 57 HE1 PHE 57 -14.945 -16.388 -8.164 436 HE2 PHE 57 HE2 PHE 57 -12.874 -15.841 -11.850 437 HZ PHE 57 HZ PHE 57 -14.007 -17.322 -10.241 438 H ILE 58 H ILE 58 -12.016 -9.748 -9.884 439 HA ILE 58 HA ILE 58 -12.359 -7.756 -7.738 440 HB ILE 58 HB ILE 58 -10.747 -7.432 -10.271 441 HG12 ILE 58 2HG1 ILE 58 -9.639 -7.660 -7.480 442 HG13 ILE 58 3HG1 ILE 58 -9.887 -9.082 -8.488 443 HG21 ILE 58 1HG2 ILE 58 -11.791 -5.387 -9.210 444 HG22 ILE 58 2HG2 ILE 58 -10.741 -5.683 -7.826 445 HG23 ILE 58 3HG2 ILE 58 -10.039 -5.350 -9.409 446 HD11 ILE 58 3HD1 ILE 58 -7.573 -8.119 -8.495 447 HD12 ILE 58 1HD1 ILE 58 -8.312 -8.335 -10.081 448 HD13 ILE 58 2HD1 ILE 58 -8.236 -6.729 -9.354 449 H GLU 59 H GLU 59 -14.674 -7.891 -8.231 450 HA GLU 59 HA GLU 59 -15.843 -7.316 -10.677 451 HB2 GLU 59 2HB GLU 59 -16.957 -6.312 -8.067 452 HB3 GLU 59 3HB GLU 59 -17.836 -6.840 -9.494 453 HG2 GLU 59 2HG GLU 59 -18.057 -8.816 -8.530 454 HG3 GLU 59 3HG GLU 59 -16.322 -9.046 -8.738 455 H GLU 60 H GLU 60 -17.237 -5.215 -10.966 456 HA GLU 60 HA GLU 60 -15.431 -3.109 -11.480 457 HB2 GLU 60 2HB GLU 60 -18.431 -3.316 -11.553 458 HB3 GLU 60 3HB GLU 60 -17.610 -1.799 -11.893 459 HG2 GLU 60 2HG GLU 60 -16.647 -2.604 -13.838 460 HG3 GLU 60 3HG GLU 60 -16.851 -4.288 -13.360 461 H ASP 61 H ASP 61 -17.574 -3.805 -8.814 462 HA ASP 61 HA ASP 61 -17.652 -1.259 -7.628 463 HB2 ASP 61 2HB ASP 61 -17.932 -4.039 -6.494 464 HB3 ASP 61 3HB ASP 61 -18.086 -2.599 -5.492 465 H GLU 62 H GLU 62 -15.142 -3.593 -7.838 466 HA GLU 62 HA GLU 62 -13.591 -2.162 -5.784 467 HB2 GLU 62 2HB GLU 62 -12.111 -4.360 -6.174 468 HB3 GLU 62 3HB GLU 62 -13.430 -4.295 -5.014 469 HG2 GLU 62 2HG GLU 62 -14.909 -5.165 -6.894 470 HG3 GLU 62 3HG GLU 62 -13.409 -5.527 -7.746 471 H LEU 63 H LEU 63 -13.695 -3.184 -9.110 472 HA LEU 63 HA LEU 63 -11.029 -2.768 -9.840 473 HB2 LEU 63 2HB LEU 63 -13.309 -3.547 -11.123 474 HB3 LEU 63 3HB LEU 63 -13.016 -1.963 -11.838 475 HG LEU 63 HG LEU 63 -11.189 -4.360 -11.890 476 HD11 LEU 63 1HD1 LEU 63 -13.080 -3.110 -13.764 477 HD12 LEU 63 2HD1 LEU 63 -12.503 -4.774 -13.667 478 HD13 LEU 63 3HD1 LEU 63 -11.509 -3.540 -14.441 479 HD21 LEU 63 3HD2 LEU 63 -9.878 -2.329 -11.546 480 HD22 LEU 63 1HD2 LEU 63 -10.688 -1.566 -12.914 481 HD23 LEU 63 2HD2 LEU 63 -9.648 -2.967 -13.175 482 H LYS 64 H LYS 64 -13.769 -0.523 -9.752 483 HA LYS 64 HA LYS 64 -12.676 1.705 -10.919 484 HB2 LYS 64 2HB LYS 64 -14.128 3.026 -9.331 485 HB3 LYS 64 3HB LYS 64 -14.954 1.768 -10.241 486 HG2 LYS 64 2HG LYS 64 -15.332 0.484 -8.397 487 HG3 LYS 64 3HG LYS 64 -13.903 1.082 -7.550 488 HD2 LYS 64 2HD LYS 64 -15.977 1.875 -6.507 489 HD3 LYS 64 3HD LYS 64 -15.015 3.210 -7.143 490 HE2 LYS 64 2HE LYS 64 -16.525 3.701 -8.774 491 HE3 LYS 64 3HE LYS 64 -17.049 2.026 -8.944 492 HZ1 LYS 64 3HZ LYS 64 -18.070 4.115 -7.220 493 HZ2 LYS 64 1HZ LYS 64 -17.908 2.603 -6.479 494 HZ3 LYS 64 2HZ LYS 64 -18.856 2.765 -7.870 495 H TYR 65 H TYR 65 -11.931 0.315 -7.816 496 HA TYR 65 HA TYR 65 -10.335 2.629 -7.034 497 HB2 TYR 65 2HB TYR 65 -10.855 0.035 -5.566 498 HB3 TYR 65 3HB TYR 65 -10.021 1.438 -4.909 499 HD1 TYR 65 HD1 TYR 65 -11.479 3.708 -5.211 500 HD2 TYR 65 HD2 TYR 65 -13.043 -0.237 -4.911 501 HE1 TYR 65 HE1 TYR 65 -13.624 4.625 -4.433 502 HE2 TYR 65 HE2 TYR 65 -15.193 0.668 -4.133 503 HH TYR 65 HH TYR 65 -15.721 3.302 -2.845 504 H PHE 66 H PHE 66 -9.372 1.447 -9.316 505 HA PHE 66 HA PHE 66 -7.297 -0.444 -8.686 506 HB2 PHE 66 2HB PHE 66 -8.206 -0.657 -10.860 507 HB3 PHE 66 3HB PHE 66 -8.052 1.068 -11.179 508 HD1 PHE 66 HD1 PHE 66 -5.903 -1.861 -10.330 509 HD2 PHE 66 HD2 PHE 66 -6.332 1.756 -12.531 510 HE1 PHE 66 HE1 PHE 66 -3.726 -2.261 -11.406 511 HE2 PHE 66 HE2 PHE 66 -4.157 1.361 -13.611 512 HZ PHE 66 HZ PHE 66 -2.852 -0.650 -13.050 513 H LEU 67 H LEU 67 -7.571 3.014 -9.061 514 HA LEU 67 HA LEU 67 -4.714 3.441 -9.110 515 HB2 LEU 67 2HB LEU 67 -6.742 5.575 -8.573 516 HB3 LEU 67 3HB LEU 67 -5.180 5.705 -9.380 517 HG LEU 67 HG LEU 67 -7.778 4.673 -10.478 518 HD11 LEU 67 1HD1 LEU 67 -6.226 6.371 -12.184 519 HD12 LEU 67 2HD1 LEU 67 -6.416 7.123 -10.600 520 HD13 LEU 67 3HD1 LEU 67 -7.839 6.629 -11.517 521 HD21 LEU 67 3HD2 LEU 67 -6.054 3.041 -11.055 522 HD22 LEU 67 1HD2 LEU 67 -5.035 4.334 -11.686 523 HD23 LEU 67 2HD2 LEU 67 -6.568 3.957 -12.473 524 H GLN 68 H GLN 68 -6.855 2.628 -6.738 525 HA GLN 68 HA GLN 68 -5.634 4.255 -4.648 526 HB2 GLN 68 2HB GLN 68 -8.117 2.743 -4.952 527 HB3 GLN 68 3HB GLN 68 -7.343 2.487 -3.394 528 HG2 GLN 68 2HG GLN 68 -8.288 4.363 -2.706 529 HG3 GLN 68 3HG GLN 68 -7.220 5.234 -3.805 530 HE21 GLN 68 1HE2 GLN 68 -8.161 4.766 -6.230 531 HE22 GLN 68 2HE2 GLN 68 -9.794 5.305 -6.398 532 H ARG 69 H ARG 69 -4.762 1.574 -6.240 533 HA ARG 69 HA ARG 69 -3.762 0.158 -3.870 534 HB2 ARG 69 2HB ARG 69 -3.371 -0.986 -6.579 535 HB3 ARG 69 3HB ARG 69 -3.793 -1.783 -5.069 536 HG2 ARG 69 2HG ARG 69 -5.651 -0.167 -6.802 537 HG3 ARG 69 3HG ARG 69 -5.611 -1.926 -6.666 538 HD2 ARG 69 2HD ARG 69 -6.443 0.099 -4.612 539 HD3 ARG 69 3HD ARG 69 -7.376 -1.243 -5.274 540 HE ARG 69 HE ARG 69 -5.333 -2.500 -4.057 541 HH11 ARG 69 1HH1 ARG 69 -7.533 -0.019 -2.997 542 HH12 ARG 69 2HH1 ARG 69 -7.495 -0.512 -1.337 543 HH21 ARG 69 1HH2 ARG 69 -5.275 -3.160 -1.874 544 HH22 ARG 69 2HH2 ARG 69 -6.210 -2.298 -0.699 545 H PHE 70 H PHE 70 -2.771 1.880 -6.742 546 HA PHE 70 HA PHE 70 0.046 1.308 -6.199 547 HB2 PHE 70 2HB PHE 70 -1.325 2.670 -8.522 548 HB3 PHE 70 3HB PHE 70 0.423 2.531 -8.365 549 HD1 PHE 70 HD1 PHE 70 -2.665 0.457 -8.440 550 HD2 PHE 70 HD2 PHE 70 1.508 0.692 -9.245 551 HE1 PHE 70 HE1 PHE 70 -2.750 -1.756 -9.513 552 HE2 PHE 70 HE2 PHE 70 1.429 -1.520 -10.320 553 HZ PHE 70 HZ PHE 70 -0.702 -2.746 -10.456 554 H GLU 71 H GLU 71 -2.326 3.772 -5.830 555 HA GLU 71 HA GLU 71 -0.233 5.711 -5.097 556 HB2 GLU 71 2HB GLU 71 -2.172 6.100 -6.930 557 HB3 GLU 71 3HB GLU 71 -3.014 6.650 -5.488 558 HG2 GLU 71 2HG GLU 71 -0.356 7.680 -6.451 559 HG3 GLU 71 3HG GLU 71 -1.910 8.478 -6.681 560 H SER 72 H SER 72 -3.225 4.170 -4.107 561 HA SER 72 HA SER 72 -4.209 3.910 -2.072 562 HB2 SER 72 2HB SER 72 -1.656 3.553 -1.506 563 HB3 SER 72 3HB SER 72 -1.846 5.092 -0.664 564 HG SER 72 HG SER 72 -2.901 4.095 0.848 565 H GLY 73 H GLY 73 -5.281 5.929 -3.200 566 HA2 GLY 73 2HA GLY 73 -6.469 7.559 -1.490 567 HA3 GLY 73 3HA GLY 73 -4.914 8.365 -1.630 568 H ALA 74 H ALA 74 -4.992 7.229 -4.538 569 HA ALA 74 HA ALA 74 -5.782 9.635 -5.773 570 HB1 ALA 74 1HB ALA 74 -5.754 8.003 -7.865 571 HB2 ALA 74 2HB ALA 74 -4.271 8.544 -7.078 572 HB3 ALA 74 3HB ALA 74 -4.934 6.952 -6.711 573 H ARG 75 H ARG 75 -7.322 9.327 -7.847 574 HA ARG 75 HA ARG 75 -9.944 8.971 -6.732 575 HB2 ARG 75 2HB ARG 75 -10.727 9.666 -8.981 576 HB3 ARG 75 3HB ARG 75 -9.569 10.789 -8.279 577 HG2 ARG 75 2HG ARG 75 -7.798 9.832 -9.661 578 HG3 ARG 75 3HG ARG 75 -8.958 8.702 -10.362 579 HD2 ARG 75 2HD ARG 75 -8.896 11.699 -10.626 580 HD3 ARG 75 3HD ARG 75 -8.711 10.496 -11.901 581 HE ARG 75 HE ARG 75 -11.017 10.151 -11.888 582 HH11 ARG 75 1HH1 ARG 75 -10.050 12.427 -9.438 583 HH12 ARG 75 2HH1 ARG 75 -11.658 13.009 -9.159 584 HH21 ARG 75 1HH2 ARG 75 -13.139 10.909 -11.530 585 HH22 ARG 75 2HH2 ARG 75 -13.414 12.144 -10.349 586 H VAL 76 H VAL 76 -11.570 7.887 -8.452 587 HA VAL 76 HA VAL 76 -10.643 5.113 -8.674 588 HB VAL 76 HB VAL 76 -12.915 4.425 -8.646 589 HG11 VAL 76 1HG1 VAL 76 -13.679 5.228 -6.531 590 HG12 VAL 76 2HG1 VAL 76 -11.915 5.189 -6.483 591 HG13 VAL 76 3HG1 VAL 76 -12.759 6.722 -6.703 592 HG21 VAL 76 3HG2 VAL 76 -13.392 7.105 -9.653 593 HG22 VAL 76 1HG2 VAL 76 -14.377 5.650 -9.802 594 HG23 VAL 76 2HG2 VAL 76 -14.514 6.665 -8.366 595 H LEU 77 H LEU 77 -12.454 4.131 -10.499 596 HA LEU 77 HA LEU 77 -11.492 5.370 -12.982 597 HB2 LEU 77 2HB LEU 77 -12.659 2.619 -12.616 598 HB3 LEU 77 3HB LEU 77 -11.834 3.247 -14.041 599 HG LEU 77 HG LEU 77 -10.578 2.635 -11.367 600 HD11 LEU 77 1HD1 LEU 77 -10.413 1.292 -14.058 601 HD12 LEU 77 2HD1 LEU 77 -11.066 0.621 -12.563 602 HD13 LEU 77 3HD1 LEU 77 -9.337 0.943 -12.704 603 HD21 LEU 77 3HD2 LEU 77 -9.558 4.005 -13.818 604 HD22 LEU 77 1HD2 LEU 77 -8.466 3.027 -12.838 605 HD23 LEU 77 2HD2 LEU 77 -9.302 4.404 -12.118 606 H THR 78 H THR 78 -12.868 6.087 -14.525 607 HA THR 78 HA THR 78 -15.599 6.542 -13.780 608 HB THR 78 HB THR 78 -14.323 8.227 -15.046 609 HG1 THR 78 HG1 THR 78 -16.484 8.458 -15.336 610 HG21 THR 78 3HG2 THR 78 -14.581 7.122 -17.673 611 HG22 THR 78 1HG2 THR 78 -13.641 6.019 -16.669 612 HG23 THR 78 2HG2 THR 78 -13.131 7.698 -16.851 613 H ALA 79 H ALA 79 -17.205 6.276 -15.813 614 HA ALA 79 HA ALA 79 -17.668 3.480 -16.012 615 HB1 ALA 79 1HB ALA 79 -19.592 4.808 -15.985 616 HB2 ALA 79 2HB ALA 79 -18.977 5.884 -17.240 617 HB3 ALA 79 3HB ALA 79 -19.477 4.244 -17.652 618 H SER 80 H SER 80 -15.611 5.503 -17.707 619 HA SER 80 HA SER 80 -15.715 3.846 -20.132 620 HB2 SER 80 2HB SER 80 -15.879 6.348 -20.365 621 HB3 SER 80 3HB SER 80 -14.231 6.454 -19.747 622 HG SER 80 HG SER 80 -14.408 6.418 -22.078 623 H GLU 81 H GLU 81 -14.046 4.167 -17.263 624 HA GLU 81 HA GLU 81 -11.508 3.221 -18.378 625 HB2 GLU 81 2HB GLU 81 -12.296 4.292 -15.677 626 HB3 GLU 81 3HB GLU 81 -10.762 3.473 -15.935 627 HG2 GLU 81 2HG GLU 81 -11.703 5.973 -17.321 628 HG3 GLU 81 3HG GLU 81 -10.484 5.872 -16.052 629 H THR 82 H THR 82 -13.605 2.403 -15.608 630 HA THR 82 HA THR 82 -12.544 -0.068 -15.005 631 HB THR 82 HB THR 82 -15.264 -0.432 -14.574 632 HG1 THR 82 HG1 THR 82 -16.068 1.514 -14.865 633 HG21 THR 82 3HG2 THR 82 -12.952 -0.247 -13.091 634 HG22 THR 82 1HG2 THR 82 -14.563 -0.561 -12.448 635 HG23 THR 82 2HG2 THR 82 -13.927 1.084 -12.469 636 H LYS 83 H LYS 83 -15.213 0.644 -17.249 637 HA LYS 83 HA LYS 83 -15.807 -1.952 -18.028 638 HB2 LYS 83 2HB LYS 83 -16.137 0.737 -19.242 639 HB3 LYS 83 3HB LYS 83 -16.305 -0.644 -20.317 640 HG2 LYS 83 2HG LYS 83 -17.913 -1.529 -18.463 641 HG3 LYS 83 3HG LYS 83 -17.993 0.173 -18.002 642 HD2 LYS 83 2HD LYS 83 -18.761 0.783 -20.202 643 HD3 LYS 83 3HD LYS 83 -18.532 -0.868 -20.782 644 HE2 LYS 83 2HE LYS 83 -20.802 -0.820 -20.374 645 HE3 LYS 83 3HE LYS 83 -20.179 -1.480 -18.862 646 HZ1 LYS 83 3HZ LYS 83 -21.884 0.478 -18.864 647 HZ2 LYS 83 1HZ LYS 83 -20.502 1.425 -19.099 648 HZ3 LYS 83 2HZ LYS 83 -20.628 0.436 -17.732 649 H THR 84 H THR 84 -13.491 0.319 -19.484 650 HA THR 84 HA THR 84 -12.600 -1.302 -21.565 651 HB THR 84 HB THR 84 -10.915 0.676 -20.017 652 HG1 THR 84 HG1 THR 84 -11.841 2.233 -21.224 653 HG21 THR 84 3HG2 THR 84 -10.095 -1.035 -21.957 654 HG22 THR 84 1HG2 THR 84 -9.376 0.548 -21.664 655 HG23 THR 84 2HG2 THR 84 -10.593 0.352 -22.925 656 H PHE 85 H PHE 85 -11.063 -0.829 -18.377 657 HA PHE 85 HA PHE 85 -9.021 -2.662 -18.616 658 HB2 PHE 85 2HB PHE 85 -9.576 -1.029 -16.687 659 HB3 PHE 85 3HB PHE 85 -10.533 -2.355 -16.034 660 HD1 PHE 85 HD2 PHE 85 -9.373 -4.553 -15.564 661 HD2 PHE 85 HD1 PHE 85 -7.266 -0.944 -16.374 662 HE1 PHE 85 HE2 PHE 85 -7.350 -5.509 -14.541 663 HE2 PHE 85 HE1 PHE 85 -5.239 -1.895 -15.352 664 HZ PHE 85 HZ PHE 85 -5.280 -4.179 -14.433 665 H LEU 86 H LEU 86 -12.341 -3.238 -17.505 666 HA LEU 86 HA LEU 86 -11.992 -5.993 -16.964 667 HB2 LEU 86 2HB LEU 86 -13.824 -4.864 -15.965 668 HB3 LEU 86 3HB LEU 86 -14.424 -4.317 -17.529 669 HG LEU 86 HG LEU 86 -14.666 -6.923 -17.938 670 HD11 LEU 86 1HD1 LEU 86 -14.638 -6.610 -14.954 671 HD12 LEU 86 2HD1 LEU 86 -13.791 -7.794 -15.949 672 HD13 LEU 86 3HD1 LEU 86 -15.540 -7.900 -15.750 673 HD21 LEU 86 3HD2 LEU 86 -16.493 -5.373 -18.106 674 HD22 LEU 86 1HD2 LEU 86 -16.560 -5.195 -16.353 675 HD23 LEU 86 2HD2 LEU 86 -16.997 -6.732 -17.100 676 H ALA 87 H ALA 87 -12.930 -4.202 -19.840 677 HA ALA 87 HA ALA 87 -13.617 -6.552 -21.347 678 HB1 ALA 87 1HB ALA 87 -14.695 -4.432 -21.839 679 HB2 ALA 87 2HB ALA 87 -13.137 -3.715 -22.252 680 HB3 ALA 87 3HB ALA 87 -13.803 -5.010 -23.247 681 H ALA 88 H ALA 88 -10.749 -5.578 -20.226 682 HA ALA 88 HA ALA 88 -9.286 -6.440 -22.636 683 HB1 ALA 88 1HB ALA 88 -8.550 -4.270 -22.233 684 HB2 ALA 88 2HB ALA 88 -8.561 -4.487 -20.482 685 HB3 ALA 88 3HB ALA 88 -7.319 -5.269 -21.460 686 H ALA 89 H ALA 89 -10.100 -7.199 -19.427 687 HA ALA 89 HA ALA 89 -7.967 -9.232 -19.320 688 HB1 ALA 89 1HB ALA 89 -8.926 -7.347 -17.320 689 HB2 ALA 89 2HB ALA 89 -8.895 -9.012 -16.740 690 HB3 ALA 89 3HB ALA 89 -7.426 -8.274 -17.378 691 H ASP 90 H ASP 90 -11.276 -8.586 -18.147 692 HA ASP 90 HA ASP 90 -11.940 -11.230 -17.544 693 HB2 ASP 90 2HB ASP 90 -13.312 -9.424 -16.734 694 HB3 ASP 90 3HB ASP 90 -13.691 -8.910 -18.376 695 H HIS 91 H HIS 91 -13.289 -9.441 -20.313 696 HA HIS 91 HA HIS 91 -13.883 -10.100 -22.408 697 HB2 HIS 91 2HB HIS 91 -11.330 -10.694 -22.283 698 HB3 HIS 91 3HB HIS 91 -11.914 -12.355 -22.292 699 HD1 HIS 91 HD1 HIS 91 -10.527 -12.338 -24.637 700 HD2 HIS 91 HD2 HIS 91 -14.087 -10.199 -24.537 701 HE1 HIS 91 HE1 HIS 91 -11.167 -11.986 -27.043 702 H ASP 92 H ASP 92 -14.679 -11.694 -19.802 703 HA ASP 92 HA ASP 92 -15.831 -14.028 -21.169 704 HB2 ASP 92 2HB ASP 92 -15.910 -13.644 -18.195 705 HB3 ASP 92 3HB ASP 92 -15.902 -15.141 -19.124 706 H GLY 93 H GLY 93 -16.600 -10.984 -19.819 707 HA2 GLY 93 2HA GLY 93 -18.624 -9.852 -19.958 708 HA3 GLY 93 3HA GLY 93 -19.385 -11.338 -20.508 709 H ASP 94 H ASP 94 -17.521 -11.664 -17.676 710 HA ASP 94 HA ASP 94 -19.908 -12.170 -16.123 711 HB2 ASP 94 2HB ASP 94 -17.213 -12.239 -14.862 712 HB3 ASP 94 3HB ASP 94 -18.567 -13.352 -14.686 713 H GLY 95 H GLY 95 -17.377 -9.755 -16.313 714 HA2 GLY 95 2HA GLY 95 -17.705 -7.511 -15.616 715 HA3 GLY 95 3HA GLY 95 -18.937 -8.067 -14.494 716 H LYS 96 H LYS 96 -16.668 -10.251 -13.986 717 HA LYS 96 HA LYS 96 -15.222 -8.602 -12.016 718 HB2 LYS 96 2HB LYS 96 -15.200 -10.537 -10.519 719 HB3 LYS 96 3HB LYS 96 -16.848 -10.073 -10.922 720 HG2 LYS 96 2HG LYS 96 -16.118 -11.962 -12.845 721 HG3 LYS 96 3HG LYS 96 -15.509 -12.583 -11.309 722 HD2 LYS 96 2HD LYS 96 -18.254 -11.474 -11.307 723 HD3 LYS 96 3HD LYS 96 -18.013 -12.998 -12.165 724 HE2 LYS 96 2HE LYS 96 -17.851 -14.135 -10.256 725 HE3 LYS 96 3HE LYS 96 -16.667 -13.002 -9.606 726 HZ1 LYS 96 3HZ LYS 96 -18.783 -11.530 -9.285 727 HZ2 LYS 96 1HZ LYS 96 -18.383 -12.720 -8.151 728 HZ3 LYS 96 2HZ LYS 96 -19.583 -13.020 -9.304 729 H ILE 97 H ILE 97 -13.057 -8.726 -12.015 730 HA ILE 97 HA ILE 97 -11.756 -10.233 -14.094 731 HB ILE 97 HB ILE 97 -10.596 -8.473 -11.932 732 HG12 ILE 97 2HG1 ILE 97 -12.092 -7.396 -13.661 733 HG13 ILE 97 3HG1 ILE 97 -10.450 -6.767 -13.597 734 HG21 ILE 97 1HG2 ILE 97 -9.358 -10.177 -13.981 735 HG22 ILE 97 2HG2 ILE 97 -8.733 -8.531 -13.891 736 HG23 ILE 97 3HG2 ILE 97 -8.702 -9.565 -12.463 737 HD11 ILE 97 3HD1 ILE 97 -11.819 -7.668 -15.834 738 HD12 ILE 97 1HD1 ILE 97 -10.103 -7.282 -15.720 739 HD13 ILE 97 2HD1 ILE 97 -10.653 -8.940 -15.475 740 H GLY 98 H GLY 98 -10.335 -11.934 -13.876 741 HA2 GLY 98 2HA GLY 98 -10.262 -13.192 -11.202 742 HA3 GLY 98 3HA GLY 98 -10.404 -14.110 -12.694 743 H ALA 99 H ALA 99 -8.410 -14.496 -10.704 744 HA ALA 99 HA ALA 99 -5.964 -13.252 -11.434 745 HB1 ALA 99 1HB ALA 99 -6.578 -15.740 -9.857 746 HB2 ALA 99 2HB ALA 99 -4.941 -15.130 -10.103 747 HB3 ALA 99 3HB ALA 99 -6.129 -14.148 -9.246 748 H GLU 100 H GLU 100 -7.832 -15.405 -13.107 749 HA GLU 100 HA GLU 100 -5.551 -16.761 -14.358 750 HB2 GLU 100 2HB GLU 100 -7.363 -18.218 -13.617 751 HB3 GLU 100 3HB GLU 100 -8.518 -17.299 -14.572 752 HG2 GLU 100 2HG GLU 100 -7.627 -18.078 -16.600 753 HG3 GLU 100 3HG GLU 100 -6.171 -18.689 -15.817 754 H GLU 101 H GLU 101 -7.855 -14.276 -14.861 755 HA GLU 101 HA GLU 101 -7.154 -14.159 -17.721 756 HB2 GLU 101 2HB GLU 101 -9.231 -13.154 -18.184 757 HB3 GLU 101 3HB GLU 101 -9.602 -14.454 -17.060 758 HG2 GLU 101 2HG GLU 101 -9.227 -12.425 -15.332 759 HG3 GLU 101 3HG GLU 101 -9.831 -11.541 -16.733 760 H PHE 102 H PHE 102 -6.463 -12.801 -14.801 761 HA PHE 102 HA PHE 102 -6.414 -10.032 -15.479 762 HB2 PHE 102 2HB PHE 102 -6.503 -10.841 -13.143 763 HB3 PHE 102 3HB PHE 102 -4.880 -11.498 -13.323 764 HD1 PHE 102 HD2 PHE 102 -6.834 -8.357 -13.333 765 HD2 PHE 102 HD1 PHE 102 -2.988 -10.152 -13.006 766 HE1 PHE 102 HE2 PHE 102 -5.888 -6.195 -12.636 767 HE2 PHE 102 HE1 PHE 102 -2.036 -7.994 -12.308 768 HZ PHE 102 HZ PHE 102 -3.486 -6.011 -12.123 769 H GLN 103 H GLN 103 -3.662 -12.186 -14.769 770 HA GLN 103 HA GLN 103 -1.667 -10.607 -15.819 771 HB2 GLN 103 2HB GLN 103 -0.342 -12.673 -16.050 772 HB3 GLN 103 3HB GLN 103 -1.191 -12.599 -14.512 773 HG2 GLN 103 2HG GLN 103 -2.966 -13.921 -16.146 774 HG3 GLN 103 3HG GLN 103 -1.396 -14.533 -16.666 775 HE21 GLN 103 1HE2 GLN 103 -2.598 -13.526 -13.490 776 HE22 GLN 103 2HE2 GLN 103 -2.284 -15.030 -12.701 777 H GLU 104 H GLU 104 -3.863 -12.772 -17.491 778 HA GLU 104 HA GLU 104 -2.592 -12.966 -19.956 779 HB2 GLU 104 2HB GLU 104 -5.578 -12.708 -19.628 780 HB3 GLU 104 3HB GLU 104 -4.699 -13.595 -20.865 781 HG2 GLU 104 2HG GLU 104 -4.961 -14.287 -17.953 782 HG3 GLU 104 3HG GLU 104 -5.607 -15.170 -19.336 783 H MET 105 H MET 105 -4.338 -10.317 -18.529 784 HA MET 105 HA MET 105 -4.554 -8.851 -21.013 785 HB2 MET 105 2HB MET 105 -5.837 -7.322 -19.859 786 HB3 MET 105 3HB MET 105 -6.130 -8.779 -18.918 787 HG2 MET 105 2HG MET 105 -5.614 -7.507 -17.164 788 HG3 MET 105 3HG MET 105 -3.945 -7.763 -17.667 789 HE1 MET 105 3HE MET 105 -6.445 -4.930 -19.683 790 HE2 MET 105 1HE MET 105 -7.055 -5.883 -18.330 791 HE3 MET 105 2HE MET 105 -6.635 -4.187 -18.094 792 H VAL 106 H VAL 106 -2.240 -9.270 -18.543 793 HA VAL 106 HA VAL 106 -0.947 -6.715 -18.853 794 HB VAL 106 HB VAL 106 0.221 -9.196 -17.597 795 HG11 VAL 106 1HG1 VAL 106 1.161 -6.526 -17.995 796 HG12 VAL 106 2HG1 VAL 106 0.974 -6.830 -16.266 797 HG13 VAL 106 3HG1 VAL 106 1.984 -7.894 -17.246 798 HG21 VAL 106 3HG2 VAL 106 -2.131 -8.110 -16.801 799 HG22 VAL 106 1HG2 VAL 106 -0.997 -8.925 -15.724 800 HG23 VAL 106 2HG2 VAL 106 -0.988 -7.166 -15.847 801 H GLN 107 H GLN 107 0.573 -9.902 -19.193 802 HA GLN 107 HA GLN 107 2.496 -9.000 -21.041 803 HB2 GLN 107 2HB GLN 107 1.581 -11.847 -20.618 804 HB3 GLN 107 3HB GLN 107 3.122 -11.322 -21.283 805 HG2 GLN 107 2HG GLN 107 4.023 -11.091 -19.269 806 HG3 GLN 107 3HG GLN 107 2.632 -10.193 -18.664 807 HE21 GLN 107 1HE2 GLN 107 0.691 -11.550 -18.170 808 HE22 GLN 107 2HE2 GLN 107 0.967 -13.076 -17.409 809 H SER 108 H SER 108 -0.658 -10.490 -21.439 810 HA SER 108 HA SER 108 -0.363 -10.206 -24.358 811 HB2 SER 108 2HB SER 108 -0.630 -12.529 -23.890 812 HB3 SER 108 3HB SER 108 -1.931 -12.219 -22.742 813 HG SER 108 HG SER 108 -3.312 -12.046 -24.339 Start of MODEL 13 1 H1 SER 1 H SER 1 0.221 0.665 -1.404 2 HA SER 1 HA SER 1 1.422 0.204 -3.883 3 HB2 SER 1 2HB SER 1 2.850 0.680 -1.257 4 HB3 SER 1 3HB SER 1 3.477 1.003 -2.873 5 HG SER 1 HG SER 1 1.908 2.602 -3.117 6 H LEU 2 H LEU 2 1.619 -1.824 -4.642 7 HA LEU 2 HA LEU 2 1.999 -4.164 -3.245 8 HB2 LEU 2 2HB LEU 2 3.245 -3.642 -5.930 9 HB3 LEU 2 3HB LEU 2 2.660 -5.174 -5.285 10 HG LEU 2 HG LEU 2 0.933 -4.734 -6.675 11 HD11 LEU 2 1HD1 LEU 2 0.236 -4.428 -4.169 12 HD12 LEU 2 2HD1 LEU 2 -0.913 -4.109 -5.467 13 HD13 LEU 2 3HD1 LEU 2 -0.082 -2.770 -4.678 14 HD21 LEU 2 3HD2 LEU 2 0.211 -2.175 -6.914 15 HD22 LEU 2 1HD2 LEU 2 1.476 -2.907 -7.901 16 HD23 LEU 2 2HD2 LEU 2 1.907 -1.945 -6.486 17 H THR 3 H THR 3 4.596 -2.428 -4.974 18 HA THR 3 HA THR 3 6.851 -2.359 -4.651 19 HB THR 3 HB THR 3 7.192 -2.725 -1.893 20 HG1 THR 3 HG1 THR 3 5.180 -2.497 -1.210 21 HG21 THR 3 3HG2 THR 3 7.505 -0.706 -3.864 22 HG22 THR 3 1HG2 THR 3 8.261 -0.810 -2.275 23 HG23 THR 3 2HG2 THR 3 6.717 0.023 -2.465 24 H ASP 4 H ASP 4 5.436 -5.020 -4.858 25 HA ASP 4 HA ASP 4 7.638 -6.663 -3.792 26 HB2 ASP 4 2HB ASP 4 4.704 -7.039 -3.621 27 HB3 ASP 4 3HB ASP 4 5.650 -8.479 -3.991 28 H ILE 5 H ILE 5 6.190 -5.490 -6.513 29 HA ILE 5 HA ILE 5 7.293 -7.679 -8.137 30 HB ILE 5 HB ILE 5 4.743 -6.205 -8.801 31 HG12 ILE 5 2HG1 ILE 5 4.036 -8.819 -8.504 32 HG13 ILE 5 3HG1 ILE 5 5.267 -8.663 -7.256 33 HG21 ILE 5 1HG2 ILE 5 6.255 -7.086 -10.660 34 HG22 ILE 5 2HG2 ILE 5 5.803 -8.695 -10.098 35 HG23 ILE 5 3HG2 ILE 5 4.564 -7.586 -10.686 36 HD11 ILE 5 3HD1 ILE 5 3.444 -8.076 -6.051 37 HD12 ILE 5 1HD1 ILE 5 3.871 -6.487 -6.686 38 HD13 ILE 5 2HD1 ILE 5 2.588 -7.427 -7.449 39 H LEU 6 H LEU 6 6.341 -4.283 -7.963 40 HA LEU 6 HA LEU 6 8.424 -3.679 -9.949 41 HB2 LEU 6 2HB LEU 6 5.623 -2.605 -9.802 42 HB3 LEU 6 3HB LEU 6 6.910 -1.748 -10.647 43 HG LEU 6 HG LEU 6 6.455 -4.578 -11.404 44 HD11 LEU 6 1HD1 LEU 6 4.377 -4.375 -12.164 45 HD12 LEU 6 2HD1 LEU 6 4.728 -2.818 -12.913 46 HD13 LEU 6 3HD1 LEU 6 4.257 -2.893 -11.215 47 HD21 LEU 6 3HD2 LEU 6 7.680 -2.183 -12.464 48 HD22 LEU 6 1HD2 LEU 6 6.578 -2.919 -13.628 49 HD23 LEU 6 2HD2 LEU 6 7.897 -3.867 -12.941 50 H SER 7 H SER 7 9.295 -1.500 -9.797 51 HA SER 7 HA SER 7 9.723 -0.742 -7.066 52 HB2 SER 7 2HB SER 7 11.048 -0.349 -9.557 53 HB3 SER 7 3HB SER 7 10.742 1.239 -8.853 54 HG SER 7 HG SER 7 11.810 -0.847 -7.289 55 HA PRO 8 HA PRO 8 6.818 2.503 -6.552 56 HB2 PRO 8 2HB PRO 8 8.255 4.368 -5.200 57 HB3 PRO 8 3HB PRO 8 7.718 2.852 -4.467 58 HG2 PRO 8 2HG PRO 8 10.396 3.565 -5.598 59 HG3 PRO 8 3HG PRO 8 10.009 2.687 -4.107 60 HD2 PRO 8 2HD PRO 8 10.770 1.431 -6.382 61 HD3 PRO 8 3HD PRO 8 9.640 0.704 -5.221 62 H SER 9 H SER 9 10.001 3.848 -7.455 63 HA SER 9 HA SER 9 9.143 6.250 -8.523 64 HB2 SER 9 2HB SER 9 11.242 6.039 -9.996 65 HB3 SER 9 3HB SER 9 11.472 5.986 -8.248 66 HG SER 9 HG SER 9 12.082 4.128 -10.087 67 H ASP 10 H ASP 10 9.528 3.125 -10.162 68 HA ASP 10 HA ASP 10 8.842 3.957 -12.740 69 HB2 ASP 10 2HB ASP 10 8.496 1.284 -11.373 70 HB3 ASP 10 3HB ASP 10 8.202 1.542 -13.090 71 H ILE 11 H ILE 11 6.844 3.072 -9.995 72 HA ILE 11 HA ILE 11 4.393 3.018 -11.483 73 HB ILE 11 HB ILE 11 4.916 3.135 -8.513 74 HG12 ILE 11 2HG1 ILE 11 3.688 0.812 -9.929 75 HG13 ILE 11 3HG1 ILE 11 5.422 1.063 -10.095 76 HG21 ILE 11 1HG2 ILE 11 2.782 4.133 -8.870 77 HG22 ILE 11 2HG2 ILE 11 2.324 2.881 -10.023 78 HG23 ILE 11 3HG2 ILE 11 2.507 2.483 -8.315 79 HD11 ILE 11 3HD1 ILE 11 3.856 0.544 -7.590 80 HD12 ILE 11 1HD1 ILE 11 5.131 -0.439 -8.310 81 HD13 ILE 11 2HD1 ILE 11 5.524 1.117 -7.577 82 H ALA 12 H ALA 12 5.820 5.287 -9.137 83 HA ALA 12 HA ALA 12 3.826 7.222 -9.189 84 HB1 ALA 12 1HB ALA 12 6.295 8.570 -8.941 85 HB2 ALA 12 2HB ALA 12 5.185 8.078 -7.661 86 HB3 ALA 12 3HB ALA 12 6.479 6.994 -8.171 87 H ALA 13 H ALA 13 6.223 6.443 -11.554 88 HA ALA 13 HA ALA 13 6.082 8.950 -12.957 89 HB1 ALA 13 1HB ALA 13 7.524 6.406 -13.261 90 HB2 ALA 13 2HB ALA 13 7.149 7.247 -14.767 91 HB3 ALA 13 3HB ALA 13 8.075 8.064 -13.507 92 H ALA 14 H ALA 14 4.286 6.010 -12.927 93 HA ALA 14 HA ALA 14 3.067 6.537 -15.525 94 HB1 ALA 14 1HB ALA 14 2.198 4.319 -13.726 95 HB2 ALA 14 2HB ALA 14 2.257 4.381 -15.488 96 HB3 ALA 14 3HB ALA 14 3.748 4.211 -14.561 97 H LEU 15 H LEU 15 2.129 6.281 -12.110 98 HA LEU 15 HA LEU 15 -0.593 6.742 -12.365 99 HB2 LEU 15 2HB LEU 15 1.367 7.412 -10.195 100 HB3 LEU 15 3HB LEU 15 -0.347 7.791 -10.040 101 HG LEU 15 HG LEU 15 0.851 5.039 -10.351 102 HD11 LEU 15 1HD1 LEU 15 1.106 5.133 -8.150 103 HD12 LEU 15 2HD1 LEU 15 -0.648 5.240 -8.008 104 HD13 LEU 15 3HD1 LEU 15 0.322 6.711 -8.068 105 HD21 LEU 15 3HD2 LEU 15 -1.485 4.293 -9.883 106 HD22 LEU 15 1HD2 LEU 15 -1.269 5.070 -11.452 107 HD23 LEU 15 2HD2 LEU 15 -2.009 5.961 -10.121 108 H ARG 16 H ARG 16 1.999 9.130 -11.853 109 HA ARG 16 HA ARG 16 0.254 11.373 -12.044 110 HB2 ARG 16 2HB ARG 16 3.239 11.377 -12.487 111 HB3 ARG 16 3HB ARG 16 2.230 12.718 -11.962 112 HG2 ARG 16 2HG ARG 16 1.857 11.698 -9.836 113 HG3 ARG 16 3HG ARG 16 2.642 10.206 -10.359 114 HD2 ARG 16 2HD ARG 16 4.597 10.995 -9.667 115 HD3 ARG 16 3HD ARG 16 4.455 12.337 -10.802 116 HE ARG 16 HE ARG 16 3.973 12.401 -7.959 117 HH11 ARG 16 1HH1 ARG 16 3.403 13.950 -11.025 118 HH12 ARG 16 2HH1 ARG 16 3.078 15.502 -10.328 119 HH21 ARG 16 1HH2 ARG 16 3.547 14.440 -7.030 120 HH22 ARG 16 2HH2 ARG 16 3.161 15.780 -8.055 121 H ASP 17 H ASP 17 2.153 9.533 -14.329 122 HA ASP 17 HA ASP 17 2.288 11.282 -16.471 123 HB2 ASP 17 2HB ASP 17 3.476 9.286 -16.740 124 HB3 ASP 17 3HB ASP 17 2.094 8.291 -16.290 125 H CYS 18 H CYS 18 -0.374 9.200 -15.451 126 HA CYS 18 HA CYS 18 -2.168 10.763 -17.157 127 HB2 CYS 18 2HB CYS 18 -1.862 7.770 -17.170 128 HB3 CYS 18 3HB CYS 18 -3.379 8.529 -17.635 129 HG CYS 18 HG CYS 18 -2.505 8.286 -20.083 130 H GLN 19 H GLN 19 -1.862 11.155 -14.470 131 HA GLN 19 HA GLN 19 -3.577 9.633 -12.832 132 HB2 GLN 19 2HB GLN 19 -3.521 11.685 -11.347 133 HB3 GLN 19 3HB GLN 19 -1.959 10.984 -11.751 134 HG2 GLN 19 2HG GLN 19 -1.409 12.721 -13.189 135 HG3 GLN 19 3HG GLN 19 -3.085 13.240 -13.358 136 HE21 GLN 19 1HE2 GLN 19 -0.736 12.735 -10.741 137 HE22 GLN 19 2HE2 GLN 19 -1.071 14.221 -9.925 138 H ALA 20 H ALA 20 -4.126 12.367 -14.948 139 HA ALA 20 HA ALA 20 -6.564 13.304 -14.080 140 HB1 ALA 20 1HB ALA 20 -6.933 14.121 -16.299 141 HB2 ALA 20 2HB ALA 20 -5.208 14.239 -15.950 142 HB3 ALA 20 3HB ALA 20 -5.813 12.938 -16.975 143 HA PRO 21 HA PRO 21 -9.469 10.043 -14.595 144 HB2 PRO 21 2HB PRO 21 -11.734 11.497 -14.948 145 HB3 PRO 21 3HB PRO 21 -10.926 11.342 -13.384 146 HG2 PRO 21 2HG PRO 21 -10.792 13.576 -15.372 147 HG3 PRO 21 3HG PRO 21 -10.938 13.657 -13.606 148 HD2 PRO 21 2HD PRO 21 -8.585 14.034 -14.892 149 HD3 PRO 21 3HD PRO 21 -8.684 13.302 -13.278 150 H ASP 22 H ASP 22 -10.307 8.827 -16.212 151 HA ASP 22 HA ASP 22 -10.804 8.116 -18.315 152 HB2 ASP 22 2HB ASP 22 -12.534 9.995 -17.976 153 HB3 ASP 22 3HB ASP 22 -11.499 10.957 -19.028 154 H SER 23 H SER 23 -8.157 9.487 -17.619 155 HA SER 23 HA SER 23 -7.255 9.891 -20.397 156 HB2 SER 23 2HB SER 23 -6.708 11.422 -17.924 157 HB3 SER 23 3HB SER 23 -5.315 11.126 -18.963 158 HG SER 23 HG SER 23 -7.692 12.526 -19.533 159 H PHE 24 H PHE 24 -7.396 7.503 -18.482 160 HA PHE 24 HA PHE 24 -4.606 6.659 -18.880 161 HB2 PHE 24 2HB PHE 24 -5.234 7.178 -16.451 162 HB3 PHE 24 3HB PHE 24 -6.262 5.751 -16.532 163 HD1 PHE 24 HD1 PHE 24 -2.955 6.164 -18.131 164 HD2 PHE 24 HD2 PHE 24 -5.180 4.356 -14.985 165 HE1 PHE 24 HE1 PHE 24 -1.020 4.746 -17.582 166 HE2 PHE 24 HE2 PHE 24 -3.249 2.936 -14.430 167 HZ PHE 24 HZ PHE 24 -1.165 3.130 -15.729 168 H SER 25 H SER 25 -4.351 4.277 -18.940 169 HA SER 25 HA SER 25 -6.769 2.847 -19.774 170 HB2 SER 25 2HB SER 25 -4.479 3.569 -21.482 171 HB3 SER 25 3HB SER 25 -4.950 1.872 -21.566 172 HG SER 25 HG SER 25 -6.909 2.435 -22.318 173 HA PRO 26 HA PRO 26 -5.135 -0.577 -17.574 174 HB2 PRO 26 2HB PRO 26 -5.883 -2.681 -19.118 175 HB3 PRO 26 3HB PRO 26 -7.029 -1.738 -18.158 176 HG2 PRO 26 2HG PRO 26 -6.401 -1.553 -21.079 177 HG3 PRO 26 3HG PRO 26 -7.978 -1.503 -20.269 178 HD2 PRO 26 2HD PRO 26 -6.709 0.731 -21.125 179 HD3 PRO 26 3HD PRO 26 -7.749 0.716 -19.687 180 H LYS 27 H LYS 27 -4.072 0.045 -20.781 181 HA LYS 27 HA LYS 27 -1.832 -1.839 -20.467 182 HB2 LYS 27 2HB LYS 27 -2.150 -0.560 -23.087 183 HB3 LYS 27 3HB LYS 27 -1.892 -2.252 -22.683 184 HG2 LYS 27 2HG LYS 27 -4.539 -0.839 -22.449 185 HG3 LYS 27 3HG LYS 27 -4.037 -1.800 -23.841 186 HD2 LYS 27 2HD LYS 27 -4.095 -2.901 -21.041 187 HD3 LYS 27 3HD LYS 27 -5.488 -2.974 -22.123 188 HE2 LYS 27 2HE LYS 27 -2.806 -3.993 -22.989 189 HE3 LYS 27 3HE LYS 27 -3.882 -4.994 -22.015 190 HZ1 LYS 27 3HZ LYS 27 -4.083 -5.314 -24.462 191 HZ2 LYS 27 1HZ LYS 27 -4.693 -3.740 -24.577 192 HZ3 LYS 27 2HZ LYS 27 -5.535 -4.911 -23.695 193 H LYS 28 H LYS 28 -2.378 1.111 -19.582 194 HA LYS 28 HA LYS 28 0.064 2.290 -20.720 195 HB2 LYS 28 2HB LYS 28 -2.412 3.470 -19.503 196 HB3 LYS 28 3HB LYS 28 -0.918 4.398 -19.541 197 HG2 LYS 28 2HG LYS 28 -2.007 3.153 -22.034 198 HG3 LYS 28 3HG LYS 28 -2.624 4.698 -21.444 199 HD2 LYS 28 2HD LYS 28 0.324 4.314 -21.694 200 HD3 LYS 28 3HD LYS 28 -0.629 4.608 -23.151 201 HE2 LYS 28 2HE LYS 28 -0.853 6.365 -20.725 202 HE3 LYS 28 3HE LYS 28 0.380 6.634 -21.956 203 HZ1 LYS 28 3HZ LYS 28 -1.732 6.474 -23.508 204 HZ2 LYS 28 1HZ LYS 28 -1.262 7.930 -22.787 205 HZ3 LYS 28 2HZ LYS 28 -2.510 7.014 -22.107 206 H PHE 29 H PHE 29 -0.403 0.316 -18.383 207 HA PHE 29 HA PHE 29 1.165 1.826 -16.397 208 HB2 PHE 29 2HB PHE 29 -1.295 0.681 -15.980 209 HB3 PHE 29 3HB PHE 29 -0.203 -0.582 -15.422 210 HD1 PHE 29 HD1 PHE 29 2.002 1.247 -14.425 211 HD2 PHE 29 HD2 PHE 29 -2.222 1.317 -13.908 212 HE1 PHE 29 HE1 PHE 29 2.286 2.437 -12.290 213 HE2 PHE 29 HE2 PHE 29 -1.945 2.507 -11.773 214 HZ PHE 29 HZ PHE 29 0.311 3.069 -10.962 215 H PHE 30 H PHE 30 1.340 -0.519 -18.693 216 HA PHE 30 HA PHE 30 3.305 -2.135 -17.229 217 HB2 PHE 30 2HB PHE 30 2.882 -3.883 -18.682 218 HB3 PHE 30 3HB PHE 30 1.307 -3.096 -18.641 219 HD1 PHE 30 HD1 PHE 30 4.313 -3.713 -20.637 220 HD2 PHE 30 HD2 PHE 30 0.450 -1.926 -20.558 221 HE1 PHE 30 HE1 PHE 30 4.379 -3.470 -23.085 222 HE2 PHE 30 HE2 PHE 30 0.510 -1.681 -23.005 223 HZ PHE 30 HZ PHE 30 2.476 -2.454 -24.272 224 H GLN 31 H GLN 31 3.103 0.432 -19.380 225 HA GLN 31 HA GLN 31 5.624 -0.157 -20.721 226 HB2 GLN 31 2HB GLN 31 4.218 2.447 -21.069 227 HB3 GLN 31 3HB GLN 31 5.086 1.474 -22.250 228 HG2 GLN 31 2HG GLN 31 3.214 -0.146 -22.220 229 HG3 GLN 31 3HG GLN 31 2.339 0.943 -21.145 230 HE21 GLN 31 1HE2 GLN 31 0.694 1.555 -22.418 231 HE22 GLN 31 2HE2 GLN 31 0.870 2.371 -23.930 232 H ILE 32 H ILE 32 4.317 1.861 -18.197 233 HA ILE 32 HA ILE 32 6.854 3.303 -17.942 234 HB ILE 32 HB ILE 32 4.280 3.738 -16.423 235 HG12 ILE 32 2HG1 ILE 32 4.601 5.920 -18.034 236 HG13 ILE 32 3HG1 ILE 32 5.207 4.635 -19.073 237 HG21 ILE 32 1HG2 ILE 32 5.890 4.697 -15.091 238 HG22 ILE 32 2HG2 ILE 32 6.935 5.095 -16.454 239 HG23 ILE 32 3HG2 ILE 32 5.481 6.046 -16.151 240 HD11 ILE 32 3HD1 ILE 32 2.619 4.206 -17.690 241 HD12 ILE 32 1HD1 ILE 32 2.668 5.328 -19.049 242 HD13 ILE 32 2HD1 ILE 32 3.167 3.650 -19.271 243 H SER 33 H SER 33 4.927 0.855 -16.415 244 HA SER 33 HA SER 33 6.601 0.884 -14.017 245 HB2 SER 33 2HB SER 33 4.026 0.633 -14.001 246 HB3 SER 33 3HB SER 33 4.328 -1.025 -14.521 247 HG SER 33 HG SER 33 4.583 0.081 -12.061 248 H GLY 34 H GLY 34 5.277 -1.744 -16.035 249 HA2 GLY 34 2HA GLY 34 6.998 -3.054 -17.317 250 HA3 GLY 34 3HA GLY 34 7.909 -3.070 -15.815 251 H MET 35 H MET 35 4.430 -3.415 -15.913 252 HA MET 35 HA MET 35 4.420 -5.737 -14.346 253 HB2 MET 35 2HB MET 35 2.225 -4.846 -16.220 254 HB3 MET 35 3HB MET 35 2.053 -5.850 -14.787 255 HG2 MET 35 2HG MET 35 2.684 -3.978 -13.375 256 HG3 MET 35 3HG MET 35 2.918 -2.969 -14.800 257 HE1 MET 35 3HE MET 35 -1.193 -4.693 -13.609 258 HE2 MET 35 1HE MET 35 0.148 -5.654 -14.232 259 HE3 MET 35 2HE MET 35 0.251 -4.934 -12.626 260 H SER 36 H SER 36 3.774 -5.368 -17.834 261 HA SER 36 HA SER 36 3.401 -8.040 -18.460 262 HB2 SER 36 2HB SER 36 4.812 -6.070 -20.265 263 HB3 SER 36 3HB SER 36 3.819 -7.448 -20.739 264 HG SER 36 HG SER 36 2.019 -6.365 -19.855 265 H LYS 37 H LYS 37 6.371 -6.254 -17.957 266 HA LYS 37 HA LYS 37 8.166 -8.140 -19.033 267 HB2 LYS 37 2HB LYS 37 8.762 -6.302 -16.718 268 HB3 LYS 37 3HB LYS 37 9.887 -6.930 -17.915 269 HG2 LYS 37 2HG LYS 37 7.698 -4.917 -18.383 270 HG3 LYS 37 3HG LYS 37 9.437 -4.612 -18.364 271 HD2 LYS 37 2HD LYS 37 9.321 -6.553 -20.227 272 HD3 LYS 37 3HD LYS 37 7.737 -5.810 -20.462 273 HE2 LYS 37 2HE LYS 37 8.828 -3.617 -20.703 274 HE3 LYS 37 3HE LYS 37 10.401 -4.392 -20.516 275 HZ1 LYS 37 3HZ LYS 37 10.285 -5.337 -22.575 276 HZ2 LYS 37 1HZ LYS 37 9.410 -3.919 -22.871 277 HZ3 LYS 37 2HZ LYS 37 8.594 -5.377 -22.605 278 H LYS 38 H LYS 38 6.239 -8.224 -16.239 279 HA LYS 38 HA LYS 38 7.960 -10.030 -14.762 280 HB2 LYS 38 2HB LYS 38 5.082 -9.374 -14.147 281 HB3 LYS 38 3HB LYS 38 6.319 -9.956 -13.041 282 HG2 LYS 38 2HG LYS 38 6.375 -7.268 -14.394 283 HG3 LYS 38 3HG LYS 38 5.771 -7.560 -12.761 284 HD2 LYS 38 2HD LYS 38 7.860 -7.207 -12.059 285 HD3 LYS 38 3HD LYS 38 8.265 -8.767 -12.780 286 HE2 LYS 38 2HE LYS 38 8.417 -7.228 -14.963 287 HE3 LYS 38 3HE LYS 38 8.812 -6.020 -13.742 288 HZ1 LYS 38 3HZ LYS 38 10.738 -7.280 -14.721 289 HZ2 LYS 38 1HZ LYS 38 10.181 -8.643 -13.888 290 HZ3 LYS 38 2HZ LYS 38 10.659 -7.265 -13.031 291 H SER 39 H SER 39 5.991 -11.748 -13.702 292 HA SER 39 HA SER 39 5.310 -13.373 -16.065 293 HB2 SER 39 2HB SER 39 7.209 -14.238 -14.608 294 HB3 SER 39 3HB SER 39 6.004 -14.489 -13.345 295 HG SER 39 HG SER 39 6.586 -16.068 -15.401 296 H SER 40 H SER 40 3.465 -14.790 -15.831 297 HA SER 40 HA SER 40 1.172 -13.548 -14.942 298 HB2 SER 40 2HB SER 40 0.610 -16.288 -14.762 299 HB3 SER 40 3HB SER 40 0.371 -15.248 -16.166 300 HG SER 40 HG SER 40 1.952 -16.243 -17.109 301 H SER 41 H SER 41 3.409 -15.548 -13.171 302 HA SER 41 HA SER 41 1.697 -15.999 -10.924 303 HB2 SER 41 2HB SER 41 4.633 -16.388 -11.446 304 HB3 SER 41 3HB SER 41 3.975 -16.583 -9.821 305 HG SER 41 HG SER 41 3.330 -18.478 -10.420 306 H GLN 42 H GLN 42 4.157 -13.630 -11.767 307 HA GLN 42 HA GLN 42 4.201 -12.399 -9.181 308 HB2 GLN 42 2HB GLN 42 5.399 -11.830 -11.847 309 HB3 GLN 42 3HB GLN 42 5.277 -10.498 -10.705 310 HG2 GLN 42 2HG GLN 42 6.446 -11.994 -9.037 311 HG3 GLN 42 3HG GLN 42 6.778 -13.077 -10.388 312 HE21 GLN 42 1HE2 GLN 42 7.202 -9.759 -9.267 313 HE22 GLN 42 2HE2 GLN 42 8.685 -9.474 -10.107 314 H LEU 43 H LEU 43 2.405 -11.952 -12.141 315 HA LEU 43 HA LEU 43 1.336 -9.390 -11.418 316 HB2 LEU 43 2HB LEU 43 0.287 -11.337 -13.462 317 HB3 LEU 43 3HB LEU 43 -0.049 -9.609 -13.369 318 HG LEU 43 HG LEU 43 2.765 -10.526 -13.759 319 HD11 LEU 43 1HD1 LEU 43 0.549 -10.697 -15.744 320 HD12 LEU 43 2HD1 LEU 43 1.923 -11.772 -15.493 321 HD13 LEU 43 3HD1 LEU 43 2.157 -10.212 -16.281 322 HD21 LEU 43 3HD2 LEU 43 1.126 -8.091 -14.305 323 HD22 LEU 43 1HD2 LEU 43 2.576 -8.402 -15.260 324 HD23 LEU 43 2HD2 LEU 43 2.693 -8.238 -13.508 325 H LYS 44 H LYS 44 0.665 -12.585 -10.527 326 HA LYS 44 HA LYS 44 -2.143 -12.392 -10.121 327 HB2 LYS 44 2HB LYS 44 0.016 -14.270 -9.282 328 HB3 LYS 44 3HB LYS 44 -1.508 -14.322 -8.405 329 HG2 LYS 44 2HG LYS 44 -2.717 -14.917 -10.336 330 HG3 LYS 44 3HG LYS 44 -1.370 -14.505 -11.399 331 HD2 LYS 44 2HD LYS 44 -0.305 -16.470 -11.026 332 HD3 LYS 44 3HD LYS 44 -0.828 -16.556 -9.343 333 HE2 LYS 44 2HE LYS 44 -2.704 -16.997 -11.653 334 HE3 LYS 44 3HE LYS 44 -1.771 -18.304 -10.926 335 HZ1 LYS 44 3HZ LYS 44 -3.108 -18.369 -9.156 336 HZ2 LYS 44 1HZ LYS 44 -4.209 -17.503 -10.105 337 HZ3 LYS 44 2HZ LYS 44 -3.202 -16.686 -9.020 338 H GLU 45 H GLU 45 0.672 -11.883 -8.034 339 HA GLU 45 HA GLU 45 -0.540 -11.565 -5.587 340 HB2 GLU 45 2HB GLU 45 1.749 -9.925 -6.690 341 HB3 GLU 45 3HB GLU 45 1.337 -10.094 -4.989 342 HG2 GLU 45 2HG GLU 45 2.371 -12.214 -6.849 343 HG3 GLU 45 3HG GLU 45 3.169 -11.531 -5.433 344 H ILE 46 H ILE 46 -0.096 -9.101 -8.107 345 HA ILE 46 HA ILE 46 -1.113 -6.893 -6.812 346 HB ILE 46 HB ILE 46 -1.517 -7.626 -9.715 347 HG12 ILE 46 2HG1 ILE 46 0.509 -5.630 -8.925 348 HG13 ILE 46 3HG1 ILE 46 0.859 -7.282 -8.430 349 HG21 ILE 46 1HG2 ILE 46 -2.957 -5.872 -9.514 350 HG22 ILE 46 2HG2 ILE 46 -2.098 -5.179 -8.140 351 HG23 ILE 46 3HG2 ILE 46 -1.459 -4.978 -9.771 352 HD11 ILE 46 3HD1 ILE 46 0.063 -7.528 -11.065 353 HD12 ILE 46 1HD1 ILE 46 1.031 -6.055 -11.037 354 HD13 ILE 46 2HD1 ILE 46 1.716 -7.571 -10.452 355 H PHE 47 H PHE 47 -2.906 -9.384 -8.597 356 HA PHE 47 HA PHE 47 -5.452 -8.290 -8.417 357 HB2 PHE 47 2HB PHE 47 -5.617 -10.117 -9.737 358 HB3 PHE 47 3HB PHE 47 -4.318 -10.957 -8.896 359 HD1 PHE 47 HD1 PHE 47 -4.786 -12.336 -6.944 360 HD2 PHE 47 HD2 PHE 47 -7.910 -10.412 -9.101 361 HE1 PHE 47 HE1 PHE 47 -6.437 -13.791 -5.844 362 HE2 PHE 47 HE2 PHE 47 -9.567 -11.863 -8.004 363 HZ PHE 47 HZ PHE 47 -8.831 -13.554 -6.372 364 H ARG 48 H ARG 48 -3.622 -10.160 -6.067 365 HA ARG 48 HA ARG 48 -5.729 -10.614 -4.243 366 HB2 ARG 48 2HB ARG 48 -2.943 -11.159 -4.390 367 HB3 ARG 48 3HB ARG 48 -3.247 -10.365 -2.851 368 HG2 ARG 48 2HG ARG 48 -4.722 -12.791 -3.852 369 HG3 ARG 48 3HG ARG 48 -3.366 -12.823 -2.723 370 HD2 ARG 48 2HD ARG 48 -5.457 -10.971 -1.916 371 HD3 ARG 48 3HD ARG 48 -6.040 -12.628 -2.064 372 HE ARG 48 HE ARG 48 -3.588 -12.441 -0.600 373 HH11 ARG 48 1HH1 ARG 48 -7.049 -12.145 -0.377 374 HH12 ARG 48 2HH1 ARG 48 -7.100 -12.492 1.320 375 HH21 ARG 48 1HH2 ARG 48 -3.642 -12.899 1.634 376 HH22 ARG 48 2HH2 ARG 48 -5.162 -12.920 2.463 377 H ILE 49 H ILE 49 -4.095 -7.782 -5.099 378 HA ILE 49 HA ILE 49 -4.667 -6.473 -2.541 379 HB ILE 49 HB ILE 49 -3.264 -5.251 -4.912 380 HG12 ILE 49 2HG1 ILE 49 -2.049 -7.267 -4.232 381 HG13 ILE 49 3HG1 ILE 49 -1.148 -5.820 -3.793 382 HG21 ILE 49 1HG2 ILE 49 -2.271 -4.152 -2.594 383 HG22 ILE 49 2HG2 ILE 49 -3.492 -3.430 -3.642 384 HG23 ILE 49 3HG2 ILE 49 -3.983 -4.371 -2.233 385 HD11 ILE 49 3HD1 ILE 49 -2.848 -7.444 -1.916 386 HD12 ILE 49 1HD1 ILE 49 -1.092 -7.529 -2.044 387 HD13 ILE 49 2HD1 ILE 49 -1.865 -6.042 -1.494 388 H LEU 50 H LEU 50 -6.005 -6.914 -5.607 389 HA LEU 50 HA LEU 50 -7.467 -4.387 -5.580 390 HB2 LEU 50 2HB LEU 50 -6.934 -6.511 -7.570 391 HB3 LEU 50 3HB LEU 50 -8.475 -5.666 -7.705 392 HG LEU 50 HG LEU 50 -6.729 -3.584 -7.492 393 HD11 LEU 50 1HD1 LEU 50 -5.351 -5.531 -9.311 394 HD12 LEU 50 2HD1 LEU 50 -4.879 -5.336 -7.624 395 HD13 LEU 50 3HD1 LEU 50 -4.782 -3.966 -8.731 396 HD21 LEU 50 3HD2 LEU 50 -7.314 -3.112 -9.682 397 HD22 LEU 50 1HD2 LEU 50 -8.614 -4.185 -9.163 398 HD23 LEU 50 2HD2 LEU 50 -7.300 -4.810 -10.161 399 H ASP 51 H ASP 51 -7.879 -7.736 -4.830 400 HA ASP 51 HA ASP 51 -10.715 -7.829 -4.973 401 HB2 ASP 51 2HB ASP 51 -9.226 -9.837 -4.980 402 HB3 ASP 51 3HB ASP 51 -8.886 -9.541 -3.278 403 H ASN 52 H ASN 52 -11.653 -6.139 -3.883 404 HA ASN 52 HA ASN 52 -10.949 -5.618 -1.117 405 HB2 ASN 52 2HB ASN 52 -12.423 -4.229 -3.236 406 HB3 ASN 52 3HB ASN 52 -13.181 -4.092 -1.652 407 HD21 ASN 52 1HD2 ASN 52 -9.796 -4.215 -2.699 408 HD22 ASN 52 2HD2 ASN 52 -9.332 -2.729 -1.950 409 H ASP 53 H ASP 53 -12.599 -8.007 -2.428 410 HA ASP 53 HA ASP 53 -14.623 -8.052 -0.286 411 HB2 ASP 53 2HB ASP 53 -14.973 -9.537 -2.876 412 HB3 ASP 53 3HB ASP 53 -16.195 -9.068 -1.698 413 H GLN 54 H GLN 54 -11.916 -9.523 -1.670 414 HA GLN 54 HA GLN 54 -10.756 -11.425 -1.211 415 HB2 GLN 54 2HB GLN 54 -12.553 -11.784 1.182 416 HB3 GLN 54 3HB GLN 54 -10.895 -12.336 0.980 417 HG2 GLN 54 2HG GLN 54 -11.607 -9.424 0.987 418 HG3 GLN 54 3HG GLN 54 -11.294 -10.318 2.474 419 HE21 GLN 54 1HE2 GLN 54 -9.931 -8.376 0.226 420 HE22 GLN 54 2HE2 GLN 54 -8.272 -8.819 0.416 421 H SER 55 H SER 55 -13.556 -11.428 -2.526 422 HA SER 55 HA SER 55 -14.596 -14.045 -2.026 423 HB2 SER 55 2HB SER 55 -15.726 -13.425 -4.377 424 HB3 SER 55 3HB SER 55 -16.287 -12.742 -2.851 425 HG SER 55 HG SER 55 -14.903 -11.544 -4.938 426 H GLY 56 H GLY 56 -12.438 -12.616 -4.415 427 HA2 GLY 56 2HA GLY 56 -10.716 -14.410 -5.076 428 HA3 GLY 56 3HA GLY 56 -12.131 -15.255 -5.684 429 H PHE 57 H PHE 57 -13.119 -12.352 -6.314 430 HA PHE 57 HA PHE 57 -11.520 -11.955 -8.746 431 HB2 PHE 57 2HB PHE 57 -14.538 -11.828 -8.692 432 HB3 PHE 57 3HB PHE 57 -13.491 -11.700 -10.101 433 HD1 PHE 57 HD1 PHE 57 -14.842 -13.990 -7.562 434 HD2 PHE 57 HD2 PHE 57 -12.620 -13.636 -11.175 435 HE1 PHE 57 HE1 PHE 57 -15.016 -16.421 -7.903 436 HE2 PHE 57 HE2 PHE 57 -12.792 -16.066 -11.523 437 HZ PHE 57 HZ PHE 57 -13.992 -17.462 -9.886 438 H ILE 58 H ILE 58 -12.160 -9.814 -9.828 439 HA ILE 58 HA ILE 58 -12.550 -7.787 -7.724 440 HB ILE 58 HB ILE 58 -10.934 -7.511 -10.260 441 HG12 ILE 58 2HG1 ILE 58 -9.751 -7.374 -7.522 442 HG13 ILE 58 3HG1 ILE 58 -10.122 -8.959 -8.192 443 HG21 ILE 58 1HG2 ILE 58 -12.066 -5.445 -9.402 444 HG22 ILE 58 2HG2 ILE 58 -11.108 -5.612 -7.932 445 HG23 ILE 58 3HG2 ILE 58 -10.307 -5.351 -9.481 446 HD11 ILE 58 3HD1 ILE 58 -7.795 -8.263 -8.570 447 HD12 ILE 58 1HD1 ILE 58 -8.677 -8.548 -10.071 448 HD13 ILE 58 2HD1 ILE 58 -8.380 -6.898 -9.521 449 H GLU 59 H GLU 59 -14.826 -7.800 -8.096 450 HA GLU 59 HA GLU 59 -16.046 -7.387 -10.584 451 HB2 GLU 59 2HB GLU 59 -17.153 -6.345 -7.985 452 HB3 GLU 59 3HB GLU 59 -18.037 -6.922 -9.391 453 HG2 GLU 59 2HG GLU 59 -18.216 -8.872 -8.363 454 HG3 GLU 59 3HG GLU 59 -16.485 -9.086 -8.616 455 H GLU 60 H GLU 60 -17.132 -5.456 -11.372 456 HA GLU 60 HA GLU 60 -15.446 -3.287 -11.706 457 HB2 GLU 60 2HB GLU 60 -18.401 -3.648 -12.075 458 HB3 GLU 60 3HB GLU 60 -17.667 -2.070 -12.324 459 HG2 GLU 60 2HG GLU 60 -16.377 -2.826 -14.123 460 HG3 GLU 60 3HG GLU 60 -16.639 -4.519 -13.711 461 H ASP 61 H ASP 61 -17.666 -3.978 -9.138 462 HA ASP 61 HA ASP 61 -17.972 -1.361 -8.115 463 HB2 ASP 61 2HB ASP 61 -19.084 -3.773 -7.533 464 HB3 ASP 61 3HB ASP 61 -17.991 -3.578 -6.165 465 H GLU 62 H GLU 62 -15.424 -3.696 -7.900 466 HA GLU 62 HA GLU 62 -14.060 -2.053 -5.875 467 HB2 GLU 62 2HB GLU 62 -12.534 -4.151 -5.770 468 HB3 GLU 62 3HB GLU 62 -14.112 -4.201 -4.995 469 HG2 GLU 62 2HG GLU 62 -14.984 -5.278 -7.095 470 HG3 GLU 62 3HG GLU 62 -13.307 -5.428 -7.615 471 H LEU 63 H LEU 63 -13.904 -3.284 -9.115 472 HA LEU 63 HA LEU 63 -11.187 -2.926 -9.668 473 HB2 LEU 63 2HB LEU 63 -13.361 -3.779 -11.068 474 HB3 LEU 63 3HB LEU 63 -13.028 -2.232 -11.844 475 HG LEU 63 HG LEU 63 -11.120 -4.557 -11.600 476 HD11 LEU 63 1HD1 LEU 63 -13.164 -3.940 -13.485 477 HD12 LEU 63 2HD1 LEU 63 -12.025 -5.286 -13.486 478 HD13 LEU 63 3HD1 LEU 63 -11.594 -3.766 -14.269 479 HD21 LEU 63 3HD2 LEU 63 -9.994 -2.367 -11.468 480 HD22 LEU 63 1HD2 LEU 63 -10.749 -1.909 -12.994 481 HD23 LEU 63 2HD2 LEU 63 -9.599 -3.245 -12.946 482 H LYS 64 H LYS 64 -13.784 -0.638 -9.371 483 HA LYS 64 HA LYS 64 -12.648 1.528 -10.763 484 HB2 LYS 64 2HB LYS 64 -14.142 2.911 -9.226 485 HB3 LYS 64 3HB LYS 64 -14.938 1.704 -10.229 486 HG2 LYS 64 2HG LYS 64 -15.586 0.465 -8.463 487 HG3 LYS 64 3HG LYS 64 -14.118 0.808 -7.544 488 HD2 LYS 64 2HD LYS 64 -16.065 1.803 -6.468 489 HD3 LYS 64 3HD LYS 64 -14.964 3.055 -7.046 490 HE2 LYS 64 2HE LYS 64 -16.628 3.965 -8.198 491 HE3 LYS 64 3HE LYS 64 -16.768 2.486 -9.146 492 HZ1 LYS 64 3HZ LYS 64 -18.324 3.347 -6.810 493 HZ2 LYS 64 1HZ LYS 64 -18.115 1.690 -7.086 494 HZ3 LYS 64 2HZ LYS 64 -18.855 2.656 -8.261 495 H TYR 65 H TYR 65 -11.683 0.012 -7.908 496 HA TYR 65 HA TYR 65 -10.285 2.404 -6.936 497 HB2 TYR 65 2HB TYR 65 -10.916 -0.243 -5.629 498 HB3 TYR 65 3HB TYR 65 -9.817 0.933 -4.916 499 HD1 TYR 65 HD1 TYR 65 -11.019 3.471 -5.183 500 HD2 TYR 65 HD2 TYR 65 -12.941 -0.269 -4.537 501 HE1 TYR 65 HE1 TYR 65 -12.926 4.636 -4.155 502 HE2 TYR 65 HE2 TYR 65 -14.854 0.885 -3.508 503 HH TYR 65 HH TYR 65 -14.830 4.387 -2.999 504 H PHE 66 H PHE 66 -9.334 1.247 -9.292 505 HA PHE 66 HA PHE 66 -7.117 -0.489 -8.667 506 HB2 PHE 66 2HB PHE 66 -8.099 -0.861 -10.792 507 HB3 PHE 66 3HB PHE 66 -8.063 0.852 -11.194 508 HD1 PHE 66 HD1 PHE 66 -5.816 -2.020 -10.465 509 HD2 PHE 66 HD2 PHE 66 -6.331 1.698 -12.472 510 HE1 PHE 66 HE1 PHE 66 -3.659 -2.340 -11.605 511 HE2 PHE 66 HE2 PHE 66 -4.176 1.384 -13.615 512 HZ PHE 66 HZ PHE 66 -2.837 -0.638 -13.183 513 H LEU 67 H LEU 67 -7.686 2.883 -8.804 514 HA LEU 67 HA LEU 67 -4.858 3.531 -9.115 515 HB2 LEU 67 2HB LEU 67 -7.040 5.512 -8.579 516 HB3 LEU 67 3HB LEU 67 -5.502 5.757 -9.403 517 HG LEU 67 HG LEU 67 -8.017 4.499 -10.455 518 HD11 LEU 67 1HD1 LEU 67 -6.538 6.303 -12.163 519 HD12 LEU 67 2HD1 LEU 67 -6.932 7.047 -10.614 520 HD13 LEU 67 3HD1 LEU 67 -8.215 6.379 -11.623 521 HD21 LEU 67 3HD2 LEU 67 -6.192 2.983 -11.017 522 HD22 LEU 67 1HD2 LEU 67 -5.260 4.331 -11.669 523 HD23 LEU 67 2HD2 LEU 67 -6.763 3.840 -12.450 524 H GLN 68 H GLN 68 -6.893 2.668 -6.652 525 HA GLN 68 HA GLN 68 -5.677 4.412 -4.651 526 HB2 GLN 68 2HB GLN 68 -8.125 2.829 -4.839 527 HB3 GLN 68 3HB GLN 68 -7.301 2.632 -3.297 528 HG2 GLN 68 2HG GLN 68 -8.337 4.480 -2.650 529 HG3 GLN 68 3HG GLN 68 -7.237 5.355 -3.716 530 HE21 GLN 68 1HE2 GLN 68 -8.070 4.994 -6.155 531 HE22 GLN 68 2HE2 GLN 68 -9.711 5.487 -6.378 532 H ARG 69 H ARG 69 -4.739 1.731 -6.181 533 HA ARG 69 HA ARG 69 -3.670 0.389 -3.800 534 HB2 ARG 69 2HB ARG 69 -3.267 -0.745 -6.519 535 HB3 ARG 69 3HB ARG 69 -3.583 -1.563 -4.995 536 HG2 ARG 69 2HG ARG 69 -5.590 -0.090 -6.688 537 HG3 ARG 69 3HG ARG 69 -5.455 -1.839 -6.489 538 HD2 ARG 69 2HD ARG 69 -6.362 0.223 -4.513 539 HD3 ARG 69 3HD ARG 69 -7.189 -1.239 -5.048 540 HE ARG 69 HE ARG 69 -5.003 -2.225 -3.833 541 HH11 ARG 69 1HH1 ARG 69 -7.373 0.129 -2.851 542 HH12 ARG 69 2HH1 ARG 69 -7.232 -0.240 -1.164 543 HH21 ARG 69 1HH2 ARG 69 -4.809 -2.720 -1.614 544 HH22 ARG 69 2HH2 ARG 69 -5.773 -1.860 -0.462 545 H PHE 70 H PHE 70 -2.730 1.997 -6.778 546 HA PHE 70 HA PHE 70 0.100 1.611 -6.161 547 HB2 PHE 70 2HB PHE 70 -1.296 2.780 -8.574 548 HB3 PHE 70 3HB PHE 70 0.453 2.712 -8.390 549 HD1 PHE 70 HD1 PHE 70 -2.581 0.578 -8.496 550 HD2 PHE 70 HD2 PHE 70 1.634 0.816 -9.034 551 HE1 PHE 70 HE1 PHE 70 -2.577 -1.694 -9.442 552 HE2 PHE 70 HE2 PHE 70 1.645 -1.455 -9.981 553 HZ PHE 70 HZ PHE 70 -0.462 -2.712 -10.187 554 H GLU 71 H GLU 71 -2.387 4.012 -6.060 555 HA GLU 71 HA GLU 71 -0.403 6.090 -5.427 556 HB2 GLU 71 2HB GLU 71 -2.196 6.383 -7.284 557 HB3 GLU 71 3HB GLU 71 -3.309 6.634 -5.947 558 HG2 GLU 71 2HG GLU 71 -2.355 8.624 -5.338 559 HG3 GLU 71 3HG GLU 71 -0.787 8.209 -6.029 560 H SER 72 H SER 72 -3.295 4.461 -4.276 561 HA SER 72 HA SER 72 -4.259 4.312 -2.221 562 HB2 SER 72 2HB SER 72 -1.783 3.838 -1.661 563 HB3 SER 72 3HB SER 72 -1.755 5.483 -1.025 564 HG SER 72 HG SER 72 -2.588 3.319 0.200 565 H GLY 73 H GLY 73 -5.410 6.258 -3.316 566 HA2 GLY 73 2HA GLY 73 -6.473 7.974 -1.607 567 HA3 GLY 73 3HA GLY 73 -4.938 8.774 -1.910 568 H ALA 74 H ALA 74 -5.218 7.499 -4.739 569 HA ALA 74 HA ALA 74 -6.147 9.833 -6.023 570 HB1 ALA 74 1HB ALA 74 -6.210 8.114 -8.040 571 HB2 ALA 74 2HB ALA 74 -4.692 8.718 -7.374 572 HB3 ALA 74 3HB ALA 74 -5.294 7.129 -6.899 573 H ARG 75 H ARG 75 -7.819 9.424 -7.956 574 HA ARG 75 HA ARG 75 -10.344 8.994 -6.642 575 HB2 ARG 75 2HB ARG 75 -11.338 9.751 -8.731 576 HB3 ARG 75 3HB ARG 75 -10.031 10.827 -8.256 577 HG2 ARG 75 2HG ARG 75 -8.545 9.674 -9.854 578 HG3 ARG 75 3HG ARG 75 -9.914 8.686 -10.369 579 HD2 ARG 75 2HD ARG 75 -9.505 11.643 -10.696 580 HD3 ARG 75 3HD ARG 75 -9.773 10.427 -11.944 581 HE ARG 75 HE ARG 75 -11.775 11.756 -10.350 582 HH11 ARG 75 1HH1 ARG 75 -11.025 9.002 -12.343 583 HH12 ARG 75 2HH1 ARG 75 -12.679 8.681 -12.749 584 HH21 ARG 75 1HH2 ARG 75 -13.956 11.344 -10.876 585 HH22 ARG 75 2HH2 ARG 75 -14.345 10.014 -11.914 586 H VAL 76 H VAL 76 -12.059 7.840 -8.195 587 HA VAL 76 HA VAL 76 -11.024 5.118 -8.562 588 HB VAL 76 HB VAL 76 -13.162 4.283 -8.157 589 HG11 VAL 76 1HG1 VAL 76 -13.846 5.216 -6.070 590 HG12 VAL 76 2HG1 VAL 76 -12.092 5.378 -6.176 591 HG13 VAL 76 3HG1 VAL 76 -13.127 6.777 -6.467 592 HG21 VAL 76 3HG2 VAL 76 -14.133 7.011 -8.938 593 HG22 VAL 76 1HG2 VAL 76 -14.542 5.444 -9.637 594 HG23 VAL 76 2HG2 VAL 76 -15.165 5.892 -8.049 595 H LEU 77 H LEU 77 -11.569 3.896 -10.408 596 HA LEU 77 HA LEU 77 -11.358 5.207 -12.852 597 HB2 LEU 77 2HB LEU 77 -12.572 2.489 -12.388 598 HB3 LEU 77 3HB LEU 77 -11.857 3.085 -13.885 599 HG LEU 77 HG LEU 77 -10.417 2.421 -11.320 600 HD11 LEU 77 1HD1 LEU 77 -10.458 1.176 -14.060 601 HD12 LEU 77 2HD1 LEU 77 -10.964 0.448 -12.536 602 HD13 LEU 77 3HD1 LEU 77 -9.259 0.794 -12.824 603 HD21 LEU 77 3HD2 LEU 77 -9.575 3.937 -13.740 604 HD22 LEU 77 1HD2 LEU 77 -8.415 2.853 -12.971 605 HD23 LEU 77 2HD2 LEU 77 -9.135 4.172 -12.048 606 H THR 78 H THR 78 -12.765 6.102 -14.233 607 HA THR 78 HA THR 78 -15.477 6.514 -13.393 608 HB THR 78 HB THR 78 -14.232 8.296 -14.536 609 HG1 THR 78 HG1 THR 78 -15.922 8.782 -16.077 610 HG21 THR 78 3HG2 THR 78 -14.512 7.370 -17.241 611 HG22 THR 78 1HG2 THR 78 -13.520 6.242 -16.318 612 HG23 THR 78 2HG2 THR 78 -13.070 7.945 -16.405 613 H ALA 79 H ALA 79 -17.118 6.430 -15.421 614 HA ALA 79 HA ALA 79 -17.652 3.678 -15.813 615 HB1 ALA 79 1HB ALA 79 -19.364 5.499 -15.706 616 HB2 ALA 79 2HB ALA 79 -18.874 5.974 -17.333 617 HB3 ALA 79 3HB ALA 79 -19.567 4.376 -17.051 618 H SER 80 H SER 80 -15.532 5.751 -17.385 619 HA SER 80 HA SER 80 -15.624 4.190 -19.876 620 HB2 SER 80 2HB SER 80 -15.790 6.719 -19.982 621 HB3 SER 80 3HB SER 80 -14.120 6.772 -19.418 622 HG SER 80 HG SER 80 -14.768 6.670 -21.850 623 H GLU 81 H GLU 81 -13.947 4.476 -16.990 624 HA GLU 81 HA GLU 81 -11.392 3.607 -18.106 625 HB2 GLU 81 2HB GLU 81 -12.258 4.426 -15.338 626 HB3 GLU 81 3HB GLU 81 -10.686 3.707 -15.655 627 HG2 GLU 81 2HG GLU 81 -11.646 6.166 -17.081 628 HG3 GLU 81 3HG GLU 81 -10.793 6.231 -15.539 629 H THR 82 H THR 82 -13.512 2.544 -15.438 630 HA THR 82 HA THR 82 -12.414 0.052 -15.015 631 HB THR 82 HB THR 82 -15.156 -0.356 -14.663 632 HG1 THR 82 HG1 THR 82 -15.861 1.664 -14.856 633 HG21 THR 82 3HG2 THR 82 -12.876 -0.416 -13.154 634 HG22 THR 82 1HG2 THR 82 -14.504 -0.691 -12.537 635 HG23 THR 82 2HG2 THR 82 -13.773 0.908 -12.411 636 H LYS 83 H LYS 83 -15.047 0.908 -17.246 637 HA LYS 83 HA LYS 83 -15.705 -1.575 -18.219 638 HB2 LYS 83 2HB LYS 83 -15.742 1.172 -19.350 639 HB3 LYS 83 3HB LYS 83 -15.940 -0.159 -20.482 640 HG2 LYS 83 2HG LYS 83 -17.802 -0.996 -19.033 641 HG3 LYS 83 3HG LYS 83 -17.667 0.503 -18.111 642 HD2 LYS 83 2HD LYS 83 -19.291 1.106 -19.604 643 HD3 LYS 83 3HD LYS 83 -17.856 1.586 -20.513 644 HE2 LYS 83 2HE LYS 83 -18.959 -1.174 -20.819 645 HE3 LYS 83 3HE LYS 83 -19.725 0.172 -21.661 646 HZ1 LYS 83 3HZ LYS 83 -17.238 -1.153 -22.215 647 HZ2 LYS 83 1HZ LYS 83 -17.094 0.532 -22.186 648 HZ3 LYS 83 2HZ LYS 83 -18.205 -0.204 -23.227 649 H THR 84 H THR 84 -13.079 0.542 -19.323 650 HA THR 84 HA THR 84 -12.166 -1.088 -21.417 651 HB THR 84 HB THR 84 -10.451 0.742 -19.732 652 HG1 THR 84 HG1 THR 84 -12.140 1.322 -21.955 653 HG21 THR 84 3HG2 THR 84 -9.439 -0.870 -21.474 654 HG22 THR 84 1HG2 THR 84 -8.979 0.830 -21.545 655 HG23 THR 84 2HG2 THR 84 -10.178 0.194 -22.670 656 H PHE 85 H PHE 85 -10.725 -0.690 -18.173 657 HA PHE 85 HA PHE 85 -8.843 -2.696 -18.318 658 HB2 PHE 85 2HB PHE 85 -9.316 -0.970 -16.440 659 HB3 PHE 85 3HB PHE 85 -10.376 -2.210 -15.778 660 HD1 PHE 85 HD2 PHE 85 -9.337 -4.531 -15.378 661 HD2 PHE 85 HD1 PHE 85 -7.056 -0.982 -15.947 662 HE1 PHE 85 HE2 PHE 85 -7.405 -5.604 -14.297 663 HE2 PHE 85 HE1 PHE 85 -5.120 -2.050 -14.867 664 HZ PHE 85 HZ PHE 85 -5.293 -4.363 -14.040 665 H LEU 86 H LEU 86 -12.271 -2.948 -17.552 666 HA LEU 86 HA LEU 86 -12.170 -5.713 -16.839 667 HB2 LEU 86 2HB LEU 86 -13.923 -4.285 -15.985 668 HB3 LEU 86 3HB LEU 86 -14.474 -3.934 -17.622 669 HG LEU 86 HG LEU 86 -15.088 -6.341 -17.855 670 HD11 LEU 86 1HD1 LEU 86 -14.225 -6.367 -14.982 671 HD12 LEU 86 2HD1 LEU 86 -13.760 -7.458 -16.287 672 HD13 LEU 86 3HD1 LEU 86 -15.389 -7.530 -15.616 673 HD21 LEU 86 3HD2 LEU 86 -17.143 -5.751 -17.240 674 HD22 LEU 86 1HD2 LEU 86 -16.439 -4.264 -16.604 675 HD23 LEU 86 2HD2 LEU 86 -16.681 -5.651 -15.541 676 H ALA 87 H ALA 87 -12.808 -3.913 -19.788 677 HA ALA 87 HA ALA 87 -13.565 -6.285 -21.264 678 HB1 ALA 87 1HB ALA 87 -14.698 -4.328 -21.926 679 HB2 ALA 87 2HB ALA 87 -13.200 -3.403 -22.038 680 HB3 ALA 87 3HB ALA 87 -13.545 -4.669 -23.217 681 H ALA 88 H ALA 88 -10.725 -5.407 -20.090 682 HA ALA 88 HA ALA 88 -9.227 -6.245 -22.487 683 HB1 ALA 88 1HB ALA 88 -8.591 -4.013 -21.963 684 HB2 ALA 88 2HB ALA 88 -8.395 -4.405 -20.254 685 HB3 ALA 88 3HB ALA 88 -7.275 -5.067 -21.445 686 H ALA 89 H ALA 89 -10.089 -6.991 -19.283 687 HA ALA 89 HA ALA 89 -7.977 -9.042 -19.143 688 HB1 ALA 89 1HB ALA 89 -9.002 -7.176 -17.149 689 HB2 ALA 89 2HB ALA 89 -8.945 -8.847 -16.587 690 HB3 ALA 89 3HB ALA 89 -7.482 -8.071 -17.192 691 H ASP 90 H ASP 90 -11.306 -8.398 -18.029 692 HA ASP 90 HA ASP 90 -11.986 -11.051 -17.478 693 HB2 ASP 90 2HB ASP 90 -13.373 -9.279 -16.644 694 HB3 ASP 90 3HB ASP 90 -13.702 -8.694 -18.273 695 H HIS 91 H HIS 91 -13.340 -9.222 -20.215 696 HA HIS 91 HA HIS 91 -13.920 -9.845 -22.324 697 HB2 HIS 91 2HB HIS 91 -11.355 -10.384 -22.213 698 HB3 HIS 91 3HB HIS 91 -11.900 -12.058 -22.257 699 HD1 HIS 91 HD1 HIS 91 -10.251 -11.127 -24.577 700 HD2 HIS 91 HD2 HIS 91 -14.387 -10.744 -24.480 701 HE1 HIS 91 HE1 HIS 91 -10.966 -10.952 -26.981 702 H ASP 92 H ASP 92 -14.696 -11.507 -19.761 703 HA ASP 92 HA ASP 92 -15.797 -13.831 -21.186 704 HB2 ASP 92 2HB ASP 92 -15.890 -13.550 -18.205 705 HB3 ASP 92 3HB ASP 92 -15.813 -15.011 -19.186 706 H GLY 93 H GLY 93 -16.623 -10.821 -19.855 707 HA2 GLY 93 2HA GLY 93 -18.656 -9.727 -19.847 708 HA3 GLY 93 3HA GLY 93 -19.382 -11.166 -20.546 709 H ASP 94 H ASP 94 -17.626 -10.799 -17.488 710 HA ASP 94 HA ASP 94 -20.062 -11.705 -16.099 711 HB2 ASP 94 2HB ASP 94 -17.427 -12.026 -14.775 712 HB3 ASP 94 3HB ASP 94 -18.829 -13.092 -14.770 713 H GLY 95 H GLY 95 -17.411 -9.423 -16.125 714 HA2 GLY 95 2HA GLY 95 -17.630 -7.217 -15.278 715 HA3 GLY 95 3HA GLY 95 -18.878 -7.790 -14.182 716 H LYS 96 H LYS 96 -16.707 -10.106 -13.852 717 HA LYS 96 HA LYS 96 -15.178 -8.666 -11.783 718 HB2 LYS 96 2HB LYS 96 -15.245 -10.667 -10.409 719 HB3 LYS 96 3HB LYS 96 -16.882 -10.175 -10.823 720 HG2 LYS 96 2HG LYS 96 -16.096 -11.958 -12.831 721 HG3 LYS 96 3HG LYS 96 -15.549 -12.666 -11.310 722 HD2 LYS 96 2HD LYS 96 -18.257 -11.540 -11.226 723 HD3 LYS 96 3HD LYS 96 -18.066 -12.905 -12.328 724 HE2 LYS 96 2HE LYS 96 -16.799 -13.951 -10.268 725 HE3 LYS 96 3HE LYS 96 -17.771 -12.789 -9.366 726 HZ1 LYS 96 3HZ LYS 96 -19.710 -13.839 -9.922 727 HZ2 LYS 96 1HZ LYS 96 -18.668 -15.169 -9.846 728 HZ3 LYS 96 2HZ LYS 96 -19.089 -14.510 -11.345 729 H ILE 97 H ILE 97 -13.016 -8.923 -11.758 730 HA ILE 97 HA ILE 97 -11.813 -10.397 -13.950 731 HB ILE 97 HB ILE 97 -10.568 -8.615 -11.853 732 HG12 ILE 97 2HG1 ILE 97 -12.073 -7.506 -13.510 733 HG13 ILE 97 3HG1 ILE 97 -10.400 -6.968 -13.610 734 HG21 ILE 97 1HG2 ILE 97 -9.403 -10.378 -13.893 735 HG22 ILE 97 2HG2 ILE 97 -8.762 -8.736 -13.867 736 HG23 ILE 97 3HG2 ILE 97 -8.697 -9.730 -12.413 737 HD11 ILE 97 3HD1 ILE 97 -12.063 -8.158 -15.621 738 HD12 ILE 97 1HD1 ILE 97 -10.484 -7.390 -15.777 739 HD13 ILE 97 2HD1 ILE 97 -10.595 -9.106 -15.387 740 H GLY 98 H GLY 98 -10.394 -12.105 -13.760 741 HA2 GLY 98 2HA GLY 98 -10.256 -13.341 -11.078 742 HA3 GLY 98 3HA GLY 98 -10.434 -14.268 -12.560 743 H ALA 99 H ALA 99 -8.458 -15.071 -11.020 744 HA ALA 99 HA ALA 99 -5.985 -13.703 -11.620 745 HB1 ALA 99 1HB ALA 99 -6.428 -16.378 -10.298 746 HB2 ALA 99 2HB ALA 99 -4.921 -15.461 -10.329 747 HB3 ALA 99 3HB ALA 99 -6.320 -14.828 -9.462 748 H GLU 100 H GLU 100 -7.934 -15.497 -13.479 749 HA GLU 100 HA GLU 100 -5.720 -16.853 -14.870 750 HB2 GLU 100 2HB GLU 100 -8.650 -17.486 -14.662 751 HB3 GLU 100 3HB GLU 100 -7.682 -18.117 -15.987 752 HG2 GLU 100 2HG GLU 100 -7.172 -18.575 -13.057 753 HG3 GLU 100 3HG GLU 100 -7.884 -19.731 -14.181 754 H GLU 101 H GLU 101 -7.806 -14.233 -15.016 755 HA GLU 101 HA GLU 101 -7.380 -13.983 -17.921 756 HB2 GLU 101 2HB GLU 101 -9.491 -13.008 -18.220 757 HB3 GLU 101 3HB GLU 101 -9.792 -14.350 -17.125 758 HG2 GLU 101 2HG GLU 101 -9.349 -12.406 -15.335 759 HG3 GLU 101 3HG GLU 101 -9.989 -11.446 -16.668 760 H PHE 102 H PHE 102 -6.309 -12.905 -15.090 761 HA PHE 102 HA PHE 102 -6.347 -10.056 -15.634 762 HB2 PHE 102 2HB PHE 102 -6.544 -10.888 -13.315 763 HB3 PHE 102 3HB PHE 102 -4.938 -11.596 -13.444 764 HD1 PHE 102 HD2 PHE 102 -6.753 -8.364 -13.608 765 HD2 PHE 102 HD1 PHE 102 -3.051 -10.346 -12.915 766 HE1 PHE 102 HE2 PHE 102 -5.765 -6.243 -12.846 767 HE2 PHE 102 HE1 PHE 102 -2.057 -8.229 -12.151 768 HZ PHE 102 HZ PHE 102 -3.413 -6.174 -12.117 769 H GLN 103 H GLN 103 -3.688 -12.309 -14.873 770 HA GLN 103 HA GLN 103 -1.605 -10.772 -15.807 771 HB2 GLN 103 2HB GLN 103 -0.346 -12.879 -16.058 772 HB3 GLN 103 3HB GLN 103 -1.237 -12.812 -14.544 773 HG2 GLN 103 2HG GLN 103 -3.009 -14.028 -16.262 774 HG3 GLN 103 3HG GLN 103 -1.447 -14.683 -16.753 775 HE21 GLN 103 1HE2 GLN 103 -2.691 -13.710 -13.584 776 HE22 GLN 103 2HE2 GLN 103 -2.458 -15.245 -12.827 777 H GLU 104 H GLU 104 -3.777 -12.860 -17.620 778 HA GLU 104 HA GLU 104 -2.421 -12.986 -20.043 779 HB2 GLU 104 2HB GLU 104 -4.452 -13.655 -21.019 780 HB3 GLU 104 3HB GLU 104 -4.573 -14.177 -19.345 781 HG2 GLU 104 2HG GLU 104 -6.622 -13.245 -19.587 782 HG3 GLU 104 3HG GLU 104 -5.726 -11.821 -19.062 783 H MET 105 H MET 105 -4.328 -10.403 -18.650 784 HA MET 105 HA MET 105 -4.415 -8.855 -21.075 785 HB2 MET 105 2HB MET 105 -5.724 -7.353 -19.912 786 HB3 MET 105 3HB MET 105 -6.045 -8.833 -19.020 787 HG2 MET 105 2HG MET 105 -5.565 -7.623 -17.216 788 HG3 MET 105 3HG MET 105 -3.884 -7.851 -17.692 789 HE1 MET 105 3HE MET 105 -6.403 -4.737 -19.489 790 HE2 MET 105 1HE MET 105 -6.981 -6.021 -18.427 791 HE3 MET 105 2HE MET 105 -6.644 -4.419 -17.771 792 H VAL 106 H VAL 106 -2.148 -9.372 -18.593 793 HA VAL 106 HA VAL 106 -0.844 -6.805 -18.805 794 HB VAL 106 HB VAL 106 0.263 -9.311 -17.544 795 HG11 VAL 106 1HG1 VAL 106 1.282 -6.687 -17.918 796 HG12 VAL 106 2HG1 VAL 106 0.979 -6.921 -16.195 797 HG13 VAL 106 3HG1 VAL 106 2.021 -8.044 -17.069 798 HG21 VAL 106 3HG2 VAL 106 -2.098 -8.182 -16.807 799 HG22 VAL 106 1HG2 VAL 106 -1.021 -9.056 -15.718 800 HG23 VAL 106 2HG2 VAL 106 -0.958 -7.296 -15.795 801 H GLN 107 H GLN 107 0.679 -9.990 -19.129 802 HA GLN 107 HA GLN 107 2.651 -9.072 -20.919 803 HB2 GLN 107 2HB GLN 107 1.735 -11.922 -20.515 804 HB3 GLN 107 3HB GLN 107 3.285 -11.397 -21.159 805 HG2 GLN 107 2HG GLN 107 4.156 -11.195 -19.133 806 HG3 GLN 107 3HG GLN 107 2.786 -10.244 -18.562 807 HE21 GLN 107 1HE2 GLN 107 0.726 -11.708 -18.365 808 HE22 GLN 107 2HE2 GLN 107 0.971 -13.161 -17.463 809 H SER 108 H SER 108 -0.477 -10.593 -21.408 810 HA SER 108 HA SER 108 -0.085 -10.371 -24.319 811 HB2 SER 108 2HB SER 108 -0.776 -12.612 -22.942 812 HB3 SER 108 3HB SER 108 -2.369 -11.963 -23.330 813 HG SER 108 HG SER 108 -1.922 -13.077 -25.106 Start of MODEL 14 1 H1 SER 1 H SER 1 -0.140 -0.442 -1.038 2 HA SER 1 HA SER 1 1.391 -0.196 -3.540 3 HB2 SER 1 2HB SER 1 1.804 1.368 -1.494 4 HB3 SER 1 3HB SER 1 2.636 -0.028 -0.811 5 HG SER 1 HG SER 1 3.254 1.426 -3.153 6 H LEU 2 H LEU 2 2.924 -1.732 -4.079 7 HA LEU 2 HA LEU 2 2.727 -4.260 -2.585 8 HB2 LEU 2 2HB LEU 2 3.765 -4.093 -5.377 9 HB3 LEU 2 3HB LEU 2 2.973 -5.437 -4.556 10 HG LEU 2 HG LEU 2 1.388 -4.776 -6.103 11 HD11 LEU 2 1HD1 LEU 2 0.782 -4.503 -3.498 12 HD12 LEU 2 2HD1 LEU 2 -0.390 -4.308 -4.801 13 HD13 LEU 2 3HD1 LEU 2 0.371 -2.890 -4.080 14 HD21 LEU 2 3HD2 LEU 2 0.965 -2.032 -5.872 15 HD22 LEU 2 1HD2 LEU 2 1.743 -2.880 -7.208 16 HD23 LEU 2 2HD2 LEU 2 2.718 -2.223 -5.894 17 H THR 3 H THR 3 5.050 -2.481 -4.628 18 HA THR 3 HA THR 3 7.325 -2.345 -4.576 19 HB THR 3 HB THR 3 7.975 -2.676 -1.863 20 HG1 THR 3 HG1 THR 3 6.309 -1.163 -1.009 21 HG21 THR 3 3HG2 THR 3 8.037 -0.678 -3.881 22 HG22 THR 3 1HG2 THR 3 8.961 -0.748 -2.382 23 HG23 THR 3 2HG2 THR 3 7.391 0.054 -2.413 24 H ASP 4 H ASP 4 6.005 -5.053 -4.623 25 HA ASP 4 HA ASP 4 8.350 -6.613 -3.754 26 HB2 ASP 4 2HB ASP 4 5.994 -6.931 -2.589 27 HB3 ASP 4 3HB ASP 4 5.674 -7.915 -4.015 28 H ILE 5 H ILE 5 6.595 -5.515 -6.348 29 HA ILE 5 HA ILE 5 7.674 -7.648 -8.065 30 HB ILE 5 HB ILE 5 5.035 -6.254 -8.517 31 HG12 ILE 5 2HG1 ILE 5 4.351 -8.827 -8.199 32 HG13 ILE 5 3HG1 ILE 5 5.764 -8.792 -7.150 33 HG21 ILE 5 1HG2 ILE 5 6.460 -7.079 -10.490 34 HG22 ILE 5 2HG2 ILE 5 6.035 -8.697 -9.934 35 HG23 ILE 5 3HG2 ILE 5 4.768 -7.572 -10.421 36 HD11 ILE 5 3HD1 ILE 5 4.099 -8.285 -5.672 37 HD12 ILE 5 1HD1 ILE 5 4.601 -6.668 -6.166 38 HD13 ILE 5 2HD1 ILE 5 3.156 -7.396 -6.868 39 H LEU 6 H LEU 6 6.546 -4.295 -7.876 40 HA LEU 6 HA LEU 6 8.473 -3.620 -9.998 41 HB2 LEU 6 2HB LEU 6 5.664 -2.644 -9.594 42 HB3 LEU 6 3HB LEU 6 6.843 -1.712 -10.515 43 HG LEU 6 HG LEU 6 6.246 -4.555 -11.247 44 HD11 LEU 6 1HD1 LEU 6 4.259 -4.103 -12.158 45 HD12 LEU 6 2HD1 LEU 6 4.792 -2.538 -12.770 46 HD13 LEU 6 3HD1 LEU 6 4.243 -2.691 -11.101 47 HD21 LEU 6 3HD2 LEU 6 8.007 -2.632 -12.191 48 HD22 LEU 6 1HD2 LEU 6 6.680 -2.618 -13.354 49 HD23 LEU 6 2HD2 LEU 6 7.534 -4.122 -13.010 50 H SER 7 H SER 7 9.317 -1.434 -9.902 51 HA SER 7 HA SER 7 9.956 -0.676 -7.211 52 HB2 SER 7 2HB SER 7 11.058 -0.245 -9.809 53 HB3 SER 7 3HB SER 7 10.803 1.327 -9.052 54 HG SER 7 HG SER 7 11.970 -0.720 -7.540 55 HA PRO 8 HA PRO 8 7.066 2.534 -6.453 56 HB2 PRO 8 2HB PRO 8 8.588 4.436 -5.255 57 HB3 PRO 8 3HB PRO 8 8.150 2.918 -4.464 58 HG2 PRO 8 2HG PRO 8 10.697 3.667 -5.846 59 HG3 PRO 8 3HG PRO 8 10.467 2.797 -4.318 60 HD2 PRO 8 2HD PRO 8 11.035 1.532 -6.644 61 HD3 PRO 8 3HD PRO 8 10.031 0.797 -5.377 62 H SER 9 H SER 9 10.125 3.912 -7.673 63 HA SER 9 HA SER 9 9.137 6.296 -8.667 64 HB2 SER 9 2HB SER 9 11.084 6.151 -10.303 65 HB3 SER 9 3HB SER 9 11.498 6.000 -8.596 66 HG SER 9 HG SER 9 12.544 4.385 -9.738 67 H ASP 10 H ASP 10 9.390 3.159 -10.310 68 HA ASP 10 HA ASP 10 8.454 3.950 -12.817 69 HB2 ASP 10 2HB ASP 10 8.244 1.301 -11.380 70 HB3 ASP 10 3HB ASP 10 7.775 1.530 -13.063 71 H ILE 11 H ILE 11 6.723 3.098 -9.885 72 HA ILE 11 HA ILE 11 4.142 3.050 -11.141 73 HB ILE 11 HB ILE 11 4.936 3.159 -8.231 74 HG12 ILE 11 2HG1 ILE 11 3.572 0.830 -9.486 75 HG13 ILE 11 3HG1 ILE 11 5.266 1.089 -9.892 76 HG21 ILE 11 1HG2 ILE 11 2.832 3.997 -8.039 77 HG22 ILE 11 2HG2 ILE 11 2.289 3.285 -9.557 78 HG23 ILE 11 3HG2 ILE 11 2.430 2.282 -8.114 79 HD11 ILE 11 3HD1 ILE 11 4.071 0.597 -7.183 80 HD12 ILE 11 1HD1 ILE 11 5.211 -0.412 -8.074 81 HD13 ILE 11 2HD1 ILE 11 5.730 1.144 -7.424 82 H ALA 12 H ALA 12 5.769 5.298 -8.905 83 HA ALA 12 HA ALA 12 3.770 7.245 -8.831 84 HB1 ALA 12 1HB ALA 12 6.289 8.539 -8.658 85 HB2 ALA 12 2HB ALA 12 5.185 8.099 -7.354 86 HB3 ALA 12 3HB ALA 12 6.428 6.963 -7.877 87 H ALA 13 H ALA 13 6.324 6.664 -11.166 88 HA ALA 13 HA ALA 13 6.043 9.135 -12.556 89 HB1 ALA 13 1HB ALA 13 7.415 6.544 -13.107 90 HB2 ALA 13 2HB ALA 13 7.216 7.716 -14.410 91 HB3 ALA 13 3HB ALA 13 8.091 8.165 -12.947 92 H ALA 14 H ALA 14 4.465 6.029 -12.734 93 HA ALA 14 HA ALA 14 3.193 6.590 -15.269 94 HB1 ALA 14 1HB ALA 14 2.552 4.366 -13.343 95 HB2 ALA 14 2HB ALA 14 2.178 4.444 -15.065 96 HB3 ALA 14 3HB ALA 14 3.852 4.290 -14.532 97 H LEU 15 H LEU 15 2.223 6.397 -11.862 98 HA LEU 15 HA LEU 15 -0.506 6.838 -12.171 99 HB2 LEU 15 2HB LEU 15 1.455 7.343 -9.986 100 HB3 LEU 15 3HB LEU 15 -0.170 8.008 -9.838 101 HG LEU 15 HG LEU 15 0.446 5.081 -10.224 102 HD11 LEU 15 1HD1 LEU 15 1.120 5.186 -8.090 103 HD12 LEU 15 2HD1 LEU 15 -0.600 5.326 -7.728 104 HD13 LEU 15 3HD1 LEU 15 0.399 6.775 -7.834 105 HD21 LEU 15 3HD2 LEU 15 -1.885 4.759 -9.611 106 HD22 LEU 15 1HD2 LEU 15 -1.756 5.791 -11.035 107 HD23 LEU 15 2HD2 LEU 15 -2.103 6.503 -9.459 108 H ARG 16 H ARG 16 2.117 9.196 -11.754 109 HA ARG 16 HA ARG 16 0.371 11.456 -11.928 110 HB2 ARG 16 2HB ARG 16 3.372 11.351 -12.276 111 HB3 ARG 16 3HB ARG 16 2.408 12.785 -11.952 112 HG2 ARG 16 2HG ARG 16 2.086 10.627 -9.995 113 HG3 ARG 16 3HG ARG 16 3.701 11.335 -10.068 114 HD2 ARG 16 2HD ARG 16 2.328 13.590 -10.061 115 HD3 ARG 16 3HD ARG 16 1.108 12.574 -9.293 116 HE ARG 16 HE ARG 16 2.408 12.489 -7.404 117 HH11 ARG 16 1HH1 ARG 16 4.285 13.754 -10.049 118 HH12 ARG 16 2HH1 ARG 16 5.623 14.217 -9.049 119 HH21 ARG 16 1HH2 ARG 16 4.162 13.094 -6.078 120 HH22 ARG 16 2HH2 ARG 16 5.552 13.840 -6.791 121 H ASP 17 H ASP 17 2.271 9.583 -14.184 122 HA ASP 17 HA ASP 17 2.450 11.298 -16.342 123 HB2 ASP 17 2HB ASP 17 3.580 9.275 -16.607 124 HB3 ASP 17 3HB ASP 17 2.182 8.318 -16.123 125 H CYS 18 H CYS 18 -0.279 9.315 -15.307 126 HA CYS 18 HA CYS 18 -2.012 10.900 -17.058 127 HB2 CYS 18 2HB CYS 18 -1.992 7.882 -16.889 128 HB3 CYS 18 3HB CYS 18 -3.288 8.815 -17.627 129 HG CYS 18 HG CYS 18 -2.228 8.837 -19.954 130 H GLN 19 H GLN 19 -1.597 11.205 -14.299 131 HA GLN 19 HA GLN 19 -3.314 9.866 -12.597 132 HB2 GLN 19 2HB GLN 19 -3.373 12.085 -11.321 133 HB3 GLN 19 3HB GLN 19 -1.798 11.353 -11.596 134 HG2 GLN 19 2HG GLN 19 -1.246 12.906 -13.266 135 HG3 GLN 19 3HG GLN 19 -2.914 13.458 -13.416 136 HE21 GLN 19 1HE2 GLN 19 -0.152 13.366 -11.230 137 HE22 GLN 19 2HE2 GLN 19 -0.541 14.822 -10.385 138 H ALA 20 H ALA 20 -3.999 12.505 -14.824 139 HA ALA 20 HA ALA 20 -6.531 13.245 -13.984 140 HB1 ALA 20 1HB ALA 20 -6.915 14.015 -16.265 141 HB2 ALA 20 2HB ALA 20 -5.287 14.427 -15.725 142 HB3 ALA 20 3HB ALA 20 -5.534 13.071 -16.825 143 HA PRO 21 HA PRO 21 -9.241 9.889 -14.798 144 HB2 PRO 21 2HB PRO 21 -11.499 11.196 -15.551 145 HB3 PRO 21 3HB PRO 21 -10.914 11.171 -13.883 146 HG2 PRO 21 2HG PRO 21 -10.604 13.297 -15.967 147 HG3 PRO 21 3HG PRO 21 -11.003 13.466 -14.247 148 HD2 PRO 21 2HD PRO 21 -8.511 13.900 -15.215 149 HD3 PRO 21 3HD PRO 21 -8.804 13.253 -13.588 150 H ASP 22 H ASP 22 -10.097 8.621 -16.440 151 HA ASP 22 HA ASP 22 -10.029 7.733 -18.551 152 HB2 ASP 22 2HB ASP 22 -11.421 8.896 -20.134 153 HB3 ASP 22 3HB ASP 22 -12.103 9.132 -18.527 154 H SER 23 H SER 23 -7.589 9.046 -17.762 155 HA SER 23 HA SER 23 -6.641 10.069 -20.357 156 HB2 SER 23 2HB SER 23 -5.044 11.384 -19.241 157 HB3 SER 23 3HB SER 23 -6.480 11.528 -18.229 158 HG SER 23 HG SER 23 -4.358 11.013 -17.191 159 H PHE 24 H PHE 24 -6.495 7.470 -18.205 160 HA PHE 24 HA PHE 24 -3.999 6.497 -19.432 161 HB2 PHE 24 2HB PHE 24 -3.871 4.968 -17.433 162 HB3 PHE 24 3HB PHE 24 -3.686 6.681 -17.067 163 HD1 PHE 24 HD2 PHE 24 -5.538 7.922 -16.005 164 HD2 PHE 24 HD1 PHE 24 -5.685 3.707 -16.575 165 HE1 PHE 24 HE2 PHE 24 -7.359 7.766 -14.358 166 HE2 PHE 24 HE1 PHE 24 -7.508 3.544 -14.930 167 HZ PHE 24 HZ PHE 24 -8.346 5.575 -13.818 168 H SER 25 H SER 25 -4.070 3.878 -19.023 169 HA SER 25 HA SER 25 -6.630 2.747 -19.737 170 HB2 SER 25 2HB SER 25 -4.691 3.448 -21.775 171 HB3 SER 25 3HB SER 25 -5.004 1.713 -21.766 172 HG SER 25 HG SER 25 -6.898 2.088 -22.580 173 HA PRO 26 HA PRO 26 -4.999 -0.864 -17.856 174 HB2 PRO 26 2HB PRO 26 -6.110 -2.859 -19.325 175 HB3 PRO 26 3HB PRO 26 -7.040 -1.860 -18.202 176 HG2 PRO 26 2HG PRO 26 -6.791 -1.637 -21.177 177 HG3 PRO 26 3HG PRO 26 -8.238 -1.491 -20.161 178 HD2 PRO 26 2HD PRO 26 -6.921 0.664 -21.138 179 HD3 PRO 26 3HD PRO 26 -7.759 0.686 -19.573 180 H LYS 27 H LYS 27 -4.327 -0.233 -21.166 181 HA LYS 27 HA LYS 27 -2.118 -2.184 -21.105 182 HB2 LYS 27 2HB LYS 27 -2.337 -2.553 -23.416 183 HB3 LYS 27 3HB LYS 27 -3.989 -2.549 -22.814 184 HG2 LYS 27 2HG LYS 27 -3.629 0.074 -23.455 185 HG3 LYS 27 3HG LYS 27 -2.663 -0.741 -24.688 186 HD2 LYS 27 2HD LYS 27 -4.825 -0.551 -25.606 187 HD3 LYS 27 3HD LYS 27 -4.687 -2.229 -25.075 188 HE2 LYS 27 2HE LYS 27 -5.810 -1.508 -22.930 189 HE3 LYS 27 3HE LYS 27 -6.147 0.031 -23.723 190 HZ1 LYS 27 3HZ LYS 27 -7.283 -1.280 -25.493 191 HZ2 LYS 27 1HZ LYS 27 -8.042 -1.344 -23.983 192 HZ3 LYS 27 2HZ LYS 27 -7.119 -2.655 -24.521 193 H LYS 28 H LYS 28 -2.283 0.676 -20.224 194 HA LYS 28 HA LYS 28 -0.009 1.645 -21.816 195 HB2 LYS 28 2HB LYS 28 -2.448 3.189 -20.953 196 HB3 LYS 28 3HB LYS 28 -0.936 3.990 -21.360 197 HG2 LYS 28 2HG LYS 28 -2.273 2.094 -23.259 198 HG3 LYS 28 3HG LYS 28 -2.711 3.802 -23.179 199 HD2 LYS 28 2HD LYS 28 -0.255 4.312 -23.510 200 HD3 LYS 28 3HD LYS 28 -0.042 2.601 -23.887 201 HE2 LYS 28 2HE LYS 28 -1.859 4.525 -25.335 202 HE3 LYS 28 3HE LYS 28 -0.304 3.934 -25.918 203 HZ1 LYS 28 3HZ LYS 28 -2.879 2.567 -25.780 204 HZ2 LYS 28 1HZ LYS 28 -1.499 1.632 -25.487 205 HZ3 LYS 28 2HZ LYS 28 -1.661 2.466 -26.950 206 H PHE 29 H PHE 29 -0.766 0.435 -18.997 207 HA PHE 29 HA PHE 29 0.715 2.402 -17.389 208 HB2 PHE 29 2HB PHE 29 -1.638 1.002 -16.845 209 HB3 PHE 29 3HB PHE 29 -0.408 0.186 -15.887 210 HD1 PHE 29 HD1 PHE 29 1.064 1.639 -14.382 211 HD2 PHE 29 HD2 PHE 29 -2.589 2.984 -16.103 212 HE1 PHE 29 HE1 PHE 29 0.924 3.417 -12.687 213 HE2 PHE 29 HE2 PHE 29 -2.735 4.764 -14.412 214 HZ PHE 29 HZ PHE 29 -0.977 4.983 -12.701 215 H PHE 30 H PHE 30 0.694 -0.907 -18.511 216 HA PHE 30 HA PHE 30 2.800 -1.851 -16.857 217 HB2 PHE 30 2HB PHE 30 2.749 -3.818 -18.155 218 HB3 PHE 30 3HB PHE 30 1.089 -3.232 -18.175 219 HD1 PHE 30 HD2 PHE 30 0.114 -2.320 -20.195 220 HD2 PHE 30 HD1 PHE 30 4.115 -3.770 -20.140 221 HE1 PHE 30 HE2 PHE 30 0.136 -2.344 -22.656 222 HE2 PHE 30 HE1 PHE 30 4.144 -3.796 -22.600 223 HZ PHE 30 HZ PHE 30 2.152 -3.083 -23.861 224 H GLN 31 H GLN 31 2.771 0.305 -19.431 225 HA GLN 31 HA GLN 31 5.366 -0.359 -20.501 226 HB2 GLN 31 2HB GLN 31 4.024 2.276 -20.964 227 HB3 GLN 31 3HB GLN 31 5.013 1.323 -22.062 228 HG2 GLN 31 2HG GLN 31 3.174 -0.329 -22.208 229 HG3 GLN 31 3HG GLN 31 2.185 0.743 -21.218 230 HE21 GLN 31 1HE2 GLN 31 2.718 3.186 -22.216 231 HE22 GLN 31 2HE2 GLN 31 2.222 3.291 -23.867 232 H ILE 32 H ILE 32 4.007 2.064 -18.322 233 HA ILE 32 HA ILE 32 6.598 3.311 -17.927 234 HB ILE 32 HB ILE 32 4.004 3.881 -16.493 235 HG12 ILE 32 2HG1 ILE 32 4.529 5.968 -18.251 236 HG13 ILE 32 3HG1 ILE 32 4.906 4.526 -19.188 237 HG21 ILE 32 1HG2 ILE 32 5.839 4.731 -15.244 238 HG22 ILE 32 2HG2 ILE 32 6.611 5.370 -16.695 239 HG23 ILE 32 3HG2 ILE 32 5.119 6.097 -16.097 240 HD11 ILE 32 3HD1 ILE 32 2.386 4.425 -17.685 241 HD12 ILE 32 1HD1 ILE 32 2.452 5.610 -18.989 242 HD13 ILE 32 2HD1 ILE 32 2.756 3.906 -19.329 243 H SER 33 H SER 33 4.468 1.070 -16.306 244 HA SER 33 HA SER 33 5.983 1.143 -13.837 245 HB2 SER 33 2HB SER 33 4.404 -0.601 -13.086 246 HB3 SER 33 3HB SER 33 3.559 0.802 -13.738 247 HG SER 33 HG SER 33 2.595 -0.651 -14.919 248 H GLY 34 H GLY 34 5.024 -1.610 -15.892 249 HA2 GLY 34 2HA GLY 34 6.895 -2.856 -16.987 250 HA3 GLY 34 3HA GLY 34 7.724 -2.726 -15.443 251 H MET 35 H MET 35 4.309 -3.463 -15.985 252 HA MET 35 HA MET 35 4.456 -5.730 -14.244 253 HB2 MET 35 2HB MET 35 2.145 -5.093 -16.062 254 HB3 MET 35 3HB MET 35 2.117 -5.898 -14.499 255 HG2 MET 35 2HG MET 35 2.747 -3.787 -13.419 256 HG3 MET 35 3HG MET 35 2.718 -2.991 -14.991 257 HE1 MET 35 3HE MET 35 -1.013 -4.830 -12.993 258 HE2 MET 35 1HE MET 35 0.372 -5.764 -13.561 259 HE3 MET 35 2HE MET 35 0.539 -4.699 -12.165 260 H SER 36 H SER 36 3.862 -5.315 -17.727 261 HA SER 36 HA SER 36 3.519 -7.967 -18.433 262 HB2 SER 36 2HB SER 36 4.035 -7.323 -20.676 263 HB3 SER 36 3HB SER 36 3.259 -5.931 -19.921 264 HG SER 36 HG SER 36 5.736 -6.143 -20.976 265 H LYS 37 H LYS 37 6.464 -6.210 -17.738 266 HA LYS 37 HA LYS 37 8.310 -8.059 -18.789 267 HB2 LYS 37 2HB LYS 37 8.825 -6.351 -16.364 268 HB3 LYS 37 3HB LYS 37 9.972 -6.880 -17.588 269 HG2 LYS 37 2HG LYS 37 7.808 -4.812 -17.868 270 HG3 LYS 37 3HG LYS 37 9.555 -4.573 -17.947 271 HD2 LYS 37 2HD LYS 37 7.877 -6.134 -19.913 272 HD3 LYS 37 3HD LYS 37 8.575 -4.534 -20.177 273 HE2 LYS 37 2HE LYS 37 10.828 -5.520 -19.865 274 HE3 LYS 37 3HE LYS 37 10.079 -7.111 -19.736 275 HZ1 LYS 37 3HZ LYS 37 9.058 -6.480 -22.010 276 HZ2 LYS 37 1HZ LYS 37 10.661 -7.017 -21.943 277 HZ3 LYS 37 2HZ LYS 37 10.328 -5.366 -22.090 278 H LYS 38 H LYS 38 6.241 -8.250 -16.105 279 HA LYS 38 HA LYS 38 7.891 -10.212 -14.710 280 HB2 LYS 38 2HB LYS 38 5.120 -9.302 -13.946 281 HB3 LYS 38 3HB LYS 38 6.326 -10.067 -12.920 282 HG2 LYS 38 2HG LYS 38 6.653 -7.341 -14.150 283 HG3 LYS 38 3HG LYS 38 6.027 -7.630 -12.525 284 HD2 LYS 38 2HD LYS 38 8.092 -7.820 -11.721 285 HD3 LYS 38 3HD LYS 38 8.470 -9.085 -12.892 286 HE2 LYS 38 2HE LYS 38 8.807 -7.180 -14.564 287 HE3 LYS 38 3HE LYS 38 8.819 -6.113 -13.161 288 HZ1 LYS 38 3HZ LYS 38 10.993 -6.561 -13.126 289 HZ2 LYS 38 1HZ LYS 38 10.844 -7.935 -14.102 290 HZ3 LYS 38 2HZ LYS 38 10.554 -8.044 -12.440 291 H SER 39 H SER 39 6.831 -12.252 -13.987 292 HA SER 39 HA SER 39 5.770 -13.631 -16.254 293 HB2 SER 39 2HB SER 39 7.303 -14.536 -14.356 294 HB3 SER 39 3HB SER 39 5.795 -14.772 -13.473 295 HG SER 39 HG SER 39 5.716 -16.577 -14.547 296 H SER 40 H SER 40 3.893 -15.316 -15.561 297 HA SER 40 HA SER 40 1.568 -13.638 -15.218 298 HB2 SER 40 2HB SER 40 0.417 -15.295 -16.264 299 HB3 SER 40 3HB SER 40 2.027 -15.857 -16.716 300 HG SER 40 HG SER 40 0.215 -17.129 -15.281 301 H SER 41 H SER 41 3.622 -14.954 -13.076 302 HA SER 41 HA SER 41 1.530 -15.663 -11.134 303 HB2 SER 41 2HB SER 41 4.489 -16.294 -11.161 304 HB3 SER 41 3HB SER 41 3.402 -16.694 -9.831 305 HG SER 41 HG SER 41 2.664 -18.319 -10.943 306 H GLN 42 H GLN 42 4.192 -13.499 -11.777 307 HA GLN 42 HA GLN 42 4.315 -12.377 -9.154 308 HB2 GLN 42 2HB GLN 42 5.494 -11.745 -11.814 309 HB3 GLN 42 3HB GLN 42 5.454 -10.460 -10.614 310 HG2 GLN 42 2HG GLN 42 6.593 -12.048 -9.034 311 HG3 GLN 42 3HG GLN 42 6.817 -13.128 -10.409 312 HE21 GLN 42 1HE2 GLN 42 7.461 -9.844 -9.282 313 HE22 GLN 42 2HE2 GLN 42 8.940 -9.644 -10.151 314 H LEU 43 H LEU 43 2.361 -11.838 -11.955 315 HA LEU 43 HA LEU 43 1.479 -9.211 -11.163 316 HB2 LEU 43 2HB LEU 43 0.206 -11.047 -13.178 317 HB3 LEU 43 3HB LEU 43 0.035 -9.297 -13.059 318 HG LEU 43 HG LEU 43 2.738 -10.443 -13.577 319 HD11 LEU 43 1HD1 LEU 43 0.466 -10.337 -15.532 320 HD12 LEU 43 2HD1 LEU 43 1.587 -11.659 -15.208 321 HD13 LEU 43 3HD1 LEU 43 2.147 -10.216 -16.052 322 HD21 LEU 43 3HD2 LEU 43 1.272 -7.892 -14.034 323 HD22 LEU 43 1HD2 LEU 43 2.598 -8.318 -15.116 324 HD23 LEU 43 2HD2 LEU 43 2.889 -8.166 -13.383 325 H LYS 44 H LYS 44 0.626 -12.441 -10.434 326 HA LYS 44 HA LYS 44 -2.119 -12.015 -9.795 327 HB2 LYS 44 2HB LYS 44 -0.128 -14.180 -9.194 328 HB3 LYS 44 3HB LYS 44 -1.706 -14.184 -8.418 329 HG2 LYS 44 2HG LYS 44 -2.599 -13.947 -10.852 330 HG3 LYS 44 3HG LYS 44 -1.006 -14.569 -11.292 331 HD2 LYS 44 2HD LYS 44 -2.665 -15.955 -9.217 332 HD3 LYS 44 3HD LYS 44 -2.959 -16.234 -10.935 333 HE2 LYS 44 2HE LYS 44 -0.240 -16.516 -9.681 334 HE3 LYS 44 3HE LYS 44 -1.387 -17.851 -9.774 335 HZ1 LYS 44 3HZ LYS 44 -1.447 -17.355 -12.246 336 HZ2 LYS 44 1HZ LYS 44 -0.038 -18.074 -11.648 337 HZ3 LYS 44 2HZ LYS 44 -0.060 -16.419 -11.994 338 H GLU 45 H GLU 45 0.896 -11.708 -8.047 339 HA GLU 45 HA GLU 45 0.017 -11.694 -5.425 340 HB2 GLU 45 2HB GLU 45 2.155 -9.947 -6.659 341 HB3 GLU 45 3HB GLU 45 1.960 -10.255 -4.939 342 HG2 GLU 45 2HG GLU 45 2.629 -12.293 -7.049 343 HG3 GLU 45 3HG GLU 45 3.734 -11.616 -5.855 344 H ILE 46 H ILE 46 0.178 -8.962 -7.695 345 HA ILE 46 HA ILE 46 -0.900 -7.061 -5.889 346 HB ILE 46 HB ILE 46 -1.022 -6.918 -8.899 347 HG12 ILE 46 2HG1 ILE 46 1.163 -5.437 -8.150 348 HG13 ILE 46 3HG1 ILE 46 1.267 -6.814 -7.059 349 HG21 ILE 46 1HG2 ILE 46 -2.174 -5.073 -8.298 350 HG22 ILE 46 2HG2 ILE 46 -1.481 -5.036 -6.678 351 HG23 ILE 46 3HG2 ILE 46 -0.560 -4.409 -8.045 352 HD11 ILE 46 3HD1 ILE 46 0.706 -7.838 -9.621 353 HD12 ILE 46 1HD1 ILE 46 1.989 -6.641 -9.804 354 HD13 ILE 46 2HD1 ILE 46 2.192 -7.988 -8.682 355 H PHE 47 H PHE 47 -2.322 -9.213 -8.282 356 HA PHE 47 HA PHE 47 -4.884 -8.151 -8.431 357 HB2 PHE 47 2HB PHE 47 -4.420 -9.852 -9.969 358 HB3 PHE 47 3HB PHE 47 -3.802 -10.936 -8.727 359 HD1 PHE 47 HD1 PHE 47 -5.370 -12.102 -7.214 360 HD2 PHE 47 HD2 PHE 47 -6.722 -9.793 -10.524 361 HE1 PHE 47 HE1 PHE 47 -7.565 -13.206 -7.083 362 HE2 PHE 47 HE2 PHE 47 -8.919 -10.892 -10.398 363 HZ PHE 47 HZ PHE 47 -9.343 -12.601 -8.675 364 H ARG 48 H ARG 48 -3.479 -10.344 -6.050 365 HA ARG 48 HA ARG 48 -5.899 -10.861 -4.658 366 HB2 ARG 48 2HB ARG 48 -3.209 -11.714 -4.508 367 HB3 ARG 48 3HB ARG 48 -3.615 -11.056 -2.929 368 HG2 ARG 48 2HG ARG 48 -5.082 -13.237 -4.396 369 HG3 ARG 48 3HG ARG 48 -4.054 -13.423 -2.973 370 HD2 ARG 48 2HD ARG 48 -5.837 -11.529 -2.143 371 HD3 ARG 48 3HD ARG 48 -6.837 -12.535 -3.191 372 HE ARG 48 HE ARG 48 -6.692 -14.235 -1.654 373 HH11 ARG 48 1HH1 ARG 48 -4.352 -11.773 -0.891 374 HH12 ARG 48 2HH1 ARG 48 -3.940 -12.457 0.646 375 HH21 ARG 48 1HH2 ARG 48 -6.158 -15.145 0.368 376 HH22 ARG 48 2HH2 ARG 48 -4.967 -14.376 1.361 377 H ILE 49 H ILE 49 -4.049 -8.089 -4.911 378 HA ILE 49 HA ILE 49 -4.719 -7.110 -2.238 379 HB ILE 49 HB ILE 49 -3.158 -5.698 -4.402 380 HG12 ILE 49 2HG1 ILE 49 -2.003 -7.747 -3.780 381 HG13 ILE 49 3HG1 ILE 49 -1.152 -6.362 -3.107 382 HG21 ILE 49 1HG2 ILE 49 -2.384 -4.819 -1.871 383 HG22 ILE 49 2HG2 ILE 49 -3.354 -3.943 -3.055 384 HG23 ILE 49 3HG2 ILE 49 -4.144 -4.913 -1.812 385 HD11 ILE 49 3HD1 ILE 49 -2.721 -8.479 -1.729 386 HD12 ILE 49 1HD1 ILE 49 -1.136 -7.811 -1.339 387 HD13 ILE 49 2HD1 ILE 49 -2.595 -6.880 -0.995 388 H LEU 50 H LEU 50 -5.941 -7.077 -5.390 389 HA LEU 50 HA LEU 50 -7.300 -4.520 -5.124 390 HB2 LEU 50 2HB LEU 50 -6.905 -6.519 -7.274 391 HB3 LEU 50 3HB LEU 50 -8.380 -5.556 -7.337 392 HG LEU 50 HG LEU 50 -6.520 -3.615 -6.983 393 HD11 LEU 50 1HD1 LEU 50 -5.203 -5.541 -8.872 394 HD12 LEU 50 2HD1 LEU 50 -4.759 -5.441 -7.168 395 HD13 LEU 50 3HD1 LEU 50 -4.567 -4.033 -8.213 396 HD21 LEU 50 3HD2 LEU 50 -6.611 -3.838 -9.710 397 HD22 LEU 50 1HD2 LEU 50 -7.834 -3.060 -8.705 398 HD23 LEU 50 2HD2 LEU 50 -8.043 -4.738 -9.207 399 H ASP 51 H ASP 51 -7.912 -7.889 -4.638 400 HA ASP 51 HA ASP 51 -10.724 -7.879 -4.818 401 HB2 ASP 51 2HB ASP 51 -9.305 -9.930 -4.783 402 HB3 ASP 51 3HB ASP 51 -8.998 -9.647 -3.072 403 H ASN 52 H ASN 52 -11.658 -6.169 -3.756 404 HA ASN 52 HA ASN 52 -11.051 -5.687 -0.959 405 HB2 ASN 52 2HB ASN 52 -12.343 -4.221 -3.130 406 HB3 ASN 52 3HB ASN 52 -13.221 -4.093 -1.608 407 HD21 ASN 52 1HD2 ASN 52 -9.789 -4.207 -2.512 408 HD22 ASN 52 2HD2 ASN 52 -9.341 -2.779 -1.648 409 H ASP 53 H ASP 53 -12.710 -8.017 -2.344 410 HA ASP 53 HA ASP 53 -14.830 -8.002 -0.298 411 HB2 ASP 53 2HB ASP 53 -15.114 -9.453 -2.916 412 HB3 ASP 53 3HB ASP 53 -16.372 -8.962 -1.785 413 H GLN 54 H GLN 54 -12.100 -9.536 -1.531 414 HA GLN 54 HA GLN 54 -11.033 -11.486 -1.053 415 HB2 GLN 54 2HB GLN 54 -12.937 -11.796 1.262 416 HB3 GLN 54 3HB GLN 54 -11.289 -12.395 1.126 417 HG2 GLN 54 2HG GLN 54 -11.922 -9.464 1.122 418 HG3 GLN 54 3HG GLN 54 -11.684 -10.375 2.612 419 HE21 GLN 54 1HE2 GLN 54 -10.195 -8.459 0.420 420 HE22 GLN 54 2HE2 GLN 54 -8.555 -8.943 0.667 421 H SER 55 H SER 55 -13.752 -11.397 -2.504 422 HA SER 55 HA SER 55 -14.906 -13.978 -2.051 423 HB2 SER 55 2HB SER 55 -15.926 -13.318 -4.437 424 HB3 SER 55 3HB SER 55 -16.515 -12.606 -2.934 425 HG SER 55 HG SER 55 -14.918 -11.487 -4.938 426 H GLY 56 H GLY 56 -12.557 -12.626 -4.284 427 HA2 GLY 56 2HA GLY 56 -10.886 -14.464 -4.901 428 HA3 GLY 56 3HA GLY 56 -12.298 -15.265 -5.572 429 H PHE 57 H PHE 57 -13.188 -12.350 -6.249 430 HA PHE 57 HA PHE 57 -11.468 -11.992 -8.605 431 HB2 PHE 57 2HB PHE 57 -14.482 -11.787 -8.674 432 HB3 PHE 57 3HB PHE 57 -13.376 -11.671 -10.039 433 HD1 PHE 57 HD1 PHE 57 -14.879 -13.951 -7.578 434 HD2 PHE 57 HD2 PHE 57 -12.506 -13.617 -11.095 435 HE1 PHE 57 HE1 PHE 57 -15.094 -16.374 -7.949 436 HE2 PHE 57 HE2 PHE 57 -12.718 -16.039 -11.472 437 HZ PHE 57 HZ PHE 57 -14.014 -17.421 -9.899 438 H ILE 58 H ILE 58 -12.009 -9.833 -9.712 439 HA ILE 58 HA ILE 58 -12.411 -7.796 -7.620 440 HB ILE 58 HB ILE 58 -10.738 -7.532 -10.120 441 HG12 ILE 58 2HG1 ILE 58 -9.694 -7.636 -7.300 442 HG13 ILE 58 3HG1 ILE 58 -9.924 -9.107 -8.239 443 HG21 ILE 58 1HG2 ILE 58 -11.819 -5.458 -9.185 444 HG22 ILE 58 2HG2 ILE 58 -10.842 -5.700 -7.737 445 HG23 ILE 58 3HG2 ILE 58 -10.059 -5.417 -9.291 446 HD11 ILE 58 3HD1 ILE 58 -7.613 -8.209 -8.278 447 HD12 ILE 58 1HD1 ILE 58 -8.343 -8.386 -9.873 448 HD13 ILE 58 2HD1 ILE 58 -8.227 -6.791 -9.128 449 H GLU 59 H GLU 59 -14.703 -7.890 -8.124 450 HA GLU 59 HA GLU 59 -15.852 -7.425 -10.601 451 HB2 GLU 59 2HB GLU 59 -16.942 -6.287 -8.031 452 HB3 GLU 59 3HB GLU 59 -17.841 -6.817 -9.446 453 HG2 GLU 59 2HG GLU 59 -18.127 -8.767 -8.449 454 HG3 GLU 59 3HG GLU 59 -16.396 -9.053 -8.622 455 H GLU 60 H GLU 60 -17.122 -5.367 -11.152 456 HA GLU 60 HA GLU 60 -15.286 -3.302 -11.678 457 HB2 GLU 60 2HB GLU 60 -18.264 -3.556 -11.934 458 HB3 GLU 60 3HB GLU 60 -17.481 -2.010 -12.231 459 HG2 GLU 60 2HG GLU 60 -16.321 -2.811 -14.081 460 HG3 GLU 60 3HG GLU 60 -16.559 -4.495 -13.618 461 H ASP 61 H ASP 61 -17.564 -3.813 -9.084 462 HA ASP 61 HA ASP 61 -17.681 -1.196 -8.070 463 HB2 ASP 61 2HB ASP 61 -18.220 -3.918 -6.985 464 HB3 ASP 61 3HB ASP 61 -18.050 -2.598 -5.832 465 H GLU 62 H GLU 62 -15.209 -3.597 -7.943 466 HA GLU 62 HA GLU 62 -13.738 -2.019 -5.940 467 HB2 GLU 62 2HB GLU 62 -12.273 -4.203 -5.970 468 HB3 GLU 62 3HB GLU 62 -13.762 -4.134 -5.037 469 HG2 GLU 62 2HG GLU 62 -14.915 -5.165 -7.028 470 HG3 GLU 62 3HG GLU 62 -13.309 -5.450 -7.697 471 H LEU 63 H LEU 63 -13.708 -3.249 -9.188 472 HA LEU 63 HA LEU 63 -10.995 -2.953 -9.808 473 HB2 LEU 63 2HB LEU 63 -13.141 -3.851 -11.146 474 HB3 LEU 63 3HB LEU 63 -12.971 -2.266 -11.897 475 HG LEU 63 HG LEU 63 -10.958 -4.509 -11.881 476 HD11 LEU 63 1HD1 LEU 63 -12.933 -3.467 -13.789 477 HD12 LEU 63 2HD1 LEU 63 -12.206 -5.068 -13.663 478 HD13 LEU 63 3HD1 LEU 63 -11.326 -3.760 -14.454 479 HD21 LEU 63 3HD2 LEU 63 -9.737 -2.464 -11.597 480 HD22 LEU 63 1HD2 LEU 63 -10.686 -1.668 -12.852 481 HD23 LEU 63 2HD2 LEU 63 -9.584 -2.977 -13.278 482 H LYS 64 H LYS 64 -13.576 -0.619 -9.555 483 HA LYS 64 HA LYS 64 -12.416 1.512 -10.960 484 HB2 LYS 64 2HB LYS 64 -13.873 2.944 -9.461 485 HB3 LYS 64 3HB LYS 64 -14.706 1.694 -10.376 486 HG2 LYS 64 2HG LYS 64 -15.206 0.468 -8.519 487 HG3 LYS 64 3HG LYS 64 -13.798 1.044 -7.624 488 HD2 LYS 64 2HD LYS 64 -15.853 1.945 -6.675 489 HD3 LYS 64 3HD LYS 64 -14.866 3.235 -7.364 490 HE2 LYS 64 2HE LYS 64 -16.526 3.837 -8.712 491 HE3 LYS 64 3HE LYS 64 -16.626 2.206 -9.372 492 HZ1 LYS 64 3HZ LYS 64 -18.145 1.580 -7.675 493 HZ2 LYS 64 1HZ LYS 64 -18.709 3.034 -8.330 494 HZ3 LYS 64 2HZ LYS 64 -17.921 3.030 -6.834 495 H TYR 65 H TYR 65 -11.865 0.278 -7.741 496 HA TYR 65 HA TYR 65 -10.355 2.568 -6.869 497 HB2 TYR 65 2HB TYR 65 -10.841 -0.168 -5.703 498 HB3 TYR 65 3HB TYR 65 -9.742 0.984 -4.953 499 HD1 TYR 65 HD1 TYR 65 -11.181 3.522 -5.326 500 HD2 TYR 65 HD2 TYR 65 -12.646 -0.322 -4.240 501 HE1 TYR 65 HE1 TYR 65 -13.074 4.578 -4.164 502 HE2 TYR 65 HE2 TYR 65 -14.544 0.723 -3.077 503 HH TYR 65 HH TYR 65 -15.804 2.902 -3.198 504 H PHE 66 H PHE 66 -9.613 0.782 -9.276 505 HA PHE 66 HA PHE 66 -7.247 -0.587 -8.791 506 HB2 PHE 66 2HB PHE 66 -8.285 -0.820 -10.924 507 HB3 PHE 66 3HB PHE 66 -8.205 0.912 -11.228 508 HD1 PHE 66 HD1 PHE 66 -5.925 -1.950 -10.504 509 HD2 PHE 66 HD2 PHE 66 -6.561 1.681 -12.631 510 HE1 PHE 66 HE1 PHE 66 -3.779 -2.260 -11.668 511 HE2 PHE 66 HE2 PHE 66 -4.417 1.377 -13.799 512 HZ PHE 66 HZ PHE 66 -3.024 -0.596 -13.319 513 H LEU 67 H LEU 67 -7.842 2.838 -9.088 514 HA LEU 67 HA LEU 67 -5.040 3.518 -9.265 515 HB2 LEU 67 2HB LEU 67 -7.208 5.464 -8.591 516 HB3 LEU 67 3HB LEU 67 -5.714 5.729 -9.488 517 HG LEU 67 HG LEU 67 -8.313 4.587 -10.432 518 HD11 LEU 67 1HD1 LEU 67 -6.703 6.279 -12.177 519 HD12 LEU 67 2HD1 LEU 67 -7.133 7.049 -10.650 520 HD13 LEU 67 3HD1 LEU 67 -8.397 6.418 -11.705 521 HD21 LEU 67 3HD2 LEU 67 -6.960 2.894 -11.244 522 HD22 LEU 67 1HD2 LEU 67 -5.574 3.963 -11.460 523 HD23 LEU 67 2HD2 LEU 67 -6.942 4.060 -12.568 524 H GLN 68 H GLN 68 -7.119 2.626 -6.800 525 HA GLN 68 HA GLN 68 -5.814 4.249 -4.758 526 HB2 GLN 68 2HB GLN 68 -8.314 2.747 -4.968 527 HB3 GLN 68 3HB GLN 68 -7.485 2.496 -3.438 528 HG2 GLN 68 2HG GLN 68 -8.461 4.360 -2.746 529 HG3 GLN 68 3HG GLN 68 -7.346 5.224 -3.804 530 HE21 GLN 68 1HE2 GLN 68 -8.220 4.899 -6.248 531 HE22 GLN 68 2HE2 GLN 68 -9.843 5.456 -6.445 532 H ARG 69 H ARG 69 -4.840 1.709 -6.386 533 HA ARG 69 HA ARG 69 -3.866 0.194 -4.062 534 HB2 ARG 69 2HB ARG 69 -3.435 -0.822 -6.819 535 HB3 ARG 69 3HB ARG 69 -3.822 -1.698 -5.344 536 HG2 ARG 69 2HG ARG 69 -5.742 -0.067 -6.994 537 HG3 ARG 69 3HG ARG 69 -5.645 -1.828 -6.937 538 HD2 ARG 69 2HD ARG 69 -6.552 0.080 -4.809 539 HD3 ARG 69 3HD ARG 69 -7.413 -1.294 -5.501 540 HE ARG 69 HE ARG 69 -5.300 -2.470 -4.330 541 HH11 ARG 69 1HH1 ARG 69 -7.612 -0.132 -3.189 542 HH12 ARG 69 2HH1 ARG 69 -7.533 -0.662 -1.542 543 HH21 ARG 69 1HH2 ARG 69 -5.186 -3.178 -2.164 544 HH22 ARG 69 2HH2 ARG 69 -6.151 -2.395 -0.960 545 H PHE 70 H PHE 70 -2.881 2.053 -6.848 546 HA PHE 70 HA PHE 70 -0.059 1.508 -6.313 547 HB2 PHE 70 2HB PHE 70 -1.437 2.988 -8.560 548 HB3 PHE 70 3HB PHE 70 0.311 2.853 -8.403 549 HD1 PHE 70 HD1 PHE 70 -2.758 0.759 -8.607 550 HD2 PHE 70 HD2 PHE 70 1.413 1.082 -9.393 551 HE1 PHE 70 HE1 PHE 70 -2.821 -1.387 -9.809 552 HE2 PHE 70 HE2 PHE 70 1.356 -1.063 -10.597 553 HZ PHE 70 HZ PHE 70 -0.763 -2.300 -10.807 554 H GLU 71 H GLU 71 -2.465 3.990 -5.981 555 HA GLU 71 HA GLU 71 -0.407 5.873 -5.042 556 HB2 GLU 71 2HB GLU 71 -2.000 6.516 -6.951 557 HB3 GLU 71 3HB GLU 71 -3.249 6.600 -5.717 558 HG2 GLU 71 2HG GLU 71 -2.300 8.792 -6.208 559 HG3 GLU 71 3HG GLU 71 -2.014 8.312 -4.536 560 H SER 72 H SER 72 -3.387 4.234 -4.215 561 HA SER 72 HA SER 72 -4.434 3.874 -2.227 562 HB2 SER 72 2HB SER 72 -1.910 3.545 -1.577 563 HB3 SER 72 3HB SER 72 -2.135 5.068 -0.718 564 HG SER 72 HG SER 72 -2.700 3.560 0.740 565 H GLY 73 H GLY 73 -5.499 5.922 -3.341 566 HA2 GLY 73 2HA GLY 73 -6.769 7.454 -1.561 567 HA3 GLY 73 3HA GLY 73 -5.250 8.324 -1.718 568 H ALA 74 H ALA 74 -5.240 7.295 -4.625 569 HA ALA 74 HA ALA 74 -6.138 9.641 -5.840 570 HB1 ALA 74 1HB ALA 74 -6.183 7.968 -7.923 571 HB2 ALA 74 2HB ALA 74 -4.686 8.584 -7.221 572 HB3 ALA 74 3HB ALA 74 -5.269 6.977 -6.786 573 H ARG 75 H ARG 75 -7.742 9.354 -7.856 574 HA ARG 75 HA ARG 75 -10.327 8.956 -6.663 575 HB2 ARG 75 2HB ARG 75 -11.223 9.866 -8.686 576 HB3 ARG 75 3HB ARG 75 -9.788 10.797 -8.278 577 HG2 ARG 75 2HG ARG 75 -8.502 9.674 -9.954 578 HG3 ARG 75 3HG ARG 75 -9.824 8.549 -10.276 579 HD2 ARG 75 2HD ARG 75 -9.764 11.512 -10.817 580 HD3 ARG 75 3HD ARG 75 -9.808 10.208 -12.003 581 HE ARG 75 HE ARG 75 -12.065 9.783 -10.616 582 HH11 ARG 75 1HH1 ARG 75 -10.718 12.653 -12.054 583 HH12 ARG 75 2HH1 ARG 75 -12.260 13.376 -12.371 584 HH21 ARG 75 1HH2 ARG 75 -14.101 10.724 -11.028 585 HH22 ARG 75 2HH2 ARG 75 -14.184 12.278 -11.786 586 H VAL 76 H VAL 76 -12.028 7.847 -8.194 587 HA VAL 76 HA VAL 76 -11.046 5.118 -8.620 588 HB VAL 76 HB VAL 76 -13.210 4.331 -8.285 589 HG11 VAL 76 1HG1 VAL 76 -13.828 5.124 -6.183 590 HG12 VAL 76 2HG1 VAL 76 -12.120 5.555 -6.299 591 HG13 VAL 76 3HG1 VAL 76 -13.361 6.781 -6.565 592 HG21 VAL 76 3HG2 VAL 76 -14.044 7.034 -9.215 593 HG22 VAL 76 1HG2 VAL 76 -14.614 5.442 -9.715 594 HG23 VAL 76 2HG2 VAL 76 -15.137 6.123 -8.174 595 H LEU 77 H LEU 77 -11.629 3.930 -10.497 596 HA LEU 77 HA LEU 77 -11.260 5.245 -12.915 597 HB2 LEU 77 2HB LEU 77 -12.644 2.605 -12.470 598 HB3 LEU 77 3HB LEU 77 -11.942 3.167 -13.985 599 HG LEU 77 HG LEU 77 -10.416 2.521 -11.463 600 HD11 LEU 77 1HD1 LEU 77 -10.683 1.045 -14.077 601 HD12 LEU 77 2HD1 LEU 77 -11.266 0.517 -12.499 602 HD13 LEU 77 3HD1 LEU 77 -9.534 0.644 -12.800 603 HD21 LEU 77 3HD2 LEU 77 -9.600 3.612 -14.132 604 HD22 LEU 77 1HD2 LEU 77 -8.479 2.666 -13.153 605 HD23 LEU 77 2HD2 LEU 77 -9.154 4.166 -12.518 606 H THR 78 H THR 78 -12.583 6.071 -14.462 607 HA THR 78 HA THR 78 -15.234 6.828 -13.664 608 HB THR 78 HB THR 78 -13.835 8.376 -14.953 609 HG1 THR 78 HG1 THR 78 -15.828 8.975 -15.415 610 HG21 THR 78 3HG2 THR 78 -14.186 7.255 -17.570 611 HG22 THR 78 1HG2 THR 78 -13.326 6.108 -16.544 612 HG23 THR 78 2HG2 THR 78 -12.697 7.741 -16.760 613 H ALA 79 H ALA 79 -16.871 6.740 -15.712 614 HA ALA 79 HA ALA 79 -17.648 4.007 -15.872 615 HB1 ALA 79 1HB ALA 79 -19.564 5.147 -16.029 616 HB2 ALA 79 2HB ALA 79 -18.760 6.593 -16.641 617 HB3 ALA 79 3HB ALA 79 -19.181 5.285 -17.745 618 H SER 80 H SER 80 -15.384 5.756 -17.585 619 HA SER 80 HA SER 80 -15.669 4.044 -19.964 620 HB2 SER 80 2HB SER 80 -15.786 6.439 -20.474 621 HB3 SER 80 3HB SER 80 -14.234 6.696 -19.678 622 HG SER 80 HG SER 80 -14.706 5.964 -22.197 623 H GLU 81 H GLU 81 -13.944 4.379 -17.156 624 HA GLU 81 HA GLU 81 -11.421 3.413 -18.270 625 HB2 GLU 81 2HB GLU 81 -12.251 4.446 -15.575 626 HB3 GLU 81 3HB GLU 81 -10.757 3.541 -15.765 627 HG2 GLU 81 2HG GLU 81 -11.384 5.964 -17.418 628 HG3 GLU 81 3HG GLU 81 -10.596 6.066 -15.844 629 H THR 82 H THR 82 -13.526 2.507 -15.534 630 HA THR 82 HA THR 82 -12.499 0.006 -15.027 631 HB THR 82 HB THR 82 -15.237 -0.338 -14.643 632 HG1 THR 82 HG1 THR 82 -15.811 1.734 -15.076 633 HG21 THR 82 3HG2 THR 82 -12.949 -0.323 -13.137 634 HG22 THR 82 1HG2 THR 82 -14.577 -0.573 -12.508 635 HG23 THR 82 2HG2 THR 82 -13.849 1.033 -12.461 636 H LYS 83 H LYS 83 -15.114 0.841 -17.287 637 HA LYS 83 HA LYS 83 -15.829 -1.665 -18.162 638 HB2 LYS 83 2HB LYS 83 -15.813 1.039 -19.401 639 HB3 LYS 83 3HB LYS 83 -16.063 -0.334 -20.471 640 HG2 LYS 83 2HG LYS 83 -17.866 -1.029 -18.741 641 HG3 LYS 83 3HG LYS 83 -17.779 0.661 -18.240 642 HD2 LYS 83 2HD LYS 83 -19.422 0.803 -19.827 643 HD3 LYS 83 3HD LYS 83 -18.001 1.083 -20.836 644 HE2 LYS 83 2HE LYS 83 -18.043 -1.101 -21.689 645 HE3 LYS 83 3HE LYS 83 -19.113 -1.673 -20.411 646 HZ1 LYS 83 3HZ LYS 83 -19.841 0.174 -22.619 647 HZ2 LYS 83 1HZ LYS 83 -20.872 -0.266 -21.352 648 HZ3 LYS 83 2HZ LYS 83 -20.334 -1.435 -22.450 649 H THR 84 H THR 84 -13.323 0.419 -19.609 650 HA THR 84 HA THR 84 -12.413 -1.289 -21.572 651 HB THR 84 HB THR 84 -10.631 0.508 -19.921 652 HG1 THR 84 HG1 THR 84 -11.916 2.016 -20.679 653 HG21 THR 84 3HG2 THR 84 -9.790 -1.214 -21.748 654 HG22 THR 84 1HG2 THR 84 -9.095 0.401 -21.619 655 HG23 THR 84 2HG2 THR 84 -10.315 0.061 -22.848 656 H PHE 85 H PHE 85 -11.072 -0.970 -18.280 657 HA PHE 85 HA PHE 85 -9.175 -2.967 -18.403 658 HB2 PHE 85 2HB PHE 85 -9.683 -1.309 -16.501 659 HB3 PHE 85 3HB PHE 85 -10.839 -2.510 -15.935 660 HD1 PHE 85 HD2 PHE 85 -9.927 -4.897 -15.556 661 HD2 PHE 85 HD1 PHE 85 -7.473 -1.431 -15.841 662 HE1 PHE 85 HE2 PHE 85 -8.119 -6.084 -14.382 663 HE2 PHE 85 HE1 PHE 85 -5.661 -2.613 -14.669 664 HZ PHE 85 HZ PHE 85 -5.983 -4.942 -13.937 665 H LEU 86 H LEU 86 -12.609 -3.256 -17.579 666 HA LEU 86 HA LEU 86 -12.535 -6.034 -17.023 667 HB2 LEU 86 2HB LEU 86 -14.309 -4.500 -16.249 668 HB3 LEU 86 3HB LEU 86 -14.869 -4.345 -17.912 669 HG LEU 86 HG LEU 86 -15.128 -6.948 -17.748 670 HD11 LEU 86 1HD1 LEU 86 -15.074 -6.070 -14.874 671 HD12 LEU 86 2HD1 LEU 86 -14.160 -7.369 -15.639 672 HD13 LEU 86 3HD1 LEU 86 -15.901 -7.532 -15.413 673 HD21 LEU 86 3HD2 LEU 86 -17.176 -6.130 -18.084 674 HD22 LEU 86 1HD2 LEU 86 -16.856 -4.701 -17.101 675 HD23 LEU 86 2HD2 LEU 86 -17.373 -6.202 -16.333 676 H ALA 87 H ALA 87 -12.713 -4.196 -19.945 677 HA ALA 87 HA ALA 87 -13.618 -6.458 -21.533 678 HB1 ALA 87 1HB ALA 87 -14.498 -4.349 -22.194 679 HB2 ALA 87 2HB ALA 87 -12.889 -3.628 -22.260 680 HB3 ALA 87 3HB ALA 87 -13.356 -4.852 -23.440 681 H ALA 88 H ALA 88 -10.768 -5.638 -20.173 682 HA ALA 88 HA ALA 88 -9.197 -6.751 -22.407 683 HB1 ALA 88 1HB ALA 88 -8.418 -4.555 -22.084 684 HB2 ALA 88 2HB ALA 88 -8.441 -4.718 -20.327 685 HB3 ALA 88 3HB ALA 88 -7.240 -5.592 -21.279 686 H ALA 89 H ALA 89 -10.218 -7.136 -19.172 687 HA ALA 89 HA ALA 89 -8.400 -9.433 -18.872 688 HB1 ALA 89 1HB ALA 89 -8.974 -7.234 -16.954 689 HB2 ALA 89 2HB ALA 89 -8.713 -8.858 -16.318 690 HB3 ALA 89 3HB ALA 89 -7.463 -8.079 -17.287 691 H ASP 90 H ASP 90 -11.560 -8.263 -18.933 692 HA ASP 90 HA ASP 90 -12.556 -10.823 -17.890 693 HB2 ASP 90 2HB ASP 90 -13.020 -9.293 -16.121 694 HB3 ASP 90 3HB ASP 90 -13.592 -8.063 -17.243 695 H HIS 91 H HIS 91 -12.058 -9.670 -20.606 696 HA HIS 91 HA HIS 91 -14.314 -8.879 -21.955 697 HB2 HIS 91 2HB HIS 91 -11.801 -9.545 -22.709 698 HB3 HIS 91 3HB HIS 91 -12.691 -10.924 -23.348 699 HD1 HIS 91 HD1 HIS 91 -11.288 -8.567 -25.015 700 HD2 HIS 91 HD2 HIS 91 -15.349 -9.025 -24.267 701 HE1 HIS 91 HE1 HIS 91 -12.456 -7.306 -26.851 702 H ASP 92 H ASP 92 -13.828 -11.812 -20.335 703 HA ASP 92 HA ASP 92 -15.365 -13.589 -21.871 704 HB2 ASP 92 2HB ASP 92 -15.690 -14.784 -19.643 705 HB3 ASP 92 3HB ASP 92 -14.025 -14.523 -20.155 706 H GLY 93 H GLY 93 -16.261 -11.023 -19.705 707 HA2 GLY 93 2HA GLY 93 -18.369 -9.986 -19.669 708 HA3 GLY 93 3HA GLY 93 -19.054 -11.399 -20.457 709 H ASP 94 H ASP 94 -17.109 -11.195 -17.498 710 HA ASP 94 HA ASP 94 -19.292 -12.560 -16.082 711 HB2 ASP 94 2HB ASP 94 -16.439 -12.291 -15.139 712 HB3 ASP 94 3HB ASP 94 -17.666 -13.420 -14.571 713 H GLY 95 H GLY 95 -17.275 -9.710 -16.072 714 HA2 GLY 95 2HA GLY 95 -17.851 -7.658 -15.093 715 HA3 GLY 95 3HA GLY 95 -19.061 -8.485 -14.124 716 H LYS 96 H LYS 96 -15.997 -9.975 -14.146 717 HA LYS 96 HA LYS 96 -14.912 -8.495 -11.923 718 HB2 LYS 96 2HB LYS 96 -14.904 -10.433 -10.376 719 HB3 LYS 96 3HB LYS 96 -16.523 -9.840 -10.722 720 HG2 LYS 96 2HG LYS 96 -15.641 -11.960 -12.525 721 HG3 LYS 96 3HG LYS 96 -15.731 -12.448 -10.831 722 HD2 LYS 96 2HD LYS 96 -18.017 -10.864 -11.765 723 HD3 LYS 96 3HD LYS 96 -17.835 -12.428 -12.564 724 HE2 LYS 96 2HE LYS 96 -18.412 -13.567 -10.718 725 HE3 LYS 96 3HE LYS 96 -17.473 -12.516 -9.660 726 HZ1 LYS 96 3HZ LYS 96 -19.471 -11.824 -8.975 727 HZ2 LYS 96 1HZ LYS 96 -20.275 -12.414 -10.341 728 HZ3 LYS 96 2HZ LYS 96 -19.499 -10.912 -10.399 729 H ILE 97 H ILE 97 -12.744 -8.707 -11.821 730 HA ILE 97 HA ILE 97 -11.443 -10.290 -13.847 731 HB ILE 97 HB ILE 97 -10.210 -8.577 -11.686 732 HG12 ILE 97 2HG1 ILE 97 -11.704 -7.301 -13.181 733 HG13 ILE 97 3HG1 ILE 97 -10.016 -6.854 -13.409 734 HG21 ILE 97 1HG2 ILE 97 -9.108 -10.261 -13.805 735 HG22 ILE 97 2HG2 ILE 97 -8.479 -8.614 -13.799 736 HG23 ILE 97 3HG2 ILE 97 -8.342 -9.615 -12.354 737 HD11 ILE 97 3HD1 ILE 97 -11.916 -7.904 -15.299 738 HD12 ILE 97 1HD1 ILE 97 -10.341 -7.162 -15.575 739 HD13 ILE 97 2HD1 ILE 97 -10.455 -8.890 -15.241 740 H GLY 98 H GLY 98 -9.947 -11.949 -13.522 741 HA2 GLY 98 2HA GLY 98 -9.970 -13.145 -10.820 742 HA3 GLY 98 3HA GLY 98 -10.173 -14.117 -12.269 743 H ALA 99 H ALA 99 -8.246 -14.967 -10.717 744 HA ALA 99 HA ALA 99 -5.715 -13.710 -11.328 745 HB1 ALA 99 1HB ALA 99 -6.208 -16.351 -9.963 746 HB2 ALA 99 2HB ALA 99 -4.727 -15.394 -9.936 747 HB3 ALA 99 3HB ALA 99 -6.179 -14.792 -9.137 748 H GLU 100 H GLU 100 -7.688 -15.360 -13.220 749 HA GLU 100 HA GLU 100 -5.525 -16.866 -14.538 750 HB2 GLU 100 2HB GLU 100 -7.561 -18.142 -13.597 751 HB3 GLU 100 3HB GLU 100 -8.451 -17.433 -14.937 752 HG2 GLU 100 2HG GLU 100 -7.318 -18.651 -16.518 753 HG3 GLU 100 3HG GLU 100 -5.907 -18.881 -15.486 754 H GLU 101 H GLU 101 -7.629 -14.245 -14.761 755 HA GLU 101 HA GLU 101 -7.193 -14.078 -17.671 756 HB2 GLU 101 2HB GLU 101 -9.271 -12.705 -17.765 757 HB3 GLU 101 3HB GLU 101 -9.546 -14.372 -17.281 758 HG2 GLU 101 2HG GLU 101 -9.574 -13.600 -14.910 759 HG3 GLU 101 3HG GLU 101 -9.507 -11.944 -15.509 760 H PHE 102 H PHE 102 -6.285 -12.850 -14.767 761 HA PHE 102 HA PHE 102 -6.247 -10.050 -15.389 762 HB2 PHE 102 2HB PHE 102 -6.339 -10.774 -13.066 763 HB3 PHE 102 3HB PHE 102 -4.811 -11.630 -13.247 764 HD1 PHE 102 HD2 PHE 102 -6.337 -8.252 -13.353 765 HD2 PHE 102 HD1 PHE 102 -2.786 -10.546 -12.856 766 HE1 PHE 102 HE2 PHE 102 -5.126 -6.223 -12.668 767 HE2 PHE 102 HE1 PHE 102 -1.570 -8.520 -12.170 768 HZ PHE 102 HZ PHE 102 -2.739 -6.355 -12.076 769 H GLN 103 H GLN 103 -3.562 -12.323 -14.792 770 HA GLN 103 HA GLN 103 -1.522 -10.767 -15.804 771 HB2 GLN 103 2HB GLN 103 -0.273 -12.868 -16.127 772 HB3 GLN 103 3HB GLN 103 -1.095 -12.817 -14.573 773 HG2 GLN 103 2HG GLN 103 -2.952 -14.026 -16.175 774 HG3 GLN 103 3HG GLN 103 -1.431 -14.646 -16.817 775 HE21 GLN 103 1HE2 GLN 103 -2.573 -13.833 -13.557 776 HE22 GLN 103 2HE2 GLN 103 -2.197 -15.367 -12.857 777 H GLU 104 H GLU 104 -3.779 -12.843 -17.523 778 HA GLU 104 HA GLU 104 -2.542 -12.948 -20.010 779 HB2 GLU 104 2HB GLU 104 -5.522 -12.704 -19.615 780 HB3 GLU 104 3HB GLU 104 -4.671 -13.525 -20.916 781 HG2 GLU 104 2HG GLU 104 -3.746 -15.073 -19.130 782 HG3 GLU 104 3HG GLU 104 -4.950 -14.370 -18.053 783 H MET 105 H MET 105 -4.222 -10.343 -18.449 784 HA MET 105 HA MET 105 -4.440 -8.784 -20.888 785 HB2 MET 105 2HB MET 105 -5.777 -7.328 -19.707 786 HB3 MET 105 3HB MET 105 -6.063 -8.821 -18.823 787 HG2 MET 105 2HG MET 105 -5.582 -7.636 -17.006 788 HG3 MET 105 3HG MET 105 -3.902 -7.784 -17.516 789 HE1 MET 105 3HE MET 105 -6.586 -4.887 -19.299 790 HE2 MET 105 1HE MET 105 -7.100 -6.055 -18.080 791 HE3 MET 105 2HE MET 105 -6.780 -4.383 -17.619 792 H VAL 106 H VAL 106 -2.167 -9.310 -18.413 793 HA VAL 106 HA VAL 106 -0.897 -6.723 -18.581 794 HB VAL 106 HB VAL 106 0.252 -9.234 -17.369 795 HG11 VAL 106 1HG1 VAL 106 1.169 -6.534 -17.641 796 HG12 VAL 106 2HG1 VAL 106 0.955 -6.924 -15.933 797 HG13 VAL 106 3HG1 VAL 106 1.996 -7.927 -16.945 798 HG21 VAL 106 3HG2 VAL 106 -2.132 -8.162 -16.612 799 HG22 VAL 106 1HG2 VAL 106 -1.043 -9.047 -15.543 800 HG23 VAL 106 2HG2 VAL 106 -1.007 -7.284 -15.575 801 H GLN 107 H GLN 107 0.658 -9.887 -18.973 802 HA GLN 107 HA GLN 107 2.606 -8.894 -20.763 803 HB2 GLN 107 2HB GLN 107 1.761 -11.749 -20.239 804 HB3 GLN 107 3HB GLN 107 3.229 -11.258 -21.074 805 HG2 GLN 107 2HG GLN 107 4.316 -10.938 -19.169 806 HG3 GLN 107 3HG GLN 107 2.995 -9.991 -18.486 807 HE21 GLN 107 1HE2 GLN 107 0.972 -11.611 -18.181 808 HE22 GLN 107 2HE2 GLN 107 1.359 -12.973 -17.191 809 H SER 108 H SER 108 -0.479 -10.507 -21.226 810 HA SER 108 HA SER 108 -0.118 -10.280 -24.140 811 HB2 SER 108 2HB SER 108 -0.494 -12.562 -23.658 812 HB3 SER 108 3HB SER 108 -1.740 -12.191 -22.467 813 HG SER 108 HG SER 108 -2.023 -11.548 -25.207 Start of MODEL 15 1 H1 SER 1 H SER 1 -1.764 -1.363 -2.742 2 HA SER 1 HA SER 1 0.550 -0.177 -3.802 3 HB2 SER 1 2HB SER 1 0.215 1.194 -1.666 4 HB3 SER 1 3HB SER 1 0.636 -0.276 -0.788 5 HG SER 1 HG SER 1 2.448 1.100 -1.196 6 H LEU 2 H LEU 2 1.911 -1.773 -4.305 7 HA LEU 2 HA LEU 2 1.578 -4.349 -2.924 8 HB2 LEU 2 2HB LEU 2 2.937 -4.085 -5.565 9 HB3 LEU 2 3HB LEU 2 2.060 -5.456 -4.890 10 HG LEU 2 HG LEU 2 0.667 -4.749 -6.593 11 HD11 LEU 2 1HD1 LEU 2 -0.250 -4.559 -4.073 12 HD12 LEU 2 2HD1 LEU 2 -1.257 -4.318 -5.500 13 HD13 LEU 2 3HD1 LEU 2 -0.591 -2.926 -4.647 14 HD21 LEU 2 3HD2 LEU 2 0.209 -2.013 -6.329 15 HD22 LEU 2 1HD2 LEU 2 1.141 -2.820 -7.590 16 HD23 LEU 2 2HD2 LEU 2 1.954 -2.205 -6.151 17 H THR 3 H THR 3 4.102 -2.487 -4.625 18 HA THR 3 HA THR 3 6.356 -2.343 -4.307 19 HB THR 3 HB THR 3 6.685 -2.727 -1.543 20 HG1 THR 3 HG1 THR 3 4.873 -1.121 -0.991 21 HG21 THR 3 3HG2 THR 3 6.960 -0.683 -3.500 22 HG22 THR 3 1HG2 THR 3 7.710 -0.784 -1.908 23 HG23 THR 3 2HG2 THR 3 6.147 0.010 -2.097 24 H ASP 4 H ASP 4 5.083 -5.055 -4.574 25 HA ASP 4 HA ASP 4 7.334 -6.613 -3.485 26 HB2 ASP 4 2HB ASP 4 4.416 -7.134 -3.398 27 HB3 ASP 4 3HB ASP 4 5.447 -8.518 -3.747 28 H ILE 5 H ILE 5 5.857 -5.479 -6.219 29 HA ILE 5 HA ILE 5 7.087 -7.596 -7.852 30 HB ILE 5 HB ILE 5 4.510 -6.178 -8.532 31 HG12 ILE 5 2HG1 ILE 5 3.860 -8.803 -8.357 32 HG13 ILE 5 3HG1 ILE 5 5.096 -8.704 -7.108 33 HG21 ILE 5 1HG2 ILE 5 6.065 -6.908 -10.403 34 HG22 ILE 5 2HG2 ILE 5 5.714 -8.563 -9.906 35 HG23 ILE 5 3HG2 ILE 5 4.410 -7.515 -10.466 36 HD11 ILE 5 3HD1 ILE 5 3.230 -8.246 -5.888 37 HD12 ILE 5 1HD1 ILE 5 3.700 -6.612 -6.356 38 HD13 ILE 5 2HD1 ILE 5 2.412 -7.444 -7.229 39 H LEU 6 H LEU 6 5.569 -4.393 -8.285 40 HA LEU 6 HA LEU 6 7.730 -3.678 -10.125 41 HB2 LEU 6 2HB LEU 6 5.029 -2.485 -9.565 42 HB3 LEU 6 3HB LEU 6 6.238 -1.666 -10.552 43 HG LEU 6 HG LEU 6 5.269 -4.427 -11.229 44 HD11 LEU 6 1HD1 LEU 6 3.304 -3.692 -11.949 45 HD12 LEU 6 2HD1 LEU 6 4.063 -2.369 -12.833 46 HD13 LEU 6 3HD1 LEU 6 3.633 -2.162 -11.136 47 HD21 LEU 6 3HD2 LEU 6 7.174 -2.607 -12.305 48 HD22 LEU 6 1HD2 LEU 6 5.856 -2.791 -13.463 49 HD23 LEU 6 2HD2 LEU 6 6.726 -4.212 -12.886 50 H SER 7 H SER 7 8.752 -1.584 -9.963 51 HA SER 7 HA SER 7 9.469 -0.963 -7.249 52 HB2 SER 7 2HB SER 7 10.640 -0.623 -9.819 53 HB3 SER 7 3HB SER 7 10.511 0.972 -9.079 54 HG SER 7 HG SER 7 11.637 -1.303 -7.810 55 HA PRO 8 HA PRO 8 6.885 2.490 -6.450 56 HB2 PRO 8 2HB PRO 8 8.563 4.183 -5.149 57 HB3 PRO 8 3HB PRO 8 7.948 2.693 -4.423 58 HG2 PRO 8 2HG PRO 8 10.597 3.217 -5.716 59 HG3 PRO 8 3HG PRO 8 10.236 2.326 -4.226 60 HD2 PRO 8 2HD PRO 8 10.733 1.085 -6.581 61 HD3 PRO 8 3HD PRO 8 9.625 0.418 -5.365 62 H SER 9 H SER 9 10.105 3.609 -7.514 63 HA SER 9 HA SER 9 9.363 6.099 -8.471 64 HB2 SER 9 2HB SER 9 11.390 5.966 -9.902 65 HB3 SER 9 3HB SER 9 11.700 5.455 -8.243 66 HG SER 9 HG SER 9 11.896 4.041 -10.562 67 H ASP 10 H ASP 10 9.514 3.018 -10.238 68 HA ASP 10 HA ASP 10 8.726 3.979 -12.739 69 HB2 ASP 10 2HB ASP 10 8.305 1.268 -11.470 70 HB3 ASP 10 3HB ASP 10 7.988 1.619 -13.166 71 H ILE 11 H ILE 11 6.837 3.068 -9.926 72 HA ILE 11 HA ILE 11 4.310 3.147 -11.266 73 HB ILE 11 HB ILE 11 5.068 3.137 -8.351 74 HG12 ILE 11 2HG1 ILE 11 3.443 1.052 -9.754 75 HG13 ILE 11 3HG1 ILE 11 5.184 1.090 -10.007 76 HG21 ILE 11 1HG2 ILE 11 3.053 4.395 -8.429 77 HG22 ILE 11 2HG2 ILE 11 2.331 3.284 -9.592 78 HG23 ILE 11 3HG2 ILE 11 2.620 2.758 -7.934 79 HD11 ILE 11 3HD1 ILE 11 3.694 0.656 -7.440 80 HD12 ILE 11 1HD1 ILE 11 4.794 -0.445 -8.270 81 HD13 ILE 11 2HD1 ILE 11 5.421 1.013 -7.499 82 H ALA 12 H ALA 12 5.916 5.328 -8.947 83 HA ALA 12 HA ALA 12 3.998 7.341 -8.919 84 HB1 ALA 12 1HB ALA 12 6.542 8.568 -8.714 85 HB2 ALA 12 2HB ALA 12 5.423 8.139 -7.420 86 HB3 ALA 12 3HB ALA 12 6.646 6.983 -7.948 87 H ALA 13 H ALA 13 6.270 6.483 -11.367 88 HA ALA 13 HA ALA 13 6.175 9.029 -12.726 89 HB1 ALA 13 1HB ALA 13 7.633 6.511 -13.020 90 HB2 ALA 13 2HB ALA 13 7.194 7.271 -14.550 91 HB3 ALA 13 3HB ALA 13 8.141 8.166 -13.362 92 H ALA 14 H ALA 14 4.399 6.062 -12.749 93 HA ALA 14 HA ALA 14 3.166 6.601 -15.326 94 HB1 ALA 14 1HB ALA 14 2.149 4.456 -13.544 95 HB2 ALA 14 2HB ALA 14 2.395 4.458 -15.291 96 HB3 ALA 14 3HB ALA 14 3.774 4.279 -14.206 97 H LEU 15 H LEU 15 2.540 7.101 -11.965 98 HA LEU 15 HA LEU 15 -0.285 7.361 -12.118 99 HB2 LEU 15 2HB LEU 15 1.794 8.221 -10.140 100 HB3 LEU 15 3HB LEU 15 0.112 8.717 -9.956 101 HG LEU 15 HG LEU 15 1.150 5.883 -9.966 102 HD11 LEU 15 1HD1 LEU 15 1.423 6.130 -7.783 103 HD12 LEU 15 2HD1 LEU 15 -0.268 6.598 -7.615 104 HD13 LEU 15 3HD1 LEU 15 0.961 7.827 -7.911 105 HD21 LEU 15 3HD2 LEU 15 -1.187 5.320 -9.325 106 HD22 LEU 15 1HD2 LEU 15 -1.025 5.918 -10.976 107 HD23 LEU 15 2HD2 LEU 15 -1.647 6.979 -9.712 108 H ARG 16 H ARG 16 2.283 9.824 -11.837 109 HA ARG 16 HA ARG 16 0.550 12.013 -12.297 110 HB2 ARG 16 2HB ARG 16 3.516 11.994 -12.833 111 HB3 ARG 16 3HB ARG 16 2.508 13.360 -12.375 112 HG2 ARG 16 2HG ARG 16 2.085 12.021 -10.207 113 HG3 ARG 16 3HG ARG 16 3.520 11.113 -10.687 114 HD2 ARG 16 2HD ARG 16 4.039 13.905 -10.979 115 HD3 ARG 16 3HD ARG 16 3.383 13.609 -9.369 116 HE ARG 16 HE ARG 16 5.317 12.513 -8.816 117 HH11 ARG 16 1HH1 ARG 16 5.164 12.903 -12.272 118 HH12 ARG 16 2HH1 ARG 16 6.784 12.349 -12.537 119 HH21 ARG 16 1HH2 ARG 16 7.451 11.782 -9.152 120 HH22 ARG 16 2HH2 ARG 16 8.084 11.711 -10.762 121 H ASP 17 H ASP 17 2.143 9.789 -14.394 122 HA ASP 17 HA ASP 17 2.373 11.283 -16.737 123 HB2 ASP 17 2HB ASP 17 3.395 9.197 -16.846 124 HB3 ASP 17 3HB ASP 17 2.000 8.365 -16.165 125 H CYS 18 H CYS 18 -0.339 9.244 -15.653 126 HA CYS 18 HA CYS 18 -2.120 10.883 -17.318 127 HB2 CYS 18 2HB CYS 18 -1.890 7.889 -17.251 128 HB3 CYS 18 3HB CYS 18 -3.422 8.653 -17.655 129 HG CYS 18 HG CYS 18 -2.787 9.529 -20.048 130 H GLN 19 H GLN 19 -1.705 11.298 -14.619 131 HA GLN 19 HA GLN 19 -3.396 9.933 -12.870 132 HB2 GLN 19 2HB GLN 19 -3.376 12.154 -11.585 133 HB3 GLN 19 3HB GLN 19 -1.831 11.364 -11.872 134 HG2 GLN 19 2HG GLN 19 -1.231 12.899 -13.540 135 HG3 GLN 19 3HG GLN 19 -2.878 13.509 -13.685 136 HE21 GLN 19 1HE2 GLN 19 -0.553 13.020 -11.044 137 HE22 GLN 19 2HE2 GLN 19 -0.719 14.605 -10.377 138 H ALA 20 H ALA 20 -4.039 12.620 -15.054 139 HA ALA 20 HA ALA 20 -6.528 13.433 -14.179 140 HB1 ALA 20 1HB ALA 20 -6.881 14.352 -16.333 141 HB2 ALA 20 2HB ALA 20 -5.146 14.440 -16.029 142 HB3 ALA 20 3HB ALA 20 -5.792 13.185 -17.086 143 HA PRO 21 HA PRO 21 -9.309 10.101 -14.864 144 HB2 PRO 21 2HB PRO 21 -11.600 11.470 -15.358 145 HB3 PRO 21 3HB PRO 21 -10.878 11.357 -13.749 146 HG2 PRO 21 2HG PRO 21 -10.710 13.579 -15.749 147 HG3 PRO 21 3HG PRO 21 -10.959 13.668 -13.995 148 HD2 PRO 21 2HD PRO 21 -8.551 14.118 -15.150 149 HD3 PRO 21 3HD PRO 21 -8.716 13.396 -13.537 150 H ASP 22 H ASP 22 -10.194 8.885 -16.495 151 HA ASP 22 HA ASP 22 -10.596 8.151 -18.611 152 HB2 ASP 22 2HB ASP 22 -12.252 10.068 -18.491 153 HB3 ASP 22 3HB ASP 22 -11.060 11.042 -19.347 154 H SER 23 H SER 23 -7.919 9.389 -17.748 155 HA SER 23 HA SER 23 -6.797 9.764 -20.446 156 HB2 SER 23 2HB SER 23 -6.431 11.231 -18.008 157 HB3 SER 23 3HB SER 23 -4.891 10.518 -18.487 158 HG SER 23 HG SER 23 -5.123 11.507 -20.510 159 H PHE 24 H PHE 24 -6.928 7.696 -17.763 160 HA PHE 24 HA PHE 24 -4.370 6.422 -18.342 161 HB2 PHE 24 2HB PHE 24 -5.523 6.837 -15.982 162 HB3 PHE 24 3HB PHE 24 -6.282 5.292 -16.352 163 HD1 PHE 24 HD2 PHE 24 -3.031 6.983 -15.888 164 HD2 PHE 24 HD1 PHE 24 -5.098 3.271 -16.144 165 HE1 PHE 24 HE2 PHE 24 -1.016 5.811 -15.101 166 HE2 PHE 24 HE1 PHE 24 -3.086 2.093 -15.356 167 HZ PHE 24 HZ PHE 24 -1.042 3.362 -14.835 168 H SER 25 H SER 25 -4.363 3.987 -18.453 169 HA SER 25 HA SER 25 -6.734 2.754 -19.561 170 HB2 SER 25 2HB SER 25 -4.709 3.870 -21.280 171 HB3 SER 25 3HB SER 25 -4.754 2.117 -21.469 172 HG SER 25 HG SER 25 -6.779 4.013 -21.934 173 HA PRO 26 HA PRO 26 -4.997 -0.876 -17.813 174 HB2 PRO 26 2HB PRO 26 -5.956 -2.798 -19.474 175 HB3 PRO 26 3HB PRO 26 -6.975 -1.931 -18.318 176 HG2 PRO 26 2HG PRO 26 -6.624 -1.467 -21.255 177 HG3 PRO 26 3HG PRO 26 -8.113 -1.465 -20.292 178 HD2 PRO 26 2HD PRO 26 -6.863 0.816 -21.047 179 HD3 PRO 26 3HD PRO 26 -7.761 0.679 -19.521 180 H LYS 27 H LYS 27 -4.249 0.016 -21.053 181 HA LYS 27 HA LYS 27 -1.950 -1.828 -21.044 182 HB2 LYS 27 2HB LYS 27 -2.039 -1.951 -23.415 183 HB3 LYS 27 3HB LYS 27 -3.685 -2.196 -22.846 184 HG2 LYS 27 2HG LYS 27 -3.543 0.530 -23.222 185 HG3 LYS 27 3HG LYS 27 -2.594 -0.124 -24.559 186 HD2 LYS 27 2HD LYS 27 -4.821 0.011 -25.342 187 HD3 LYS 27 3HD LYS 27 -4.532 -1.694 -24.992 188 HE2 LYS 27 2HE LYS 27 -5.862 -1.659 -23.093 189 HE3 LYS 27 3HE LYS 27 -5.722 0.089 -22.906 190 HZ1 LYS 27 3HZ LYS 27 -7.455 0.444 -24.250 191 HZ2 LYS 27 1HZ LYS 27 -7.845 -1.177 -23.964 192 HZ3 LYS 27 2HZ LYS 27 -6.991 -0.746 -25.359 193 H LYS 28 H LYS 28 -2.105 0.820 -19.836 194 HA LYS 28 HA LYS 28 0.086 2.072 -21.337 195 HB2 LYS 28 2HB LYS 28 -2.370 3.441 -20.245 196 HB3 LYS 28 3HB LYS 28 -0.893 4.315 -20.632 197 HG2 LYS 28 2HG LYS 28 -2.321 2.598 -22.639 198 HG3 LYS 28 3HG LYS 28 -2.707 4.303 -22.394 199 HD2 LYS 28 2HD LYS 28 -0.272 4.799 -22.805 200 HD3 LYS 28 3HD LYS 28 -0.089 3.114 -23.296 201 HE2 LYS 28 2HE LYS 28 -1.924 5.151 -24.555 202 HE3 LYS 28 3HE LYS 28 -0.410 4.555 -25.233 203 HZ1 LYS 28 3HZ LYS 28 -2.938 3.070 -24.838 204 HZ2 LYS 28 1HZ LYS 28 -1.469 2.283 -25.126 205 HZ3 LYS 28 2HZ LYS 28 -2.100 3.344 -26.282 206 H PHE 29 H PHE 29 -0.368 0.414 -18.789 207 HA PHE 29 HA PHE 29 1.039 2.237 -16.950 208 HB2 PHE 29 2HB PHE 29 -1.164 1.568 -16.096 209 HB3 PHE 29 3HB PHE 29 -0.720 -0.128 -16.265 210 HD1 PHE 29 HD1 PHE 29 1.380 2.642 -14.981 211 HD2 PHE 29 HD2 PHE 29 -0.813 -0.888 -14.061 212 HE1 PHE 29 HE1 PHE 29 2.309 2.662 -12.702 213 HE2 PHE 29 HE2 PHE 29 0.111 -0.873 -11.781 214 HZ PHE 29 HZ PHE 29 1.674 0.904 -11.099 215 H PHE 30 H PHE 30 1.097 -0.757 -18.641 216 HA PHE 30 HA PHE 30 3.169 -1.971 -17.062 217 HB2 PHE 30 2HB PHE 30 3.096 -3.763 -18.607 218 HB3 PHE 30 3HB PHE 30 1.434 -3.200 -18.473 219 HD1 PHE 30 HD2 PHE 30 0.394 -1.949 -20.300 220 HD2 PHE 30 HD1 PHE 30 4.325 -3.546 -20.644 221 HE1 PHE 30 HE2 PHE 30 0.295 -1.658 -22.741 222 HE2 PHE 30 HE1 PHE 30 4.233 -3.257 -23.086 223 HZ PHE 30 HZ PHE 30 2.216 -2.313 -24.138 224 H GLN 31 H GLN 31 3.071 0.409 -19.469 225 HA GLN 31 HA GLN 31 5.716 -0.119 -20.522 226 HB2 GLN 31 2HB GLN 31 4.291 2.463 -20.984 227 HB3 GLN 31 3HB GLN 31 5.295 1.528 -22.084 228 HG2 GLN 31 2HG GLN 31 3.477 -0.157 -22.220 229 HG3 GLN 31 3HG GLN 31 2.472 0.914 -21.245 230 HE21 GLN 31 1HE2 GLN 31 2.856 3.338 -22.227 231 HE22 GLN 31 2HE2 GLN 31 2.418 3.428 -23.896 232 H ILE 32 H ILE 32 4.187 2.032 -18.212 233 HA ILE 32 HA ILE 32 6.688 3.464 -17.760 234 HB ILE 32 HB ILE 32 3.992 3.847 -16.453 235 HG12 ILE 32 2HG1 ILE 32 4.654 6.067 -18.033 236 HG13 ILE 32 3HG1 ILE 32 5.048 4.665 -19.022 237 HG21 ILE 32 1HG2 ILE 32 5.581 4.706 -14.963 238 HG22 ILE 32 2HG2 ILE 32 6.587 5.341 -16.264 239 HG23 ILE 32 3HG2 ILE 32 5.044 6.107 -15.889 240 HD11 ILE 32 3HD1 ILE 32 2.427 4.704 -17.636 241 HD12 ILE 32 1HD1 ILE 32 2.652 5.748 -19.039 242 HD13 ILE 32 2HD1 ILE 32 2.879 4.005 -19.191 243 H SER 33 H SER 33 4.661 1.044 -16.285 244 HA SER 33 HA SER 33 6.218 1.097 -13.815 245 HB2 SER 33 2HB SER 33 3.594 0.743 -14.108 246 HB3 SER 33 3HB SER 33 4.089 -0.940 -14.285 247 HG SER 33 HG SER 33 4.502 0.791 -12.085 248 H GLY 34 H GLY 34 5.045 -1.536 -15.923 249 HA2 GLY 34 2HA GLY 34 6.798 -2.878 -17.077 250 HA3 GLY 34 3HA GLY 34 7.678 -2.831 -15.556 251 H MET 35 H MET 35 4.239 -3.440 -16.218 252 HA MET 35 HA MET 35 4.191 -5.643 -14.400 253 HB2 MET 35 2HB MET 35 2.069 -4.996 -16.438 254 HB3 MET 35 3HB MET 35 1.874 -5.804 -14.888 255 HG2 MET 35 2HG MET 35 2.389 -3.731 -13.725 256 HG3 MET 35 3HG MET 35 2.629 -2.916 -15.269 257 HE1 MET 35 3HE MET 35 -1.449 -4.653 -13.985 258 HE2 MET 35 1HE MET 35 -0.071 -5.628 -14.494 259 HE3 MET 35 2HE MET 35 -0.013 -4.751 -12.965 260 H SER 36 H SER 36 3.885 -5.368 -17.935 261 HA SER 36 HA SER 36 3.559 -8.043 -18.553 262 HB2 SER 36 2HB SER 36 4.353 -7.501 -20.776 263 HB3 SER 36 3HB SER 36 3.398 -6.147 -20.173 264 HG SER 36 HG SER 36 6.054 -6.266 -20.827 265 H LYS 37 H LYS 37 6.490 -6.275 -17.780 266 HA LYS 37 HA LYS 37 8.365 -8.210 -18.577 267 HB2 LYS 37 2HB LYS 37 8.720 -6.344 -16.236 268 HB3 LYS 37 3HB LYS 37 9.960 -6.995 -17.299 269 HG2 LYS 37 2HG LYS 37 7.880 -4.928 -17.968 270 HG3 LYS 37 3HG LYS 37 9.628 -4.706 -17.860 271 HD2 LYS 37 2HD LYS 37 8.173 -6.413 -19.880 272 HD3 LYS 37 3HD LYS 37 8.906 -4.837 -20.187 273 HE2 LYS 37 2HE LYS 37 10.919 -6.377 -19.011 274 HE3 LYS 37 3HE LYS 37 10.118 -7.454 -20.155 275 HZ1 LYS 37 3HZ LYS 37 10.395 -5.668 -21.843 276 HZ2 LYS 37 1HZ LYS 37 11.853 -6.331 -21.296 277 HZ3 LYS 37 2HZ LYS 37 11.348 -4.818 -20.734 278 H LYS 38 H LYS 38 6.168 -8.141 -15.958 279 HA LYS 38 HA LYS 38 7.671 -10.071 -14.377 280 HB2 LYS 38 2HB LYS 38 4.885 -9.055 -13.832 281 HB3 LYS 38 3HB LYS 38 6.011 -9.782 -12.693 282 HG2 LYS 38 2HG LYS 38 6.482 -7.147 -14.068 283 HG3 LYS 38 3HG LYS 38 5.749 -7.316 -12.471 284 HD2 LYS 38 2HD LYS 38 7.759 -7.474 -11.534 285 HD3 LYS 38 3HD LYS 38 8.157 -8.852 -12.562 286 HE2 LYS 38 2HE LYS 38 8.559 -6.984 -14.362 287 HE3 LYS 38 3HE LYS 38 8.753 -5.954 -12.944 288 HZ1 LYS 38 3HZ LYS 38 10.444 -8.135 -13.902 289 HZ2 LYS 38 1HZ LYS 38 10.314 -7.933 -12.227 290 HZ3 LYS 38 2HZ LYS 38 10.878 -6.663 -13.191 291 H SER 39 H SER 39 6.897 -12.154 -13.868 292 HA SER 39 HA SER 39 5.609 -13.478 -16.049 293 HB2 SER 39 2HB SER 39 6.367 -14.542 -13.316 294 HB3 SER 39 3HB SER 39 5.913 -15.519 -14.713 295 HG SER 39 HG SER 39 8.077 -15.480 -14.809 296 H SER 40 H SER 40 3.730 -14.907 -15.793 297 HA SER 40 HA SER 40 1.455 -13.555 -14.975 298 HB2 SER 40 2HB SER 40 0.878 -16.327 -14.803 299 HB3 SER 40 3HB SER 40 0.546 -15.233 -16.145 300 HG SER 40 HG SER 40 2.736 -16.952 -15.747 301 H SER 41 H SER 41 3.645 -15.502 -13.135 302 HA SER 41 HA SER 41 1.879 -16.003 -10.940 303 HB2 SER 41 2HB SER 41 4.901 -16.125 -11.081 304 HB3 SER 41 3HB SER 41 3.913 -16.760 -9.766 305 HG SER 41 HG SER 41 4.556 -17.924 -12.085 306 H GLN 42 H GLN 42 4.280 -13.555 -11.723 307 HA GLN 42 HA GLN 42 4.232 -12.314 -9.148 308 HB2 GLN 42 2HB GLN 42 5.408 -11.670 -11.811 309 HB3 GLN 42 3HB GLN 42 5.241 -10.367 -10.642 310 HG2 GLN 42 2HG GLN 42 6.459 -11.890 -9.011 311 HG3 GLN 42 3HG GLN 42 6.859 -12.880 -10.414 312 HE21 GLN 42 1HE2 GLN 42 7.117 -9.628 -9.081 313 HE22 GLN 42 2HE2 GLN 42 8.578 -9.211 -9.904 314 H LEU 43 H LEU 43 2.484 -11.897 -12.154 315 HA LEU 43 HA LEU 43 1.270 -9.412 -11.401 316 HB2 LEU 43 2HB LEU 43 0.334 -11.350 -13.504 317 HB3 LEU 43 3HB LEU 43 -0.030 -9.629 -13.395 318 HG LEU 43 HG LEU 43 2.823 -10.388 -13.670 319 HD11 LEU 43 1HD1 LEU 43 0.733 -10.996 -15.686 320 HD12 LEU 43 2HD1 LEU 43 2.262 -11.809 -15.355 321 HD13 LEU 43 3HD1 LEU 43 2.248 -10.291 -16.253 322 HD21 LEU 43 3HD2 LEU 43 1.012 -8.146 -14.367 323 HD22 LEU 43 1HD2 LEU 43 2.410 -8.420 -15.407 324 HD23 LEU 43 2HD2 LEU 43 2.638 -8.122 -13.684 325 H LYS 44 H LYS 44 0.739 -12.647 -10.578 326 HA LYS 44 HA LYS 44 -2.086 -12.599 -10.244 327 HB2 LYS 44 2HB LYS 44 0.140 -14.404 -9.484 328 HB3 LYS 44 3HB LYS 44 -1.322 -14.515 -8.511 329 HG2 LYS 44 2HG LYS 44 -2.337 -14.534 -11.040 330 HG3 LYS 44 3HG LYS 44 -0.811 -15.396 -11.250 331 HD2 LYS 44 2HD LYS 44 -2.963 -16.053 -9.238 332 HD3 LYS 44 3HD LYS 44 -2.620 -16.944 -10.722 333 HE2 LYS 44 2HE LYS 44 -0.182 -16.742 -9.339 334 HE3 LYS 44 3HE LYS 44 -1.396 -17.171 -8.135 335 HZ1 LYS 44 3HZ LYS 44 -0.670 -19.200 -8.963 336 HZ2 LYS 44 1HZ LYS 44 -0.609 -18.654 -10.564 337 HZ3 LYS 44 2HZ LYS 44 -2.103 -18.932 -9.821 338 H GLU 45 H GLU 45 0.650 -12.008 -8.076 339 HA GLU 45 HA GLU 45 -0.609 -11.808 -5.650 340 HB2 GLU 45 2HB GLU 45 1.624 -10.098 -6.752 341 HB3 GLU 45 3HB GLU 45 1.141 -10.110 -5.062 342 HG2 GLU 45 2HG GLU 45 2.090 -12.533 -6.570 343 HG3 GLU 45 3HG GLU 45 3.120 -11.513 -5.567 344 H ILE 46 H ILE 46 -0.339 -9.290 -8.135 345 HA ILE 46 HA ILE 46 -1.469 -7.152 -6.839 346 HB ILE 46 HB ILE 46 -1.883 -7.963 -9.718 347 HG12 ILE 46 2HG1 ILE 46 -0.089 -5.733 -9.042 348 HG13 ILE 46 3HG1 ILE 46 0.454 -7.300 -8.452 349 HG21 ILE 46 1HG2 ILE 46 -3.280 -6.251 -9.909 350 HG22 ILE 46 2HG2 ILE 46 -3.071 -5.854 -8.205 351 HG23 ILE 46 3HG2 ILE 46 -1.985 -5.163 -9.410 352 HD11 ILE 46 3HD1 ILE 46 -0.316 -7.796 -11.059 353 HD12 ILE 46 1HD1 ILE 46 0.472 -6.221 -11.131 354 HD13 ILE 46 2HD1 ILE 46 1.332 -7.608 -10.462 355 H PHE 47 H PHE 47 -3.157 -9.788 -8.510 356 HA PHE 47 HA PHE 47 -5.762 -8.862 -8.265 357 HB2 PHE 47 2HB PHE 47 -5.602 -10.737 -9.607 358 HB3 PHE 47 3HB PHE 47 -4.533 -11.576 -8.488 359 HD1 PHE 47 HD1 PHE 47 -5.440 -12.737 -6.537 360 HD2 PHE 47 HD2 PHE 47 -7.979 -10.885 -9.407 361 HE1 PHE 47 HE1 PHE 47 -7.355 -14.006 -5.657 362 HE2 PHE 47 HE2 PHE 47 -9.898 -12.150 -8.532 363 HZ PHE 47 HZ PHE 47 -9.588 -13.713 -6.654 364 H ARG 48 H ARG 48 -3.763 -10.612 -5.947 365 HA ARG 48 HA ARG 48 -5.819 -11.027 -4.032 366 HB2 ARG 48 2HB ARG 48 -3.112 -11.751 -4.328 367 HB3 ARG 48 3HB ARG 48 -3.214 -10.854 -2.818 368 HG2 ARG 48 2HG ARG 48 -4.984 -13.185 -3.516 369 HG3 ARG 48 3HG ARG 48 -3.495 -13.311 -2.578 370 HD2 ARG 48 2HD ARG 48 -5.492 -11.308 -1.695 371 HD3 ARG 48 3HD ARG 48 -5.894 -13.007 -1.449 372 HE ARG 48 HE ARG 48 -3.411 -12.860 -0.439 373 HH11 ARG 48 1HH1 ARG 48 -6.249 -10.901 0.043 374 HH12 ARG 48 2HH1 ARG 48 -5.836 -10.473 1.670 375 HH21 ARG 48 1HH2 ARG 48 -2.857 -12.303 1.702 376 HH22 ARG 48 2HH2 ARG 48 -3.906 -11.270 2.613 377 H ILE 49 H ILE 49 -4.255 -8.245 -5.032 378 HA ILE 49 HA ILE 49 -4.561 -6.912 -2.436 379 HB ILE 49 HB ILE 49 -3.310 -5.766 -4.930 380 HG12 ILE 49 2HG1 ILE 49 -2.094 -7.787 -4.234 381 HG13 ILE 49 3HG1 ILE 49 -1.138 -6.337 -3.947 382 HG21 ILE 49 1HG2 ILE 49 -2.288 -4.752 -2.460 383 HG22 ILE 49 2HG2 ILE 49 -3.113 -3.893 -3.759 384 HG23 ILE 49 3HG2 ILE 49 -4.047 -4.634 -2.461 385 HD11 ILE 49 3HD1 ILE 49 -2.749 -7.743 -1.833 386 HD12 ILE 49 1HD1 ILE 49 -1.031 -8.013 -2.125 387 HD13 ILE 49 2HD1 ILE 49 -1.598 -6.426 -1.605 388 H LEU 50 H LEU 50 -6.022 -7.225 -5.514 389 HA LEU 50 HA LEU 50 -7.473 -4.712 -5.325 390 HB2 LEU 50 2HB LEU 50 -7.099 -6.816 -7.371 391 HB3 LEU 50 3HB LEU 50 -8.630 -5.944 -7.401 392 HG LEU 50 HG LEU 50 -6.801 -3.908 -7.256 393 HD11 LEU 50 1HD1 LEU 50 -5.672 -5.922 -9.185 394 HD12 LEU 50 2HD1 LEU 50 -5.003 -5.631 -7.579 395 HD13 LEU 50 3HD1 LEU 50 -5.027 -4.332 -8.772 396 HD21 LEU 50 3HD2 LEU 50 -7.212 -3.860 -9.818 397 HD22 LEU 50 1HD2 LEU 50 -8.576 -3.667 -8.717 398 HD23 LEU 50 2HD2 LEU 50 -8.284 -5.223 -9.495 399 H ASP 51 H ASP 51 -7.917 -8.080 -4.641 400 HA ASP 51 HA ASP 51 -10.727 -8.191 -4.639 401 HB2 ASP 51 2HB ASP 51 -8.743 -10.015 -4.265 402 HB3 ASP 51 3HB ASP 51 -9.340 -9.834 -2.618 403 H ASN 52 H ASN 52 -12.148 -7.210 -3.372 404 HA ASN 52 HA ASN 52 -11.232 -6.052 -0.842 405 HB2 ASN 52 2HB ASN 52 -12.781 -4.400 -1.121 406 HB3 ASN 52 3HB ASN 52 -12.624 -4.871 -2.811 407 HD21 ASN 52 1HD2 ASN 52 -14.062 -7.029 -3.137 408 HD22 ASN 52 2HD2 ASN 52 -15.715 -6.788 -2.693 409 H ASP 53 H ASP 53 -13.056 -8.644 -2.069 410 HA ASP 53 HA ASP 53 -14.088 -9.204 0.629 411 HB2 ASP 53 2HB ASP 53 -16.106 -10.195 -0.369 412 HB3 ASP 53 3HB ASP 53 -15.960 -8.487 -0.774 413 H GLN 54 H GLN 54 -11.953 -10.114 -1.613 414 HA GLN 54 HA GLN 54 -10.871 -12.038 -2.179 415 HB2 GLN 54 2HB GLN 54 -11.834 -13.250 0.388 416 HB3 GLN 54 3HB GLN 54 -10.264 -13.404 -0.391 417 HG2 GLN 54 2HG GLN 54 -11.252 -10.832 0.803 418 HG3 GLN 54 3HG GLN 54 -10.332 -12.029 1.713 419 HE21 GLN 54 1HE2 GLN 54 -10.100 -9.260 -0.031 420 HE22 GLN 54 2HE2 GLN 54 -8.436 -9.341 -0.488 421 H SER 55 H SER 55 -13.829 -11.796 -2.725 422 HA SER 55 HA SER 55 -15.079 -14.291 -2.475 423 HB2 SER 55 2HB SER 55 -16.394 -13.440 -4.554 424 HB3 SER 55 3HB SER 55 -16.521 -12.541 -3.042 425 HG SER 55 HG SER 55 -14.567 -11.876 -4.961 426 H GLY 56 H GLY 56 -12.510 -13.281 -4.483 427 HA2 GLY 56 2HA GLY 56 -11.249 -15.133 -5.515 428 HA3 GLY 56 3HA GLY 56 -12.794 -15.754 -6.078 429 H PHE 57 H PHE 57 -13.465 -12.755 -6.551 430 HA PHE 57 HA PHE 57 -11.829 -12.266 -8.918 431 HB2 PHE 57 2HB PHE 57 -14.843 -12.279 -9.105 432 HB3 PHE 57 3HB PHE 57 -13.684 -12.103 -10.419 433 HD1 PHE 57 HD1 PHE 57 -15.139 -14.465 -7.999 434 HD2 PHE 57 HD2 PHE 57 -12.692 -13.995 -11.450 435 HE1 PHE 57 HE1 PHE 57 -15.202 -16.896 -8.372 436 HE2 PHE 57 HE2 PHE 57 -12.752 -16.425 -11.829 437 HZ PHE 57 HZ PHE 57 -14.010 -17.879 -10.289 438 H ILE 58 H ILE 58 -11.729 -10.121 -9.542 439 HA ILE 58 HA ILE 58 -12.664 -8.223 -7.537 440 HB ILE 58 HB ILE 58 -10.823 -7.803 -9.895 441 HG12 ILE 58 2HG1 ILE 58 -9.827 -7.607 -7.118 442 HG13 ILE 58 3HG1 ILE 58 -10.263 -9.226 -7.654 443 HG21 ILE 58 1HG2 ILE 58 -11.980 -5.756 -9.264 444 HG22 ILE 58 2HG2 ILE 58 -11.488 -5.982 -7.586 445 HG23 ILE 58 3HG2 ILE 58 -10.274 -5.670 -8.825 446 HD11 ILE 58 3HD1 ILE 58 -7.889 -8.709 -7.993 447 HD12 ILE 58 1HD1 ILE 58 -8.726 -9.066 -9.503 448 HD13 ILE 58 2HD1 ILE 58 -8.347 -7.397 -9.078 449 H GLU 59 H GLU 59 -14.729 -7.632 -7.862 450 HA GLU 59 HA GLU 59 -15.848 -7.314 -10.487 451 HB2 GLU 59 2HB GLU 59 -17.057 -6.373 -7.890 452 HB3 GLU 59 3HB GLU 59 -17.892 -6.774 -9.384 453 HG2 GLU 59 2HG GLU 59 -18.283 -8.743 -8.428 454 HG3 GLU 59 3HG GLU 59 -16.601 -9.109 -8.810 455 H GLU 60 H GLU 60 -16.968 -5.277 -11.125 456 HA GLU 60 HA GLU 60 -15.192 -3.176 -11.418 457 HB2 GLU 60 2HB GLU 60 -18.188 -3.322 -11.641 458 HB3 GLU 60 3HB GLU 60 -17.325 -1.817 -11.928 459 HG2 GLU 60 2HG GLU 60 -16.385 -2.558 -13.868 460 HG3 GLU 60 3HG GLU 60 -16.416 -4.248 -13.368 461 H ASP 61 H ASP 61 -17.433 -3.844 -8.837 462 HA ASP 61 HA ASP 61 -17.543 -1.294 -7.660 463 HB2 ASP 61 2HB ASP 61 -18.880 -3.503 -7.158 464 HB3 ASP 61 3HB ASP 61 -17.600 -3.770 -5.978 465 H GLU 62 H GLU 62 -15.066 -3.694 -7.718 466 HA GLU 62 HA GLU 62 -13.557 -2.210 -5.670 467 HB2 GLU 62 2HB GLU 62 -12.137 -4.468 -5.870 468 HB3 GLU 62 3HB GLU 62 -13.506 -4.302 -4.780 469 HG2 GLU 62 2HG GLU 62 -14.936 -5.253 -6.627 470 HG3 GLU 62 3HG GLU 62 -13.434 -5.644 -7.463 471 H LEU 63 H LEU 63 -13.756 -2.952 -8.968 472 HA LEU 63 HA LEU 63 -10.962 -2.762 -9.588 473 HB2 LEU 63 2HB LEU 63 -13.193 -3.651 -10.916 474 HB3 LEU 63 3HB LEU 63 -12.834 -2.135 -11.741 475 HG LEU 63 HG LEU 63 -10.949 -4.471 -11.429 476 HD11 LEU 63 1HD1 LEU 63 -13.043 -3.976 -13.280 477 HD12 LEU 63 2HD1 LEU 63 -11.875 -5.297 -13.262 478 HD13 LEU 63 3HD1 LEU 63 -11.505 -3.804 -14.125 479 HD21 LEU 63 3HD2 LEU 63 -9.741 -2.371 -11.444 480 HD22 LEU 63 1HD2 LEU 63 -10.629 -1.843 -12.874 481 HD23 LEU 63 2HD2 LEU 63 -9.516 -3.208 -12.981 482 H LYS 64 H LYS 64 -13.624 -0.542 -9.279 483 HA LYS 64 HA LYS 64 -12.546 1.634 -10.710 484 HB2 LYS 64 2HB LYS 64 -14.092 2.997 -9.210 485 HB3 LYS 64 3HB LYS 64 -14.845 1.747 -10.192 486 HG2 LYS 64 2HG LYS 64 -15.467 0.527 -8.405 487 HG3 LYS 64 3HG LYS 64 -14.014 0.928 -7.487 488 HD2 LYS 64 2HD LYS 64 -15.982 1.891 -6.431 489 HD3 LYS 64 3HD LYS 64 -14.924 3.165 -7.045 490 HE2 LYS 64 2HE LYS 64 -16.629 3.992 -8.202 491 HE3 LYS 64 3HE LYS 64 -16.709 2.493 -9.126 492 HZ1 LYS 64 3HZ LYS 64 -18.440 1.726 -7.910 493 HZ2 LYS 64 1HZ LYS 64 -18.733 3.379 -7.705 494 HZ3 LYS 64 2HZ LYS 64 -17.954 2.501 -6.487 495 H TYR 65 H TYR 65 -11.549 0.187 -7.834 496 HA TYR 65 HA TYR 65 -10.238 2.634 -6.878 497 HB2 TYR 65 2HB TYR 65 -10.736 -0.031 -5.546 498 HB3 TYR 65 3HB TYR 65 -9.742 1.236 -4.835 499 HD1 TYR 65 HD1 TYR 65 -11.164 3.671 -5.248 500 HD2 TYR 65 HD2 TYR 65 -12.735 -0.193 -4.410 501 HE1 TYR 65 HE1 TYR 65 -13.172 4.706 -4.276 502 HE2 TYR 65 HE2 TYR 65 -14.748 0.831 -3.436 503 HH TYR 65 HH TYR 65 -15.798 2.718 -2.939 504 H PHE 66 H PHE 66 -9.147 1.716 -9.176 505 HA PHE 66 HA PHE 66 -6.900 -0.015 -8.556 506 HB2 PHE 66 2HB PHE 66 -7.894 -0.382 -10.698 507 HB3 PHE 66 3HB PHE 66 -7.822 1.332 -11.096 508 HD1 PHE 66 HD1 PHE 66 -5.630 -1.568 -10.305 509 HD2 PHE 66 HD2 PHE 66 -6.055 2.146 -12.342 510 HE1 PHE 66 HE1 PHE 66 -3.451 -1.918 -11.393 511 HE2 PHE 66 HE2 PHE 66 -3.878 1.800 -13.434 512 HZ PHE 66 HZ PHE 66 -2.573 -0.234 -12.961 513 H LEU 67 H LEU 67 -7.607 3.339 -8.721 514 HA LEU 67 HA LEU 67 -4.778 4.066 -8.898 515 HB2 LEU 67 2HB LEU 67 -6.986 6.053 -8.613 516 HB3 LEU 67 3HB LEU 67 -5.437 6.213 -9.437 517 HG LEU 67 HG LEU 67 -7.912 4.803 -10.411 518 HD11 LEU 67 1HD1 LEU 67 -6.640 6.607 -12.240 519 HD12 LEU 67 2HD1 LEU 67 -6.946 7.418 -10.705 520 HD13 LEU 67 3HD1 LEU 67 -8.274 6.653 -11.577 521 HD21 LEU 67 3HD2 LEU 67 -5.884 3.455 -10.877 522 HD22 LEU 67 1HD2 LEU 67 -5.198 4.842 -11.722 523 HD23 LEU 67 2HD2 LEU 67 -6.663 4.074 -12.334 524 H GLN 68 H GLN 68 -6.900 3.192 -6.556 525 HA GLN 68 HA GLN 68 -5.995 5.123 -4.563 526 HB2 GLN 68 2HB GLN 68 -8.271 3.325 -4.850 527 HB3 GLN 68 3HB GLN 68 -7.541 3.230 -3.253 528 HG2 GLN 68 2HG GLN 68 -8.762 4.998 -2.719 529 HG3 GLN 68 3HG GLN 68 -7.680 5.941 -3.743 530 HE21 GLN 68 1HE2 GLN 68 -8.353 5.326 -6.229 531 HE22 GLN 68 2HE2 GLN 68 -10.004 5.715 -6.556 532 H ARG 69 H ARG 69 -4.645 2.544 -5.899 533 HA ARG 69 HA ARG 69 -3.586 1.470 -3.370 534 HB2 ARG 69 2HB ARG 69 -3.354 0.173 -6.082 535 HB3 ARG 69 3HB ARG 69 -3.076 -0.558 -4.507 536 HG2 ARG 69 2HG ARG 69 -5.210 -1.128 -4.301 537 HG3 ARG 69 3HG ARG 69 -5.759 0.493 -4.730 538 HD2 ARG 69 2HD ARG 69 -6.466 -1.428 -6.254 539 HD3 ARG 69 3HD ARG 69 -5.777 0.003 -7.020 540 HE ARG 69 HE ARG 69 -4.095 -1.314 -7.805 541 HH11 ARG 69 1HH1 ARG 69 -5.510 -2.872 -5.032 542 HH12 ARG 69 2HH1 ARG 69 -4.544 -4.303 -5.180 543 HH21 ARG 69 1HH2 ARG 69 -2.817 -3.192 -8.010 544 HH22 ARG 69 2HH2 ARG 69 -3.012 -4.484 -6.874 545 H PHE 70 H PHE 70 -2.680 2.592 -6.602 546 HA PHE 70 HA PHE 70 0.143 2.503 -5.960 547 HB2 PHE 70 2HB PHE 70 -1.279 3.572 -8.408 548 HB3 PHE 70 3HB PHE 70 0.462 3.367 -8.244 549 HD1 PHE 70 HD1 PHE 70 -2.753 1.548 -8.364 550 HD2 PHE 70 HD2 PHE 70 1.486 1.295 -8.657 551 HE1 PHE 70 HE1 PHE 70 -2.952 -0.757 -9.200 552 HE2 PHE 70 HE2 PHE 70 1.293 -1.011 -9.494 553 HZ PHE 70 HZ PHE 70 -0.928 -2.040 -9.768 554 H GLU 71 H GLU 71 -2.447 4.782 -5.901 555 HA GLU 71 HA GLU 71 -0.533 6.957 -5.362 556 HB2 GLU 71 2HB GLU 71 -2.218 7.097 -7.343 557 HB3 GLU 71 3HB GLU 71 -3.405 7.429 -6.089 558 HG2 GLU 71 2HG GLU 71 -2.480 9.460 -5.554 559 HG3 GLU 71 3HG GLU 71 -0.886 9.014 -6.161 560 H SER 72 H SER 72 -3.204 5.115 -4.168 561 HA SER 72 HA SER 72 -4.417 5.182 -2.233 562 HB2 SER 72 2HB SER 72 -3.080 5.427 -0.207 563 HB3 SER 72 3HB SER 72 -2.175 4.511 -1.412 564 HG SER 72 HG SER 72 -0.851 6.195 -1.728 565 H GLY 73 H GLY 73 -5.734 6.943 -3.105 566 HA2 GLY 73 2HA GLY 73 -6.705 8.787 -1.579 567 HA3 GLY 73 3HA GLY 73 -5.163 9.566 -1.899 568 H ALA 74 H ALA 74 -5.585 8.078 -4.673 569 HA ALA 74 HA ALA 74 -6.484 10.421 -6.034 570 HB1 ALA 74 1HB ALA 74 -6.438 8.683 -8.018 571 HB2 ALA 74 2HB ALA 74 -4.949 9.315 -7.312 572 HB3 ALA 74 3HB ALA 74 -5.541 7.721 -6.843 573 H ARG 75 H ARG 75 -8.069 9.754 -8.046 574 HA ARG 75 HA ARG 75 -10.613 9.294 -6.742 575 HB2 ARG 75 2HB ARG 75 -11.614 10.032 -8.801 576 HB3 ARG 75 3HB ARG 75 -10.285 11.116 -8.410 577 HG2 ARG 75 2HG ARG 75 -8.884 10.108 -10.060 578 HG3 ARG 75 3HG ARG 75 -10.062 8.827 -10.349 579 HD2 ARG 75 2HD ARG 75 -10.331 11.757 -10.989 580 HD3 ARG 75 3HD ARG 75 -10.252 10.411 -12.125 581 HE ARG 75 HE ARG 75 -12.440 9.814 -10.689 582 HH11 ARG 75 1HH1 ARG 75 -11.408 12.739 -12.270 583 HH12 ARG 75 2HH1 ARG 75 -13.019 13.285 -12.598 584 HH21 ARG 75 1HH2 ARG 75 -14.566 10.523 -11.115 585 HH22 ARG 75 2HH2 ARG 75 -14.815 12.024 -11.939 586 H VAL 76 H VAL 76 -12.257 8.001 -8.180 587 HA VAL 76 HA VAL 76 -11.078 5.343 -8.542 588 HB VAL 76 HB VAL 76 -13.175 4.408 -8.139 589 HG11 VAL 76 1HG1 VAL 76 -13.988 5.429 -6.095 590 HG12 VAL 76 2HG1 VAL 76 -12.225 5.487 -6.143 591 HG13 VAL 76 3HG1 VAL 76 -13.166 6.937 -6.496 592 HG21 VAL 76 3HG2 VAL 76 -14.274 7.071 -8.974 593 HG22 VAL 76 1HG2 VAL 76 -14.600 5.474 -9.648 594 HG23 VAL 76 2HG2 VAL 76 -15.257 5.916 -8.072 595 H LEU 77 H LEU 77 -11.545 4.065 -10.372 596 HA LEU 77 HA LEU 77 -11.374 5.339 -12.835 597 HB2 LEU 77 2HB LEU 77 -12.479 2.581 -12.336 598 HB3 LEU 77 3HB LEU 77 -11.772 3.181 -13.835 599 HG LEU 77 HG LEU 77 -10.344 2.597 -11.245 600 HD11 LEU 77 1HD1 LEU 77 -10.300 1.357 -13.986 601 HD12 LEU 77 2HD1 LEU 77 -10.751 0.601 -12.458 602 HD13 LEU 77 3HD1 LEU 77 -9.071 1.047 -12.759 603 HD21 LEU 77 3HD2 LEU 77 -9.536 4.176 -13.633 604 HD22 LEU 77 1HD2 LEU 77 -8.336 3.130 -12.871 605 HD23 LEU 77 2HD2 LEU 77 -9.121 4.401 -11.932 606 H THR 78 H THR 78 -12.804 6.173 -14.226 607 HA THR 78 HA THR 78 -15.541 6.469 -13.422 608 HB THR 78 HB THR 78 -14.350 8.291 -14.572 609 HG1 THR 78 HG1 THR 78 -16.236 8.868 -15.333 610 HG21 THR 78 3HG2 THR 78 -14.595 7.330 -17.269 611 HG22 THR 78 1HG2 THR 78 -13.561 6.249 -16.336 612 HG23 THR 78 2HG2 THR 78 -13.176 7.967 -16.439 613 H ALA 79 H ALA 79 -17.167 6.285 -15.441 614 HA ALA 79 HA ALA 79 -17.579 3.516 -15.816 615 HB1 ALA 79 1HB ALA 79 -19.450 5.030 -15.750 616 HB2 ALA 79 2HB ALA 79 -18.858 5.884 -17.176 617 HB3 ALA 79 3HB ALA 79 -19.421 4.218 -17.316 618 H SER 80 H SER 80 -15.554 5.683 -17.416 619 HA SER 80 HA SER 80 -15.545 4.088 -19.882 620 HB2 SER 80 2HB SER 80 -15.769 6.614 -19.995 621 HB3 SER 80 3HB SER 80 -14.106 6.703 -19.414 622 HG SER 80 HG SER 80 -13.455 5.562 -21.254 623 H GLU 81 H GLU 81 -13.904 4.456 -16.975 624 HA GLU 81 HA GLU 81 -11.324 3.616 -18.056 625 HB2 GLU 81 2HB GLU 81 -12.221 4.461 -15.304 626 HB3 GLU 81 3HB GLU 81 -10.626 3.790 -15.613 627 HG2 GLU 81 2HG GLU 81 -11.197 5.912 -17.463 628 HG3 GLU 81 3HG GLU 81 -11.418 6.457 -15.801 629 H THR 82 H THR 82 -13.441 2.568 -15.380 630 HA THR 82 HA THR 82 -12.285 0.093 -14.934 631 HB THR 82 HB THR 82 -14.992 -0.354 -14.473 632 HG1 THR 82 HG1 THR 82 -15.847 1.584 -14.575 633 HG21 THR 82 3HG2 THR 82 -12.634 -0.190 -13.029 634 HG22 THR 82 1HG2 THR 82 -14.214 -0.652 -12.397 635 HG23 THR 82 2HG2 THR 82 -13.672 1.023 -12.280 636 H LYS 83 H LYS 83 -15.006 0.890 -17.083 637 HA LYS 83 HA LYS 83 -15.638 -1.629 -18.003 638 HB2 LYS 83 2HB LYS 83 -15.770 1.097 -19.224 639 HB3 LYS 83 3HB LYS 83 -16.120 -0.301 -20.232 640 HG2 LYS 83 2HG LYS 83 -17.503 -0.246 -17.639 641 HG3 LYS 83 3HG LYS 83 -17.962 1.023 -18.777 642 HD2 LYS 83 2HD LYS 83 -18.405 -0.682 -20.484 643 HD3 LYS 83 3HD LYS 83 -17.961 -1.944 -19.333 644 HE2 LYS 83 2HE LYS 83 -20.249 -1.942 -19.122 645 HE3 LYS 83 3HE LYS 83 -19.793 -0.814 -17.846 646 HZ1 LYS 83 3HZ LYS 83 -21.662 -0.160 -19.451 647 HZ2 LYS 83 1HZ LYS 83 -20.423 0.158 -20.559 648 HZ3 LYS 83 2HZ LYS 83 -20.480 0.996 -19.091 649 H THR 84 H THR 84 -13.156 0.581 -19.252 650 HA THR 84 HA THR 84 -12.291 -0.986 -21.399 651 HB THR 84 HB THR 84 -10.557 0.844 -19.731 652 HG1 THR 84 HG1 THR 84 -11.979 2.277 -20.407 653 HG21 THR 84 3HG2 THR 84 -9.632 -0.770 -21.588 654 HG22 THR 84 1HG2 THR 84 -9.069 0.898 -21.489 655 HG23 THR 84 2HG2 THR 84 -10.293 0.449 -22.678 656 H PHE 85 H PHE 85 -10.780 -0.681 -18.177 657 HA PHE 85 HA PHE 85 -8.839 -2.618 -18.446 658 HB2 PHE 85 2HB PHE 85 -9.289 -1.002 -16.489 659 HB3 PHE 85 3HB PHE 85 -10.356 -2.259 -15.871 660 HD1 PHE 85 HD2 PHE 85 -9.363 -4.570 -15.478 661 HD2 PHE 85 HD1 PHE 85 -7.000 -1.084 -16.093 662 HE1 PHE 85 HE2 PHE 85 -7.436 -5.699 -14.447 663 HE2 PHE 85 HE1 PHE 85 -5.068 -2.207 -15.063 664 HZ PHE 85 HZ PHE 85 -5.285 -4.517 -14.237 665 H LEU 86 H LEU 86 -12.161 -3.047 -17.252 666 HA LEU 86 HA LEU 86 -11.972 -5.822 -16.810 667 HB2 LEU 86 2HB LEU 86 -13.747 -4.714 -15.760 668 HB3 LEU 86 3HB LEU 86 -14.268 -3.947 -17.259 669 HG LEU 86 HG LEU 86 -14.771 -6.430 -17.972 670 HD11 LEU 86 1HD1 LEU 86 -14.935 -6.559 -14.964 671 HD12 LEU 86 2HD1 LEU 86 -13.820 -7.464 -15.987 672 HD13 LEU 86 3HD1 LEU 86 -15.553 -7.775 -16.083 673 HD21 LEU 86 3HD2 LEU 86 -16.870 -5.700 -17.884 674 HD22 LEU 86 1HD2 LEU 86 -16.264 -4.279 -17.033 675 HD23 LEU 86 2HD2 LEU 86 -16.854 -5.669 -16.120 676 H ALA 87 H ALA 87 -12.860 -3.924 -19.639 677 HA ALA 87 HA ALA 87 -13.651 -6.213 -21.189 678 HB1 ALA 87 1HB ALA 87 -14.685 -4.101 -21.669 679 HB2 ALA 87 2HB ALA 87 -13.117 -3.352 -21.973 680 HB3 ALA 87 3HB ALA 87 -13.730 -4.590 -23.069 681 H ALA 88 H ALA 88 -10.720 -5.261 -20.118 682 HA ALA 88 HA ALA 88 -9.325 -6.164 -22.551 683 HB1 ALA 88 1HB ALA 88 -8.592 -3.976 -22.053 684 HB2 ALA 88 2HB ALA 88 -8.431 -4.339 -20.335 685 HB3 ALA 88 3HB ALA 88 -7.312 -5.053 -21.495 686 H ALA 89 H ALA 89 -10.107 -6.948 -19.338 687 HA ALA 89 HA ALA 89 -8.028 -9.038 -19.292 688 HB1 ALA 89 1HB ALA 89 -8.974 -7.195 -17.234 689 HB2 ALA 89 2HB ALA 89 -8.910 -8.877 -16.707 690 HB3 ALA 89 3HB ALA 89 -7.462 -8.097 -17.344 691 H ASP 90 H ASP 90 -11.312 -8.356 -18.069 692 HA ASP 90 HA ASP 90 -12.015 -11.017 -17.561 693 HB2 ASP 90 2HB ASP 90 -13.313 -9.203 -16.629 694 HB3 ASP 90 3HB ASP 90 -13.747 -8.632 -18.237 695 H HIS 91 H HIS 91 -13.427 -9.068 -20.185 696 HA HIS 91 HA HIS 91 -14.105 -9.610 -22.288 697 HB2 HIS 91 2HB HIS 91 -11.544 -10.240 -22.266 698 HB3 HIS 91 3HB HIS 91 -12.165 -11.883 -22.397 699 HD1 HIS 91 HD1 HIS 91 -10.520 -10.606 -24.673 700 HD2 HIS 91 HD2 HIS 91 -14.670 -10.601 -24.490 701 HE1 HIS 91 HE1 HIS 91 -11.297 -10.319 -27.047 702 H ASP 92 H ASP 92 -14.845 -11.316 -19.754 703 HA ASP 92 HA ASP 92 -16.032 -13.588 -21.192 704 HB2 ASP 92 2HB ASP 92 -16.038 -13.320 -18.203 705 HB3 ASP 92 3HB ASP 92 -16.078 -14.780 -19.187 706 H GLY 93 H GLY 93 -16.763 -10.619 -19.636 707 HA2 GLY 93 2HA GLY 93 -18.785 -9.470 -19.698 708 HA3 GLY 93 3HA GLY 93 -19.561 -10.922 -20.312 709 H ASP 94 H ASP 94 -17.605 -11.081 -17.451 710 HA ASP 94 HA ASP 94 -20.021 -11.654 -15.891 711 HB2 ASP 94 2HB ASP 94 -17.386 -12.125 -14.653 712 HB3 ASP 94 3HB ASP 94 -18.809 -13.162 -14.708 713 H GLY 95 H GLY 95 -17.503 -9.342 -16.253 714 HA2 GLY 95 2HA GLY 95 -17.296 -7.255 -15.283 715 HA3 GLY 95 3HA GLY 95 -18.721 -7.608 -14.316 716 H LYS 96 H LYS 96 -16.058 -9.823 -14.292 717 HA LYS 96 HA LYS 96 -14.947 -8.676 -11.855 718 HB2 LYS 96 2HB LYS 96 -15.167 -10.785 -10.613 719 HB3 LYS 96 3HB LYS 96 -16.738 -10.114 -11.032 720 HG2 LYS 96 2HG LYS 96 -16.066 -11.814 -13.145 721 HG3 LYS 96 3HG LYS 96 -15.616 -12.677 -11.672 722 HD2 LYS 96 2HD LYS 96 -18.233 -11.312 -11.630 723 HD3 LYS 96 3HD LYS 96 -18.099 -12.697 -12.715 724 HE2 LYS 96 2HE LYS 96 -17.117 -13.949 -10.724 725 HE3 LYS 96 3HE LYS 96 -17.693 -12.606 -9.737 726 HZ1 LYS 96 3HZ LYS 96 -19.185 -14.669 -10.074 727 HZ2 LYS 96 1HZ LYS 96 -19.544 -13.971 -11.573 728 HZ3 LYS 96 2HZ LYS 96 -19.882 -13.129 -10.146 729 H ILE 97 H ILE 97 -12.804 -8.821 -11.895 730 HA ILE 97 HA ILE 97 -11.518 -10.427 -13.932 731 HB ILE 97 HB ILE 97 -10.305 -8.575 -11.877 732 HG12 ILE 97 2HG1 ILE 97 -11.792 -7.417 -13.457 733 HG13 ILE 97 3HG1 ILE 97 -10.108 -6.984 -13.731 734 HG21 ILE 97 1HG2 ILE 97 -9.158 -10.340 -13.932 735 HG22 ILE 97 2HG2 ILE 97 -8.516 -8.698 -13.896 736 HG23 ILE 97 3HG2 ILE 97 -8.443 -9.705 -12.450 737 HD11 ILE 97 3HD1 ILE 97 -12.019 -8.203 -15.515 738 HD12 ILE 97 1HD1 ILE 97 -10.467 -7.445 -15.867 739 HD13 ILE 97 2HD1 ILE 97 -10.533 -9.146 -15.404 740 H GLY 98 H GLY 98 -9.938 -12.014 -13.558 741 HA2 GLY 98 2HA GLY 98 -9.900 -13.108 -10.814 742 HA3 GLY 98 3HA GLY 98 -10.112 -14.144 -12.217 743 H ALA 99 H ALA 99 -8.163 -15.019 -10.840 744 HA ALA 99 HA ALA 99 -5.655 -13.694 -11.461 745 HB1 ALA 99 1HB ALA 99 -6.222 -16.269 -9.997 746 HB2 ALA 99 2HB ALA 99 -4.632 -15.524 -10.170 747 HB3 ALA 99 3HB ALA 99 -5.902 -14.694 -9.270 748 H GLU 100 H GLU 100 -7.644 -15.364 -13.315 749 HA GLU 100 HA GLU 100 -5.489 -16.843 -14.678 750 HB2 GLU 100 2HB GLU 100 -8.363 -17.497 -14.222 751 HB3 GLU 100 3HB GLU 100 -7.616 -18.035 -15.720 752 HG2 GLU 100 2HG GLU 100 -7.358 -19.839 -14.286 753 HG3 GLU 100 3HG GLU 100 -5.790 -19.035 -14.238 754 H GLU 101 H GLU 101 -7.556 -14.214 -14.844 755 HA GLU 101 HA GLU 101 -7.246 -14.071 -17.772 756 HB2 GLU 101 2HB GLU 101 -9.298 -12.606 -17.729 757 HB3 GLU 101 3HB GLU 101 -9.576 -14.301 -17.354 758 HG2 GLU 101 2HG GLU 101 -9.470 -13.660 -14.922 759 HG3 GLU 101 3HG GLU 101 -9.502 -11.979 -15.452 760 H PHE 102 H PHE 102 -6.315 -12.789 -14.855 761 HA PHE 102 HA PHE 102 -6.206 -10.016 -15.543 762 HB2 PHE 102 2HB PHE 102 -6.274 -10.727 -13.204 763 HB3 PHE 102 3HB PHE 102 -4.740 -11.569 -13.400 764 HD1 PHE 102 HD2 PHE 102 -6.340 -8.245 -13.341 765 HD2 PHE 102 HD1 PHE 102 -2.684 -10.423 -13.240 766 HE1 PHE 102 HE2 PHE 102 -5.140 -6.194 -12.704 767 HE2 PHE 102 HE1 PHE 102 -1.478 -8.375 -12.602 768 HZ PHE 102 HZ PHE 102 -2.706 -6.257 -12.334 769 H GLN 103 H GLN 103 -3.531 -12.288 -14.905 770 HA GLN 103 HA GLN 103 -1.492 -10.795 -15.994 771 HB2 GLN 103 2HB GLN 103 -0.264 -12.906 -16.262 772 HB3 GLN 103 3HB GLN 103 -1.096 -12.832 -14.715 773 HG2 GLN 103 2HG GLN 103 -2.947 -14.051 -16.319 774 HG3 GLN 103 3HG GLN 103 -1.423 -14.688 -16.935 775 HE21 GLN 103 1HE2 GLN 103 -2.525 -13.797 -13.685 776 HE22 GLN 103 2HE2 GLN 103 -2.193 -15.332 -12.964 777 H GLU 104 H GLU 104 -3.796 -12.886 -17.631 778 HA GLU 104 HA GLU 104 -2.593 -13.066 -20.131 779 HB2 GLU 104 2HB GLU 104 -5.564 -12.786 -19.692 780 HB3 GLU 104 3HB GLU 104 -4.746 -13.633 -20.997 781 HG2 GLU 104 2HG GLU 104 -3.776 -15.121 -19.140 782 HG3 GLU 104 3HG GLU 104 -5.054 -14.441 -18.134 783 H MET 105 H MET 105 -4.279 -10.418 -18.627 784 HA MET 105 HA MET 105 -4.509 -8.915 -21.093 785 HB2 MET 105 2HB MET 105 -5.795 -7.408 -19.915 786 HB3 MET 105 3HB MET 105 -6.081 -8.876 -18.990 787 HG2 MET 105 2HG MET 105 -5.551 -7.641 -17.218 788 HG3 MET 105 3HG MET 105 -3.884 -7.856 -17.747 789 HE1 MET 105 3HE MET 105 -6.391 -4.776 -19.631 790 HE2 MET 105 1HE MET 105 -6.990 -6.107 -18.641 791 HE3 MET 105 2HE MET 105 -6.747 -4.515 -17.923 792 H VAL 106 H VAL 106 -2.188 -9.389 -18.645 793 HA VAL 106 HA VAL 106 -0.891 -6.828 -18.928 794 HB VAL 106 HB VAL 106 0.265 -9.310 -17.663 795 HG11 VAL 106 1HG1 VAL 106 1.193 -6.629 -18.037 796 HG12 VAL 106 2HG1 VAL 106 0.997 -6.951 -16.313 797 HG13 VAL 106 3HG1 VAL 106 2.019 -8.000 -17.297 798 HG21 VAL 106 3HG2 VAL 106 -2.100 -8.201 -16.891 799 HG22 VAL 106 1HG2 VAL 106 -0.998 -9.069 -15.822 800 HG23 VAL 106 2HG2 VAL 106 -0.949 -7.307 -15.898 801 H GLN 107 H GLN 107 0.636 -10.012 -19.238 802 HA GLN 107 HA GLN 107 2.561 -9.115 -21.089 803 HB2 GLN 107 2HB GLN 107 1.648 -11.936 -20.501 804 HB3 GLN 107 3HB GLN 107 3.116 -11.500 -21.367 805 HG2 GLN 107 2HG GLN 107 4.241 -11.167 -19.484 806 HG3 GLN 107 3HG GLN 107 2.949 -10.186 -18.794 807 HE21 GLN 107 1HE2 GLN 107 0.907 -11.730 -18.394 808 HE22 GLN 107 2HE2 GLN 107 1.281 -13.098 -17.409 809 H SER 108 H SER 108 -0.574 -10.647 -21.478 810 HA SER 108 HA SER 108 -1.835 -11.143 -23.311 811 HB2 SER 108 2HB SER 108 -1.790 -8.678 -23.479 812 HB3 SER 108 3HB SER 108 -0.340 -8.781 -24.477 813 HG SER 108 HG SER 108 -2.749 -10.090 -25.172 Start of MODEL 16 1 H1 SER 1 H SER 1 0.468 -0.181 -0.858 2 HA SER 1 HA SER 1 1.005 -0.021 -3.752 3 HB2 SER 1 2HB SER 1 2.189 1.782 -2.674 4 HB3 SER 1 3HB SER 1 2.825 0.692 -1.442 5 HG SER 1 HG SER 1 3.511 0.881 -4.170 6 H LEU 2 H LEU 2 1.555 -1.885 -4.653 7 HA LEU 2 HA LEU 2 1.679 -4.317 -3.377 8 HB2 LEU 2 2HB LEU 2 3.278 -3.710 -5.846 9 HB3 LEU 2 3HB LEU 2 2.522 -5.233 -5.384 10 HG LEU 2 HG LEU 2 1.036 -4.587 -6.966 11 HD11 LEU 2 1HD1 LEU 2 -0.926 -3.949 -5.964 12 HD12 LEU 2 2HD1 LEU 2 -0.145 -2.733 -4.954 13 HD13 LEU 2 3HD1 LEU 2 0.019 -4.443 -4.559 14 HD21 LEU 2 3HD2 LEU 2 0.473 -1.978 -7.074 15 HD22 LEU 2 1HD2 LEU 2 1.820 -2.703 -7.952 16 HD23 LEU 2 2HD2 LEU 2 2.108 -1.884 -6.416 17 H THR 3 H THR 3 4.509 -2.516 -4.598 18 HA THR 3 HA THR 3 6.720 -2.619 -4.038 19 HB THR 3 HB THR 3 7.048 -2.831 -1.437 20 HG1 THR 3 HG1 THR 3 4.340 -2.012 -1.465 21 HG21 THR 3 3HG2 THR 3 6.381 -0.690 -3.211 22 HG22 THR 3 1HG2 THR 3 7.385 -0.653 -1.762 23 HG23 THR 3 2HG2 THR 3 5.647 -0.383 -1.637 24 H ASP 4 H ASP 4 5.276 -5.192 -4.565 25 HA ASP 4 HA ASP 4 7.279 -6.963 -3.339 26 HB2 ASP 4 2HB ASP 4 4.314 -7.257 -3.412 27 HB3 ASP 4 3HB ASP 4 5.288 -8.711 -3.607 28 H ILE 5 H ILE 5 6.198 -5.638 -6.106 29 HA ILE 5 HA ILE 5 7.246 -7.861 -7.704 30 HB ILE 5 HB ILE 5 4.792 -6.299 -8.508 31 HG12 ILE 5 2HG1 ILE 5 3.895 -8.822 -8.248 32 HG13 ILE 5 3HG1 ILE 5 5.131 -8.832 -6.995 33 HG21 ILE 5 1HG2 ILE 5 6.322 -7.197 -10.298 34 HG22 ILE 5 2HG2 ILE 5 5.911 -8.812 -9.725 35 HG23 ILE 5 3HG2 ILE 5 4.652 -7.759 -10.370 36 HD11 ILE 5 3HD1 ILE 5 3.418 -8.104 -5.733 37 HD12 ILE 5 1HD1 ILE 5 3.903 -6.538 -6.381 38 HD13 ILE 5 2HD1 ILE 5 2.555 -7.413 -7.106 39 H LEU 6 H LEU 6 5.840 -4.650 -8.356 40 HA LEU 6 HA LEU 6 8.173 -4.027 -10.008 41 HB2 LEU 6 2HB LEU 6 5.407 -2.901 -9.791 42 HB3 LEU 6 3HB LEU 6 6.694 -1.978 -10.565 43 HG LEU 6 HG LEU 6 6.093 -4.761 -11.484 44 HD11 LEU 6 1HD1 LEU 6 4.018 -4.186 -12.042 45 HD12 LEU 6 2HD1 LEU 6 4.739 -3.089 -13.219 46 HD13 LEU 6 3HD1 LEU 6 4.290 -2.495 -11.621 47 HD21 LEU 6 3HD2 LEU 6 7.974 -2.900 -12.187 48 HD22 LEU 6 1HD2 LEU 6 6.717 -2.646 -13.398 49 HD23 LEU 6 2HD2 LEU 6 7.436 -4.244 -13.195 50 H SER 7 H SER 7 9.151 -1.891 -9.862 51 HA SER 7 HA SER 7 9.706 -1.192 -7.138 52 HB2 SER 7 2HB SER 7 10.902 -0.733 -9.723 53 HB3 SER 7 3HB SER 7 10.801 0.782 -8.825 54 HG SER 7 HG SER 7 11.643 -0.806 -7.044 55 HA PRO 8 HA PRO 8 6.983 2.182 -6.480 56 HB2 PRO 8 2HB PRO 8 8.558 3.970 -5.178 57 HB3 PRO 8 3HB PRO 8 7.985 2.473 -4.433 58 HG2 PRO 8 2HG PRO 8 10.642 3.076 -5.673 59 HG3 PRO 8 3HG PRO 8 10.280 2.204 -4.172 60 HD2 PRO 8 2HD PRO 8 10.886 0.933 -6.485 61 HD3 PRO 8 3HD PRO 8 9.774 0.248 -5.282 62 H SER 9 H SER 9 10.181 3.368 -7.533 63 HA SER 9 HA SER 9 9.385 5.822 -8.543 64 HB2 SER 9 2HB SER 9 11.479 4.401 -10.085 65 HB3 SER 9 3HB SER 9 11.514 5.999 -9.339 66 HG SER 9 HG SER 9 12.788 4.058 -8.423 67 H ASP 10 H ASP 10 9.570 2.693 -10.208 68 HA ASP 10 HA ASP 10 8.823 3.564 -12.755 69 HB2 ASP 10 2HB ASP 10 8.443 0.910 -11.367 70 HB3 ASP 10 3HB ASP 10 8.027 1.173 -13.058 71 H ILE 11 H ILE 11 6.896 2.790 -9.930 72 HA ILE 11 HA ILE 11 4.389 2.860 -11.331 73 HB ILE 11 HB ILE 11 5.020 2.912 -8.380 74 HG12 ILE 11 2HG1 ILE 11 3.654 0.660 -9.788 75 HG13 ILE 11 3HG1 ILE 11 5.393 0.840 -9.993 76 HG21 ILE 11 1HG2 ILE 11 2.942 3.903 -8.404 77 HG22 ILE 11 2HG2 ILE 11 2.431 3.044 -9.856 78 HG23 ILE 11 3HG2 ILE 11 2.510 2.196 -8.312 79 HD11 ILE 11 3HD1 ILE 11 3.859 0.330 -7.469 80 HD12 ILE 11 1HD1 ILE 11 5.108 -0.663 -8.220 81 HD13 ILE 11 2HD1 ILE 11 5.536 0.873 -7.465 82 H ALA 12 H ALA 12 5.984 5.011 -8.980 83 HA ALA 12 HA ALA 12 4.098 7.043 -8.940 84 HB1 ALA 12 1HB ALA 12 6.512 8.368 -8.696 85 HB2 ALA 12 2HB ALA 12 5.576 7.646 -7.387 86 HB3 ALA 12 3HB ALA 12 6.872 6.728 -8.154 87 H ALA 13 H ALA 13 6.549 6.310 -11.320 88 HA ALA 13 HA ALA 13 6.366 8.810 -12.703 89 HB1 ALA 13 1HB ALA 13 7.860 6.323 -12.978 90 HB2 ALA 13 2HB ALA 13 7.388 7.030 -14.525 91 HB3 ALA 13 3HB ALA 13 8.327 7.978 -13.372 92 H ALA 14 H ALA 14 4.677 5.772 -12.823 93 HA ALA 14 HA ALA 14 3.407 6.383 -15.364 94 HB1 ALA 14 1HB ALA 14 2.795 4.091 -13.510 95 HB2 ALA 14 2HB ALA 14 2.410 4.227 -15.226 96 HB3 ALA 14 3HB ALA 14 4.088 4.061 -14.709 97 H LEU 15 H LEU 15 2.751 6.638 -11.967 98 HA LEU 15 HA LEU 15 -0.080 6.866 -12.158 99 HB2 LEU 15 2HB LEU 15 1.958 7.491 -10.065 100 HB3 LEU 15 3HB LEU 15 0.299 8.053 -9.868 101 HG LEU 15 HG LEU 15 1.175 5.177 -10.142 102 HD11 LEU 15 1HD1 LEU 15 1.584 5.301 -7.965 103 HD12 LEU 15 2HD1 LEU 15 -0.136 5.599 -7.720 104 HD13 LEU 15 3HD1 LEU 15 0.978 6.956 -7.883 105 HD21 LEU 15 3HD2 LEU 15 -1.190 4.706 -9.527 106 HD22 LEU 15 1HD2 LEU 15 -0.999 5.450 -11.115 107 HD23 LEU 15 2HD2 LEU 15 -1.543 6.421 -9.746 108 H ARG 16 H ARG 16 2.475 9.302 -11.640 109 HA ARG 16 HA ARG 16 0.698 11.506 -11.946 110 HB2 ARG 16 2HB ARG 16 3.695 11.579 -12.283 111 HB3 ARG 16 3HB ARG 16 2.633 12.890 -11.787 112 HG2 ARG 16 2HG ARG 16 2.944 10.395 -10.151 113 HG3 ARG 16 3HG ARG 16 4.035 11.773 -9.987 114 HD2 ARG 16 2HD ARG 16 1.041 11.988 -9.750 115 HD3 ARG 16 3HD ARG 16 2.104 11.711 -8.371 116 HE ARG 16 HE ARG 16 3.137 13.924 -9.572 117 HH11 ARG 16 1HH1 ARG 16 -0.006 13.043 -8.361 118 HH12 ARG 16 2HH1 ARG 16 -0.444 14.667 -7.943 119 HH21 ARG 16 1HH2 ARG 16 2.572 16.066 -9.026 120 HH22 ARG 16 2HH2 ARG 16 1.023 16.385 -8.323 121 H ASP 17 H ASP 17 2.062 9.380 -14.157 122 HA ASP 17 HA ASP 17 2.453 11.190 -16.340 123 HB2 ASP 17 2HB ASP 17 3.705 9.203 -16.484 124 HB3 ASP 17 3HB ASP 17 2.313 8.194 -16.103 125 H CYS 18 H CYS 18 -0.149 9.047 -15.286 126 HA CYS 18 HA CYS 18 -1.963 10.477 -17.092 127 HB2 CYS 18 2HB CYS 18 -3.126 8.226 -17.470 128 HB3 CYS 18 3HB CYS 18 -1.613 8.500 -18.325 129 HG CYS 18 HG CYS 18 -1.141 7.031 -15.377 130 H GLN 19 H GLN 19 -1.562 10.883 -14.327 131 HA GLN 19 HA GLN 19 -3.345 9.497 -12.673 132 HB2 GLN 19 2HB GLN 19 -3.270 11.637 -11.284 133 HB3 GLN 19 3HB GLN 19 -1.736 10.836 -11.596 134 HG2 GLN 19 2HG GLN 19 -1.035 12.465 -13.080 135 HG3 GLN 19 3HG GLN 19 -2.675 13.037 -13.382 136 HE21 GLN 19 1HE2 GLN 19 0.167 13.549 -11.683 137 HE22 GLN 19 2HE2 GLN 19 -0.409 14.735 -10.566 138 H ALA 20 H ALA 20 -3.820 12.219 -14.837 139 HA ALA 20 HA ALA 20 -6.286 13.151 -13.998 140 HB1 ALA 20 1HB ALA 20 -6.587 14.021 -16.221 141 HB2 ALA 20 2HB ALA 20 -4.890 14.180 -15.767 142 HB3 ALA 20 3HB ALA 20 -5.393 12.895 -16.866 143 HA PRO 21 HA PRO 21 -9.200 9.953 -14.765 144 HB2 PRO 21 2HB PRO 21 -11.418 11.431 -15.283 145 HB3 PRO 21 3HB PRO 21 -10.730 11.268 -13.664 146 HG2 PRO 21 2HG PRO 21 -10.426 13.500 -15.635 147 HG3 PRO 21 3HG PRO 21 -10.702 13.583 -13.885 148 HD2 PRO 21 2HD PRO 21 -8.256 13.935 -14.993 149 HD3 PRO 21 3HD PRO 21 -8.482 13.204 -13.391 150 H ASP 22 H ASP 22 -10.220 8.835 -16.417 151 HA ASP 22 HA ASP 22 -10.318 8.079 -18.580 152 HB2 ASP 22 2HB ASP 22 -11.782 9.381 -19.979 153 HB3 ASP 22 3HB ASP 22 -12.338 9.531 -18.314 154 H SER 23 H SER 23 -7.780 9.229 -17.909 155 HA SER 23 HA SER 23 -6.969 10.227 -20.561 156 HB2 SER 23 2HB SER 23 -6.266 11.197 -17.834 157 HB3 SER 23 3HB SER 23 -4.995 11.217 -19.056 158 HG SER 23 HG SER 23 -7.358 12.688 -18.912 159 H PHE 24 H PHE 24 -6.968 7.574 -18.819 160 HA PHE 24 HA PHE 24 -4.291 6.761 -19.727 161 HB2 PHE 24 2HB PHE 24 -3.736 5.770 -17.732 162 HB3 PHE 24 3HB PHE 24 -4.729 7.094 -17.130 163 HD1 PHE 24 HD2 PHE 24 -7.406 6.340 -17.340 164 HD2 PHE 24 HD1 PHE 24 -4.054 3.834 -16.563 165 HE1 PHE 24 HE2 PHE 24 -8.880 4.722 -16.216 166 HE2 PHE 24 HE1 PHE 24 -5.523 2.212 -15.439 167 HZ PHE 24 HZ PHE 24 -7.939 2.655 -15.263 168 H SER 25 H SER 25 -4.206 4.195 -19.488 169 HA SER 25 HA SER 25 -6.732 3.002 -20.344 170 HB2 SER 25 2HB SER 25 -4.590 3.665 -22.140 171 HB3 SER 25 3HB SER 25 -4.760 1.911 -22.058 172 HG SER 25 HG SER 25 -6.171 2.600 -23.605 173 HA PRO 26 HA PRO 26 -5.409 -0.491 -18.044 174 HB2 PRO 26 2HB PRO 26 -6.456 -2.543 -19.481 175 HB3 PRO 26 3HB PRO 26 -7.447 -1.443 -18.516 176 HG2 PRO 26 2HG PRO 26 -6.920 -1.426 -21.463 177 HG3 PRO 26 3HG PRO 26 -8.446 -1.168 -20.597 178 HD2 PRO 26 2HD PRO 26 -6.965 0.875 -21.581 179 HD3 PRO 26 3HD PRO 26 -7.942 1.027 -20.106 180 H LYS 27 H LYS 27 -4.333 -0.007 -21.240 181 HA LYS 27 HA LYS 27 -2.237 -2.046 -20.870 182 HB2 LYS 27 2HB LYS 27 -2.207 -2.489 -23.210 183 HB3 LYS 27 3HB LYS 27 -3.889 -2.564 -22.701 184 HG2 LYS 27 2HG LYS 27 -3.714 0.029 -23.428 185 HG3 LYS 27 3HG LYS 27 -2.545 -0.700 -24.531 186 HD2 LYS 27 2HD LYS 27 -4.679 -0.696 -25.613 187 HD3 LYS 27 3HD LYS 27 -4.300 -2.362 -25.167 188 HE2 LYS 27 2HE LYS 27 -6.423 -2.305 -24.382 189 HE3 LYS 27 3HE LYS 27 -5.626 -1.619 -22.967 190 HZ1 LYS 27 3HZ LYS 27 -7.679 -0.454 -24.088 191 HZ2 LYS 27 1HZ LYS 27 -6.482 0.217 -25.077 192 HZ3 LYS 27 2HZ LYS 27 -6.423 0.449 -23.403 193 H LYS 28 H LYS 28 -2.193 0.715 -20.020 194 HA LYS 28 HA LYS 28 0.114 1.613 -21.602 195 HB2 LYS 28 2HB LYS 28 -2.272 3.238 -20.755 196 HB3 LYS 28 3HB LYS 28 -0.719 3.995 -21.080 197 HG2 LYS 28 2HG LYS 28 -2.218 2.285 -23.051 198 HG3 LYS 28 3HG LYS 28 -2.287 4.048 -22.996 199 HD2 LYS 28 2HD LYS 28 0.274 3.952 -23.182 200 HD3 LYS 28 3HD LYS 28 0.037 2.275 -23.680 201 HE2 LYS 28 2HE LYS 28 0.121 3.486 -25.685 202 HE3 LYS 28 3HE LYS 28 -1.596 3.198 -25.408 203 HZ1 LYS 28 3HZ LYS 28 -0.095 5.696 -25.326 204 HZ2 LYS 28 1HZ LYS 28 -1.342 5.523 -24.196 205 HZ3 LYS 28 2HZ LYS 28 -1.676 5.399 -25.849 206 H PHE 29 H PHE 29 -0.414 0.246 -18.934 207 HA PHE 29 HA PHE 29 1.076 2.157 -17.256 208 HB2 PHE 29 2HB PHE 29 -1.336 0.719 -16.715 209 HB3 PHE 29 3HB PHE 29 -0.078 0.129 -15.634 210 HD1 PHE 29 HD1 PHE 29 1.242 1.877 -14.308 211 HD2 PHE 29 HD2 PHE 29 -2.454 2.697 -16.252 212 HE1 PHE 29 HE1 PHE 29 0.922 3.842 -12.863 213 HE2 PHE 29 HE2 PHE 29 -2.780 4.664 -14.811 214 HZ PHE 29 HZ PHE 29 -1.090 5.239 -13.114 215 H PHE 30 H PHE 30 1.385 -0.580 -19.038 216 HA PHE 30 HA PHE 30 3.215 -1.939 -17.212 217 HB2 PHE 30 2HB PHE 30 3.138 -3.788 -18.685 218 HB3 PHE 30 3HB PHE 30 1.492 -3.167 -18.642 219 HD1 PHE 30 HD1 PHE 30 4.532 -3.495 -20.660 220 HD2 PHE 30 HD2 PHE 30 0.492 -2.159 -20.576 221 HE1 PHE 30 HE1 PHE 30 4.548 -3.303 -23.113 222 HE2 PHE 30 HE2 PHE 30 0.501 -1.966 -23.028 223 HZ PHE 30 HZ PHE 30 2.530 -2.539 -24.300 224 H GLN 31 H GLN 31 3.273 0.341 -19.718 225 HA GLN 31 HA GLN 31 5.935 -0.303 -20.652 226 HB2 GLN 31 2HB GLN 31 4.607 2.301 -21.260 227 HB3 GLN 31 3HB GLN 31 5.620 1.296 -22.288 228 HG2 GLN 31 2HG GLN 31 3.751 -0.344 -22.409 229 HG3 GLN 31 3HG GLN 31 2.749 0.815 -21.536 230 HE21 GLN 31 1HE2 GLN 31 3.273 3.166 -22.629 231 HE22 GLN 31 2HE2 GLN 31 2.907 3.181 -24.317 232 H ILE 32 H ILE 32 4.400 1.955 -18.457 233 HA ILE 32 HA ILE 32 6.915 3.355 -17.988 234 HB ILE 32 HB ILE 32 4.225 3.820 -16.697 235 HG12 ILE 32 2HG1 ILE 32 4.720 5.951 -18.367 236 HG13 ILE 32 3HG1 ILE 32 5.323 4.590 -19.306 237 HG21 ILE 32 1HG2 ILE 32 5.983 4.697 -15.336 238 HG22 ILE 32 2HG2 ILE 32 6.770 5.429 -16.733 239 HG23 ILE 32 3HG2 ILE 32 5.218 6.049 -16.171 240 HD11 ILE 32 3HD1 ILE 32 2.739 4.049 -18.109 241 HD12 ILE 32 1HD1 ILE 32 2.719 5.456 -19.172 242 HD13 ILE 32 2HD1 ILE 32 3.270 3.896 -19.784 243 H SER 33 H SER 33 4.789 1.039 -16.466 244 HA SER 33 HA SER 33 6.262 1.138 -13.958 245 HB2 SER 33 2HB SER 33 3.760 0.857 -14.035 246 HB3 SER 33 3HB SER 33 4.022 -0.742 -14.731 247 HG SER 33 HG SER 33 3.784 -0.462 -12.310 248 H GLY 34 H GLY 34 5.218 -1.606 -15.983 249 HA2 GLY 34 2HA GLY 34 7.096 -2.900 -17.048 250 HA3 GLY 34 3HA GLY 34 7.856 -2.832 -15.466 251 H MET 35 H MET 35 4.416 -3.312 -15.934 252 HA MET 35 HA MET 35 4.360 -5.604 -14.290 253 HB2 MET 35 2HB MET 35 2.252 -4.790 -16.292 254 HB3 MET 35 3HB MET 35 2.027 -5.754 -14.838 255 HG2 MET 35 2HG MET 35 2.489 -3.851 -13.445 256 HG3 MET 35 3HG MET 35 2.888 -2.872 -14.855 257 HE1 MET 35 3HE MET 35 -1.358 -4.556 -14.207 258 HE2 MET 35 1HE MET 35 0.026 -5.501 -14.757 259 HE3 MET 35 2HE MET 35 -0.033 -4.909 -13.097 260 H SER 36 H SER 36 4.047 -5.233 -17.815 261 HA SER 36 HA SER 36 3.660 -7.882 -18.505 262 HB2 SER 36 2HB SER 36 4.394 -7.299 -20.711 263 HB3 SER 36 3HB SER 36 3.587 -5.879 -20.046 264 HG SER 36 HG SER 36 5.740 -5.622 -21.125 265 H LYS 37 H LYS 37 6.632 -6.206 -17.682 266 HA LYS 37 HA LYS 37 8.452 -8.183 -18.523 267 HB2 LYS 37 2HB LYS 37 8.881 -6.356 -16.165 268 HB3 LYS 37 3HB LYS 37 10.089 -7.020 -17.257 269 HG2 LYS 37 2HG LYS 37 8.051 -4.893 -17.863 270 HG3 LYS 37 3HG LYS 37 9.805 -4.713 -17.774 271 HD2 LYS 37 2HD LYS 37 8.291 -6.361 -19.801 272 HD3 LYS 37 3HD LYS 37 9.040 -4.790 -20.094 273 HE2 LYS 37 2HE LYS 37 11.231 -5.802 -19.457 274 HE3 LYS 37 3HE LYS 37 10.428 -7.370 -19.379 275 HZ1 LYS 37 3HZ LYS 37 11.494 -7.084 -21.505 276 HZ2 LYS 37 1HZ LYS 37 10.660 -5.638 -21.781 277 HZ3 LYS 37 2HZ LYS 37 9.816 -7.103 -21.720 278 H LYS 38 H LYS 38 6.283 -8.064 -15.879 279 HA LYS 38 HA LYS 38 7.738 -10.041 -14.318 280 HB2 LYS 38 2HB LYS 38 4.968 -8.977 -13.778 281 HB3 LYS 38 3HB LYS 38 6.071 -9.738 -12.639 282 HG2 LYS 38 2HG LYS 38 6.599 -7.098 -13.985 283 HG3 LYS 38 3HG LYS 38 5.866 -7.273 -12.389 284 HD2 LYS 38 2HD LYS 38 7.904 -7.363 -11.505 285 HD3 LYS 38 3HD LYS 38 8.190 -8.865 -12.387 286 HE2 LYS 38 2HE LYS 38 8.669 -7.173 -14.369 287 HE3 LYS 38 3HE LYS 38 9.027 -6.085 -13.029 288 HZ1 LYS 38 3HZ LYS 38 10.523 -7.909 -12.182 289 HZ2 LYS 38 1HZ LYS 38 11.044 -7.116 -13.583 290 HZ3 LYS 38 2HZ LYS 38 10.344 -8.652 -13.691 291 H SER 39 H SER 39 6.869 -12.098 -13.773 292 HA SER 39 HA SER 39 5.612 -13.411 -15.981 293 HB2 SER 39 2HB SER 39 6.253 -14.474 -13.219 294 HB3 SER 39 3HB SER 39 5.830 -15.446 -14.628 295 HG SER 39 HG SER 39 8.209 -14.205 -13.978 296 H SER 40 H SER 40 3.707 -14.843 -15.705 297 HA SER 40 HA SER 40 1.458 -13.372 -14.892 298 HB2 SER 40 2HB SER 40 0.932 -16.222 -14.978 299 HB3 SER 40 3HB SER 40 0.361 -14.948 -16.055 300 HG SER 40 HG SER 40 1.727 -16.613 -17.031 301 H SER 41 H SER 41 3.602 -15.362 -13.127 302 HA SER 41 HA SER 41 1.737 -16.001 -11.015 303 HB2 SER 41 2HB SER 41 3.545 -17.156 -9.974 304 HB3 SER 41 3HB SER 41 3.700 -17.460 -11.704 305 HG SER 41 HG SER 41 5.227 -15.674 -11.712 306 H GLN 42 H GLN 42 3.905 -13.450 -11.797 307 HA GLN 42 HA GLN 42 3.997 -12.454 -9.061 308 HB2 GLN 42 2HB GLN 42 5.382 -11.764 -11.613 309 HB3 GLN 42 3HB GLN 42 5.262 -10.532 -10.365 310 HG2 GLN 42 2HG GLN 42 6.263 -12.226 -8.780 311 HG3 GLN 42 3HG GLN 42 6.614 -13.206 -10.203 312 HE21 GLN 42 1HE2 GLN 42 7.124 -10.005 -8.804 313 HE22 GLN 42 2HE2 GLN 42 8.670 -9.738 -9.529 314 H LEU 43 H LEU 43 2.364 -11.873 -12.071 315 HA LEU 43 HA LEU 43 1.371 -9.276 -11.356 316 HB2 LEU 43 2HB LEU 43 0.350 -11.156 -13.476 317 HB3 LEU 43 3HB LEU 43 0.050 -9.423 -13.364 318 HG LEU 43 HG LEU 43 2.876 -10.292 -13.595 319 HD11 LEU 43 1HD1 LEU 43 0.797 -10.836 -15.629 320 HD12 LEU 43 2HD1 LEU 43 2.326 -11.658 -15.316 321 HD13 LEU 43 3HD1 LEU 43 2.311 -10.128 -16.194 322 HD21 LEU 43 3HD2 LEU 43 1.177 -7.964 -14.251 323 HD22 LEU 43 1HD2 LEU 43 2.525 -8.292 -15.341 324 HD23 LEU 43 2HD2 LEU 43 2.824 -8.030 -13.622 325 H LYS 44 H LYS 44 0.454 -12.517 -10.723 326 HA LYS 44 HA LYS 44 -2.332 -12.043 -10.284 327 HB2 LYS 44 2HB LYS 44 -2.462 -14.275 -9.597 328 HB3 LYS 44 3HB LYS 44 -1.159 -14.280 -10.778 329 HG2 LYS 44 2HG LYS 44 0.377 -13.970 -8.715 330 HG3 LYS 44 3HG LYS 44 -1.019 -14.558 -7.808 331 HD2 LYS 44 2HD LYS 44 -0.080 -16.061 -10.215 332 HD3 LYS 44 3HD LYS 44 0.784 -16.236 -8.685 333 HE2 LYS 44 2HE LYS 44 -1.477 -16.733 -7.640 334 HE3 LYS 44 3HE LYS 44 -2.093 -16.875 -9.286 335 HZ1 LYS 44 3HZ LYS 44 -1.076 -18.838 -9.587 336 HZ2 LYS 44 1HZ LYS 44 -1.076 -18.910 -7.897 337 HZ3 LYS 44 2HZ LYS 44 0.308 -18.396 -8.721 338 H GLU 45 H GLU 45 0.542 -11.618 -8.426 339 HA GLU 45 HA GLU 45 -0.494 -11.786 -5.826 340 HB2 GLU 45 2HB GLU 45 1.806 -10.232 -6.997 341 HB3 GLU 45 3HB GLU 45 1.419 -10.174 -5.283 342 HG2 GLU 45 2HG GLU 45 1.832 -12.796 -6.655 343 HG3 GLU 45 3HG GLU 45 3.208 -11.830 -6.125 344 H ILE 46 H ILE 46 -0.199 -9.011 -8.022 345 HA ILE 46 HA ILE 46 -1.150 -7.023 -6.332 346 HB ILE 46 HB ILE 46 -1.587 -7.246 -9.313 347 HG12 ILE 46 2HG1 ILE 46 0.418 -5.394 -8.819 348 HG13 ILE 46 3HG1 ILE 46 0.760 -6.685 -7.672 349 HG21 ILE 46 1HG2 ILE 46 -2.984 -5.523 -8.802 350 HG22 ILE 46 2HG2 ILE 46 -2.109 -5.103 -7.331 351 HG23 ILE 46 3HG2 ILE 46 -1.469 -4.626 -8.904 352 HD11 ILE 46 3HD1 ILE 46 0.153 -7.800 -10.236 353 HD12 ILE 46 1HD1 ILE 46 1.417 -6.580 -10.387 354 HD13 ILE 46 2HD1 ILE 46 1.626 -7.933 -9.275 355 H PHE 47 H PHE 47 -2.918 -9.349 -8.304 356 HA PHE 47 HA PHE 47 -5.476 -8.287 -8.126 357 HB2 PHE 47 2HB PHE 47 -5.592 -10.073 -9.508 358 HB3 PHE 47 3HB PHE 47 -4.313 -10.935 -8.658 359 HD1 PHE 47 HD1 PHE 47 -4.845 -12.290 -6.670 360 HD2 PHE 47 HD2 PHE 47 -7.883 -10.469 -9.031 361 HE1 PHE 47 HE1 PHE 47 -6.521 -13.778 -5.655 362 HE2 PHE 47 HE2 PHE 47 -9.564 -11.954 -8.019 363 HZ PHE 47 HZ PHE 47 -8.884 -13.611 -6.328 364 H ARG 48 H ARG 48 -3.679 -10.246 -5.817 365 HA ARG 48 HA ARG 48 -5.820 -10.735 -4.037 366 HB2 ARG 48 2HB ARG 48 -3.049 -11.344 -4.181 367 HB3 ARG 48 3HB ARG 48 -3.342 -10.596 -2.616 368 HG2 ARG 48 2HG ARG 48 -4.746 -13.012 -3.738 369 HG3 ARG 48 3HG ARG 48 -3.547 -12.992 -2.443 370 HD2 ARG 48 2HD ARG 48 -5.485 -11.169 -1.637 371 HD3 ARG 48 3HD ARG 48 -6.398 -12.506 -2.336 372 HE ARG 48 HE ARG 48 -4.864 -12.534 0.099 373 HH11 ARG 48 1HH1 ARG 48 -6.229 -14.459 -2.461 374 HH12 ARG 48 2HH1 ARG 48 -6.285 -15.910 -1.516 375 HH21 ARG 48 1HH2 ARG 48 -4.933 -14.438 1.353 376 HH22 ARG 48 2HH2 ARG 48 -5.549 -15.897 0.653 377 H ILE 49 H ILE 49 -4.155 -7.902 -4.781 378 HA ILE 49 HA ILE 49 -4.673 -6.685 -2.168 379 HB ILE 49 HB ILE 49 -3.335 -5.348 -4.510 380 HG12 ILE 49 2HG1 ILE 49 -2.115 -7.415 -4.034 381 HG13 ILE 49 3HG1 ILE 49 -1.180 -6.015 -3.518 382 HG21 ILE 49 1HG2 ILE 49 -2.281 -4.517 -2.046 383 HG22 ILE 49 2HG2 ILE 49 -3.326 -3.607 -3.135 384 HG23 ILE 49 3HG2 ILE 49 -4.032 -4.574 -1.840 385 HD11 ILE 49 3HD1 ILE 49 -2.162 -8.257 -1.984 386 HD12 ILE 49 1HD1 ILE 49 -0.929 -7.062 -1.582 387 HD13 ILE 49 2HD1 ILE 49 -2.630 -6.713 -1.273 388 H LEU 50 H LEU 50 -6.082 -7.005 -5.217 389 HA LEU 50 HA LEU 50 -7.522 -4.471 -5.072 390 HB2 LEU 50 2HB LEU 50 -7.068 -6.542 -7.137 391 HB3 LEU 50 3HB LEU 50 -8.599 -5.673 -7.206 392 HG LEU 50 HG LEU 50 -6.830 -3.618 -6.982 393 HD11 LEU 50 1HD1 LEU 50 -5.501 -5.545 -8.862 394 HD12 LEU 50 2HD1 LEU 50 -4.991 -5.366 -7.184 395 HD13 LEU 50 3HD1 LEU 50 -4.913 -3.988 -8.281 396 HD21 LEU 50 3HD2 LEU 50 -7.189 -3.304 -9.388 397 HD22 LEU 50 1HD2 LEU 50 -8.675 -3.764 -8.557 398 HD23 LEU 50 2HD2 LEU 50 -7.792 -4.958 -9.509 399 H ASP 51 H ASP 51 -7.954 -7.846 -4.434 400 HA ASP 51 HA ASP 51 -10.793 -7.897 -4.491 401 HB2 ASP 51 2HB ASP 51 -9.193 -9.891 -4.567 402 HB3 ASP 51 3HB ASP 51 -9.052 -9.707 -2.821 403 H ASN 52 H ASN 52 -12.134 -6.909 -3.146 404 HA ASN 52 HA ASN 52 -11.194 -6.268 -0.431 405 HB2 ASN 52 2HB ASN 52 -12.654 -4.750 -2.435 406 HB3 ASN 52 3HB ASN 52 -13.511 -4.788 -0.896 407 HD21 ASN 52 1HD2 ASN 52 -10.228 -4.334 -2.162 408 HD22 ASN 52 2HD2 ASN 52 -9.809 -3.049 -1.086 409 H ASP 53 H ASP 53 -12.693 -8.683 -1.728 410 HA ASP 53 HA ASP 53 -14.565 -8.984 0.504 411 HB2 ASP 53 2HB ASP 53 -15.453 -10.053 -2.128 412 HB3 ASP 53 3HB ASP 53 -16.410 -9.453 -0.776 413 H GLN 54 H GLN 54 -11.976 -10.125 -1.110 414 HA GLN 54 HA GLN 54 -10.899 -12.127 -1.277 415 HB2 GLN 54 2HB GLN 54 -12.521 -13.054 1.076 416 HB3 GLN 54 3HB GLN 54 -10.849 -13.423 0.679 417 HG2 GLN 54 2HG GLN 54 -11.797 -10.679 1.454 418 HG3 GLN 54 3HG GLN 54 -11.188 -11.864 2.608 419 HE21 GLN 54 1HE2 GLN 54 -10.387 -9.380 0.509 420 HE22 GLN 54 2HE2 GLN 54 -8.672 -9.586 0.505 421 H SER 55 H SER 55 -13.658 -11.805 -2.495 422 HA SER 55 HA SER 55 -14.903 -14.366 -2.420 423 HB2 SER 55 2HB SER 55 -15.927 -13.372 -4.661 424 HB3 SER 55 3HB SER 55 -16.419 -12.763 -3.080 425 HG SER 55 HG SER 55 -15.905 -10.969 -4.189 426 H GLY 56 H GLY 56 -12.288 -12.998 -4.223 427 HA2 GLY 56 2HA GLY 56 -10.762 -14.691 -5.191 428 HA3 GLY 56 3HA GLY 56 -12.194 -15.448 -5.874 429 H PHE 57 H PHE 57 -13.142 -12.520 -6.316 430 HA PHE 57 HA PHE 57 -11.480 -11.942 -8.670 431 HB2 PHE 57 2HB PHE 57 -14.501 -11.832 -8.682 432 HB3 PHE 57 3HB PHE 57 -13.421 -11.583 -10.050 433 HD1 PHE 57 HD1 PHE 57 -14.808 -14.082 -7.738 434 HD2 PHE 57 HD2 PHE 57 -12.510 -13.418 -11.258 435 HE1 PHE 57 HE1 PHE 57 -14.951 -16.478 -8.280 436 HE2 PHE 57 HE2 PHE 57 -12.651 -15.812 -11.807 437 HZ PHE 57 HZ PHE 57 -13.873 -17.346 -10.317 438 H ILE 58 H ILE 58 -12.055 -9.728 -9.596 439 HA ILE 58 HA ILE 58 -12.555 -7.863 -7.368 440 HB ILE 58 HB ILE 58 -10.791 -7.410 -9.778 441 HG12 ILE 58 2HG1 ILE 58 -9.709 -7.419 -7.012 442 HG13 ILE 58 3HG1 ILE 58 -10.149 -8.981 -7.693 443 HG21 ILE 58 1HG2 ILE 58 -11.772 -5.343 -9.075 444 HG22 ILE 58 2HG2 ILE 58 -11.410 -5.689 -7.385 445 HG23 ILE 58 3HG2 ILE 58 -10.098 -5.372 -8.520 446 HD11 ILE 58 3HD1 ILE 58 -7.787 -8.432 -8.031 447 HD12 ILE 58 1HD1 ILE 58 -8.654 -8.625 -9.554 448 HD13 ILE 58 2HD1 ILE 58 -8.262 -7.011 -8.960 449 H GLU 59 H GLU 59 -14.800 -7.809 -7.858 450 HA GLU 59 HA GLU 59 -15.958 -7.298 -10.320 451 HB2 GLU 59 2HB GLU 59 -16.932 -6.230 -7.666 452 HB3 GLU 59 3HB GLU 59 -17.900 -6.510 -9.107 453 HG2 GLU 59 2HG GLU 59 -18.415 -8.445 -8.127 454 HG3 GLU 59 3HG GLU 59 -16.835 -8.971 -8.705 455 H GLU 60 H GLU 60 -17.219 -5.174 -10.776 456 HA GLU 60 HA GLU 60 -15.339 -3.182 -11.395 457 HB2 GLU 60 2HB GLU 60 -18.329 -3.333 -11.470 458 HB3 GLU 60 3HB GLU 60 -17.532 -1.791 -11.750 459 HG2 GLU 60 2HG GLU 60 -16.518 -2.522 -13.703 460 HG3 GLU 60 3HG GLU 60 -16.723 -4.223 -13.288 461 H ASP 61 H ASP 61 -17.497 -3.601 -8.675 462 HA ASP 61 HA ASP 61 -17.400 -1.001 -7.624 463 HB2 ASP 61 2HB ASP 61 -18.920 -2.928 -6.922 464 HB3 ASP 61 3HB ASP 61 -17.566 -3.510 -5.957 465 H GLU 62 H GLU 62 -15.016 -3.450 -7.781 466 HA GLU 62 HA GLU 62 -13.356 -2.005 -5.822 467 HB2 GLU 62 2HB GLU 62 -12.028 -4.319 -6.072 468 HB3 GLU 62 3HB GLU 62 -13.317 -4.082 -4.900 469 HG2 GLU 62 2HG GLU 62 -14.883 -4.980 -6.701 470 HG3 GLU 62 3HG GLU 62 -13.421 -5.517 -7.527 471 H LEU 63 H LEU 63 -13.715 -2.930 -9.093 472 HA LEU 63 HA LEU 63 -10.977 -2.817 -9.869 473 HB2 LEU 63 2HB LEU 63 -13.164 -3.751 -11.064 474 HB3 LEU 63 3HB LEU 63 -13.121 -2.155 -11.811 475 HG LEU 63 HG LEU 63 -11.001 -4.293 -11.972 476 HD11 LEU 63 1HD1 LEU 63 -13.166 -3.337 -13.744 477 HD12 LEU 63 2HD1 LEU 63 -12.459 -4.943 -13.577 478 HD13 LEU 63 3HD1 LEU 63 -11.614 -3.701 -14.499 479 HD21 LEU 63 3HD2 LEU 63 -9.852 -2.214 -11.848 480 HD22 LEU 63 1HD2 LEU 63 -11.002 -1.441 -12.940 481 HD23 LEU 63 2HD2 LEU 63 -9.902 -2.678 -13.549 482 H LYS 64 H LYS 64 -13.540 -0.462 -9.536 483 HA LYS 64 HA LYS 64 -12.410 1.640 -11.013 484 HB2 LYS 64 2HB LYS 64 -13.818 3.101 -9.484 485 HB3 LYS 64 3HB LYS 64 -14.679 1.859 -10.383 486 HG2 LYS 64 2HG LYS 64 -15.138 0.626 -8.513 487 HG3 LYS 64 3HG LYS 64 -13.727 1.223 -7.638 488 HD2 LYS 64 2HD LYS 64 -15.783 2.112 -6.678 489 HD3 LYS 64 3HD LYS 64 -14.812 3.405 -7.385 490 HE2 LYS 64 2HE LYS 64 -16.492 3.985 -8.717 491 HE3 LYS 64 3HE LYS 64 -16.575 2.351 -9.373 492 HZ1 LYS 64 3HZ LYS 64 -17.765 2.070 -6.976 493 HZ2 LYS 64 1HZ LYS 64 -18.586 2.326 -8.433 494 HZ3 LYS 64 2HZ LYS 64 -18.253 3.630 -7.409 495 H TYR 65 H TYR 65 -11.797 0.469 -7.778 496 HA TYR 65 HA TYR 65 -10.243 2.763 -6.996 497 HB2 TYR 65 2HB TYR 65 -10.740 0.064 -5.751 498 HB3 TYR 65 3HB TYR 65 -9.607 1.218 -5.055 499 HD1 TYR 65 HD1 TYR 65 -11.012 3.768 -5.452 500 HD2 TYR 65 HD2 TYR 65 -12.519 -0.026 -4.254 501 HE1 TYR 65 HE1 TYR 65 -12.863 4.882 -4.276 502 HE2 TYR 65 HE2 TYR 65 -14.375 1.077 -3.075 503 HH TYR 65 HH TYR 65 -15.547 3.668 -3.506 504 H PHE 66 H PHE 66 -9.571 0.918 -9.374 505 HA PHE 66 HA PHE 66 -7.219 -0.478 -8.913 506 HB2 PHE 66 2HB PHE 66 -8.299 -0.720 -11.025 507 HB3 PHE 66 3HB PHE 66 -8.190 1.006 -11.355 508 HD1 PHE 66 HD1 PHE 66 -5.954 -1.890 -10.626 509 HD2 PHE 66 HD2 PHE 66 -6.557 1.721 -12.796 510 HE1 PHE 66 HE1 PHE 66 -3.835 -2.259 -11.820 511 HE2 PHE 66 HE2 PHE 66 -4.439 1.358 -13.995 512 HZ PHE 66 HZ PHE 66 -3.076 -0.634 -13.508 513 H LEU 67 H LEU 67 -7.756 2.954 -9.284 514 HA LEU 67 HA LEU 67 -4.945 3.577 -9.498 515 HB2 LEU 67 2HB LEU 67 -7.026 5.604 -8.821 516 HB3 LEU 67 3HB LEU 67 -5.576 5.775 -9.808 517 HG LEU 67 HG LEU 67 -8.254 4.662 -10.563 518 HD11 LEU 67 1HD1 LEU 67 -6.809 6.283 -12.476 519 HD12 LEU 67 2HD1 LEU 67 -7.002 7.104 -10.927 520 HD13 LEU 67 3HD1 LEU 67 -8.419 6.507 -11.791 521 HD21 LEU 67 3HD2 LEU 67 -6.968 2.947 -11.429 522 HD22 LEU 67 1HD2 LEU 67 -5.584 3.997 -11.731 523 HD23 LEU 67 2HD2 LEU 67 -7.006 4.095 -12.769 524 H GLN 68 H GLN 68 -6.990 2.750 -6.993 525 HA GLN 68 HA GLN 68 -5.632 4.395 -4.999 526 HB2 GLN 68 2HB GLN 68 -8.181 2.993 -5.163 527 HB3 GLN 68 3HB GLN 68 -7.343 2.680 -3.648 528 HG2 GLN 68 2HG GLN 68 -8.135 4.596 -2.888 529 HG3 GLN 68 3HG GLN 68 -7.116 5.429 -4.060 530 HE21 GLN 68 1HE2 GLN 68 -8.280 4.927 -6.415 531 HE22 GLN 68 2HE2 GLN 68 -9.885 5.564 -6.461 532 H ARG 69 H ARG 69 -4.783 1.765 -6.585 533 HA ARG 69 HA ARG 69 -3.809 0.282 -4.243 534 HB2 ARG 69 2HB ARG 69 -3.443 -0.789 -6.991 535 HB3 ARG 69 3HB ARG 69 -3.820 -1.634 -5.495 536 HG2 ARG 69 2HG ARG 69 -5.731 -0.001 -7.152 537 HG3 ARG 69 3HG ARG 69 -5.681 -1.760 -7.030 538 HD2 ARG 69 2HD ARG 69 -6.513 0.253 -4.972 539 HD3 ARG 69 3HD ARG 69 -7.401 -1.144 -5.578 540 HE ARG 69 HE ARG 69 -5.276 -2.283 -4.388 541 HH11 ARG 69 1HH1 ARG 69 -7.546 0.134 -3.326 542 HH12 ARG 69 2HH1 ARG 69 -7.441 -0.314 -1.655 543 HH21 ARG 69 1HH2 ARG 69 -5.130 -2.882 -2.192 544 HH22 ARG 69 2HH2 ARG 69 -6.065 -2.030 -1.012 545 H PHE 70 H PHE 70 -2.804 2.080 -7.057 546 HA PHE 70 HA PHE 70 0.011 1.483 -6.507 547 HB2 PHE 70 2HB PHE 70 -1.341 2.843 -8.843 548 HB3 PHE 70 3HB PHE 70 0.406 2.714 -8.669 549 HD1 PHE 70 HD1 PHE 70 -2.665 0.613 -8.756 550 HD2 PHE 70 HD2 PHE 70 1.506 0.891 -9.558 551 HE1 PHE 70 HE1 PHE 70 -2.727 -1.600 -9.831 552 HE2 PHE 70 HE2 PHE 70 1.450 -1.320 -10.634 553 HZ PHE 70 HZ PHE 70 -0.668 -2.568 -10.773 554 H GLU 71 H GLU 71 -2.365 3.947 -6.160 555 HA GLU 71 HA GLU 71 -0.278 5.882 -5.398 556 HB2 GLU 71 2HB GLU 71 -2.043 6.353 -7.295 557 HB3 GLU 71 3HB GLU 71 -3.099 6.711 -5.936 558 HG2 GLU 71 2HG GLU 71 -0.444 8.025 -6.463 559 HG3 GLU 71 3HG GLU 71 -2.020 8.713 -6.849 560 H SER 72 H SER 72 -3.263 4.317 -4.447 561 HA SER 72 HA SER 72 -4.296 4.076 -2.434 562 HB2 SER 72 2HB SER 72 -1.854 5.206 -1.084 563 HB3 SER 72 3HB SER 72 -2.972 3.976 -0.493 564 HG SER 72 HG SER 72 -2.159 2.609 -2.189 565 H GLY 73 H GLY 73 -5.263 6.155 -3.622 566 HA2 GLY 73 2HA GLY 73 -6.422 7.790 -1.823 567 HA3 GLY 73 3HA GLY 73 -4.889 8.599 -2.110 568 H ALA 74 H ALA 74 -5.011 7.490 -4.952 569 HA ALA 74 HA ALA 74 -5.951 9.785 -6.221 570 HB1 ALA 74 1HB ALA 74 -6.090 8.052 -8.238 571 HB2 ALA 74 2HB ALA 74 -4.556 8.648 -7.604 572 HB3 ALA 74 3HB ALA 74 -5.164 7.070 -7.104 573 H ARG 75 H ARG 75 -7.642 9.436 -8.153 574 HA ARG 75 HA ARG 75 -10.176 9.096 -6.834 575 HB2 ARG 75 2HB ARG 75 -11.133 9.807 -8.996 576 HB3 ARG 75 3HB ARG 75 -9.893 10.912 -8.419 577 HG2 ARG 75 2HG ARG 75 -8.276 9.866 -9.947 578 HG3 ARG 75 3HG ARG 75 -9.557 8.814 -10.552 579 HD2 ARG 75 2HD ARG 75 -9.423 11.820 -10.741 580 HD3 ARG 75 3HD ARG 75 -9.280 10.664 -12.064 581 HE ARG 75 HE ARG 75 -11.584 10.320 -11.993 582 HH11 ARG 75 1HH1 ARG 75 -10.539 12.494 -9.482 583 HH12 ARG 75 2HH1 ARG 75 -12.138 13.060 -9.127 584 HH21 ARG 75 1HH2 ARG 75 -13.693 11.059 -11.535 585 HH22 ARG 75 2HH2 ARG 75 -13.931 12.243 -10.295 586 H VAL 76 H VAL 76 -11.933 7.996 -8.384 587 HA VAL 76 HA VAL 76 -10.977 5.244 -8.773 588 HB VAL 76 HB VAL 76 -13.098 4.448 -8.263 589 HG11 VAL 76 1HG1 VAL 76 -13.708 5.421 -6.171 590 HG12 VAL 76 2HG1 VAL 76 -11.957 5.567 -6.336 591 HG13 VAL 76 3HG1 VAL 76 -12.991 6.969 -6.617 592 HG21 VAL 76 3HG2 VAL 76 -14.053 7.149 -9.122 593 HG22 VAL 76 1HG2 VAL 76 -14.558 5.553 -9.678 594 HG23 VAL 76 2HG2 VAL 76 -15.067 6.137 -8.093 595 H LEU 77 H LEU 77 -11.599 4.054 -10.610 596 HA LEU 77 HA LEU 77 -11.473 5.385 -13.047 597 HB2 LEU 77 2HB LEU 77 -12.692 2.675 -12.549 598 HB3 LEU 77 3HB LEU 77 -12.052 3.276 -14.077 599 HG LEU 77 HG LEU 77 -10.421 2.723 -11.598 600 HD11 LEU 77 1HD1 LEU 77 -10.711 1.165 -14.163 601 HD12 LEU 77 2HD1 LEU 77 -11.256 0.665 -12.562 602 HD13 LEU 77 3HD1 LEU 77 -9.532 0.833 -12.893 603 HD21 LEU 77 3HD2 LEU 77 -9.750 3.757 -14.330 604 HD22 LEU 77 1HD2 LEU 77 -8.558 2.890 -13.363 605 HD23 LEU 77 2HD2 LEU 77 -9.269 4.384 -12.753 606 H THR 78 H THR 78 -12.941 6.179 -14.460 607 HA THR 78 HA THR 78 -15.579 6.738 -13.484 608 HB THR 78 HB THR 78 -14.358 8.394 -14.827 609 HG1 THR 78 HG1 THR 78 -16.128 8.928 -16.153 610 HG21 THR 78 3HG2 THR 78 -14.829 7.338 -17.442 611 HG22 THR 78 1HG2 THR 78 -13.869 6.182 -16.520 612 HG23 THR 78 2HG2 THR 78 -13.306 7.843 -16.711 613 H ALA 79 H ALA 79 -17.300 6.599 -15.497 614 HA ALA 79 HA ALA 79 -17.924 3.818 -15.646 615 HB1 ALA 79 1HB ALA 79 -19.800 5.174 -15.482 616 HB2 ALA 79 2HB ALA 79 -19.208 6.312 -16.693 617 HB3 ALA 79 3HB ALA 79 -19.789 4.722 -17.187 618 H SER 80 H SER 80 -15.822 5.675 -17.404 619 HA SER 80 HA SER 80 -16.156 4.014 -19.815 620 HB2 SER 80 2HB SER 80 -16.440 6.441 -20.215 621 HB3 SER 80 3HB SER 80 -14.817 6.722 -19.585 622 HG SER 80 HG SER 80 -15.150 6.479 -21.979 623 H GLU 81 H GLU 81 -14.339 4.330 -17.091 624 HA GLU 81 HA GLU 81 -11.814 3.563 -18.360 625 HB2 GLU 81 2HB GLU 81 -12.539 4.464 -15.582 626 HB3 GLU 81 3HB GLU 81 -10.988 3.712 -15.925 627 HG2 GLU 81 2HG GLU 81 -10.374 5.465 -17.407 628 HG3 GLU 81 3HG GLU 81 -11.998 6.148 -17.366 629 H THR 82 H THR 82 -13.719 2.497 -15.536 630 HA THR 82 HA THR 82 -12.529 0.059 -15.110 631 HB THR 82 HB THR 82 -15.199 -0.489 -14.611 632 HG1 THR 82 HG1 THR 82 -14.819 2.211 -13.867 633 HG21 THR 82 3HG2 THR 82 -12.886 -0.279 -13.189 634 HG22 THR 82 1HG2 THR 82 -14.470 -0.593 -12.482 635 HG23 THR 82 2HG2 THR 82 -13.830 1.050 -12.518 636 H LYS 83 H LYS 83 -15.296 0.738 -17.241 637 HA LYS 83 HA LYS 83 -15.852 -1.805 -18.133 638 HB2 LYS 83 2HB LYS 83 -16.054 0.895 -19.412 639 HB3 LYS 83 3HB LYS 83 -16.406 -0.539 -20.366 640 HG2 LYS 83 2HG LYS 83 -17.732 -0.384 -17.740 641 HG3 LYS 83 3HG LYS 83 -18.246 0.798 -18.946 642 HD2 LYS 83 2HD LYS 83 -18.776 -0.960 -20.510 643 HD3 LYS 83 3HD LYS 83 -18.123 -2.180 -19.414 644 HE2 LYS 83 2HE LYS 83 -20.335 -2.381 -18.908 645 HE3 LYS 83 3HE LYS 83 -19.898 -1.113 -17.764 646 HZ1 LYS 83 3HZ LYS 83 -21.769 -0.255 -18.754 647 HZ2 LYS 83 1HZ LYS 83 -21.412 -0.901 -20.276 648 HZ3 LYS 83 2HZ LYS 83 -20.557 0.442 -19.706 649 H THR 84 H THR 84 -13.476 0.475 -19.472 650 HA THR 84 HA THR 84 -12.566 -1.052 -21.601 651 HB THR 84 HB THR 84 -10.793 0.705 -19.901 652 HG1 THR 84 HG1 THR 84 -12.357 1.555 -22.115 653 HG21 THR 84 3HG2 THR 84 -9.938 -0.788 -21.866 654 HG22 THR 84 1HG2 THR 84 -9.407 0.889 -21.745 655 HG23 THR 84 2HG2 THR 84 -10.684 0.448 -22.879 656 H PHE 85 H PHE 85 -11.089 -0.834 -18.358 657 HA PHE 85 HA PHE 85 -9.124 -2.738 -18.660 658 HB2 PHE 85 2HB PHE 85 -9.667 -1.197 -16.648 659 HB3 PHE 85 3HB PHE 85 -10.677 -2.529 -16.095 660 HD1 PHE 85 HD2 PHE 85 -9.648 -4.712 -15.553 661 HD2 PHE 85 HD1 PHE 85 -7.308 -1.279 -16.478 662 HE1 PHE 85 HE2 PHE 85 -7.675 -5.791 -14.554 663 HE2 PHE 85 HE1 PHE 85 -5.331 -2.354 -15.482 664 HZ PHE 85 HZ PHE 85 -5.513 -4.612 -14.517 665 H LEU 86 H LEU 86 -12.475 -3.243 -17.595 666 HA LEU 86 HA LEU 86 -12.268 -6.026 -17.217 667 HB2 LEU 86 2HB LEU 86 -14.081 -4.590 -16.327 668 HB3 LEU 86 3HB LEU 86 -14.716 -4.434 -17.964 669 HG LEU 86 HG LEU 86 -14.805 -7.062 -17.827 670 HD11 LEU 86 1HD1 LEU 86 -14.447 -6.184 -15.018 671 HD12 LEU 86 2HD1 LEU 86 -13.959 -7.681 -15.811 672 HD13 LEU 86 3HD1 LEU 86 -15.640 -7.443 -15.337 673 HD21 LEU 86 3HD2 LEU 86 -16.985 -6.650 -17.911 674 HD22 LEU 86 1HD2 LEU 86 -16.631 -4.968 -17.514 675 HD23 LEU 86 2HD2 LEU 86 -17.003 -6.117 -16.229 676 H ALA 87 H ALA 87 -13.032 -4.064 -20.032 677 HA ALA 87 HA ALA 87 -13.647 -6.381 -21.660 678 HB1 ALA 87 1HB ALA 87 -14.949 -4.505 -22.194 679 HB2 ALA 87 2HB ALA 87 -13.551 -3.430 -22.206 680 HB3 ALA 87 3HB ALA 87 -13.763 -4.615 -23.495 681 H ALA 88 H ALA 88 -10.858 -5.249 -20.492 682 HA ALA 88 HA ALA 88 -9.350 -5.878 -22.947 683 HB1 ALA 88 1HB ALA 88 -8.983 -3.584 -22.294 684 HB2 ALA 88 2HB ALA 88 -8.561 -4.084 -20.656 685 HB3 ALA 88 3HB ALA 88 -7.515 -4.518 -22.008 686 H ALA 89 H ALA 89 -10.069 -6.821 -19.768 687 HA ALA 89 HA ALA 89 -7.775 -8.674 -19.756 688 HB1 ALA 89 1HB ALA 89 -8.798 -6.906 -17.691 689 HB2 ALA 89 2HB ALA 89 -8.667 -8.579 -17.147 690 HB3 ALA 89 3HB ALA 89 -7.252 -7.750 -17.797 691 H ASP 90 H ASP 90 -11.056 -8.330 -18.386 692 HA ASP 90 HA ASP 90 -11.468 -11.078 -17.969 693 HB2 ASP 90 2HB ASP 90 -13.192 -8.655 -18.049 694 HB3 ASP 90 3HB ASP 90 -13.993 -10.217 -18.201 695 H HIS 91 H HIS 91 -13.350 -9.168 -20.299 696 HA HIS 91 HA HIS 91 -14.036 -9.598 -22.428 697 HB2 HIS 91 2HB HIS 91 -11.515 -10.125 -22.664 698 HB3 HIS 91 3HB HIS 91 -12.012 -11.814 -22.627 699 HD1 HIS 91 HD1 HIS 91 -10.754 -11.299 -25.136 700 HD2 HIS 91 HD2 HIS 91 -14.707 -10.163 -24.549 701 HE1 HIS 91 HE1 HIS 91 -11.735 -11.064 -27.440 702 H ASP 92 H ASP 92 -14.525 -11.470 -19.902 703 HA ASP 92 HA ASP 92 -15.854 -13.643 -21.368 704 HB2 ASP 92 2HB ASP 92 -16.102 -14.334 -18.746 705 HB3 ASP 92 3HB ASP 92 -14.768 -14.834 -19.782 706 H GLY 93 H GLY 93 -16.453 -10.734 -19.736 707 HA2 GLY 93 2HA GLY 93 -18.460 -9.617 -19.455 708 HA3 GLY 93 3HA GLY 93 -19.291 -11.030 -20.087 709 H ASP 94 H ASP 94 -17.095 -11.510 -17.480 710 HA ASP 94 HA ASP 94 -19.220 -12.440 -15.787 711 HB2 ASP 94 2HB ASP 94 -16.304 -12.090 -15.073 712 HB3 ASP 94 3HB ASP 94 -17.481 -13.124 -14.268 713 H GLY 95 H GLY 95 -17.076 -9.643 -15.878 714 HA2 GLY 95 2HA GLY 95 -17.566 -7.526 -15.002 715 HA3 GLY 95 3HA GLY 95 -18.885 -8.236 -14.083 716 H LYS 96 H LYS 96 -15.810 -9.786 -13.942 717 HA LYS 96 HA LYS 96 -14.873 -8.341 -11.635 718 HB2 LYS 96 2HB LYS 96 -14.957 -10.303 -10.115 719 HB3 LYS 96 3HB LYS 96 -16.550 -9.691 -10.541 720 HG2 LYS 96 2HG LYS 96 -15.574 -11.800 -12.315 721 HG3 LYS 96 3HG LYS 96 -15.787 -12.303 -10.637 722 HD2 LYS 96 2HD LYS 96 -18.008 -10.686 -11.539 723 HD3 LYS 96 3HD LYS 96 -17.764 -12.083 -12.590 724 HE2 LYS 96 2HE LYS 96 -17.627 -12.580 -9.680 725 HE3 LYS 96 3HE LYS 96 -19.211 -12.162 -10.329 726 HZ1 LYS 96 3HZ LYS 96 -18.235 -14.639 -10.289 727 HZ2 LYS 96 1HZ LYS 96 -17.729 -14.154 -11.829 728 HZ3 LYS 96 2HZ LYS 96 -19.370 -14.103 -11.423 729 H ILE 97 H ILE 97 -12.757 -8.251 -11.952 730 HA ILE 97 HA ILE 97 -11.344 -9.917 -13.724 731 HB ILE 97 HB ILE 97 -10.291 -8.131 -11.529 732 HG12 ILE 97 2HG1 ILE 97 -11.686 -7.198 -13.516 733 HG13 ILE 97 3HG1 ILE 97 -10.163 -6.418 -13.106 734 HG21 ILE 97 1HG2 ILE 97 -8.935 -9.790 -13.589 735 HG22 ILE 97 2HG2 ILE 97 -8.257 -8.208 -13.209 736 HG23 ILE 97 3HG2 ILE 97 -8.446 -9.414 -11.937 737 HD11 ILE 97 3HD1 ILE 97 -10.894 -7.198 -15.595 738 HD12 ILE 97 1HD1 ILE 97 -9.231 -6.953 -15.063 739 HD13 ILE 97 2HD1 ILE 97 -9.925 -8.574 -15.067 740 H GLY 98 H GLY 98 -9.726 -11.485 -13.321 741 HA2 GLY 98 2HA GLY 98 -9.759 -12.679 -10.629 742 HA3 GLY 98 3HA GLY 98 -10.077 -13.684 -12.035 743 H ALA 99 H ALA 99 -8.254 -14.966 -11.390 744 HA ALA 99 HA ALA 99 -5.638 -13.690 -11.761 745 HB1 ALA 99 1HB ALA 99 -6.222 -16.449 -10.700 746 HB2 ALA 99 2HB ALA 99 -4.682 -15.590 -10.655 747 HB3 ALA 99 3HB ALA 99 -6.043 -15.012 -9.694 748 H GLU 100 H GLU 100 -7.854 -15.082 -13.654 749 HA GLU 100 HA GLU 100 -5.844 -16.435 -15.332 750 HB2 GLU 100 2HB GLU 100 -8.688 -17.093 -14.723 751 HB3 GLU 100 3HB GLU 100 -8.078 -17.467 -16.329 752 HG2 GLU 100 2HG GLU 100 -6.402 -18.905 -15.445 753 HG3 GLU 100 3HG GLU 100 -6.750 -18.388 -13.796 754 H GLU 101 H GLU 101 -7.698 -13.712 -15.044 755 HA GLU 101 HA GLU 101 -7.650 -13.270 -17.955 756 HB2 GLU 101 2HB GLU 101 -9.676 -11.895 -17.735 757 HB3 GLU 101 3HB GLU 101 -9.962 -13.560 -17.246 758 HG2 GLU 101 2HG GLU 101 -9.366 -12.553 -14.863 759 HG3 GLU 101 3HG GLU 101 -9.953 -11.080 -15.633 760 H PHE 102 H PHE 102 -6.254 -12.447 -15.155 761 HA PHE 102 HA PHE 102 -6.134 -9.572 -15.603 762 HB2 PHE 102 2HB PHE 102 -6.339 -10.379 -13.298 763 HB3 PHE 102 3HB PHE 102 -4.845 -11.295 -13.475 764 HD1 PHE 102 HD1 PHE 102 -2.690 -10.149 -13.584 765 HD2 PHE 102 HD2 PHE 102 -6.317 -8.015 -12.943 766 HE1 PHE 102 HE1 PHE 102 -1.403 -8.198 -12.817 767 HE2 PHE 102 HE2 PHE 102 -5.035 -6.060 -12.176 768 HZ PHE 102 HZ PHE 102 -2.574 -6.149 -12.113 769 H GLN 103 H GLN 103 -3.608 -11.987 -14.901 770 HA GLN 103 HA GLN 103 -1.466 -10.582 -15.913 771 HB2 GLN 103 2HB GLN 103 -0.328 -12.758 -16.146 772 HB3 GLN 103 3HB GLN 103 -1.179 -12.613 -14.614 773 HG2 GLN 103 2HG GLN 103 -3.064 -13.768 -16.227 774 HG3 GLN 103 3HG GLN 103 -1.566 -14.493 -16.806 775 HE21 GLN 103 1HE2 GLN 103 -2.694 -13.492 -13.596 776 HE22 GLN 103 2HE2 GLN 103 -2.443 -15.025 -12.840 777 H GLU 104 H GLU 104 -3.762 -12.629 -17.628 778 HA GLU 104 HA GLU 104 -2.470 -12.838 -20.081 779 HB2 GLU 104 2HB GLU 104 -5.450 -12.501 -19.765 780 HB3 GLU 104 3HB GLU 104 -4.593 -13.380 -21.023 781 HG2 GLU 104 2HG GLU 104 -4.860 -14.136 -18.126 782 HG3 GLU 104 3HG GLU 104 -5.556 -14.958 -19.521 783 H MET 105 H MET 105 -4.238 -10.173 -18.677 784 HA MET 105 HA MET 105 -4.340 -8.673 -21.141 785 HB2 MET 105 2HB MET 105 -5.637 -7.148 -20.010 786 HB3 MET 105 3HB MET 105 -5.949 -8.593 -19.058 787 HG2 MET 105 2HG MET 105 -5.413 -7.353 -17.296 788 HG3 MET 105 3HG MET 105 -3.743 -7.540 -17.828 789 HE1 MET 105 3HE MET 105 -6.514 -4.801 -19.611 790 HE2 MET 105 1HE MET 105 -6.940 -5.734 -18.176 791 HE3 MET 105 2HE MET 105 -6.530 -4.025 -18.026 792 H VAL 106 H VAL 106 -2.075 -9.189 -18.659 793 HA VAL 106 HA VAL 106 -0.725 -6.650 -18.920 794 HB VAL 106 HB VAL 106 0.352 -9.146 -17.615 795 HG11 VAL 106 1HG1 VAL 106 1.334 -6.478 -17.978 796 HG12 VAL 106 2HG1 VAL 106 1.112 -6.807 -16.258 797 HG13 VAL 106 3HG1 VAL 106 2.127 -7.867 -17.236 798 HG21 VAL 106 3HG2 VAL 106 -2.006 -7.987 -16.902 799 HG22 VAL 106 1HG2 VAL 106 -0.942 -8.864 -15.801 800 HG23 VAL 106 2HG2 VAL 106 -0.860 -7.105 -15.892 801 H GLN 107 H GLN 107 0.742 -9.867 -19.179 802 HA GLN 107 HA GLN 107 2.738 -9.032 -20.975 803 HB2 GLN 107 2HB GLN 107 1.704 -11.821 -20.433 804 HB3 GLN 107 3HB GLN 107 3.206 -11.439 -21.265 805 HG2 GLN 107 2HG GLN 107 4.303 -11.158 -19.357 806 HG3 GLN 107 3HG GLN 107 3.034 -10.133 -18.688 807 HE21 GLN 107 1HE2 GLN 107 0.936 -11.571 -18.301 808 HE22 GLN 107 2HE2 GLN 107 1.234 -12.971 -17.333 809 H SER 108 H SER 108 -0.438 -10.445 -21.470 810 HA SER 108 HA SER 108 -0.036 -10.203 -24.380 811 HB2 SER 108 2HB SER 108 -0.632 -12.498 -23.126 812 HB3 SER 108 3HB SER 108 -2.266 -11.869 -23.335 813 HG SER 108 HG SER 108 -0.397 -12.661 -25.258 Start of MODEL 17 1 H1 SER 1 H SER 1 0.864 -0.118 -0.506 2 HA SER 1 HA SER 1 1.564 -0.733 -3.044 3 HB2 SER 1 2HB SER 1 3.765 0.293 -2.606 4 HB3 SER 1 3HB SER 1 2.461 1.211 -1.853 5 HG SER 1 HG SER 1 4.307 0.838 -0.476 6 H LEU 2 H LEU 2 2.203 -2.539 -3.995 7 HA LEU 2 HA LEU 2 2.937 -4.891 -2.780 8 HB2 LEU 2 2HB LEU 2 4.011 -4.037 -5.455 9 HB3 LEU 2 3HB LEU 2 3.647 -5.671 -4.902 10 HG LEU 2 HG LEU 2 1.832 -5.362 -6.217 11 HD11 LEU 2 1HD1 LEU 2 -0.032 -5.084 -4.916 12 HD12 LEU 2 2HD1 LEU 2 0.637 -3.698 -4.056 13 HD13 LEU 2 3HD1 LEU 2 1.195 -5.326 -3.672 14 HD21 LEU 2 3HD2 LEU 2 0.782 -2.899 -6.222 15 HD22 LEU 2 1HD2 LEU 2 2.069 -3.401 -7.318 16 HD23 LEU 2 2HD2 LEU 2 2.460 -2.497 -5.855 17 H THR 3 H THR 3 5.255 -2.812 -4.522 18 HA THR 3 HA THR 3 7.495 -2.485 -4.260 19 HB THR 3 HB THR 3 7.993 -2.850 -1.539 20 HG1 THR 3 HG1 THR 3 6.208 -2.039 -0.498 21 HG21 THR 3 3HG2 THR 3 7.912 -0.759 -3.456 22 HG22 THR 3 1HG2 THR 3 8.752 -0.789 -1.906 23 HG23 THR 3 2HG2 THR 3 7.097 -0.187 -2.001 24 H ASP 4 H ASP 4 6.356 -5.299 -4.439 25 HA ASP 4 HA ASP 4 8.827 -6.674 -3.628 26 HB2 ASP 4 2HB ASP 4 6.333 -7.120 -2.481 27 HB3 ASP 4 3HB ASP 4 6.503 -8.426 -3.651 28 H ILE 5 H ILE 5 6.981 -5.698 -6.128 29 HA ILE 5 HA ILE 5 7.964 -7.874 -7.842 30 HB ILE 5 HB ILE 5 5.239 -6.589 -8.057 31 HG12 ILE 5 2HG1 ILE 5 4.706 -9.193 -7.869 32 HG13 ILE 5 3HG1 ILE 5 6.235 -9.191 -6.996 33 HG21 ILE 5 1HG2 ILE 5 6.498 -7.158 -10.211 34 HG22 ILE 5 2HG2 ILE 5 6.271 -8.843 -9.745 35 HG23 ILE 5 3HG2 ILE 5 4.870 -7.808 -10.019 36 HD11 ILE 5 3HD1 ILE 5 4.679 -8.919 -5.319 37 HD12 ILE 5 1HD1 ILE 5 5.184 -7.261 -5.643 38 HD13 ILE 5 2HD1 ILE 5 3.659 -7.862 -6.294 39 H LEU 6 H LEU 6 6.898 -4.525 -7.574 40 HA LEU 6 HA LEU 6 8.630 -3.868 -9.856 41 HB2 LEU 6 2HB LEU 6 5.772 -3.231 -9.440 42 HB3 LEU 6 3HB LEU 6 6.784 -1.937 -10.077 43 HG LEU 6 HG LEU 6 6.888 -4.598 -11.409 44 HD11 LEU 6 1HD1 LEU 6 4.811 -4.584 -12.206 45 HD12 LEU 6 2HD1 LEU 6 4.869 -2.856 -12.551 46 HD13 LEU 6 3HD1 LEU 6 4.436 -3.418 -10.937 47 HD21 LEU 6 3HD2 LEU 6 7.793 -1.936 -11.892 48 HD22 LEU 6 1HD2 LEU 6 6.682 -2.408 -13.178 49 HD23 LEU 6 2HD2 LEU 6 8.098 -3.400 -12.829 50 H SER 7 H SER 7 9.413 -1.655 -9.861 51 HA SER 7 HA SER 7 10.170 -0.812 -7.225 52 HB2 SER 7 2HB SER 7 11.150 -0.447 -9.870 53 HB3 SER 7 3HB SER 7 10.858 1.153 -9.187 54 HG SER 7 HG SER 7 12.777 -0.685 -8.565 55 HA PRO 8 HA PRO 8 7.203 2.314 -6.407 56 HB2 PRO 8 2HB PRO 8 8.712 4.242 -5.235 57 HB3 PRO 8 3HB PRO 8 8.317 2.714 -4.438 58 HG2 PRO 8 2HG PRO 8 10.824 3.513 -5.866 59 HG3 PRO 8 3HG PRO 8 10.639 2.636 -4.336 60 HD2 PRO 8 2HD PRO 8 11.186 1.386 -6.675 61 HD3 PRO 8 3HD PRO 8 10.220 0.630 -5.391 62 H SER 9 H SER 9 10.213 3.782 -7.650 63 HA SER 9 HA SER 9 9.138 6.131 -8.639 64 HB2 SER 9 2HB SER 9 11.088 5.971 -10.332 65 HB3 SER 9 3HB SER 9 11.484 6.012 -8.614 66 HG SER 9 HG SER 9 12.330 4.107 -8.810 67 H ASP 10 H ASP 10 9.475 2.997 -10.264 68 HA ASP 10 HA ASP 10 8.533 3.746 -12.782 69 HB2 ASP 10 2HB ASP 10 8.154 1.073 -11.417 70 HB3 ASP 10 3HB ASP 10 8.085 1.379 -13.150 71 H ILE 11 H ILE 11 6.766 2.579 -9.939 72 HA ILE 11 HA ILE 11 4.216 2.573 -11.183 73 HB ILE 11 HB ILE 11 4.995 2.680 -8.270 74 HG12 ILE 11 2HG1 ILE 11 3.660 0.346 -9.545 75 HG13 ILE 11 3HG1 ILE 11 5.349 0.630 -9.951 76 HG21 ILE 11 1HG2 ILE 11 2.871 3.537 -8.142 77 HG22 ILE 11 2HG2 ILE 11 2.326 2.697 -9.592 78 HG23 ILE 11 3HG2 ILE 11 2.528 1.809 -8.082 79 HD11 ILE 11 3HD1 ILE 11 4.122 -0.161 -7.368 80 HD12 ILE 11 1HD1 ILE 11 5.576 -0.761 -8.164 81 HD13 ILE 11 2HD1 ILE 11 5.600 0.799 -7.343 82 H ALA 12 H ALA 12 5.681 4.840 -8.850 83 HA ALA 12 HA ALA 12 3.625 6.727 -8.861 84 HB1 ALA 12 1HB ALA 12 6.071 8.105 -8.516 85 HB2 ALA 12 2HB ALA 12 4.929 7.573 -7.280 86 HB3 ALA 12 3HB ALA 12 6.248 6.513 -7.778 87 H ALA 13 H ALA 13 6.077 6.064 -11.201 88 HA ALA 13 HA ALA 13 5.892 8.618 -12.526 89 HB1 ALA 13 1HB ALA 13 7.343 6.062 -13.048 90 HB2 ALA 13 2HB ALA 13 7.176 7.251 -14.340 91 HB3 ALA 13 3HB ALA 13 7.979 7.693 -12.833 92 H ALA 14 H ALA 14 4.260 5.578 -12.663 93 HA ALA 14 HA ALA 14 3.128 6.079 -15.292 94 HB1 ALA 14 1HB ALA 14 2.539 3.853 -13.345 95 HB2 ALA 14 2HB ALA 14 2.038 3.931 -15.034 96 HB3 ALA 14 3HB ALA 14 3.748 3.793 -14.627 97 H LEU 15 H LEU 15 2.151 6.144 -11.910 98 HA LEU 15 HA LEU 15 -0.610 6.458 -12.283 99 HB2 LEU 15 2HB LEU 15 1.285 7.214 -10.093 100 HB3 LEU 15 3HB LEU 15 -0.412 7.683 -10.011 101 HG LEU 15 HG LEU 15 0.364 4.815 -10.401 102 HD11 LEU 15 1HD1 LEU 15 1.234 4.656 -8.372 103 HD12 LEU 15 2HD1 LEU 15 -0.256 5.295 -7.681 104 HD13 LEU 15 3HD1 LEU 15 1.044 6.394 -8.140 105 HD21 LEU 15 3HD2 LEU 15 -1.796 4.475 -9.236 106 HD22 LEU 15 1HD2 LEU 15 -1.954 5.357 -10.755 107 HD23 LEU 15 2HD2 LEU 15 -2.026 6.225 -9.221 108 H ARG 16 H ARG 16 1.928 8.912 -11.821 109 HA ARG 16 HA ARG 16 0.170 11.119 -12.167 110 HB2 ARG 16 2HB ARG 16 3.179 10.974 -12.436 111 HB3 ARG 16 3HB ARG 16 2.238 12.456 -12.338 112 HG2 ARG 16 2HG ARG 16 1.381 11.391 -10.099 113 HG3 ARG 16 3HG ARG 16 2.885 10.475 -10.218 114 HD2 ARG 16 2HD ARG 16 2.897 13.446 -10.560 115 HD3 ARG 16 3HD ARG 16 2.852 12.741 -8.944 116 HE ARG 16 HE ARG 16 5.096 12.859 -10.703 117 HH11 ARG 16 1HH1 ARG 16 3.598 10.980 -8.184 118 HH12 ARG 16 2HH1 ARG 16 5.085 10.267 -7.651 119 HH21 ARG 16 1HH2 ARG 16 7.060 11.928 -10.011 120 HH22 ARG 16 2HH2 ARG 16 7.054 10.808 -8.691 121 H ASP 17 H ASP 17 2.078 9.158 -14.335 122 HA ASP 17 HA ASP 17 2.250 10.771 -16.571 123 HB2 ASP 17 2HB ASP 17 3.385 8.753 -16.772 124 HB3 ASP 17 3HB ASP 17 2.015 7.808 -16.194 125 H CYS 18 H CYS 18 -0.467 8.804 -15.463 126 HA CYS 18 HA CYS 18 -2.216 10.326 -17.250 127 HB2 CYS 18 2HB CYS 18 -2.135 7.313 -17.037 128 HB3 CYS 18 3HB CYS 18 -3.468 8.201 -17.765 129 HG CYS 18 HG CYS 18 -1.000 7.019 -19.317 130 H GLN 19 H GLN 19 -1.876 10.792 -14.554 131 HA GLN 19 HA GLN 19 -3.647 9.407 -12.866 132 HB2 GLN 19 2HB GLN 19 -3.537 11.514 -11.469 133 HB3 GLN 19 3HB GLN 19 -1.991 10.767 -11.849 134 HG2 GLN 19 2HG GLN 19 -1.481 12.415 -13.461 135 HG3 GLN 19 3HG GLN 19 -3.130 13.040 -13.445 136 HE21 GLN 19 1HE2 GLN 19 -0.800 12.250 -10.889 137 HE22 GLN 19 2HE2 GLN 19 -0.846 13.802 -10.131 138 H ALA 20 H ALA 20 -4.108 12.124 -15.044 139 HA ALA 20 HA ALA 20 -6.560 13.082 -14.216 140 HB1 ALA 20 1HB ALA 20 -6.866 13.922 -16.447 141 HB2 ALA 20 2HB ALA 20 -5.162 14.062 -16.014 142 HB3 ALA 20 3HB ALA 20 -5.696 12.767 -17.086 143 HA PRO 21 HA PRO 21 -9.513 9.904 -14.911 144 HB2 PRO 21 2HB PRO 21 -11.717 11.394 -15.453 145 HB3 PRO 21 3HB PRO 21 -11.025 11.257 -13.833 146 HG2 PRO 21 2HG PRO 21 -10.704 13.445 -15.850 147 HG3 PRO 21 3HG PRO 21 -10.973 13.566 -14.102 148 HD2 PRO 21 2HD PRO 21 -8.528 13.870 -15.224 149 HD3 PRO 21 3HD PRO 21 -8.756 13.174 -13.607 150 H ASP 22 H ASP 22 -10.321 8.686 -16.554 151 HA ASP 22 HA ASP 22 -10.537 7.914 -18.688 152 HB2 ASP 22 2HB ASP 22 -12.484 9.524 -18.451 153 HB3 ASP 22 3HB ASP 22 -11.510 10.699 -19.330 154 H SER 23 H SER 23 -7.991 9.176 -17.956 155 HA SER 23 HA SER 23 -7.107 10.066 -20.624 156 HB2 SER 23 2HB SER 23 -6.888 11.550 -18.417 157 HB3 SER 23 3HB SER 23 -5.422 10.591 -18.221 158 HG SER 23 HG SER 23 -5.609 12.706 -19.640 159 H PHE 24 H PHE 24 -6.750 7.735 -18.126 160 HA PHE 24 HA PHE 24 -4.258 6.703 -19.257 161 HB2 PHE 24 2HB PHE 24 -3.871 5.672 -17.254 162 HB3 PHE 24 3HB PHE 24 -4.937 6.952 -16.683 163 HD1 PHE 24 HD2 PHE 24 -7.558 6.231 -17.037 164 HD2 PHE 24 HD1 PHE 24 -4.270 3.621 -16.337 165 HE1 PHE 24 HE2 PHE 24 -9.097 4.543 -16.124 166 HE2 PHE 24 HE1 PHE 24 -5.804 1.927 -15.424 167 HZ PHE 24 HZ PHE 24 -8.221 2.388 -15.315 168 H SER 25 H SER 25 -4.225 4.153 -19.172 169 HA SER 25 HA SER 25 -6.715 3.010 -20.172 170 HB2 SER 25 2HB SER 25 -4.483 3.752 -21.870 171 HB3 SER 25 3HB SER 25 -4.802 2.020 -21.956 172 HG SER 25 HG SER 25 -6.313 4.142 -22.847 173 HA PRO 26 HA PRO 26 -5.384 -0.618 -18.095 174 HB2 PRO 26 2HB PRO 26 -6.399 -2.577 -19.678 175 HB3 PRO 26 3HB PRO 26 -7.408 -1.552 -18.651 176 HG2 PRO 26 2HG PRO 26 -6.853 -1.332 -21.584 177 HG3 PRO 26 3HG PRO 26 -8.390 -1.145 -20.719 178 HD2 PRO 26 2HD PRO 26 -6.917 0.971 -21.549 179 HD3 PRO 26 3HD PRO 26 -7.909 1.016 -20.077 180 H LYS 27 H LYS 27 -4.300 0.068 -21.260 181 HA LYS 27 HA LYS 27 -2.180 -1.963 -20.996 182 HB2 LYS 27 2HB LYS 27 -2.145 -2.292 -23.342 183 HB3 LYS 27 3HB LYS 27 -3.839 -2.354 -22.872 184 HG2 LYS 27 2HG LYS 27 -3.455 0.305 -23.462 185 HG3 LYS 27 3HG LYS 27 -2.464 -0.526 -24.663 186 HD2 LYS 27 2HD LYS 27 -4.624 -0.284 -25.615 187 HD3 LYS 27 3HD LYS 27 -4.469 -1.978 -25.143 188 HE2 LYS 27 2HE LYS 27 -5.918 -1.741 -23.348 189 HE3 LYS 27 3HE LYS 27 -5.685 0.004 -23.261 190 HZ1 LYS 27 3HZ LYS 27 -7.743 -0.125 -24.215 191 HZ2 LYS 27 1HZ LYS 27 -7.405 -1.553 -25.057 192 HZ3 LYS 27 2HZ LYS 27 -6.783 -0.080 -25.607 193 H LYS 28 H LYS 28 -2.243 0.800 -20.032 194 HA LYS 28 HA LYS 28 0.125 1.769 -21.474 195 HB2 LYS 28 2HB LYS 28 -2.328 3.344 -20.725 196 HB3 LYS 28 3HB LYS 28 -0.773 4.128 -20.965 197 HG2 LYS 28 2HG LYS 28 -2.012 2.366 -23.054 198 HG3 LYS 28 3HG LYS 28 -2.369 4.090 -22.935 199 HD2 LYS 28 2HD LYS 28 0.050 4.565 -23.136 200 HD3 LYS 28 3HD LYS 28 0.346 2.839 -23.351 201 HE2 LYS 28 2HE LYS 28 0.280 4.045 -25.491 202 HE3 LYS 28 3HE LYS 28 -0.994 2.833 -25.371 203 HZ1 LYS 28 3HZ LYS 28 -2.616 4.447 -25.108 204 HZ2 LYS 28 1HZ LYS 28 -1.589 5.142 -26.260 205 HZ3 LYS 28 2HZ LYS 28 -1.514 5.645 -24.647 206 H PHE 29 H PHE 29 -0.681 0.410 -18.804 207 HA PHE 29 HA PHE 29 0.724 2.296 -17.031 208 HB2 PHE 29 2HB PHE 29 -1.726 1.113 -16.635 209 HB3 PHE 29 3HB PHE 29 -0.646 0.043 -15.747 210 HD1 PHE 29 HD1 PHE 29 0.969 1.149 -14.077 211 HD2 PHE 29 HD2 PHE 29 -2.478 3.075 -15.667 212 HE1 PHE 29 HE1 PHE 29 0.988 2.732 -12.192 213 HE2 PHE 29 HE2 PHE 29 -2.464 4.661 -13.786 214 HZ PHE 29 HZ PHE 29 -0.729 4.491 -12.046 215 H PHE 30 H PHE 30 1.063 -0.552 -18.743 216 HA PHE 30 HA PHE 30 2.940 -1.759 -16.859 217 HB2 PHE 30 2HB PHE 30 2.875 -3.703 -18.214 218 HB3 PHE 30 3HB PHE 30 1.217 -3.114 -18.154 219 HD1 PHE 30 HD1 PHE 30 4.175 -3.576 -20.250 220 HD2 PHE 30 HD2 PHE 30 0.154 -2.185 -20.112 221 HE1 PHE 30 HE1 PHE 30 4.106 -3.540 -22.709 222 HE2 PHE 30 HE2 PHE 30 0.079 -2.148 -22.571 223 HZ PHE 30 HZ PHE 30 2.056 -2.827 -23.873 224 H GLN 31 H GLN 31 2.927 0.345 -19.514 225 HA GLN 31 HA GLN 31 5.557 -0.336 -20.489 226 HB2 GLN 31 2HB GLN 31 4.236 2.261 -21.138 227 HB3 GLN 31 3HB GLN 31 5.199 1.208 -22.166 228 HG2 GLN 31 2HG GLN 31 3.297 -0.417 -22.131 229 HG3 GLN 31 3HG GLN 31 2.345 0.820 -21.311 230 HE21 GLN 31 1HE2 GLN 31 3.056 3.086 -22.600 231 HE22 GLN 31 2HE2 GLN 31 2.591 3.006 -24.262 232 H ILE 32 H ILE 32 4.130 1.967 -18.281 233 HA ILE 32 HA ILE 32 6.636 3.419 -17.983 234 HB ILE 32 HB ILE 32 3.988 3.802 -16.581 235 HG12 ILE 32 2HG1 ILE 32 4.573 6.018 -18.176 236 HG13 ILE 32 3HG1 ILE 32 5.005 4.632 -19.172 237 HG21 ILE 32 1HG2 ILE 32 5.661 4.650 -15.148 238 HG22 ILE 32 2HG2 ILE 32 6.559 5.356 -16.491 239 HG23 ILE 32 3HG2 ILE 32 5.010 6.046 -16.008 240 HD11 ILE 32 3HD1 ILE 32 2.365 4.777 -17.771 241 HD12 ILE 32 1HD1 ILE 32 2.628 5.547 -19.335 242 HD13 ILE 32 2HD1 ILE 32 2.832 3.804 -19.165 243 H SER 33 H SER 33 4.569 1.216 -16.164 244 HA SER 33 HA SER 33 6.233 1.325 -13.811 245 HB2 SER 33 2HB SER 33 3.807 0.942 -13.619 246 HB3 SER 33 3HB SER 33 3.975 -0.566 -14.518 247 HG SER 33 HG SER 33 3.942 -0.795 -12.187 248 H GLY 34 H GLY 34 5.194 -1.541 -15.648 249 HA2 GLY 34 2HA GLY 34 7.121 -2.713 -16.838 250 HA3 GLY 34 3HA GLY 34 7.911 -2.628 -15.270 251 H MET 35 H MET 35 4.490 -3.279 -15.788 252 HA MET 35 HA MET 35 4.579 -5.597 -14.142 253 HB2 MET 35 2HB MET 35 2.337 -4.882 -16.022 254 HB3 MET 35 3HB MET 35 2.242 -5.766 -14.504 255 HG2 MET 35 2HG MET 35 2.879 -3.704 -13.306 256 HG3 MET 35 3HG MET 35 2.850 -2.839 -14.842 257 HE1 MET 35 3HE MET 35 -0.876 -4.793 -12.941 258 HE2 MET 35 1HE MET 35 0.405 -5.719 -13.725 259 HE3 MET 35 2HE MET 35 0.735 -4.854 -12.224 260 H SER 36 H SER 36 3.999 -5.151 -17.629 261 HA SER 36 HA SER 36 3.726 -7.807 -18.354 262 HB2 SER 36 2HB SER 36 4.227 -7.130 -20.597 263 HB3 SER 36 3HB SER 36 3.387 -5.782 -19.829 264 HG SER 36 HG SER 36 5.558 -4.941 -19.386 265 H LYS 37 H LYS 37 6.631 -5.962 -17.696 266 HA LYS 37 HA LYS 37 8.520 -7.745 -18.767 267 HB2 LYS 37 2HB LYS 37 8.984 -6.047 -16.322 268 HB3 LYS 37 3HB LYS 37 10.154 -6.543 -17.538 269 HG2 LYS 37 2HG LYS 37 7.941 -4.530 -17.833 270 HG3 LYS 37 3HG LYS 37 9.682 -4.245 -17.890 271 HD2 LYS 37 2HD LYS 37 8.075 -5.846 -19.881 272 HD3 LYS 37 3HD LYS 37 8.722 -4.223 -20.131 273 HE2 LYS 37 2HE LYS 37 10.344 -6.715 -19.623 274 HE3 LYS 37 3HE LYS 37 10.126 -5.929 -21.185 275 HZ1 LYS 37 3HZ LYS 37 11.885 -5.238 -19.018 276 HZ2 LYS 37 1HZ LYS 37 11.014 -3.917 -19.616 277 HZ3 LYS 37 2HZ LYS 37 11.979 -4.834 -20.658 278 H LYS 38 H LYS 38 6.579 -7.905 -15.933 279 HA LYS 38 HA LYS 38 8.261 -9.864 -14.611 280 HB2 LYS 38 2HB LYS 38 5.447 -9.079 -13.858 281 HB3 LYS 38 3HB LYS 38 6.675 -9.806 -12.830 282 HG2 LYS 38 2HG LYS 38 6.903 -7.058 -14.034 283 HG3 LYS 38 3HG LYS 38 6.276 -7.386 -12.417 284 HD2 LYS 38 2HD LYS 38 8.361 -7.342 -11.647 285 HD3 LYS 38 3HD LYS 38 8.718 -8.770 -12.621 286 HE2 LYS 38 2HE LYS 38 8.927 -6.915 -14.523 287 HE3 LYS 38 3HE LYS 38 9.326 -5.911 -13.130 288 HZ1 LYS 38 3HZ LYS 38 10.684 -8.446 -13.148 289 HZ2 LYS 38 1HZ LYS 38 11.302 -6.889 -12.909 290 HZ3 LYS 38 2HZ LYS 38 11.070 -7.475 -14.478 291 H SER 39 H SER 39 6.293 -11.558 -13.560 292 HA SER 39 HA SER 39 5.402 -13.005 -15.969 293 HB2 SER 39 2HB SER 39 7.227 -14.233 -15.002 294 HB3 SER 39 3HB SER 39 6.533 -14.099 -13.386 295 HG SER 39 HG SER 39 5.703 -15.973 -13.876 296 H SER 40 H SER 40 3.552 -14.452 -15.630 297 HA SER 40 HA SER 40 1.333 -13.176 -14.622 298 HB2 SER 40 2HB SER 40 0.729 -15.896 -14.376 299 HB3 SER 40 3HB SER 40 0.455 -14.879 -15.790 300 HG SER 40 HG SER 40 2.511 -16.704 -15.272 301 H SER 41 H SER 41 3.301 -15.667 -13.029 302 HA SER 41 HA SER 41 1.799 -15.856 -10.671 303 HB2 SER 41 2HB SER 41 4.744 -16.335 -11.169 304 HB3 SER 41 3HB SER 41 3.922 -16.754 -9.667 305 HG SER 41 HG SER 41 4.139 -18.312 -11.654 306 H GLN 42 H GLN 42 4.064 -13.475 -11.760 307 HA GLN 42 HA GLN 42 4.329 -12.301 -9.106 308 HB2 GLN 42 2HB GLN 42 5.648 -11.862 -11.752 309 HB3 GLN 42 3HB GLN 42 5.680 -10.570 -10.560 310 HG2 GLN 42 2HG GLN 42 6.621 -12.269 -8.941 311 HG3 GLN 42 3HG GLN 42 6.834 -13.331 -10.332 312 HE21 GLN 42 1HE2 GLN 42 7.618 -10.095 -9.144 313 HE22 GLN 42 2HE2 GLN 42 9.154 -9.987 -9.927 314 H LEU 43 H LEU 43 2.342 -12.042 -11.840 315 HA LEU 43 HA LEU 43 1.591 -9.275 -11.267 316 HB2 LEU 43 2HB LEU 43 0.648 -11.133 -13.445 317 HB3 LEU 43 3HB LEU 43 0.243 -9.424 -13.297 318 HG LEU 43 HG LEU 43 3.113 -10.201 -13.520 319 HD11 LEU 43 1HD1 LEU 43 1.056 -10.627 -15.582 320 HD12 LEU 43 2HD1 LEU 43 2.648 -11.360 -15.392 321 HD13 LEU 43 3HD1 LEU 43 2.496 -9.754 -16.105 322 HD21 LEU 43 3HD2 LEU 43 1.406 -7.830 -13.936 323 HD22 LEU 43 1HD2 LEU 43 2.739 -8.042 -15.073 324 HD23 LEU 43 2HD2 LEU 43 3.063 -7.951 -13.341 325 H LYS 44 H LYS 44 0.601 -12.471 -10.611 326 HA LYS 44 HA LYS 44 -2.191 -12.047 -10.330 327 HB2 LYS 44 2HB LYS 44 -2.274 -14.193 -9.344 328 HB3 LYS 44 3HB LYS 44 -0.985 -14.276 -10.537 329 HG2 LYS 44 2HG LYS 44 0.579 -13.725 -8.567 330 HG3 LYS 44 3HG LYS 44 -0.786 -14.199 -7.554 331 HD2 LYS 44 2HD LYS 44 0.021 -16.015 -9.768 332 HD3 LYS 44 3HD LYS 44 1.043 -15.947 -8.330 333 HE2 LYS 44 2HE LYS 44 -1.370 -16.155 -7.168 334 HE3 LYS 44 3HE LYS 44 -1.694 -17.009 -8.676 335 HZ1 LYS 44 3HZ LYS 44 0.789 -17.804 -7.525 336 HZ2 LYS 44 1HZ LYS 44 -0.537 -18.752 -7.979 337 HZ3 LYS 44 2HZ LYS 44 -0.491 -18.043 -6.445 338 H GLU 45 H GLU 45 0.544 -11.364 -8.325 339 HA GLU 45 HA GLU 45 -0.596 -11.317 -5.792 340 HB2 GLU 45 2HB GLU 45 1.139 -9.576 -5.273 341 HB3 GLU 45 3HB GLU 45 1.765 -11.043 -6.012 342 HG2 GLU 45 2HG GLU 45 2.884 -9.547 -7.271 343 HG3 GLU 45 3HG GLU 45 1.400 -9.606 -8.221 344 H ILE 46 H ILE 46 -0.415 -8.699 -8.193 345 HA ILE 46 HA ILE 46 -1.585 -6.646 -6.811 346 HB ILE 46 HB ILE 46 -1.991 -7.368 -9.714 347 HG12 ILE 46 2HG1 ILE 46 -0.373 -5.113 -9.485 348 HG13 ILE 46 3HG1 ILE 46 0.176 -6.167 -8.187 349 HG21 ILE 46 1HG2 ILE 46 -3.714 -5.888 -9.416 350 HG22 ILE 46 2HG2 ILE 46 -2.902 -5.037 -8.104 351 HG23 ILE 46 3HG2 ILE 46 -2.395 -4.773 -9.772 352 HD11 ILE 46 3HD1 ILE 46 -0.180 -7.248 -10.945 353 HD12 ILE 46 1HD1 ILE 46 1.267 -6.333 -10.522 354 HD13 ILE 46 2HD1 ILE 46 0.871 -7.811 -9.645 355 H PHE 47 H PHE 47 -3.245 -9.248 -8.565 356 HA PHE 47 HA PHE 47 -5.864 -8.387 -8.234 357 HB2 PHE 47 2HB PHE 47 -5.814 -10.190 -9.633 358 HB3 PHE 47 3HB PHE 47 -4.548 -11.001 -8.716 359 HD1 PHE 47 HD1 PHE 47 -5.113 -12.329 -6.731 360 HD2 PHE 47 HD2 PHE 47 -8.120 -10.585 -9.187 361 HE1 PHE 47 HE1 PHE 47 -6.795 -13.815 -5.721 362 HE2 PHE 47 HE2 PHE 47 -9.806 -12.067 -8.181 363 HZ PHE 47 HZ PHE 47 -9.145 -13.684 -6.445 364 H ARG 48 H ARG 48 -3.772 -10.163 -6.028 365 HA ARG 48 HA ARG 48 -5.772 -10.756 -4.105 366 HB2 ARG 48 2HB ARG 48 -3.016 -11.291 -4.456 367 HB3 ARG 48 3HB ARG 48 -3.184 -10.503 -2.892 368 HG2 ARG 48 2HG ARG 48 -4.793 -12.895 -3.753 369 HG3 ARG 48 3HG ARG 48 -3.301 -12.984 -2.816 370 HD2 ARG 48 2HD ARG 48 -5.401 -11.166 -1.802 371 HD3 ARG 48 3HD ARG 48 -5.739 -12.894 -1.703 372 HE ARG 48 HE ARG 48 -3.146 -12.252 -0.704 373 HH11 ARG 48 1HH1 ARG 48 -6.535 -12.253 0.093 374 HH12 ARG 48 2HH1 ARG 48 -6.267 -12.374 1.800 375 HH21 ARG 48 1HH2 ARG 48 -2.780 -12.413 1.542 376 HH22 ARG 48 2HH2 ARG 48 -4.131 -12.464 2.623 377 H ILE 49 H ILE 49 -4.387 -7.854 -5.012 378 HA ILE 49 HA ILE 49 -4.785 -6.647 -2.361 379 HB ILE 49 HB ILE 49 -3.477 -5.350 -4.748 380 HG12 ILE 49 2HG1 ILE 49 -2.188 -7.328 -4.175 381 HG13 ILE 49 3HG1 ILE 49 -1.322 -5.891 -3.642 382 HG21 ILE 49 1HG2 ILE 49 -2.405 -4.167 -2.596 383 HG22 ILE 49 2HG2 ILE 49 -3.873 -3.590 -3.384 384 HG23 ILE 49 3HG2 ILE 49 -3.984 -4.595 -1.938 385 HD11 ILE 49 3HD1 ILE 49 -2.717 -7.969 -2.019 386 HD12 ILE 49 1HD1 ILE 49 -1.082 -7.330 -1.859 387 HD13 ILE 49 2HD1 ILE 49 -2.464 -6.350 -1.369 388 H LEU 50 H LEU 50 -6.244 -7.005 -5.381 389 HA LEU 50 HA LEU 50 -7.718 -4.492 -5.226 390 HB2 LEU 50 2HB LEU 50 -7.238 -6.550 -7.288 391 HB3 LEU 50 3HB LEU 50 -8.813 -5.759 -7.330 392 HG LEU 50 HG LEU 50 -7.140 -3.618 -7.152 393 HD11 LEU 50 1HD1 LEU 50 -5.765 -5.577 -8.978 394 HD12 LEU 50 2HD1 LEU 50 -5.191 -5.165 -7.363 395 HD13 LEU 50 3HD1 LEU 50 -5.279 -3.922 -8.610 396 HD21 LEU 50 3HD2 LEU 50 -7.531 -3.391 -9.596 397 HD22 LEU 50 1HD2 LEU 50 -8.986 -3.775 -8.677 398 HD23 LEU 50 2HD2 LEU 50 -8.172 -5.035 -9.605 399 H ASP 51 H ASP 51 -8.089 -7.868 -4.561 400 HA ASP 51 HA ASP 51 -10.925 -7.968 -4.570 401 HB2 ASP 51 2HB ASP 51 -9.201 -9.912 -4.599 402 HB3 ASP 51 3HB ASP 51 -9.214 -9.739 -2.846 403 H ASN 52 H ASN 52 -12.256 -6.969 -3.225 404 HA ASN 52 HA ASN 52 -11.284 -6.248 -0.545 405 HB2 ASN 52 2HB ASN 52 -12.862 -4.851 -2.540 406 HB3 ASN 52 3HB ASN 52 -13.695 -4.906 -0.990 407 HD21 ASN 52 1HD2 ASN 52 -10.386 -4.414 -2.183 408 HD22 ASN 52 2HD2 ASN 52 -10.051 -3.044 -1.185 409 H ASP 53 H ASP 53 -12.838 -8.699 -1.859 410 HA ASP 53 HA ASP 53 -14.541 -9.089 0.497 411 HB2 ASP 53 2HB ASP 53 -15.575 -10.181 -2.060 412 HB3 ASP 53 3HB ASP 53 -16.449 -9.539 -0.672 413 H GLN 54 H GLN 54 -12.042 -10.154 -1.325 414 HA GLN 54 HA GLN 54 -10.928 -12.125 -1.575 415 HB2 GLN 54 2HB GLN 54 -12.359 -13.113 0.874 416 HB3 GLN 54 3HB GLN 54 -10.709 -13.435 0.360 417 HG2 GLN 54 2HG GLN 54 -11.669 -10.722 1.224 418 HG3 GLN 54 3HG GLN 54 -10.957 -11.901 2.324 419 HE21 GLN 54 1HE2 GLN 54 -10.379 -9.552 -0.096 420 HE22 GLN 54 2HE2 GLN 54 -8.654 -9.652 -0.101 421 H SER 55 H SER 55 -13.775 -11.860 -2.591 422 HA SER 55 HA SER 55 -14.984 -14.422 -2.448 423 HB2 SER 55 2HB SER 55 -16.085 -13.455 -4.679 424 HB3 SER 55 3HB SER 55 -16.543 -12.861 -3.083 425 HG SER 55 HG SER 55 -14.588 -11.694 -4.780 426 H GLY 56 H GLY 56 -12.453 -13.082 -4.387 427 HA2 GLY 56 2HA GLY 56 -10.981 -14.836 -5.372 428 HA3 GLY 56 3HA GLY 56 -12.451 -15.539 -6.032 429 H PHE 57 H PHE 57 -13.333 -12.599 -6.445 430 HA PHE 57 HA PHE 57 -11.681 -12.025 -8.806 431 HB2 PHE 57 2HB PHE 57 -14.698 -11.860 -8.813 432 HB3 PHE 57 3HB PHE 57 -13.612 -11.653 -10.183 433 HD1 PHE 57 HD1 PHE 57 -15.107 -14.081 -7.873 434 HD2 PHE 57 HD2 PHE 57 -12.707 -13.533 -11.345 435 HE1 PHE 57 HE1 PHE 57 -15.314 -16.478 -8.390 436 HE2 PHE 57 HE2 PHE 57 -12.911 -15.928 -11.868 437 HZ PHE 57 HZ PHE 57 -14.216 -17.404 -10.391 438 H ILE 58 H ILE 58 -12.220 -9.798 -9.708 439 HA ILE 58 HA ILE 58 -12.706 -7.945 -7.468 440 HB ILE 58 HB ILE 58 -10.917 -7.496 -9.860 441 HG12 ILE 58 2HG1 ILE 58 -9.864 -7.556 -7.081 442 HG13 ILE 58 3HG1 ILE 58 -10.309 -9.102 -7.796 443 HG21 ILE 58 1HG2 ILE 58 -11.967 -5.447 -9.051 444 HG22 ILE 58 2HG2 ILE 58 -11.397 -5.793 -7.419 445 HG23 ILE 58 3HG2 ILE 58 -10.238 -5.454 -8.703 446 HD11 ILE 58 3HD1 ILE 58 -7.929 -8.525 -8.078 447 HD12 ILE 58 1HD1 ILE 58 -8.775 -8.761 -9.607 448 HD13 ILE 58 2HD1 ILE 58 -8.411 -7.130 -9.043 449 H GLU 59 H GLU 59 -14.957 -7.906 -8.007 450 HA GLU 59 HA GLU 59 -16.065 -7.327 -10.475 451 HB2 GLU 59 2HB GLU 59 -17.120 -6.270 -7.852 452 HB3 GLU 59 3HB GLU 59 -18.040 -6.636 -9.305 453 HG2 GLU 59 2HG GLU 59 -18.508 -8.546 -8.246 454 HG3 GLU 59 3HG GLU 59 -16.913 -9.041 -8.810 455 H GLU 60 H GLU 60 -17.307 -5.194 -10.915 456 HA GLU 60 HA GLU 60 -15.415 -3.189 -11.441 457 HB2 GLU 60 2HB GLU 60 -18.396 -3.358 -11.602 458 HB3 GLU 60 3HB GLU 60 -17.621 -1.791 -11.784 459 HG2 GLU 60 2HG GLU 60 -16.512 -2.428 -13.730 460 HG3 GLU 60 3HG GLU 60 -16.750 -4.145 -13.413 461 H ASP 61 H ASP 61 -17.582 -3.703 -8.755 462 HA ASP 61 HA ASP 61 -17.545 -1.127 -7.641 463 HB2 ASP 61 2HB ASP 61 -18.022 -3.872 -6.530 464 HB3 ASP 61 3HB ASP 61 -17.924 -2.489 -5.444 465 H GLU 62 H GLU 62 -15.104 -3.503 -7.869 466 HA GLU 62 HA GLU 62 -13.485 -2.084 -5.857 467 HB2 GLU 62 2HB GLU 62 -12.120 -4.385 -6.204 468 HB3 GLU 62 3HB GLU 62 -13.360 -4.165 -4.977 469 HG2 GLU 62 2HG GLU 62 -14.989 -5.022 -6.770 470 HG3 GLU 62 3HG GLU 62 -13.542 -5.595 -7.598 471 H LEU 63 H LEU 63 -13.812 -2.932 -9.151 472 HA LEU 63 HA LEU 63 -11.064 -2.714 -9.895 473 HB2 LEU 63 2HB LEU 63 -13.225 -3.717 -11.117 474 HB3 LEU 63 3HB LEU 63 -13.179 -2.129 -11.880 475 HG LEU 63 HG LEU 63 -11.026 -4.240 -11.955 476 HD11 LEU 63 1HD1 LEU 63 -13.143 -3.324 -13.816 477 HD12 LEU 63 2HD1 LEU 63 -12.465 -4.933 -13.570 478 HD13 LEU 63 3HD1 LEU 63 -11.570 -3.732 -14.502 479 HD21 LEU 63 3HD2 LEU 63 -9.946 -2.108 -11.822 480 HD22 LEU 63 1HD2 LEU 63 -11.047 -1.419 -13.015 481 HD23 LEU 63 2HD2 LEU 63 -9.883 -2.653 -13.499 482 H LYS 64 H LYS 64 -13.705 -0.479 -9.500 483 HA LYS 64 HA LYS 64 -12.715 1.683 -10.989 484 HB2 LYS 64 2HB LYS 64 -14.131 3.070 -9.404 485 HB3 LYS 64 3HB LYS 64 -14.969 1.793 -10.275 486 HG2 LYS 64 2HG LYS 64 -15.325 0.550 -8.398 487 HG3 LYS 64 3HG LYS 64 -13.887 1.168 -7.582 488 HD2 LYS 64 2HD LYS 64 -15.909 2.002 -6.511 489 HD3 LYS 64 3HD LYS 64 -15.009 3.325 -7.255 490 HE2 LYS 64 2HE LYS 64 -16.618 3.728 -8.796 491 HE3 LYS 64 3HE LYS 64 -17.053 2.026 -8.943 492 HZ1 LYS 64 3HZ LYS 64 -17.722 3.040 -6.373 493 HZ2 LYS 64 1HZ LYS 64 -18.717 2.302 -7.525 494 HZ3 LYS 64 2HZ LYS 64 -18.443 3.970 -7.588 495 H TYR 65 H TYR 65 -11.854 0.442 -7.861 496 HA TYR 65 HA TYR 65 -10.297 2.816 -7.200 497 HB2 TYR 65 2HB TYR 65 -10.727 0.241 -5.672 498 HB3 TYR 65 3HB TYR 65 -9.832 1.633 -5.074 499 HD1 TYR 65 HD1 TYR 65 -11.268 3.929 -5.330 500 HD2 TYR 65 HD2 TYR 65 -12.874 0.014 -4.882 501 HE1 TYR 65 HE1 TYR 65 -13.351 4.891 -4.443 502 HE2 TYR 65 HE2 TYR 65 -14.962 0.965 -3.996 503 HH TYR 65 HH TYR 65 -16.166 2.893 -3.791 504 H PHE 66 H PHE 66 -9.653 0.939 -9.455 505 HA PHE 66 HA PHE 66 -7.441 -0.653 -8.886 506 HB2 PHE 66 2HB PHE 66 -8.458 -0.861 -11.028 507 HB3 PHE 66 3HB PHE 66 -8.232 0.849 -11.380 508 HD1 PHE 66 HD1 PHE 66 -6.333 -2.280 -10.733 509 HD2 PHE 66 HD2 PHE 66 -6.386 1.549 -12.590 510 HE1 PHE 66 HE1 PHE 66 -4.208 -2.800 -11.859 511 HE2 PHE 66 HE2 PHE 66 -4.262 1.035 -13.719 512 HZ PHE 66 HZ PHE 66 -3.170 -1.142 -13.355 513 H LEU 67 H LEU 67 -7.716 2.797 -9.224 514 HA LEU 67 HA LEU 67 -4.851 3.201 -9.387 515 HB2 LEU 67 2HB LEU 67 -6.671 5.454 -8.779 516 HB3 LEU 67 3HB LEU 67 -5.300 5.372 -9.884 517 HG LEU 67 HG LEU 67 -8.135 4.491 -10.362 518 HD11 LEU 67 1HD1 LEU 67 -6.715 6.056 -12.369 519 HD12 LEU 67 2HD1 LEU 67 -6.862 6.875 -10.815 520 HD13 LEU 67 3HD1 LEU 67 -8.306 6.305 -11.651 521 HD21 LEU 67 3HD2 LEU 67 -5.870 3.130 -11.257 522 HD22 LEU 67 1HD2 LEU 67 -6.382 4.126 -12.620 523 HD23 LEU 67 2HD2 LEU 67 -7.514 2.993 -11.881 524 H GLN 68 H GLN 68 -7.115 2.677 -6.952 525 HA GLN 68 HA GLN 68 -5.756 4.251 -4.930 526 HB2 GLN 68 2HB GLN 68 -8.307 2.878 -5.176 527 HB3 GLN 68 3HB GLN 68 -7.528 2.540 -3.636 528 HG2 GLN 68 2HG GLN 68 -8.448 4.433 -2.932 529 HG3 GLN 68 3HG GLN 68 -7.211 5.250 -3.886 530 HE21 GLN 68 1HE2 GLN 68 -8.058 4.854 -6.427 531 HE22 GLN 68 2HE2 GLN 68 -9.582 5.628 -6.678 532 H ARG 69 H ARG 69 -4.842 1.614 -6.452 533 HA ARG 69 HA ARG 69 -3.952 0.164 -4.054 534 HB2 ARG 69 2HB ARG 69 -3.514 -0.985 -6.756 535 HB3 ARG 69 3HB ARG 69 -3.968 -1.780 -5.254 536 HG2 ARG 69 2HG ARG 69 -5.787 -0.144 -7.009 537 HG3 ARG 69 3HG ARG 69 -5.758 -1.904 -6.887 538 HD2 ARG 69 2HD ARG 69 -6.648 0.115 -4.859 539 HD3 ARG 69 3HD ARG 69 -7.531 -1.266 -5.507 540 HE ARG 69 HE ARG 69 -5.477 -2.445 -4.239 541 HH11 ARG 69 1HH1 ARG 69 -7.737 0.013 -3.253 542 HH12 ARG 69 2HH1 ARG 69 -7.702 -0.441 -1.582 543 HH21 ARG 69 1HH2 ARG 69 -5.423 -3.053 -2.041 544 HH22 ARG 69 2HH2 ARG 69 -6.385 -2.185 -0.893 545 H PHE 70 H PHE 70 -2.869 1.887 -6.887 546 HA PHE 70 HA PHE 70 -0.072 1.289 -6.253 547 HB2 PHE 70 2HB PHE 70 -1.328 2.630 -8.655 548 HB3 PHE 70 3HB PHE 70 0.405 2.410 -8.435 549 HD1 PHE 70 HD1 PHE 70 -2.800 0.604 -8.821 550 HD2 PHE 70 HD2 PHE 70 1.448 0.382 -8.987 551 HE1 PHE 70 HE1 PHE 70 -2.960 -1.625 -9.849 552 HE2 PHE 70 HE2 PHE 70 1.294 -1.847 -10.016 553 HZ PHE 70 HZ PHE 70 -0.911 -2.854 -10.449 554 H GLU 71 H GLU 71 -2.441 3.772 -6.029 555 HA GLU 71 HA GLU 71 -0.362 5.707 -5.247 556 HB2 GLU 71 2HB GLU 71 -1.989 6.168 -7.245 557 HB3 GLU 71 3HB GLU 71 -3.149 6.529 -5.975 558 HG2 GLU 71 2HG GLU 71 -2.146 8.570 -6.680 559 HG3 GLU 71 3HG GLU 71 -1.554 8.193 -5.063 560 H SER 72 H SER 72 -3.089 3.903 -4.240 561 HA SER 72 HA SER 72 -4.348 3.863 -2.332 562 HB2 SER 72 2HB SER 72 -2.837 4.465 -0.246 563 HB3 SER 72 3HB SER 72 -2.542 2.999 -1.180 564 HG SER 72 HG SER 72 -0.590 3.946 -1.061 565 H GLY 73 H GLY 73 -5.288 5.921 -3.486 566 HA2 GLY 73 2HA GLY 73 -6.421 7.615 -1.769 567 HA3 GLY 73 3HA GLY 73 -4.843 8.364 -1.964 568 H ALA 74 H ALA 74 -4.956 7.204 -4.833 569 HA ALA 74 HA ALA 74 -5.719 9.583 -6.115 570 HB1 ALA 74 1HB ALA 74 -5.797 7.846 -8.151 571 HB2 ALA 74 2HB ALA 74 -4.292 8.450 -7.457 572 HB3 ALA 74 3HB ALA 74 -4.915 6.872 -6.975 573 H ARG 75 H ARG 75 -7.312 9.326 -8.128 574 HA ARG 75 HA ARG 75 -9.920 9.031 -6.964 575 HB2 ARG 75 2HB ARG 75 -10.759 9.990 -8.954 576 HB3 ARG 75 3HB ARG 75 -9.223 10.794 -8.659 577 HG2 ARG 75 2HG ARG 75 -8.159 9.262 -10.287 578 HG3 ARG 75 3HG ARG 75 -9.752 8.588 -10.637 579 HD2 ARG 75 2HD ARG 75 -8.711 11.347 -11.189 580 HD3 ARG 75 3HD ARG 75 -9.402 10.181 -12.317 581 HE ARG 75 HE ARG 75 -10.821 12.092 -10.746 582 HH11 ARG 75 1HH1 ARG 75 -11.033 8.924 -12.174 583 HH12 ARG 75 2HH1 ARG 75 -12.761 8.948 -12.287 584 HH21 ARG 75 1HH2 ARG 75 -13.097 12.136 -10.890 585 HH22 ARG 75 2HH2 ARG 75 -13.934 10.776 -11.558 586 H VAL 76 H VAL 76 -11.640 7.941 -8.483 587 HA VAL 76 HA VAL 76 -10.772 5.166 -8.790 588 HB VAL 76 HB VAL 76 -13.036 4.519 -8.649 589 HG11 VAL 76 1HG1 VAL 76 -13.732 5.381 -6.550 590 HG12 VAL 76 2HG1 VAL 76 -11.967 5.412 -6.549 591 HG13 VAL 76 3HG1 VAL 76 -12.876 6.900 -6.814 592 HG21 VAL 76 3HG2 VAL 76 -13.524 7.189 -9.720 593 HG22 VAL 76 1HG2 VAL 76 -14.478 5.713 -9.871 594 HG23 VAL 76 2HG2 VAL 76 -14.650 6.732 -8.442 595 H LEU 77 H LEU 77 -12.598 4.183 -10.559 596 HA LEU 77 HA LEU 77 -11.733 5.436 -13.072 597 HB2 LEU 77 2HB LEU 77 -12.796 2.654 -12.607 598 HB3 LEU 77 3HB LEU 77 -12.142 3.287 -14.116 599 HG LEU 77 HG LEU 77 -10.598 2.788 -11.572 600 HD11 LEU 77 1HD1 LEU 77 -10.567 1.385 -14.240 601 HD12 LEU 77 2HD1 LEU 77 -11.202 0.739 -12.728 602 HD13 LEU 77 3HD1 LEU 77 -9.476 1.059 -12.893 603 HD21 LEU 77 3HD2 LEU 77 -9.953 4.229 -14.079 604 HD22 LEU 77 1HD2 LEU 77 -8.711 3.171 -13.410 605 HD23 LEU 77 2HD2 LEU 77 -9.366 4.488 -12.436 606 H THR 78 H THR 78 -13.169 6.121 -14.574 607 HA THR 78 HA THR 78 -15.885 6.525 -13.743 608 HB THR 78 HB THR 78 -14.687 8.240 -15.039 609 HG1 THR 78 HG1 THR 78 -16.524 8.809 -15.967 610 HG21 THR 78 3HG2 THR 78 -14.979 7.159 -17.665 611 HG22 THR 78 1HG2 THR 78 -14.016 6.043 -16.697 612 HG23 THR 78 2HG2 THR 78 -13.515 7.727 -16.861 613 H ALA 79 H ALA 79 -17.504 6.256 -15.806 614 HA ALA 79 HA ALA 79 -17.944 3.447 -15.970 615 HB1 ALA 79 1HB ALA 79 -19.798 5.023 -15.883 616 HB2 ALA 79 2HB ALA 79 -19.310 5.701 -17.436 617 HB3 ALA 79 3HB ALA 79 -19.882 4.036 -17.342 618 H SER 80 H SER 80 -15.937 5.486 -17.695 619 HA SER 80 HA SER 80 -16.036 3.786 -20.096 620 HB2 SER 80 2HB SER 80 -16.347 6.046 -20.747 621 HB3 SER 80 3HB SER 80 -15.070 6.613 -19.671 622 HG SER 80 HG SER 80 -13.600 6.056 -21.100 623 H GLU 81 H GLU 81 -14.345 4.227 -17.277 624 HA GLU 81 HA GLU 81 -11.752 3.492 -18.417 625 HB2 GLU 81 2HB GLU 81 -12.619 4.395 -15.678 626 HB3 GLU 81 3HB GLU 81 -11.024 3.717 -15.969 627 HG2 GLU 81 2HG GLU 81 -10.449 5.488 -17.444 628 HG3 GLU 81 3HG GLU 81 -12.105 6.092 -17.458 629 H THR 82 H THR 82 -13.771 2.416 -15.677 630 HA THR 82 HA THR 82 -12.512 0.001 -15.198 631 HB THR 82 HB THR 82 -15.182 -0.560 -14.687 632 HG1 THR 82 HG1 THR 82 -15.913 1.473 -15.182 633 HG21 THR 82 3HG2 THR 82 -12.841 -0.284 -13.278 634 HG22 THR 82 1HG2 THR 82 -14.407 -0.703 -12.585 635 HG23 THR 82 2HG2 THR 82 -13.860 0.974 -12.579 636 H LYS 83 H LYS 83 -15.298 0.630 -17.320 637 HA LYS 83 HA LYS 83 -15.815 -1.937 -18.184 638 HB2 LYS 83 2HB LYS 83 -16.186 0.771 -19.347 639 HB3 LYS 83 3HB LYS 83 -16.338 -0.594 -20.446 640 HG2 LYS 83 2HG LYS 83 -18.017 -1.572 -18.888 641 HG3 LYS 83 3HG LYS 83 -17.941 -0.077 -17.952 642 HD2 LYS 83 2HD LYS 83 -18.494 1.116 -20.142 643 HD3 LYS 83 3HD LYS 83 -18.920 -0.480 -20.766 644 HE2 LYS 83 2HE LYS 83 -20.466 -0.711 -18.790 645 HE3 LYS 83 3HE LYS 83 -20.162 0.992 -18.450 646 HZ1 LYS 83 3HZ LYS 83 -22.014 1.159 -19.736 647 HZ2 LYS 83 1HZ LYS 83 -21.667 -0.225 -20.646 648 HZ3 LYS 83 2HZ LYS 83 -20.846 1.221 -20.958 649 H THR 84 H THR 84 -13.490 0.387 -19.526 650 HA THR 84 HA THR 84 -12.585 -1.123 -21.680 651 HB THR 84 HB THR 84 -10.888 0.730 -19.999 652 HG1 THR 84 HG1 THR 84 -11.861 2.365 -20.993 653 HG21 THR 84 3HG2 THR 84 -9.960 -0.836 -21.916 654 HG22 THR 84 1HG2 THR 84 -9.403 0.828 -21.744 655 HG23 THR 84 2HG2 THR 84 -10.626 0.427 -22.950 656 H PHE 85 H PHE 85 -11.069 -0.847 -18.459 657 HA PHE 85 HA PHE 85 -9.053 -2.691 -18.773 658 HB2 PHE 85 2HB PHE 85 -9.610 -1.170 -16.759 659 HB3 PHE 85 3HB PHE 85 -10.603 -2.513 -16.200 660 HD1 PHE 85 HD2 PHE 85 -9.540 -4.695 -15.684 661 HD2 PHE 85 HD1 PHE 85 -7.258 -1.211 -16.560 662 HE1 PHE 85 HE2 PHE 85 -7.553 -5.749 -14.685 663 HE2 PHE 85 HE1 PHE 85 -5.268 -2.259 -15.563 664 HZ PHE 85 HZ PHE 85 -5.414 -4.530 -14.622 665 H LEU 86 H LEU 86 -12.357 -3.315 -17.607 666 HA LEU 86 HA LEU 86 -12.035 -6.100 -17.301 667 HB2 LEU 86 2HB LEU 86 -13.831 -4.951 -16.200 668 HB3 LEU 86 3HB LEU 86 -14.492 -4.414 -17.743 669 HG LEU 86 HG LEU 86 -14.618 -7.081 -18.089 670 HD11 LEU 86 1HD1 LEU 86 -13.880 -6.931 -15.451 671 HD12 LEU 86 2HD1 LEU 86 -14.685 -8.298 -16.220 672 HD13 LEU 86 3HD1 LEU 86 -15.635 -7.087 -15.359 673 HD21 LEU 86 3HD2 LEU 86 -16.800 -6.640 -18.237 674 HD22 LEU 86 1HD2 LEU 86 -16.379 -4.986 -17.789 675 HD23 LEU 86 2HD2 LEU 86 -16.897 -6.130 -16.550 676 H ALA 87 H ALA 87 -12.888 -4.091 -20.035 677 HA ALA 87 HA ALA 87 -13.685 -6.315 -21.691 678 HB1 ALA 87 1HB ALA 87 -14.736 -4.167 -22.038 679 HB2 ALA 87 2HB ALA 87 -13.172 -3.422 -22.372 680 HB3 ALA 87 3HB ALA 87 -13.831 -4.625 -23.481 681 H ALA 88 H ALA 88 -10.758 -5.240 -20.614 682 HA ALA 88 HA ALA 88 -9.370 -6.188 -23.036 683 HB1 ALA 88 1HB ALA 88 -8.878 -3.858 -22.634 684 HB2 ALA 88 2HB ALA 88 -8.414 -4.212 -20.969 685 HB3 ALA 88 3HB ALA 88 -7.443 -4.830 -22.305 686 H ALA 89 H ALA 89 -10.054 -6.810 -19.787 687 HA ALA 89 HA ALA 89 -7.802 -8.707 -19.616 688 HB1 ALA 89 1HB ALA 89 -8.725 -6.724 -17.749 689 HB2 ALA 89 2HB ALA 89 -8.807 -8.334 -17.033 690 HB3 ALA 89 3HB ALA 89 -7.282 -7.737 -17.687 691 H ASP 90 H ASP 90 -11.222 -8.169 -18.896 692 HA ASP 90 HA ASP 90 -11.587 -11.001 -18.293 693 HB2 ASP 90 2HB ASP 90 -13.151 -8.519 -17.838 694 HB3 ASP 90 3HB ASP 90 -14.075 -9.998 -18.087 695 H HIS 91 H HIS 91 -13.441 -8.655 -20.239 696 HA HIS 91 HA HIS 91 -14.638 -8.911 -22.164 697 HB2 HIS 91 2HB HIS 91 -11.972 -9.528 -22.668 698 HB3 HIS 91 3HB HIS 91 -12.866 -10.838 -23.435 699 HD1 HIS 91 HD1 HIS 91 -11.285 -8.630 -25.012 700 HD2 HIS 91 HD2 HIS 91 -15.377 -8.618 -24.291 701 HE1 HIS 91 HE1 HIS 91 -12.282 -7.190 -26.816 702 H ASP 92 H ASP 92 -14.928 -10.969 -19.962 703 HA ASP 92 HA ASP 92 -15.970 -13.209 -21.554 704 HB2 ASP 92 2HB ASP 92 -16.124 -14.316 -19.233 705 HB3 ASP 92 3HB ASP 92 -14.522 -14.086 -19.928 706 H GLY 93 H GLY 93 -16.910 -10.478 -19.759 707 HA2 GLY 93 2HA GLY 93 -19.087 -9.616 -19.659 708 HA3 GLY 93 3HA GLY 93 -19.710 -11.198 -20.102 709 H ASP 94 H ASP 94 -17.452 -11.547 -17.676 710 HA ASP 94 HA ASP 94 -19.436 -12.291 -15.763 711 HB2 ASP 94 2HB ASP 94 -16.502 -11.915 -15.182 712 HB3 ASP 94 3HB ASP 94 -17.638 -13.007 -14.395 713 H GLY 95 H GLY 95 -17.160 -9.591 -16.059 714 HA2 GLY 95 2HA GLY 95 -17.537 -7.408 -15.284 715 HA3 GLY 95 3HA GLY 95 -18.870 -8.008 -14.309 716 H LYS 96 H LYS 96 -15.986 -9.814 -14.070 717 HA LYS 96 HA LYS 96 -14.938 -8.281 -11.836 718 HB2 LYS 96 2HB LYS 96 -15.014 -10.258 -10.317 719 HB3 LYS 96 3HB LYS 96 -16.599 -9.598 -10.700 720 HG2 LYS 96 2HG LYS 96 -15.691 -11.744 -12.483 721 HG3 LYS 96 3HG LYS 96 -15.960 -12.223 -10.806 722 HD2 LYS 96 2HD LYS 96 -18.043 -10.524 -12.035 723 HD3 LYS 96 3HD LYS 96 -17.903 -12.168 -12.664 724 HE2 LYS 96 2HE LYS 96 -17.761 -12.198 -9.799 725 HE3 LYS 96 3HE LYS 96 -19.197 -11.317 -10.316 726 HZ1 LYS 96 3HZ LYS 96 -18.483 -14.132 -10.776 727 HZ2 LYS 96 1HZ LYS 96 -19.497 -13.343 -11.877 728 HZ3 LYS 96 2HZ LYS 96 -19.950 -13.470 -10.253 729 H ILE 97 H ILE 97 -12.799 -8.297 -11.973 730 HA ILE 97 HA ILE 97 -11.408 -9.930 -13.823 731 HB ILE 97 HB ILE 97 -10.353 -8.194 -11.589 732 HG12 ILE 97 2HG1 ILE 97 -11.684 -7.198 -13.575 733 HG13 ILE 97 3HG1 ILE 97 -10.129 -6.480 -13.167 734 HG21 ILE 97 1HG2 ILE 97 -9.000 -9.928 -13.563 735 HG22 ILE 97 2HG2 ILE 97 -8.311 -8.325 -13.313 736 HG23 ILE 97 3HG2 ILE 97 -8.491 -9.430 -11.950 737 HD11 ILE 97 3HD1 ILE 97 -10.876 -7.191 -15.655 738 HD12 ILE 97 1HD1 ILE 97 -9.201 -7.084 -15.114 739 HD13 ILE 97 2HD1 ILE 97 -10.022 -8.646 -15.143 740 H GLY 98 H GLY 98 -9.940 -11.609 -13.484 741 HA2 GLY 98 2HA GLY 98 -10.051 -12.862 -10.811 742 HA3 GLY 98 3HA GLY 98 -10.253 -13.805 -12.280 743 H ALA 99 H ALA 99 -8.388 -14.814 -10.846 744 HA ALA 99 HA ALA 99 -5.811 -13.573 -11.344 745 HB1 ALA 99 1HB ALA 99 -6.401 -16.234 -10.056 746 HB2 ALA 99 2HB ALA 99 -4.884 -15.336 -9.999 747 HB3 ALA 99 3HB ALA 99 -6.316 -14.699 -9.191 748 H GLU 100 H GLU 100 -7.788 -15.072 -13.330 749 HA GLU 100 HA GLU 100 -5.629 -16.532 -14.703 750 HB2 GLU 100 2HB GLU 100 -7.465 -17.988 -13.745 751 HB3 GLU 100 3HB GLU 100 -8.561 -17.222 -14.886 752 HG2 GLU 100 2HG GLU 100 -7.602 -18.240 -16.706 753 HG3 GLU 100 3HG GLU 100 -6.053 -18.470 -15.896 754 H GLU 101 H GLU 101 -7.605 -13.892 -14.782 755 HA GLU 101 HA GLU 101 -7.362 -13.694 -17.708 756 HB2 GLU 101 2HB GLU 101 -9.502 -12.487 -17.785 757 HB3 GLU 101 3HB GLU 101 -9.701 -14.126 -17.181 758 HG2 GLU 101 2HG GLU 101 -9.326 -12.714 -14.877 759 HG3 GLU 101 3HG GLU 101 -10.213 -11.566 -15.878 760 H PHE 102 H PHE 102 -6.118 -12.600 -15.011 761 HA PHE 102 HA PHE 102 -6.258 -9.744 -15.617 762 HB2 PHE 102 2HB PHE 102 -6.541 -10.361 -13.279 763 HB3 PHE 102 3HB PHE 102 -5.008 -11.226 -13.295 764 HD1 PHE 102 HD2 PHE 102 -6.461 -7.841 -13.788 765 HD2 PHE 102 HD1 PHE 102 -3.057 -10.143 -12.677 766 HE1 PHE 102 HE2 PHE 102 -5.300 -5.785 -13.098 767 HE2 PHE 102 HE1 PHE 102 -1.891 -8.090 -11.984 768 HZ PHE 102 HZ PHE 102 -3.012 -5.907 -12.195 769 H GLN 103 H GLN 103 -3.647 -12.010 -14.731 770 HA GLN 103 HA GLN 103 -1.512 -10.505 -15.603 771 HB2 GLN 103 2HB GLN 103 -0.284 -12.647 -15.823 772 HB3 GLN 103 3HB GLN 103 -1.186 -12.525 -14.318 773 HG2 GLN 103 2HG GLN 103 -2.986 -13.738 -15.982 774 HG3 GLN 103 3HG GLN 103 -1.449 -14.419 -16.515 775 HE21 GLN 103 1HE2 GLN 103 -2.779 -13.473 -13.363 776 HE22 GLN 103 2HE2 GLN 103 -2.474 -14.987 -12.589 777 H GLU 104 H GLU 104 -3.624 -12.617 -17.470 778 HA GLU 104 HA GLU 104 -2.190 -12.741 -19.848 779 HB2 GLU 104 2HB GLU 104 -4.246 -13.332 -20.919 780 HB3 GLU 104 3HB GLU 104 -4.271 -14.023 -19.303 781 HG2 GLU 104 2HG GLU 104 -5.734 -12.277 -18.527 782 HG3 GLU 104 3HG GLU 104 -5.628 -11.453 -20.081 783 H MET 105 H MET 105 -4.199 -10.184 -18.546 784 HA MET 105 HA MET 105 -4.234 -8.652 -20.976 785 HB2 MET 105 2HB MET 105 -5.605 -7.179 -19.866 786 HB3 MET 105 3HB MET 105 -5.891 -8.637 -18.926 787 HG2 MET 105 2HG MET 105 -5.459 -7.347 -17.163 788 HG3 MET 105 3HG MET 105 -3.769 -7.556 -17.617 789 HE1 MET 105 3HE MET 105 -6.211 -4.557 -19.693 790 HE2 MET 105 1HE MET 105 -6.848 -5.862 -18.692 791 HE3 MET 105 2HE MET 105 -6.655 -4.246 -18.014 792 H VAL 106 H VAL 106 -2.026 -9.106 -18.421 793 HA VAL 106 HA VAL 106 -0.747 -6.532 -18.617 794 HB VAL 106 HB VAL 106 0.376 -9.033 -17.357 795 HG11 VAL 106 1HG1 VAL 106 1.334 -6.358 -17.672 796 HG12 VAL 106 2HG1 VAL 106 1.076 -6.690 -15.958 797 HG13 VAL 106 3HG1 VAL 106 2.124 -7.740 -16.912 798 HG21 VAL 106 3HG2 VAL 106 -2.006 -7.942 -16.644 799 HG22 VAL 106 1HG2 VAL 106 -0.928 -8.798 -15.541 800 HG23 VAL 106 2HG2 VAL 106 -0.894 -7.037 -15.618 801 H GLN 107 H GLN 107 0.818 -9.698 -18.951 802 HA GLN 107 HA GLN 107 2.827 -8.758 -20.672 803 HB2 GLN 107 2HB GLN 107 1.859 -11.607 -20.405 804 HB3 GLN 107 3HB GLN 107 3.435 -11.080 -20.979 805 HG2 GLN 107 2HG GLN 107 4.245 -10.963 -18.919 806 HG3 GLN 107 3HG GLN 107 2.862 -10.028 -18.352 807 HE21 GLN 107 1HE2 GLN 107 0.845 -11.330 -18.004 808 HE22 GLN 107 2HE2 GLN 107 1.031 -12.881 -17.266 809 H SER 108 H SER 108 -0.314 -10.194 -21.297 810 HA SER 108 HA SER 108 0.120 -9.741 -24.177 811 HB2 SER 108 2HB SER 108 -0.081 -12.148 -23.606 812 HB3 SER 108 3HB SER 108 -1.671 -11.830 -22.913 813 HG SER 108 HG SER 108 -2.359 -12.158 -24.868 Start of MODEL 18 1 H1 SER 1 H SER 1 0.370 0.281 -2.781 2 HA SER 1 HA SER 1 2.666 0.230 -0.933 3 HB2 SER 1 2HB SER 1 0.335 0.812 -0.004 4 HB3 SER 1 3HB SER 1 -0.057 -0.885 -0.279 5 HG SER 1 HG SER 1 1.173 -1.441 1.351 6 H LEU 2 H LEU 2 3.281 -1.074 -3.070 7 HA LEU 2 HA LEU 2 2.660 -3.906 -2.539 8 HB2 LEU 2 2HB LEU 2 1.867 -2.919 -4.732 9 HB3 LEU 2 3HB LEU 2 3.567 -2.773 -5.174 10 HG LEU 2 HG LEU 2 3.821 -5.192 -5.057 11 HD11 LEU 2 1HD1 LEU 2 1.840 -6.624 -4.757 12 HD12 LEU 2 2HD1 LEU 2 0.894 -5.196 -4.339 13 HD13 LEU 2 3HD1 LEU 2 2.233 -5.698 -3.308 14 HD21 LEU 2 3HD2 LEU 2 1.919 -5.692 -6.840 15 HD22 LEU 2 1HD2 LEU 2 3.323 -4.693 -7.219 16 HD23 LEU 2 2HD2 LEU 2 1.785 -3.933 -6.809 17 H THR 3 H THR 3 5.162 -2.223 -4.428 18 HA THR 3 HA THR 3 7.418 -2.560 -4.558 19 HB THR 3 HB THR 3 8.427 -2.833 -2.095 20 HG1 THR 3 HG1 THR 3 6.997 -2.500 -0.565 21 HG21 THR 3 3HG2 THR 3 7.981 -0.742 -3.868 22 HG22 THR 3 1HG2 THR 3 9.014 -0.704 -2.440 23 HG23 THR 3 2HG2 THR 3 7.341 -0.155 -2.333 24 H ASP 4 H ASP 4 5.696 -4.966 -4.610 25 HA ASP 4 HA ASP 4 7.678 -6.940 -3.678 26 HB2 ASP 4 2HB ASP 4 4.764 -6.838 -3.395 27 HB3 ASP 4 3HB ASP 4 5.350 -8.370 -4.037 28 H ILE 5 H ILE 5 6.416 -5.468 -6.352 29 HA ILE 5 HA ILE 5 7.319 -7.663 -8.071 30 HB ILE 5 HB ILE 5 4.765 -6.121 -8.544 31 HG12 ILE 5 2HG1 ILE 5 3.907 -8.615 -8.433 32 HG13 ILE 5 3HG1 ILE 5 5.352 -8.845 -7.455 33 HG21 ILE 5 1HG2 ILE 5 6.274 -6.889 -10.516 34 HG22 ILE 5 2HG2 ILE 5 5.657 -8.493 -10.126 35 HG23 ILE 5 3HG2 ILE 5 4.540 -7.204 -10.573 36 HD11 ILE 5 3HD1 ILE 5 4.063 -8.252 -5.744 37 HD12 ILE 5 1HD1 ILE 5 4.242 -6.605 -6.349 38 HD13 ILE 5 2HD1 ILE 5 2.828 -7.560 -6.796 39 H LEU 6 H LEU 6 6.270 -4.269 -7.954 40 HA LEU 6 HA LEU 6 8.404 -3.643 -9.886 41 HB2 LEU 6 2HB LEU 6 5.585 -2.631 -9.751 42 HB3 LEU 6 3HB LEU 6 6.855 -1.692 -10.533 43 HG LEU 6 HG LEU 6 6.524 -4.504 -11.413 44 HD11 LEU 6 1HD1 LEU 6 4.469 -4.344 -12.251 45 HD12 LEU 6 2HD1 LEU 6 4.757 -2.715 -12.862 46 HD13 LEU 6 3HD1 LEU 6 4.253 -2.952 -11.189 47 HD21 LEU 6 3HD2 LEU 6 7.675 -2.020 -12.349 48 HD22 LEU 6 1HD2 LEU 6 6.630 -2.754 -13.566 49 HD23 LEU 6 2HD2 LEU 6 7.971 -3.675 -12.886 50 H SER 7 H SER 7 9.256 -1.453 -9.729 51 HA SER 7 HA SER 7 9.700 -0.711 -6.997 52 HB2 SER 7 2HB SER 7 10.990 -0.274 -9.501 53 HB3 SER 7 3HB SER 7 10.675 1.301 -8.773 54 HG SER 7 HG SER 7 11.889 -0.857 -7.391 55 HA PRO 8 HA PRO 8 6.763 2.496 -6.421 56 HB2 PRO 8 2HB PRO 8 8.195 4.372 -5.079 57 HB3 PRO 8 3HB PRO 8 7.690 2.844 -4.347 58 HG2 PRO 8 2HG PRO 8 10.341 3.601 -5.514 59 HG3 PRO 8 3HG PRO 8 9.988 2.709 -4.022 60 HD2 PRO 8 2HD PRO 8 10.732 1.476 -6.315 61 HD3 PRO 8 3HD PRO 8 9.629 0.727 -5.143 62 H SER 9 H SER 9 9.915 3.873 -7.380 63 HA SER 9 HA SER 9 9.010 6.275 -8.415 64 HB2 SER 9 2HB SER 9 11.208 5.009 -9.929 65 HB3 SER 9 3HB SER 9 11.151 6.573 -9.116 66 HG SER 9 HG SER 9 12.095 4.179 -8.219 67 H ASP 10 H ASP 10 9.406 3.162 -10.074 68 HA ASP 10 HA ASP 10 8.674 3.994 -12.638 69 HB2 ASP 10 2HB ASP 10 8.398 1.319 -11.264 70 HB3 ASP 10 3HB ASP 10 8.028 1.566 -12.968 71 H ILE 11 H ILE 11 6.721 3.072 -9.870 72 HA ILE 11 HA ILE 11 4.251 3.015 -11.328 73 HB ILE 11 HB ILE 11 4.755 3.152 -8.353 74 HG12 ILE 11 2HG1 ILE 11 3.774 0.742 -9.841 75 HG13 ILE 11 3HG1 ILE 11 5.495 1.111 -9.825 76 HG21 ILE 11 1HG2 ILE 11 2.562 3.988 -8.783 77 HG22 ILE 11 2HG2 ILE 11 2.226 2.682 -9.917 78 HG23 ILE 11 3HG2 ILE 11 2.397 2.333 -8.197 79 HD11 ILE 11 3HD1 ILE 11 3.708 0.376 -7.545 80 HD12 ILE 11 1HD1 ILE 11 5.218 -0.371 -8.064 81 HD13 ILE 11 2HD1 ILE 11 5.239 1.207 -7.276 82 H ALA 12 H ALA 12 5.686 5.262 -8.965 83 HA ALA 12 HA ALA 12 3.671 7.182 -8.984 84 HB1 ALA 12 1HB ALA 12 6.006 8.629 -8.638 85 HB2 ALA 12 2HB ALA 12 5.042 7.869 -7.371 86 HB3 ALA 12 3HB ALA 12 6.414 7.010 -8.069 87 H ALA 13 H ALA 13 6.029 6.422 -11.375 88 HA ALA 13 HA ALA 13 5.886 8.968 -12.727 89 HB1 ALA 13 1HB ALA 13 7.389 6.463 -13.047 90 HB2 ALA 13 2HB ALA 13 7.009 7.310 -14.547 91 HB3 ALA 13 3HB ALA 13 7.903 8.136 -13.270 92 H ALA 14 H ALA 14 4.152 5.993 -12.756 93 HA ALA 14 HA ALA 14 2.928 6.569 -15.348 94 HB1 ALA 14 1HB ALA 14 2.142 4.226 -13.683 95 HB2 ALA 14 2HB ALA 14 2.254 4.377 -15.437 96 HB3 ALA 14 3HB ALA 14 3.721 4.230 -14.470 97 H LEU 15 H LEU 15 2.231 6.608 -11.934 98 HA LEU 15 HA LEU 15 -0.597 6.775 -12.142 99 HB2 LEU 15 2HB LEU 15 1.332 7.565 -9.971 100 HB3 LEU 15 3HB LEU 15 -0.417 7.704 -9.803 101 HG LEU 15 HG LEU 15 1.179 5.167 -10.139 102 HD11 LEU 15 1HD1 LEU 15 1.294 5.261 -7.925 103 HD12 LEU 15 2HD1 LEU 15 -0.456 5.052 -7.891 104 HD13 LEU 15 3HD1 LEU 15 0.238 6.672 -7.866 105 HD21 LEU 15 3HD2 LEU 15 -1.012 4.034 -9.858 106 HD22 LEU 15 1HD2 LEU 15 -0.868 4.926 -11.373 107 HD23 LEU 15 2HD2 LEU 15 -1.803 5.601 -10.038 108 H ARG 16 H ARG 16 1.879 9.263 -11.504 109 HA ARG 16 HA ARG 16 0.046 11.428 -11.687 110 HB2 ARG 16 2HB ARG 16 3.050 11.500 -12.012 111 HB3 ARG 16 3HB ARG 16 2.003 12.856 -11.615 112 HG2 ARG 16 2HG ARG 16 1.368 11.587 -9.524 113 HG3 ARG 16 3HG ARG 16 2.696 10.489 -9.905 114 HD2 ARG 16 2HD ARG 16 3.603 12.063 -8.412 115 HD3 ARG 16 3HD ARG 16 4.172 12.553 -10.007 116 HE ARG 16 HE ARG 16 3.045 14.515 -9.738 117 HH11 ARG 16 1HH1 ARG 16 1.682 12.149 -7.578 118 HH12 ARG 16 2HH1 ARG 16 0.612 13.275 -6.811 119 HH21 ARG 16 1HH2 ARG 16 1.640 16.006 -8.736 120 HH22 ARG 16 2HH2 ARG 16 0.588 15.469 -7.471 121 H ASP 17 H ASP 17 1.908 9.639 -13.998 122 HA ASP 17 HA ASP 17 2.137 11.430 -16.095 123 HB2 ASP 17 2HB ASP 17 3.224 9.396 -16.433 124 HB3 ASP 17 3HB ASP 17 1.809 8.451 -15.975 125 H CYS 18 H CYS 18 -0.549 9.178 -15.458 126 HA CYS 18 HA CYS 18 -2.308 10.998 -16.954 127 HB2 CYS 18 2HB CYS 18 -2.289 7.979 -17.146 128 HB3 CYS 18 3HB CYS 18 -3.501 9.027 -17.873 129 HG CYS 18 HG CYS 18 -1.623 8.002 -19.781 130 H GLN 19 H GLN 19 -1.972 10.982 -14.179 131 HA GLN 19 HA GLN 19 -3.666 9.393 -12.686 132 HB2 GLN 19 2HB GLN 19 -3.857 11.473 -11.184 133 HB3 GLN 19 3HB GLN 19 -2.256 10.801 -11.463 134 HG2 GLN 19 2HG GLN 19 -1.643 12.535 -12.891 135 HG3 GLN 19 3HG GLN 19 -3.313 13.035 -13.150 136 HE21 GLN 19 1HE2 GLN 19 -0.577 13.156 -11.024 137 HE22 GLN 19 2HE2 GLN 19 -1.175 14.404 -9.989 138 H ALA 20 H ALA 20 -4.420 12.219 -14.638 139 HA ALA 20 HA ALA 20 -6.970 12.822 -13.794 140 HB1 ALA 20 1HB ALA 20 -7.306 13.893 -15.857 141 HB2 ALA 20 2HB ALA 20 -5.566 13.973 -15.578 142 HB3 ALA 20 3HB ALA 20 -6.225 12.786 -16.704 143 HA PRO 21 HA PRO 21 -9.571 9.419 -14.765 144 HB2 PRO 21 2HB PRO 21 -11.895 10.699 -15.340 145 HB3 PRO 21 3HB PRO 21 -11.254 10.563 -13.698 146 HG2 PRO 21 2HG PRO 21 -11.085 12.858 -15.613 147 HG3 PRO 21 3HG PRO 21 -11.431 12.875 -13.873 148 HD2 PRO 21 2HD PRO 21 -8.989 13.474 -14.880 149 HD3 PRO 21 3HD PRO 21 -9.206 12.690 -13.302 150 H ASP 22 H ASP 22 -10.452 8.259 -16.475 151 HA ASP 22 HA ASP 22 -10.409 7.543 -18.654 152 HB2 ASP 22 2HB ASP 22 -11.908 8.766 -20.089 153 HB3 ASP 22 3HB ASP 22 -12.542 8.833 -18.447 154 H SER 23 H SER 23 -7.994 8.871 -17.856 155 HA SER 23 HA SER 23 -7.177 10.065 -20.425 156 HB2 SER 23 2HB SER 23 -7.114 11.402 -18.112 157 HB3 SER 23 3HB SER 23 -5.564 10.573 -17.972 158 HG SER 23 HG SER 23 -6.228 11.899 -20.358 159 H PHE 24 H PHE 24 -6.818 7.464 -18.320 160 HA PHE 24 HA PHE 24 -4.329 6.657 -19.672 161 HB2 PHE 24 2HB PHE 24 -3.395 5.864 -17.724 162 HB3 PHE 24 3HB PHE 24 -4.318 7.221 -17.087 163 HD1 PHE 24 HD2 PHE 24 -6.411 6.837 -15.872 164 HD2 PHE 24 HD1 PHE 24 -3.979 3.610 -17.209 165 HE1 PHE 24 HE2 PHE 24 -7.603 5.313 -14.351 166 HE2 PHE 24 HE1 PHE 24 -5.167 2.081 -15.691 167 HZ PHE 24 HZ PHE 24 -6.981 2.932 -14.258 168 H SER 25 H SER 25 -4.230 4.602 -20.464 169 HA SER 25 HA SER 25 -6.755 3.127 -20.503 170 HB2 SER 25 2HB SER 25 -4.514 2.124 -22.135 171 HB3 SER 25 3HB SER 25 -6.193 2.424 -22.584 172 HG SER 25 HG SER 25 -5.714 4.597 -22.820 173 HA PRO 26 HA PRO 26 -5.406 -0.197 -17.979 174 HB2 PRO 26 2HB PRO 26 -6.437 -2.359 -19.258 175 HB3 PRO 26 3HB PRO 26 -7.436 -1.197 -18.376 176 HG2 PRO 26 2HG PRO 26 -6.911 -1.397 -21.317 177 HG3 PRO 26 3HG PRO 26 -8.439 -1.086 -20.472 178 HD2 PRO 26 2HD PRO 26 -6.975 0.888 -21.607 179 HD3 PRO 26 3HD PRO 26 -7.952 1.143 -20.146 180 H LYS 27 H LYS 27 -4.427 -0.059 -21.273 181 HA LYS 27 HA LYS 27 -2.319 -2.054 -20.757 182 HB2 LYS 27 2HB LYS 27 -2.272 -2.581 -23.072 183 HB3 LYS 27 3HB LYS 27 -3.967 -2.568 -22.605 184 HG2 LYS 27 2HG LYS 27 -3.803 -0.060 -23.419 185 HG3 LYS 27 3HG LYS 27 -2.466 -0.713 -24.368 186 HD2 LYS 27 2HD LYS 27 -4.233 -1.021 -25.812 187 HD3 LYS 27 3HD LYS 27 -4.202 -2.575 -24.977 188 HE2 LYS 27 2HE LYS 27 -5.994 -1.890 -23.528 189 HE3 LYS 27 3HE LYS 27 -5.949 -0.252 -24.177 190 HZ1 LYS 27 3HZ LYS 27 -7.074 -2.681 -25.341 191 HZ2 LYS 27 1HZ LYS 27 -6.366 -1.575 -26.407 192 HZ3 LYS 27 2HZ LYS 27 -7.639 -1.088 -25.407 193 H LYS 28 H LYS 28 -2.297 0.789 -20.051 194 HA LYS 28 HA LYS 28 0.050 1.592 -21.636 195 HB2 LYS 28 2HB LYS 28 -2.319 3.222 -20.787 196 HB3 LYS 28 3HB LYS 28 -0.754 3.995 -21.001 197 HG2 LYS 28 2HG LYS 28 -2.140 2.370 -23.120 198 HG3 LYS 28 3HG LYS 28 -2.236 4.127 -22.985 199 HD2 LYS 28 2HD LYS 28 0.288 4.147 -23.108 200 HD3 LYS 28 3HD LYS 28 0.195 2.440 -23.547 201 HE2 LYS 28 2HE LYS 28 -1.178 3.008 -25.484 202 HE3 LYS 28 3HE LYS 28 -1.119 4.712 -25.036 203 HZ1 LYS 28 3HZ LYS 28 1.025 3.005 -26.111 204 HZ2 LYS 28 1HZ LYS 28 1.420 4.360 -25.177 205 HZ3 LYS 28 2HZ LYS 28 0.536 4.547 -26.607 206 H PHE 29 H PHE 29 -0.696 0.358 -18.841 207 HA PHE 29 HA PHE 29 0.902 2.204 -17.206 208 HB2 PHE 29 2HB PHE 29 -1.243 1.693 -16.219 209 HB3 PHE 29 3HB PHE 29 -0.968 -0.035 -16.414 210 HD1 PHE 29 HD1 PHE 29 1.422 2.514 -15.180 211 HD2 PHE 29 HD2 PHE 29 -1.057 -0.809 -14.215 212 HE1 PHE 29 HE1 PHE 29 2.422 2.424 -12.934 213 HE2 PHE 29 HE2 PHE 29 -0.061 -0.903 -11.967 214 HZ PHE 29 HZ PHE 29 1.680 0.715 -11.324 215 H PHE 30 H PHE 30 0.958 -0.833 -18.771 216 HA PHE 30 HA PHE 30 3.010 -1.993 -17.109 217 HB2 PHE 30 2HB PHE 30 2.844 -3.897 -18.458 218 HB3 PHE 30 3HB PHE 30 1.211 -3.240 -18.488 219 HD1 PHE 30 HD1 PHE 30 4.268 -3.794 -20.414 220 HD2 PHE 30 HD2 PHE 30 0.297 -2.265 -20.495 221 HE1 PHE 30 HE1 PHE 30 4.345 -3.737 -22.873 222 HE2 PHE 30 HE2 PHE 30 0.366 -2.206 -22.954 223 HZ PHE 30 HZ PHE 30 2.391 -2.943 -24.146 224 H GLN 31 H GLN 31 3.005 0.406 -19.376 225 HA GLN 31 HA GLN 31 5.587 -0.274 -20.550 226 HB2 GLN 31 2HB GLN 31 4.207 2.324 -21.064 227 HB3 GLN 31 3HB GLN 31 5.185 1.346 -22.149 228 HG2 GLN 31 2HG GLN 31 3.359 -0.295 -22.280 229 HG3 GLN 31 3HG GLN 31 2.377 0.745 -21.249 230 HE21 GLN 31 1HE2 GLN 31 2.932 3.217 -22.258 231 HE22 GLN 31 2HE2 GLN 31 2.354 3.332 -23.881 232 H ILE 32 H ILE 32 4.134 2.038 -18.333 233 HA ILE 32 HA ILE 32 6.653 3.436 -17.960 234 HB ILE 32 HB ILE 32 4.000 3.819 -16.568 235 HG12 ILE 32 2HG1 ILE 32 4.575 6.047 -18.136 236 HG13 ILE 32 3HG1 ILE 32 5.037 4.683 -19.147 237 HG21 ILE 32 1HG2 ILE 32 5.573 4.698 -15.100 238 HG22 ILE 32 2HG2 ILE 32 6.615 5.266 -16.404 239 HG23 ILE 32 3HG2 ILE 32 5.097 6.096 -16.064 240 HD11 ILE 32 3HD1 ILE 32 2.442 4.414 -17.808 241 HD12 ILE 32 1HD1 ILE 32 2.547 5.706 -19.003 242 HD13 ILE 32 2HD1 ILE 32 2.914 4.044 -19.466 243 H SER 33 H SER 33 4.767 0.962 -16.428 244 HA SER 33 HA SER 33 6.402 1.075 -14.005 245 HB2 SER 33 2HB SER 33 3.759 0.661 -14.229 246 HB3 SER 33 3HB SER 33 4.309 -1.012 -14.327 247 HG SER 33 HG SER 33 5.409 0.577 -12.323 248 H GLY 34 H GLY 34 5.152 -1.618 -15.984 249 HA2 GLY 34 2HA GLY 34 6.889 -2.935 -17.221 250 HA3 GLY 34 3HA GLY 34 7.814 -2.877 -15.728 251 H MET 35 H MET 35 4.340 -3.436 -16.112 252 HA MET 35 HA MET 35 4.405 -5.680 -14.361 253 HB2 MET 35 2HB MET 35 2.153 -4.968 -16.234 254 HB3 MET 35 3HB MET 35 2.054 -5.823 -14.700 255 HG2 MET 35 2HG MET 35 2.714 -3.774 -13.528 256 HG3 MET 35 3HG MET 35 2.770 -2.924 -15.071 257 HE1 MET 35 3HE MET 35 -1.103 -4.707 -13.302 258 HE2 MET 35 1HE MET 35 0.225 -5.675 -13.943 259 HE3 MET 35 2HE MET 35 0.445 -4.752 -12.456 260 H SER 36 H SER 36 3.888 -5.343 -17.864 261 HA SER 36 HA SER 36 3.475 -8.005 -18.501 262 HB2 SER 36 2HB SER 36 4.086 -7.439 -20.757 263 HB3 SER 36 3HB SER 36 3.266 -6.041 -20.062 264 HG SER 36 HG SER 36 5.811 -6.272 -20.990 265 H LYS 37 H LYS 37 6.465 -6.302 -17.841 266 HA LYS 37 HA LYS 37 8.268 -8.235 -18.803 267 HB2 LYS 37 2HB LYS 37 8.796 -6.460 -16.428 268 HB3 LYS 37 3HB LYS 37 9.948 -7.067 -17.610 269 HG2 LYS 37 2HG LYS 37 7.842 -4.961 -18.023 270 HG3 LYS 37 3HG LYS 37 9.595 -4.755 -18.044 271 HD2 LYS 37 2HD LYS 37 7.996 -6.398 -20.009 272 HD3 LYS 37 3HD LYS 37 8.643 -4.783 -20.309 273 HE2 LYS 37 2HE LYS 37 10.473 -5.792 -21.082 274 HE3 LYS 37 3HE LYS 37 10.830 -6.219 -19.410 275 HZ1 LYS 37 3HZ LYS 37 9.001 -7.965 -20.866 276 HZ2 LYS 37 1HZ LYS 37 10.182 -8.351 -19.717 277 HZ3 LYS 37 2HZ LYS 37 10.631 -8.021 -21.314 278 H LYS 38 H LYS 38 6.180 -8.265 -16.118 279 HA LYS 38 HA LYS 38 7.755 -10.234 -14.651 280 HB2 LYS 38 2HB LYS 38 5.001 -9.240 -13.936 281 HB3 LYS 38 3HB LYS 38 6.196 -9.976 -12.877 282 HG2 LYS 38 2HG LYS 38 6.591 -7.319 -14.228 283 HG3 LYS 38 3HG LYS 38 5.908 -7.507 -12.611 284 HD2 LYS 38 2HD LYS 38 7.958 -7.610 -11.760 285 HD3 LYS 38 3HD LYS 38 8.293 -9.042 -12.737 286 HE2 LYS 38 2HE LYS 38 8.691 -7.293 -14.636 287 HE3 LYS 38 3HE LYS 38 8.909 -6.171 -13.294 288 HZ1 LYS 38 3HZ LYS 38 10.949 -6.940 -13.005 289 HZ2 LYS 38 1HZ LYS 38 10.761 -7.969 -14.335 290 HZ3 LYS 38 2HZ LYS 38 10.374 -8.515 -12.782 291 H SER 39 H SER 39 6.748 -12.259 -13.957 292 HA SER 39 HA SER 39 5.574 -13.627 -16.173 293 HB2 SER 39 2HB SER 39 7.169 -14.496 -14.251 294 HB3 SER 39 3HB SER 39 5.642 -14.839 -13.439 295 HG SER 39 HG SER 39 6.824 -16.112 -15.548 296 H SER 40 H SER 40 3.701 -15.267 -15.486 297 HA SER 40 HA SER 40 1.403 -13.606 -15.061 298 HB2 SER 40 2HB SER 40 0.785 -16.421 -14.956 299 HB3 SER 40 3HB SER 40 0.369 -15.238 -16.197 300 HG SER 40 HG SER 40 2.291 -15.661 -17.226 301 H SER 41 H SER 41 3.515 -15.189 -13.001 302 HA SER 41 HA SER 41 1.522 -15.719 -10.938 303 HB2 SER 41 2HB SER 41 4.464 -16.309 -11.192 304 HB3 SER 41 3HB SER 41 3.625 -16.476 -9.650 305 HG SER 41 HG SER 41 3.353 -17.962 -12.004 306 H GLN 42 H GLN 42 4.088 -13.477 -11.718 307 HA GLN 42 HA GLN 42 4.213 -12.243 -9.150 308 HB2 GLN 42 2HB GLN 42 5.314 -11.690 -11.853 309 HB3 GLN 42 3HB GLN 42 5.210 -10.332 -10.741 310 HG2 GLN 42 2HG GLN 42 6.462 -11.730 -9.076 311 HG3 GLN 42 3HG GLN 42 6.724 -12.900 -10.368 312 HE21 GLN 42 1HE2 GLN 42 7.203 -9.507 -9.514 313 HE22 GLN 42 2HE2 GLN 42 8.659 -9.299 -10.421 314 H LEU 43 H LEU 43 2.384 -11.663 -12.092 315 HA LEU 43 HA LEU 43 1.329 -9.141 -11.272 316 HB2 LEU 43 2HB LEU 43 0.147 -11.033 -13.292 317 HB3 LEU 43 3HB LEU 43 -0.090 -9.290 -13.184 318 HG LEU 43 HG LEU 43 2.668 -10.306 -13.648 319 HD11 LEU 43 1HD1 LEU 43 0.431 -10.392 -15.646 320 HD12 LEU 43 2HD1 LEU 43 1.611 -11.642 -15.253 321 HD13 LEU 43 3HD1 LEU 43 2.115 -10.201 -16.136 322 HD21 LEU 43 3HD2 LEU 43 1.059 -7.865 -14.214 323 HD22 LEU 43 1HD2 LEU 43 2.430 -8.244 -15.256 324 HD23 LEU 43 2HD2 LEU 43 2.675 -8.018 -13.524 325 H LYS 44 H LYS 44 0.614 -12.377 -10.483 326 HA LYS 44 HA LYS 44 -2.161 -12.101 -9.922 327 HB2 LYS 44 2HB LYS 44 -0.048 -14.115 -9.352 328 HB3 LYS 44 3HB LYS 44 -1.489 -14.152 -8.345 329 HG2 LYS 44 2HG LYS 44 -2.808 -14.184 -10.526 330 HG3 LYS 44 3HG LYS 44 -1.269 -14.554 -11.309 331 HD2 LYS 44 2HD LYS 44 -2.072 -16.169 -8.942 332 HD3 LYS 44 3HD LYS 44 -2.897 -16.465 -10.474 333 HE2 LYS 44 2HE LYS 44 -1.176 -17.868 -10.843 334 HE3 LYS 44 3HE LYS 44 -0.323 -16.395 -11.298 335 HZ1 LYS 44 3HZ LYS 44 -0.292 -17.609 -8.588 336 HZ2 LYS 44 1HZ LYS 44 0.580 -16.247 -9.083 337 HZ3 LYS 44 2HZ LYS 44 0.942 -17.765 -9.735 338 H GLU 45 H GLU 45 0.745 -11.325 -8.200 339 HA GLU 45 HA GLU 45 -0.240 -11.294 -5.573 340 HB2 GLU 45 2HB GLU 45 1.859 -9.447 -6.716 341 HB3 GLU 45 3HB GLU 45 1.661 -9.913 -5.032 342 HG2 GLU 45 2HG GLU 45 1.997 -12.332 -6.018 343 HG3 GLU 45 3HG GLU 45 2.808 -11.440 -7.305 344 H ILE 46 H ILE 46 -0.095 -8.728 -8.023 345 HA ILE 46 HA ILE 46 -1.118 -6.640 -6.494 346 HB ILE 46 HB ILE 46 -1.546 -7.120 -9.446 347 HG12 ILE 46 2HG1 ILE 46 0.459 -5.157 -8.609 348 HG13 ILE 46 3HG1 ILE 46 0.847 -6.800 -8.111 349 HG21 ILE 46 1HG2 ILE 46 -2.985 -5.400 -9.092 350 HG22 ILE 46 2HG2 ILE 46 -2.151 -4.856 -7.637 351 HG23 ILE 46 3HG2 ILE 46 -1.496 -4.465 -9.227 352 HD11 ILE 46 3HD1 ILE 46 0.031 -7.025 -10.760 353 HD12 ILE 46 1HD1 ILE 46 1.035 -5.576 -10.703 354 HD13 ILE 46 2HD1 ILE 46 1.677 -7.118 -10.135 355 H PHE 47 H PHE 47 -2.778 -9.204 -8.247 356 HA PHE 47 HA PHE 47 -5.380 -8.239 -8.175 357 HB2 PHE 47 2HB PHE 47 -5.364 -10.151 -9.399 358 HB3 PHE 47 3HB PHE 47 -4.113 -10.895 -8.409 359 HD1 PHE 47 HD1 PHE 47 -4.703 -12.102 -6.364 360 HD2 PHE 47 HD2 PHE 47 -7.683 -10.489 -8.940 361 HE1 PHE 47 HE1 PHE 47 -6.402 -13.511 -5.276 362 HE2 PHE 47 HE2 PHE 47 -9.386 -11.894 -7.856 363 HZ PHE 47 HZ PHE 47 -8.747 -13.408 -6.021 364 H ARG 48 H ARG 48 -3.525 -9.918 -5.693 365 HA ARG 48 HA ARG 48 -5.651 -10.317 -3.878 366 HB2 ARG 48 2HB ARG 48 -2.862 -10.831 -3.960 367 HB3 ARG 48 3HB ARG 48 -3.186 -9.945 -2.476 368 HG2 ARG 48 2HG ARG 48 -4.485 -12.514 -3.355 369 HG3 ARG 48 3HG ARG 48 -3.304 -12.312 -2.060 370 HD2 ARG 48 2HD ARG 48 -5.361 -10.498 -1.501 371 HD3 ARG 48 3HD ARG 48 -6.164 -11.986 -2.001 372 HE ARG 48 HE ARG 48 -4.637 -11.557 0.403 373 HH11 ARG 48 1HH1 ARG 48 -5.880 -13.911 -1.840 374 HH12 ARG 48 2HH1 ARG 48 -5.842 -15.213 -0.698 375 HH21 ARG 48 1HH2 ARG 48 -4.583 -13.263 1.917 376 HH22 ARG 48 2HH2 ARG 48 -5.106 -14.843 1.440 377 H ILE 49 H ILE 49 -4.101 -7.500 -4.881 378 HA ILE 49 HA ILE 49 -4.650 -6.066 -2.390 379 HB ILE 49 HB ILE 49 -3.399 -4.950 -4.896 380 HG12 ILE 49 2HG1 ILE 49 -2.041 -6.821 -4.129 381 HG13 ILE 49 3HG1 ILE 49 -1.224 -5.304 -3.768 382 HG21 ILE 49 1HG2 ILE 49 -2.426 -3.666 -2.622 383 HG22 ILE 49 2HG2 ILE 49 -3.585 -3.032 -3.789 384 HG23 ILE 49 3HG2 ILE 49 -4.156 -3.857 -2.338 385 HD11 ILE 49 3HD1 ILE 49 -2.810 -6.933 -1.798 386 HD12 ILE 49 1HD1 ILE 49 -1.053 -6.921 -1.941 387 HD13 ILE 49 2HD1 ILE 49 -1.908 -5.458 -1.454 388 H LEU 50 H LEU 50 -6.028 -6.674 -5.442 389 HA LEU 50 HA LEU 50 -7.634 -4.243 -5.447 390 HB2 LEU 50 2HB LEU 50 -7.095 -6.446 -7.359 391 HB3 LEU 50 3HB LEU 50 -8.650 -5.625 -7.484 392 HG LEU 50 HG LEU 50 -6.941 -3.511 -7.419 393 HD11 LEU 50 1HD1 LEU 50 -5.552 -5.488 -9.190 394 HD12 LEU 50 2HD1 LEU 50 -5.070 -5.267 -7.508 395 HD13 LEU 50 3HD1 LEU 50 -4.995 -3.910 -8.632 396 HD21 LEU 50 3HD2 LEU 50 -7.443 -3.245 -9.721 397 HD22 LEU 50 1HD2 LEU 50 -8.831 -4.054 -8.992 398 HD23 LEU 50 2HD2 LEU 50 -7.670 -4.981 -9.943 399 H ASP 51 H ASP 51 -7.858 -7.573 -4.545 400 HA ASP 51 HA ASP 51 -10.683 -7.821 -4.589 401 HB2 ASP 51 2HB ASP 51 -8.809 -9.646 -4.396 402 HB3 ASP 51 3HB ASP 51 -8.978 -9.362 -2.666 403 H ASN 52 H ASN 52 -12.080 -6.755 -3.366 404 HA ASN 52 HA ASN 52 -11.201 -5.720 -0.765 405 HB2 ASN 52 2HB ASN 52 -12.918 -4.712 -2.872 406 HB3 ASN 52 3HB ASN 52 -13.750 -4.703 -1.319 407 HD21 ASN 52 1HD2 ASN 52 -10.434 -4.064 -2.420 408 HD22 ASN 52 2HD2 ASN 52 -10.285 -2.537 -1.624 409 H ASP 53 H ASP 53 -12.662 -8.385 -1.922 410 HA ASP 53 HA ASP 53 -14.187 -8.761 0.559 411 HB2 ASP 53 2HB ASP 53 -15.421 -10.233 -1.581 412 HB3 ASP 53 3HB ASP 53 -16.134 -9.035 -0.504 413 H GLN 54 H GLN 54 -11.684 -9.741 -1.270 414 HA GLN 54 HA GLN 54 -10.446 -11.643 -1.476 415 HB2 GLN 54 2HB GLN 54 -11.736 -12.607 1.061 416 HB3 GLN 54 3HB GLN 54 -10.083 -12.844 0.509 417 HG2 GLN 54 2HG GLN 54 -11.182 -10.150 1.250 418 HG3 GLN 54 3HG GLN 54 -10.410 -11.227 2.412 419 HE21 GLN 54 1HE2 GLN 54 -9.940 -8.819 0.125 420 HE22 GLN 54 2HE2 GLN 54 -8.218 -8.904 0.011 421 H SER 55 H SER 55 -13.315 -11.624 -2.435 422 HA SER 55 HA SER 55 -14.344 -14.254 -2.131 423 HB2 SER 55 2HB SER 55 -15.585 -13.488 -4.352 424 HB3 SER 55 3HB SER 55 -16.014 -12.808 -2.783 425 HG SER 55 HG SER 55 -14.545 -11.661 -4.883 426 H GLY 56 H GLY 56 -11.829 -12.945 -4.026 427 HA2 GLY 56 2HA GLY 56 -10.306 -14.574 -5.034 428 HA3 GLY 56 3HA GLY 56 -11.725 -15.448 -5.591 429 H PHE 57 H PHE 57 -12.862 -12.612 -6.158 430 HA PHE 57 HA PHE 57 -11.356 -12.091 -8.627 431 HB2 PHE 57 2HB PHE 57 -14.374 -12.124 -8.498 432 HB3 PHE 57 3HB PHE 57 -13.365 -11.949 -9.931 433 HD1 PHE 57 HD1 PHE 57 -14.580 -14.293 -7.378 434 HD2 PHE 57 HD2 PHE 57 -12.399 -13.847 -11.006 435 HE1 PHE 57 HE1 PHE 57 -14.648 -16.729 -7.715 436 HE2 PHE 57 HE2 PHE 57 -12.464 -16.283 -11.348 437 HZ PHE 57 HZ PHE 57 -13.590 -17.727 -9.702 438 H ILE 58 H ILE 58 -12.004 -9.969 -9.630 439 HA ILE 58 HA ILE 58 -12.620 -8.005 -7.519 440 HB ILE 58 HB ILE 58 -10.796 -7.606 -9.892 441 HG12 ILE 58 2HG1 ILE 58 -9.794 -7.448 -7.103 442 HG13 ILE 58 3HG1 ILE 58 -10.165 -9.056 -7.715 443 HG21 ILE 58 1HG2 ILE 58 -11.915 -5.558 -9.272 444 HG22 ILE 58 2HG2 ILE 58 -11.488 -5.801 -7.580 445 HG23 ILE 58 3HG2 ILE 58 -10.226 -5.481 -8.769 446 HD11 ILE 58 3HD1 ILE 58 -7.800 -8.366 -7.997 447 HD12 ILE 58 1HD1 ILE 58 -8.606 -8.808 -9.501 448 HD13 ILE 58 2HD1 ILE 58 -8.347 -7.109 -9.105 449 H GLU 59 H GLU 59 -14.665 -7.387 -7.866 450 HA GLU 59 HA GLU 59 -15.768 -7.193 -10.522 451 HB2 GLU 59 2HB GLU 59 -17.078 -6.168 -8.015 452 HB3 GLU 59 3HB GLU 59 -17.840 -6.763 -9.484 453 HG2 GLU 59 2HG GLU 59 -18.170 -8.580 -8.192 454 HG3 GLU 59 3HG GLU 59 -16.556 -8.981 -8.775 455 H GLU 60 H GLU 60 -17.019 -5.164 -11.113 456 HA GLU 60 HA GLU 60 -15.283 -3.047 -11.521 457 HB2 GLU 60 2HB GLU 60 -18.274 -3.272 -11.616 458 HB3 GLU 60 3HB GLU 60 -17.492 -1.722 -11.888 459 HG2 GLU 60 2HG GLU 60 -16.574 -2.373 -13.877 460 HG3 GLU 60 3HG GLU 60 -16.552 -4.079 -13.435 461 H ASP 61 H ASP 61 -17.393 -3.705 -8.826 462 HA ASP 61 HA ASP 61 -17.460 -1.146 -7.668 463 HB2 ASP 61 2HB ASP 61 -18.743 -3.373 -7.079 464 HB3 ASP 61 3HB ASP 61 -17.410 -3.594 -5.950 465 H GLU 62 H GLU 62 -14.960 -3.505 -7.854 466 HA GLU 62 HA GLU 62 -13.368 -2.005 -5.882 467 HB2 GLU 62 2HB GLU 62 -11.958 -4.302 -6.268 468 HB3 GLU 62 3HB GLU 62 -13.124 -4.053 -4.976 469 HG2 GLU 62 2HG GLU 62 -14.858 -4.962 -6.624 470 HG3 GLU 62 3HG GLU 62 -13.475 -5.528 -7.557 471 H LEU 63 H LEU 63 -13.683 -2.876 -9.169 472 HA LEU 63 HA LEU 63 -10.947 -2.621 -9.933 473 HB2 LEU 63 2HB LEU 63 -13.205 -3.548 -11.142 474 HB3 LEU 63 3HB LEU 63 -12.980 -2.001 -11.956 475 HG LEU 63 HG LEU 63 -11.074 -4.334 -11.892 476 HD11 LEU 63 1HD1 LEU 63 -13.117 -3.413 -13.711 477 HD12 LEU 63 2HD1 LEU 63 -12.188 -4.912 -13.725 478 HD13 LEU 63 3HD1 LEU 63 -11.536 -3.464 -14.492 479 HD21 LEU 63 3HD2 LEU 63 -9.746 -2.350 -11.691 480 HD22 LEU 63 1HD2 LEU 63 -10.676 -1.541 -12.952 481 HD23 LEU 63 2HD2 LEU 63 -9.648 -2.915 -13.359 482 H LYS 64 H LYS 64 -13.599 -0.404 -9.498 483 HA LYS 64 HA LYS 64 -12.614 1.775 -10.976 484 HB2 LYS 64 2HB LYS 64 -14.056 3.139 -9.390 485 HB3 LYS 64 3HB LYS 64 -14.876 1.869 -10.290 486 HG2 LYS 64 2HG LYS 64 -15.254 0.603 -8.433 487 HG3 LYS 64 3HG LYS 64 -13.827 1.211 -7.592 488 HD2 LYS 64 2HD LYS 64 -15.876 2.020 -6.541 489 HD3 LYS 64 3HD LYS 64 -14.951 3.355 -7.233 490 HE2 LYS 64 2HE LYS 64 -16.524 3.810 -8.794 491 HE3 LYS 64 3HE LYS 64 -16.960 2.114 -9.003 492 HZ1 LYS 64 3HZ LYS 64 -18.717 3.528 -7.982 493 HZ2 LYS 64 1HZ LYS 64 -17.722 3.717 -6.627 494 HZ3 LYS 64 2HZ LYS 64 -18.286 2.181 -7.054 495 H TYR 65 H TYR 65 -11.754 0.500 -7.868 496 HA TYR 65 HA TYR 65 -10.232 2.886 -7.163 497 HB2 TYR 65 2HB TYR 65 -10.698 0.297 -5.670 498 HB3 TYR 65 3HB TYR 65 -9.759 1.651 -5.050 499 HD1 TYR 65 HD1 TYR 65 -11.191 4.000 -5.423 500 HD2 TYR 65 HD2 TYR 65 -12.781 0.117 -4.719 501 HE1 TYR 65 HE1 TYR 65 -13.242 5.011 -4.516 502 HE2 TYR 65 HE2 TYR 65 -14.837 1.117 -3.811 503 HH TYR 65 HH TYR 65 -15.727 3.071 -2.993 504 H PHE 66 H PHE 66 -9.551 1.036 -9.429 505 HA PHE 66 HA PHE 66 -7.343 -0.554 -8.867 506 HB2 PHE 66 2HB PHE 66 -8.291 -0.735 -11.028 507 HB3 PHE 66 3HB PHE 66 -8.133 0.992 -11.329 508 HD1 PHE 66 HD1 PHE 66 -6.102 -2.066 -10.740 509 HD2 PHE 66 HD2 PHE 66 -6.316 1.796 -12.515 510 HE1 PHE 66 HE1 PHE 66 -3.947 -2.465 -11.859 511 HE2 PHE 66 HE2 PHE 66 -4.163 1.404 -13.638 512 HZ PHE 66 HZ PHE 66 -2.976 -0.729 -13.311 513 H LEU 67 H LEU 67 -7.620 2.900 -9.090 514 HA LEU 67 HA LEU 67 -4.768 3.340 -9.255 515 HB2 LEU 67 2HB LEU 67 -6.613 5.520 -8.463 516 HB3 LEU 67 3HB LEU 67 -5.247 5.543 -9.576 517 HG LEU 67 HG LEU 67 -8.078 4.689 -10.099 518 HD11 LEU 67 1HD1 LEU 67 -6.575 6.347 -11.996 519 HD12 LEU 67 2HD1 LEU 67 -6.842 7.082 -10.416 520 HD13 LEU 67 3HD1 LEU 67 -8.215 6.529 -11.375 521 HD21 LEU 67 3HD2 LEU 67 -7.114 2.964 -11.228 522 HD22 LEU 67 1HD2 LEU 67 -5.580 3.809 -11.438 523 HD23 LEU 67 2HD2 LEU 67 -6.960 4.219 -12.458 524 H GLN 68 H GLN 68 -7.070 2.797 -6.802 525 HA GLN 68 HA GLN 68 -5.620 4.181 -4.721 526 HB2 GLN 68 2HB GLN 68 -8.193 2.830 -4.988 527 HB3 GLN 68 3HB GLN 68 -7.391 2.465 -3.466 528 HG2 GLN 68 2HG GLN 68 -8.149 4.377 -2.665 529 HG3 GLN 68 3HG GLN 68 -7.124 5.226 -3.822 530 HE21 GLN 68 1HE2 GLN 68 -8.229 4.941 -6.171 531 HE22 GLN 68 2HE2 GLN 68 -9.855 5.524 -6.210 532 H ARG 69 H ARG 69 -4.894 1.530 -6.401 533 HA ARG 69 HA ARG 69 -3.961 -0.040 -4.104 534 HB2 ARG 69 2HB ARG 69 -3.590 -1.040 -6.874 535 HB3 ARG 69 3HB ARG 69 -4.039 -1.910 -5.414 536 HG2 ARG 69 2HG ARG 69 -5.840 -0.145 -7.059 537 HG3 ARG 69 3HG ARG 69 -5.863 -1.909 -7.002 538 HD2 ARG 69 2HD ARG 69 -6.106 -1.360 -4.383 539 HD3 ARG 69 3HD ARG 69 -6.877 0.073 -5.061 540 HE ARG 69 HE ARG 69 -7.909 -2.204 -6.334 541 HH11 ARG 69 1HH1 ARG 69 -7.942 -0.627 -3.231 542 HH12 ARG 69 2HH1 ARG 69 -9.506 -1.232 -2.794 543 HH21 ARG 69 1HH2 ARG 69 -9.968 -3.007 -5.771 544 HH22 ARG 69 2HH2 ARG 69 -10.657 -2.587 -4.239 545 H PHE 70 H PHE 70 -2.871 1.814 -6.851 546 HA PHE 70 HA PHE 70 -0.078 1.171 -6.201 547 HB2 PHE 70 2HB PHE 70 -1.397 2.244 -8.686 548 HB3 PHE 70 3HB PHE 70 0.341 2.378 -8.438 549 HD1 PHE 70 HD1 PHE 70 -2.450 -0.017 -8.771 550 HD2 PHE 70 HD2 PHE 70 1.769 0.543 -8.798 551 HE1 PHE 70 HE1 PHE 70 -2.157 -2.298 -9.647 552 HE2 PHE 70 HE2 PHE 70 2.069 -1.737 -9.674 553 HZ PHE 70 HZ PHE 70 0.105 -3.160 -10.101 554 H GLU 71 H GLU 71 -2.445 3.580 -5.894 555 HA GLU 71 HA GLU 71 -0.385 5.611 -5.332 556 HB2 GLU 71 2HB GLU 71 -1.980 6.130 -7.205 557 HB3 GLU 71 3HB GLU 71 -3.280 6.123 -6.022 558 HG2 GLU 71 2HG GLU 71 -2.353 8.377 -6.657 559 HG3 GLU 71 3HG GLU 71 -2.449 8.028 -4.932 560 H SER 72 H SER 72 -3.329 4.062 -4.213 561 HA SER 72 HA SER 72 -4.314 3.929 -2.167 562 HB2 SER 72 2HB SER 72 -1.862 5.039 -0.850 563 HB3 SER 72 3HB SER 72 -2.924 3.736 -0.317 564 HG SER 72 HG SER 72 -2.058 2.475 -2.052 565 H GLY 73 H GLY 73 -5.296 5.983 -3.345 566 HA2 GLY 73 2HA GLY 73 -6.390 7.694 -1.639 567 HA3 GLY 73 3HA GLY 73 -4.806 8.431 -1.835 568 H ALA 74 H ALA 74 -4.965 7.256 -4.708 569 HA ALA 74 HA ALA 74 -5.737 9.661 -5.969 570 HB1 ALA 74 1HB ALA 74 -5.740 7.969 -8.032 571 HB2 ALA 74 2HB ALA 74 -4.254 8.567 -7.292 572 HB3 ALA 74 3HB ALA 74 -4.875 6.973 -6.861 573 H ARG 75 H ARG 75 -7.328 9.515 -7.929 574 HA ARG 75 HA ARG 75 -9.927 9.148 -6.832 575 HB2 ARG 75 2HB ARG 75 -10.730 9.825 -9.057 576 HB3 ARG 75 3HB ARG 75 -9.482 10.909 -8.456 577 HG2 ARG 75 2HG ARG 75 -7.970 10.275 -10.035 578 HG3 ARG 75 3HG ARG 75 -8.642 8.650 -10.186 579 HD2 ARG 75 2HD ARG 75 -8.967 10.371 -12.111 580 HD3 ARG 75 3HD ARG 75 -10.305 9.328 -11.631 581 HE ARG 75 HE ARG 75 -11.458 11.199 -11.037 582 HH11 ARG 75 1HH1 ARG 75 -8.058 11.949 -11.021 583 HH12 ARG 75 2HH1 ARG 75 -8.298 13.630 -10.675 584 HH21 ARG 75 1HH2 ARG 75 -11.786 13.409 -10.581 585 HH22 ARG 75 2HH2 ARG 75 -10.419 14.459 -10.424 586 H VAL 76 H VAL 76 -11.532 8.087 -8.687 587 HA VAL 76 HA VAL 76 -10.669 5.276 -8.784 588 HB VAL 76 HB VAL 76 -12.935 4.611 -8.683 589 HG11 VAL 76 1HG1 VAL 76 -13.663 5.477 -6.594 590 HG12 VAL 76 2HG1 VAL 76 -11.898 5.501 -6.570 591 HG13 VAL 76 3HG1 VAL 76 -12.799 6.993 -6.847 592 HG21 VAL 76 3HG2 VAL 76 -13.419 7.266 -9.776 593 HG22 VAL 76 1HG2 VAL 76 -14.381 5.794 -9.908 594 HG23 VAL 76 2HG2 VAL 76 -14.549 6.833 -8.494 595 H LEU 77 H LEU 77 -12.498 4.270 -10.563 596 HA LEU 77 HA LEU 77 -11.572 5.462 -13.083 597 HB2 LEU 77 2HB LEU 77 -12.719 2.715 -12.616 598 HB3 LEU 77 3HB LEU 77 -11.973 3.311 -14.097 599 HG LEU 77 HG LEU 77 -10.609 2.701 -11.480 600 HD11 LEU 77 1HD1 LEU 77 -10.415 1.497 -14.235 601 HD12 LEU 77 2HD1 LEU 77 -11.078 0.737 -12.789 602 HD13 LEU 77 3HD1 LEU 77 -9.354 1.099 -12.883 603 HD21 LEU 77 3HD2 LEU 77 -9.740 4.300 -13.827 604 HD22 LEU 77 1HD2 LEU 77 -8.565 3.217 -13.081 605 HD23 LEU 77 2HD2 LEU 77 -9.334 4.479 -12.119 606 H THR 78 H THR 78 -12.965 6.229 -14.567 607 HA THR 78 HA THR 78 -15.702 6.626 -13.800 608 HB THR 78 HB THR 78 -14.456 8.372 -15.008 609 HG1 THR 78 HG1 THR 78 -16.137 8.675 -16.679 610 HG21 THR 78 3HG2 THR 78 -14.691 7.343 -17.670 611 HG22 THR 78 1HG2 THR 78 -13.725 6.235 -16.698 612 HG23 THR 78 2HG2 THR 78 -13.255 7.930 -16.831 613 H ALA 79 H ALA 79 -17.304 6.405 -15.842 614 HA ALA 79 HA ALA 79 -17.762 3.625 -16.118 615 HB1 ALA 79 1HB ALA 79 -19.710 4.855 -16.162 616 HB2 ALA 79 2HB ALA 79 -19.037 6.083 -17.235 617 HB3 ALA 79 3HB ALA 79 -19.476 4.499 -17.874 618 H SER 80 H SER 80 -15.705 5.711 -17.776 619 HA SER 80 HA SER 80 -15.721 4.045 -20.196 620 HB2 SER 80 2HB SER 80 -15.939 6.430 -20.631 621 HB3 SER 80 3HB SER 80 -14.486 6.763 -19.687 622 HG SER 80 HG SER 80 -13.324 6.271 -21.362 623 H GLU 81 H GLU 81 -14.100 4.426 -17.297 624 HA GLU 81 HA GLU 81 -11.521 3.542 -18.357 625 HB2 GLU 81 2HB GLU 81 -12.408 4.511 -15.645 626 HB3 GLU 81 3HB GLU 81 -10.833 3.773 -15.905 627 HG2 GLU 81 2HG GLU 81 -11.689 6.072 -17.601 628 HG3 GLU 81 3HG GLU 81 -11.096 6.356 -15.966 629 H THR 82 H THR 82 -13.685 2.606 -15.677 630 HA THR 82 HA THR 82 -12.553 0.132 -15.138 631 HB THR 82 HB THR 82 -15.253 -0.278 -14.659 632 HG1 THR 82 HG1 THR 82 -14.744 2.417 -13.969 633 HG21 THR 82 3HG2 THR 82 -12.888 0.009 -13.215 634 HG22 THR 82 1HG2 THR 82 -14.454 -0.501 -12.585 635 HG23 THR 82 2HG2 THR 82 -13.986 1.198 -12.515 636 H LYS 83 H LYS 83 -15.243 0.906 -17.332 637 HA LYS 83 HA LYS 83 -15.927 -1.624 -18.171 638 HB2 LYS 83 2HB LYS 83 -16.024 1.075 -19.417 639 HB3 LYS 83 3HB LYS 83 -16.275 -0.309 -20.473 640 HG2 LYS 83 2HG LYS 83 -18.043 -1.070 -18.828 641 HG3 LYS 83 3HG LYS 83 -17.902 0.529 -18.093 642 HD2 LYS 83 2HD LYS 83 -19.682 0.732 -19.605 643 HD3 LYS 83 3HD LYS 83 -18.305 1.448 -20.447 644 HE2 LYS 83 2HE LYS 83 -17.998 -0.975 -21.381 645 HE3 LYS 83 3HE LYS 83 -19.695 -1.150 -20.938 646 HZ1 LYS 83 3HZ LYS 83 -20.079 -0.279 -22.942 647 HZ2 LYS 83 1HZ LYS 83 -18.506 0.323 -23.107 648 HZ3 LYS 83 2HZ LYS 83 -19.664 1.208 -22.249 649 H THR 84 H THR 84 -13.473 0.508 -19.626 650 HA THR 84 HA THR 84 -12.597 -1.145 -21.656 651 HB THR 84 HB THR 84 -10.762 0.599 -20.009 652 HG1 THR 84 HG1 THR 84 -11.448 2.294 -21.343 653 HG21 THR 84 3HG2 THR 84 -9.936 -1.002 -21.887 654 HG22 THR 84 1HG2 THR 84 -9.362 0.665 -21.860 655 HG23 THR 84 2HG2 THR 84 -10.645 0.192 -22.974 656 H PHE 85 H PHE 85 -11.152 -0.875 -18.403 657 HA PHE 85 HA PHE 85 -9.262 -2.867 -18.613 658 HB2 PHE 85 2HB PHE 85 -9.684 -1.250 -16.673 659 HB3 PHE 85 3HB PHE 85 -10.862 -2.425 -16.097 660 HD1 PHE 85 HD2 PHE 85 -10.069 -4.771 -15.589 661 HD2 PHE 85 HD1 PHE 85 -7.406 -1.513 -16.233 662 HE1 PHE 85 HE2 PHE 85 -8.272 -6.022 -14.467 663 HE2 PHE 85 HE1 PHE 85 -5.605 -2.759 -15.113 664 HZ PHE 85 HZ PHE 85 -6.037 -5.016 -14.227 665 H LEU 86 H LEU 86 -12.654 -3.188 -17.614 666 HA LEU 86 HA LEU 86 -12.541 -5.983 -17.162 667 HB2 LEU 86 2HB LEU 86 -14.266 -4.428 -16.254 668 HB3 LEU 86 3HB LEU 86 -14.953 -4.323 -17.873 669 HG LEU 86 HG LEU 86 -15.140 -6.924 -17.643 670 HD11 LEU 86 1HD1 LEU 86 -14.879 -6.000 -14.794 671 HD12 LEU 86 2HD1 LEU 86 -13.984 -7.278 -15.614 672 HD13 LEU 86 3HD1 LEU 86 -15.695 -7.496 -15.249 673 HD21 LEU 86 3HD2 LEU 86 -17.179 -5.980 -17.895 674 HD22 LEU 86 1HD2 LEU 86 -16.871 -4.730 -16.689 675 HD23 LEU 86 2HD2 LEU 86 -17.315 -6.359 -16.177 676 H ALA 87 H ALA 87 -12.854 -4.056 -20.004 677 HA ALA 87 HA ALA 87 -13.883 -6.252 -21.611 678 HB1 ALA 87 1HB ALA 87 -14.815 -4.238 -22.288 679 HB2 ALA 87 2HB ALA 87 -13.286 -3.369 -22.150 680 HB3 ALA 87 3HB ALA 87 -13.538 -4.502 -23.476 681 H ALA 88 H ALA 88 -10.938 -5.441 -20.411 682 HA ALA 88 HA ALA 88 -9.517 -6.537 -22.751 683 HB1 ALA 88 1HB ALA 88 -8.634 -4.407 -22.505 684 HB2 ALA 88 2HB ALA 88 -8.700 -4.473 -20.743 685 HB3 ALA 88 3HB ALA 88 -7.487 -5.410 -21.616 686 H ALA 89 H ALA 89 -10.345 -6.978 -19.471 687 HA ALA 89 HA ALA 89 -8.531 -9.292 -19.325 688 HB1 ALA 89 1HB ALA 89 -8.887 -7.085 -17.379 689 HB2 ALA 89 2HB ALA 89 -8.693 -8.715 -16.734 690 HB3 ALA 89 3HB ALA 89 -7.450 -8.027 -17.778 691 H ASP 90 H ASP 90 -11.667 -8.118 -19.212 692 HA ASP 90 HA ASP 90 -12.619 -10.655 -18.080 693 HB2 ASP 90 2HB ASP 90 -13.098 -7.969 -17.053 694 HB3 ASP 90 3HB ASP 90 -14.596 -8.827 -17.403 695 H HIS 91 H HIS 91 -12.272 -9.613 -20.830 696 HA HIS 91 HA HIS 91 -14.563 -8.759 -22.074 697 HB2 HIS 91 2HB HIS 91 -12.135 -9.582 -22.946 698 HB3 HIS 91 3HB HIS 91 -13.132 -10.931 -23.482 699 HD1 HIS 91 HD1 HIS 91 -11.706 -8.644 -25.271 700 HD2 HIS 91 HD2 HIS 91 -15.743 -8.990 -24.355 701 HE1 HIS 91 HE1 HIS 91 -12.917 -7.400 -27.090 702 H ASP 92 H ASP 92 -14.079 -11.700 -20.429 703 HA ASP 92 HA ASP 92 -15.819 -13.420 -21.794 704 HB2 ASP 92 2HB ASP 92 -16.091 -14.203 -19.187 705 HB3 ASP 92 3HB ASP 92 -14.771 -14.687 -20.248 706 H GLY 93 H GLY 93 -16.426 -10.803 -19.571 707 HA2 GLY 93 2HA GLY 93 -18.476 -9.651 -19.427 708 HA3 GLY 93 3HA GLY 93 -19.283 -11.045 -20.128 709 H ASP 94 H ASP 94 -17.081 -11.706 -17.591 710 HA ASP 94 HA ASP 94 -19.177 -12.730 -15.932 711 HB2 ASP 94 2HB ASP 94 -16.269 -12.369 -15.195 712 HB3 ASP 94 3HB ASP 94 -17.426 -13.482 -14.469 713 H GLY 95 H GLY 95 -17.184 -9.845 -15.962 714 HA2 GLY 95 2HA GLY 95 -17.706 -7.806 -14.949 715 HA3 GLY 95 3HA GLY 95 -18.965 -8.613 -14.026 716 H LYS 96 H LYS 96 -16.020 -10.267 -13.920 717 HA LYS 96 HA LYS 96 -14.991 -8.825 -11.617 718 HB2 LYS 96 2HB LYS 96 -14.996 -10.854 -10.193 719 HB3 LYS 96 3HB LYS 96 -16.614 -10.276 -10.565 720 HG2 LYS 96 2HG LYS 96 -15.806 -12.176 -12.543 721 HG3 LYS 96 3HG LYS 96 -15.569 -12.856 -10.931 722 HD2 LYS 96 2HD LYS 96 -18.093 -11.429 -11.191 723 HD3 LYS 96 3HD LYS 96 -17.948 -12.768 -12.331 724 HE2 LYS 96 2HE LYS 96 -18.217 -14.281 -10.717 725 HE3 LYS 96 3HE LYS 96 -17.015 -13.501 -9.690 726 HZ1 LYS 96 3HZ LYS 96 -18.796 -13.108 -8.403 727 HZ2 LYS 96 1HZ LYS 96 -19.904 -13.256 -9.673 728 HZ3 LYS 96 2HZ LYS 96 -19.057 -11.809 -9.455 729 H ILE 97 H ILE 97 -12.868 -8.712 -11.868 730 HA ILE 97 HA ILE 97 -11.466 -10.292 -13.770 731 HB ILE 97 HB ILE 97 -10.424 -8.441 -11.624 732 HG12 ILE 97 2HG1 ILE 97 -11.889 -7.535 -13.525 733 HG13 ILE 97 3HG1 ILE 97 -10.322 -6.769 -13.283 734 HG21 ILE 97 1HG2 ILE 97 -9.055 -10.166 -13.582 735 HG22 ILE 97 2HG2 ILE 97 -8.466 -8.508 -13.469 736 HG23 ILE 97 3HG2 ILE 97 -8.493 -9.533 -12.034 737 HD11 ILE 97 3HD1 ILE 97 -11.325 -7.733 -15.655 738 HD12 ILE 97 1HD1 ILE 97 -9.646 -7.310 -15.325 739 HD13 ILE 97 2HD1 ILE 97 -10.186 -8.980 -15.149 740 H GLY 98 H GLY 98 -9.956 -11.917 -13.479 741 HA2 GLY 98 2HA GLY 98 -9.827 -13.078 -10.765 742 HA3 GLY 98 3HA GLY 98 -10.087 -14.077 -12.187 743 H ALA 99 H ALA 99 -8.087 -14.957 -10.846 744 HA ALA 99 HA ALA 99 -5.603 -13.631 -11.539 745 HB1 ALA 99 1HB ALA 99 -5.990 -16.300 -10.192 746 HB2 ALA 99 2HB ALA 99 -4.520 -15.325 -10.231 747 HB3 ALA 99 3HB ALA 99 -5.934 -14.753 -9.345 748 H GLU 100 H GLU 100 -7.639 -15.236 -13.377 749 HA GLU 100 HA GLU 100 -5.532 -16.703 -14.824 750 HB2 GLU 100 2HB GLU 100 -8.387 -17.371 -14.285 751 HB3 GLU 100 3HB GLU 100 -7.695 -17.876 -15.820 752 HG2 GLU 100 2HG GLU 100 -6.356 -18.504 -13.215 753 HG3 GLU 100 3HG GLU 100 -7.635 -19.523 -13.871 754 H GLU 101 H GLU 101 -7.668 -14.104 -14.884 755 HA GLU 101 HA GLU 101 -7.358 -13.860 -17.804 756 HB2 GLU 101 2HB GLU 101 -9.501 -12.637 -17.852 757 HB3 GLU 101 3HB GLU 101 -9.691 -14.295 -17.300 758 HG2 GLU 101 2HG GLU 101 -9.390 -13.095 -14.934 759 HG3 GLU 101 3HG GLU 101 -10.077 -11.754 -15.849 760 H PHE 102 H PHE 102 -6.094 -12.778 -15.119 761 HA PHE 102 HA PHE 102 -6.267 -9.917 -15.676 762 HB2 PHE 102 2HB PHE 102 -6.463 -10.585 -13.343 763 HB3 PHE 102 3HB PHE 102 -4.921 -11.430 -13.429 764 HD1 PHE 102 HD1 PHE 102 -2.821 -10.145 -13.661 765 HD2 PHE 102 HD2 PHE 102 -6.572 -8.245 -12.999 766 HE1 PHE 102 HE1 PHE 102 -1.655 -8.092 -12.968 767 HE2 PHE 102 HE2 PHE 102 -5.412 -6.189 -12.306 768 HZ PHE 102 HZ PHE 102 -2.951 -6.110 -12.291 769 H GLN 103 H GLN 103 -3.645 -12.249 -15.019 770 HA GLN 103 HA GLN 103 -1.540 -10.676 -15.910 771 HB2 GLN 103 2HB GLN 103 -0.315 -12.821 -16.228 772 HB3 GLN 103 3HB GLN 103 -1.120 -12.695 -14.670 773 HG2 GLN 103 2HG GLN 103 -3.017 -13.908 -16.238 774 HG3 GLN 103 3HG GLN 103 -1.508 -14.603 -16.830 775 HE21 GLN 103 1HE2 GLN 103 -2.607 -13.586 -13.615 776 HE22 GLN 103 2HE2 GLN 103 -2.310 -15.104 -12.844 777 H GLU 104 H GLU 104 -3.710 -12.776 -17.720 778 HA GLU 104 HA GLU 104 -2.368 -12.860 -20.154 779 HB2 GLU 104 2HB GLU 104 -4.450 -13.471 -21.149 780 HB3 GLU 104 3HB GLU 104 -4.426 -14.159 -19.531 781 HG2 GLU 104 2HG GLU 104 -5.886 -12.445 -18.714 782 HG3 GLU 104 3HG GLU 104 -5.802 -11.583 -20.249 783 H MET 105 H MET 105 -4.288 -10.321 -18.715 784 HA MET 105 HA MET 105 -4.415 -8.759 -21.138 785 HB2 MET 105 2HB MET 105 -5.807 -7.334 -19.994 786 HB3 MET 105 3HB MET 105 -6.056 -8.812 -19.074 787 HG2 MET 105 2HG MET 105 -5.615 -7.568 -17.286 788 HG3 MET 105 3HG MET 105 -3.930 -7.684 -17.786 789 HE1 MET 105 3HE MET 105 -6.666 -4.815 -19.628 790 HE2 MET 105 1HE MET 105 -7.157 -6.082 -18.503 791 HE3 MET 105 2HE MET 105 -6.925 -4.432 -17.925 792 H VAL 106 H VAL 106 -2.147 -9.265 -18.672 793 HA VAL 106 HA VAL 106 -0.917 -6.649 -18.839 794 HB VAL 106 HB VAL 106 0.243 -9.119 -17.554 795 HG11 VAL 106 1HG1 VAL 106 1.116 -6.409 -17.854 796 HG12 VAL 106 2HG1 VAL 106 0.861 -6.765 -16.144 797 HG13 VAL 106 3HG1 VAL 106 1.948 -7.770 -17.103 798 HG21 VAL 106 3HG2 VAL 106 -2.179 -8.062 -16.872 799 HG22 VAL 106 1HG2 VAL 106 -1.112 -8.939 -15.775 800 HG23 VAL 106 2HG2 VAL 106 -1.085 -7.176 -15.810 801 H GLN 107 H GLN 107 0.683 -9.801 -19.127 802 HA GLN 107 HA GLN 107 2.678 -8.847 -20.867 803 HB2 GLN 107 2HB GLN 107 1.761 -11.687 -20.386 804 HB3 GLN 107 3HB GLN 107 3.260 -11.225 -21.183 805 HG2 GLN 107 2HG GLN 107 4.307 -10.923 -19.251 806 HG3 GLN 107 3HG GLN 107 2.979 -9.969 -18.590 807 HE21 GLN 107 1HE2 GLN 107 0.942 -11.520 -18.281 808 HE22 GLN 107 2HE2 GLN 107 1.288 -12.916 -17.323 809 H SER 108 H SER 108 -0.421 -10.392 -21.444 810 HA SER 108 HA SER 108 0.026 -10.099 -24.342 811 HB2 SER 108 2HB SER 108 -0.294 -12.412 -23.900 812 HB3 SER 108 3HB SER 108 -1.632 -12.092 -22.796 813 HG SER 108 HG SER 108 -1.584 -12.127 -25.582 Start of MODEL 19 1 H1 SER 1 H SER 1 1.979 0.663 -0.763 2 HA SER 1 HA SER 1 0.404 0.041 -3.161 3 HB2 SER 1 2HB SER 1 3.242 1.096 -3.146 4 HB3 SER 1 3HB SER 1 2.422 0.447 -4.566 5 HG SER 1 HG SER 1 2.208 2.901 -3.407 6 H LEU 2 H LEU 2 1.476 -1.708 -4.480 7 HA LEU 2 HA LEU 2 1.772 -4.025 -3.025 8 HB2 LEU 2 2HB LEU 2 3.146 -3.563 -5.659 9 HB3 LEU 2 3HB LEU 2 2.514 -5.077 -5.014 10 HG LEU 2 HG LEU 2 0.861 -4.644 -6.494 11 HD11 LEU 2 1HD1 LEU 2 0.048 -4.296 -4.030 12 HD12 LEU 2 2HD1 LEU 2 -1.035 -3.985 -5.386 13 HD13 LEU 2 3HD1 LEU 2 -0.229 -2.642 -4.576 14 HD21 LEU 2 3HD2 LEU 2 0.176 -2.077 -6.795 15 HD22 LEU 2 1HD2 LEU 2 1.467 -2.841 -7.723 16 HD23 LEU 2 2HD2 LEU 2 1.858 -1.866 -6.306 17 H THR 3 H THR 3 4.454 -2.321 -4.652 18 HA THR 3 HA THR 3 6.694 -2.266 -4.231 19 HB THR 3 HB THR 3 6.898 -2.589 -1.452 20 HG1 THR 3 HG1 THR 3 4.866 -2.310 -0.862 21 HG21 THR 3 3HG2 THR 3 7.336 -0.612 -3.442 22 HG22 THR 3 1HG2 THR 3 8.010 -0.694 -1.814 23 HG23 THR 3 2HG2 THR 3 6.490 0.154 -2.098 24 H ASP 4 H ASP 4 5.291 -4.918 -4.481 25 HA ASP 4 HA ASP 4 7.429 -6.555 -3.286 26 HB2 ASP 4 2HB ASP 4 4.480 -6.947 -3.269 27 HB3 ASP 4 3HB ASP 4 5.483 -8.380 -3.481 28 H ILE 5 H ILE 5 6.122 -5.414 -6.081 29 HA ILE 5 HA ILE 5 7.248 -7.653 -7.619 30 HB ILE 5 HB ILE 5 4.741 -6.151 -8.380 31 HG12 ILE 5 2HG1 ILE 5 3.937 -8.703 -8.150 32 HG13 ILE 5 3HG1 ILE 5 5.214 -8.705 -6.938 33 HG21 ILE 5 1HG2 ILE 5 6.327 -7.017 -10.194 34 HG22 ILE 5 2HG2 ILE 5 5.821 -8.626 -9.683 35 HG23 ILE 5 3HG2 ILE 5 4.629 -7.482 -10.299 36 HD11 ILE 5 3HD1 ILE 5 3.322 -8.171 -5.725 37 HD12 ILE 5 1HD1 ILE 5 4.050 -6.595 -6.035 38 HD13 ILE 5 2HD1 ILE 5 2.674 -7.137 -6.998 39 H LEU 6 H LEU 6 5.849 -4.429 -8.247 40 HA LEU 6 HA LEU 6 8.093 -3.862 -10.036 41 HB2 LEU 6 2HB LEU 6 5.413 -2.567 -9.623 42 HB3 LEU 6 3HB LEU 6 6.678 -1.827 -10.601 43 HG LEU 6 HG LEU 6 5.737 -4.600 -11.217 44 HD11 LEU 6 1HD1 LEU 6 3.680 -3.885 -11.649 45 HD12 LEU 6 2HD1 LEU 6 4.370 -2.893 -12.934 46 HD13 LEU 6 3HD1 LEU 6 4.125 -2.209 -11.327 47 HD21 LEU 6 3HD2 LEU 6 7.662 -2.916 -12.277 48 HD22 LEU 6 1HD2 LEU 6 6.304 -2.771 -13.393 49 HD23 LEU 6 2HD2 LEU 6 6.990 -4.357 -13.042 50 H SER 7 H SER 7 9.133 -1.755 -9.951 51 HA SER 7 HA SER 7 9.859 -1.065 -7.264 52 HB2 SER 7 2HB SER 7 10.973 -0.727 -9.871 53 HB3 SER 7 3HB SER 7 10.870 0.859 -9.107 54 HG SER 7 HG SER 7 12.779 0.018 -8.438 55 HA PRO 8 HA PRO 8 7.273 2.388 -6.476 56 HB2 PRO 8 2HB PRO 8 8.967 4.135 -5.271 57 HB3 PRO 8 3HB PRO 8 8.393 2.658 -4.488 58 HG2 PRO 8 2HG PRO 8 10.995 3.179 -5.874 59 HG3 PRO 8 3HG PRO 8 10.690 2.323 -4.351 60 HD2 PRO 8 2HD PRO 8 11.133 1.027 -6.687 61 HD3 PRO 8 3HD PRO 8 10.069 0.379 -5.422 62 H SER 9 H SER 9 10.441 3.482 -7.704 63 HA SER 9 HA SER 9 9.651 5.952 -8.687 64 HB2 SER 9 2HB SER 9 11.604 5.666 -10.295 65 HB3 SER 9 3HB SER 9 11.982 5.475 -8.584 66 HG SER 9 HG SER 9 12.255 3.357 -8.858 67 H ASP 10 H ASP 10 9.694 2.810 -10.340 68 HA ASP 10 HA ASP 10 8.830 3.698 -12.849 69 HB2 ASP 10 2HB ASP 10 8.519 1.039 -11.454 70 HB3 ASP 10 3HB ASP 10 8.011 1.310 -13.118 71 H ILE 11 H ILE 11 7.047 2.884 -9.938 72 HA ILE 11 HA ILE 11 4.471 2.952 -11.188 73 HB ILE 11 HB ILE 11 5.267 3.072 -8.279 74 HG12 ILE 11 2HG1 ILE 11 3.862 0.792 -9.625 75 HG13 ILE 11 3HG1 ILE 11 5.604 0.966 -9.807 76 HG21 ILE 11 1HG2 ILE 11 3.159 4.134 -8.404 77 HG22 ILE 11 2HG2 ILE 11 2.554 2.959 -9.570 78 HG23 ILE 11 3HG2 ILE 11 2.841 2.475 -7.899 79 HD11 ILE 11 3HD1 ILE 11 4.003 0.238 -7.430 80 HD12 ILE 11 1HD1 ILE 11 5.555 -0.384 -7.991 81 HD13 ILE 11 2HD1 ILE 11 5.473 1.175 -7.171 82 H ALA 12 H ALA 12 6.175 5.156 -8.965 83 HA ALA 12 HA ALA 12 4.288 7.184 -8.874 84 HB1 ALA 12 1HB ALA 12 6.837 8.408 -8.856 85 HB2 ALA 12 2HB ALA 12 5.811 7.995 -7.482 86 HB3 ALA 12 3HB ALA 12 6.998 6.834 -8.077 87 H ALA 13 H ALA 13 6.523 6.342 -11.398 88 HA ALA 13 HA ALA 13 6.304 8.834 -12.812 89 HB1 ALA 13 1HB ALA 13 7.647 6.236 -13.255 90 HB2 ALA 13 2HB ALA 13 7.265 7.194 -14.686 91 HB3 ALA 13 3HB ALA 13 8.270 7.879 -13.409 92 H ALA 14 H ALA 14 4.591 5.808 -12.759 93 HA ALA 14 HA ALA 14 3.192 6.333 -15.243 94 HB1 ALA 14 1HB ALA 14 2.606 4.170 -13.233 95 HB2 ALA 14 2HB ALA 14 2.146 4.219 -14.935 96 HB3 ALA 14 3HB ALA 14 3.841 4.031 -14.484 97 H LEU 15 H LEU 15 2.424 6.209 -11.779 98 HA LEU 15 HA LEU 15 -0.294 6.699 -11.887 99 HB2 LEU 15 2HB LEU 15 1.845 7.264 -9.903 100 HB3 LEU 15 3HB LEU 15 0.272 8.021 -9.662 101 HG LEU 15 HG LEU 15 0.696 5.047 -9.932 102 HD11 LEU 15 1HD1 LEU 15 1.520 5.124 -7.867 103 HD12 LEU 15 2HD1 LEU 15 -0.097 5.592 -7.343 104 HD13 LEU 15 3HD1 LEU 15 1.113 6.830 -7.682 105 HD21 LEU 15 3HD2 LEU 15 -1.560 4.846 -9.189 106 HD22 LEU 15 1HD2 LEU 15 -1.546 5.989 -10.532 107 HD23 LEU 15 2HD2 LEU 15 -1.674 6.578 -8.875 108 H ARG 16 H ARG 16 2.314 9.113 -11.601 109 HA ARG 16 HA ARG 16 0.564 11.340 -11.855 110 HB2 ARG 16 2HB ARG 16 3.526 11.323 -12.428 111 HB3 ARG 16 3HB ARG 16 2.536 12.686 -11.922 112 HG2 ARG 16 2HG ARG 16 2.282 11.795 -9.734 113 HG3 ARG 16 3HG ARG 16 3.001 10.257 -10.213 114 HD2 ARG 16 2HD ARG 16 4.495 11.834 -8.918 115 HD3 ARG 16 3HD ARG 16 5.145 11.215 -10.436 116 HE ARG 16 HE ARG 16 3.806 13.770 -10.627 117 HH11 ARG 16 1HH1 ARG 16 6.818 12.093 -10.137 118 HH12 ARG 16 2HH1 ARG 16 7.796 13.440 -10.618 119 HH21 ARG 16 1HH2 ARG 16 5.084 15.550 -11.262 120 HH22 ARG 16 2HH2 ARG 16 6.809 15.406 -11.257 121 H ASP 17 H ASP 17 2.358 9.370 -14.115 122 HA ASP 17 HA ASP 17 2.369 11.024 -16.351 123 HB2 ASP 17 2HB ASP 17 3.625 9.077 -16.591 124 HB3 ASP 17 3HB ASP 17 2.329 8.049 -15.986 125 H CYS 18 H CYS 18 -0.164 8.902 -15.110 126 HA CYS 18 HA CYS 18 -2.073 10.269 -16.868 127 HB2 CYS 18 2HB CYS 18 -3.245 8.005 -17.111 128 HB3 CYS 18 3HB CYS 18 -1.777 8.251 -18.049 129 HG CYS 18 HG CYS 18 -1.493 5.693 -17.273 130 H GLN 19 H GLN 19 -1.688 10.969 -14.265 131 HA GLN 19 HA GLN 19 -3.348 9.573 -12.434 132 HB2 GLN 19 2HB GLN 19 -3.171 11.708 -11.092 133 HB3 GLN 19 3HB GLN 19 -1.643 10.949 -11.520 134 HG2 GLN 19 2HG GLN 19 -1.225 12.555 -13.217 135 HG3 GLN 19 3HG GLN 19 -2.857 13.208 -13.085 136 HE21 GLN 19 1HE2 GLN 19 -0.520 12.352 -10.574 137 HE22 GLN 19 2HE2 GLN 19 -0.421 13.931 -9.880 138 H ALA 20 H ALA 20 -3.870 12.263 -14.639 139 HA ALA 20 HA ALA 20 -6.316 13.201 -13.726 140 HB1 ALA 20 1HB ALA 20 -6.541 14.285 -15.761 141 HB2 ALA 20 2HB ALA 20 -4.797 14.054 -15.637 142 HB3 ALA 20 3HB ALA 20 -5.758 12.983 -16.657 143 HA PRO 21 HA PRO 21 -9.231 9.994 -14.461 144 HB2 PRO 21 2HB PRO 21 -11.472 11.472 -14.867 145 HB3 PRO 21 3HB PRO 21 -10.728 11.272 -13.276 146 HG2 PRO 21 2HG PRO 21 -10.502 13.555 -15.199 147 HG3 PRO 21 3HG PRO 21 -10.718 13.591 -13.439 148 HD2 PRO 21 2HD PRO 21 -8.313 13.985 -14.620 149 HD3 PRO 21 3HD PRO 21 -8.481 13.213 -13.030 150 H ASP 22 H ASP 22 -10.230 8.886 -16.113 151 HA ASP 22 HA ASP 22 -10.532 8.205 -18.268 152 HB2 ASP 22 2HB ASP 22 -12.363 9.937 -17.932 153 HB3 ASP 22 3HB ASP 22 -11.331 11.065 -18.807 154 H SER 23 H SER 23 -7.897 9.271 -17.547 155 HA SER 23 HA SER 23 -6.988 10.012 -20.249 156 HB2 SER 23 2HB SER 23 -6.444 11.295 -17.650 157 HB3 SER 23 3HB SER 23 -5.020 11.025 -18.655 158 HG SER 23 HG SER 23 -5.744 12.424 -20.088 159 H PHE 24 H PHE 24 -7.172 7.475 -18.471 160 HA PHE 24 HA PHE 24 -4.441 6.564 -19.068 161 HB2 PHE 24 2HB PHE 24 -4.064 5.791 -16.977 162 HB3 PHE 24 3HB PHE 24 -5.308 6.947 -16.514 163 HD1 PHE 24 HD2 PHE 24 -7.669 6.151 -16.251 164 HD2 PHE 24 HD1 PHE 24 -4.387 3.481 -16.716 165 HE1 PHE 24 HE2 PHE 24 -9.038 4.318 -15.347 166 HE2 PHE 24 HE1 PHE 24 -5.751 1.643 -15.814 167 HZ PHE 24 HZ PHE 24 -8.079 2.060 -15.127 168 H SER 25 H SER 25 -4.293 4.157 -19.197 169 HA SER 25 HA SER 25 -6.806 2.862 -19.959 170 HB2 SER 25 2HB SER 25 -4.768 3.729 -21.807 171 HB3 SER 25 3HB SER 25 -4.909 1.972 -21.843 172 HG SER 25 HG SER 25 -7.165 3.672 -21.977 173 HA PRO 26 HA PRO 26 -5.188 -0.710 -17.995 174 HB2 PRO 26 2HB PRO 26 -6.110 -2.718 -19.573 175 HB3 PRO 26 3HB PRO 26 -7.159 -1.772 -18.510 176 HG2 PRO 26 2HG PRO 26 -6.694 -1.490 -21.454 177 HG3 PRO 26 3HG PRO 26 -8.218 -1.413 -20.550 178 HD2 PRO 26 2HD PRO 26 -6.911 0.804 -21.392 179 HD3 PRO 26 3HD PRO 26 -7.866 0.769 -19.896 180 H LYS 27 H LYS 27 -4.392 -0.139 -21.325 181 HA LYS 27 HA LYS 27 -2.099 -1.976 -21.103 182 HB2 LYS 27 2HB LYS 27 -2.114 -2.235 -23.459 183 HB3 LYS 27 3HB LYS 27 -3.789 -2.388 -22.945 184 HG2 LYS 27 2HG LYS 27 -3.666 0.263 -23.457 185 HG3 LYS 27 3HG LYS 27 -2.506 -0.359 -24.633 186 HD2 LYS 27 2HD LYS 27 -4.666 -0.295 -25.671 187 HD3 LYS 27 3HD LYS 27 -4.243 -1.985 -25.382 188 HE2 LYS 27 2HE LYS 27 -6.310 -2.098 -24.502 189 HE3 LYS 27 3HE LYS 27 -5.539 -1.389 -23.083 190 HZ1 LYS 27 3HZ LYS 27 -7.646 -0.292 -23.926 191 HZ2 LYS 27 1HZ LYS 27 -6.717 0.287 -25.216 192 HZ3 LYS 27 2HZ LYS 27 -6.328 0.726 -23.630 193 H LYS 28 H LYS 28 -2.256 0.754 -20.058 194 HA LYS 28 HA LYS 28 0.032 1.863 -21.528 195 HB2 LYS 28 2HB LYS 28 -2.429 3.356 -20.621 196 HB3 LYS 28 3HB LYS 28 -0.918 4.164 -21.018 197 HG2 LYS 28 2HG LYS 28 -2.272 2.331 -22.965 198 HG3 LYS 28 3HG LYS 28 -2.720 4.032 -22.822 199 HD2 LYS 28 2HD LYS 28 -0.482 4.722 -23.374 200 HD3 LYS 28 3HD LYS 28 0.085 3.050 -23.344 201 HE2 LYS 28 2HE LYS 28 -0.193 3.379 -25.601 202 HE3 LYS 28 3HE LYS 28 -1.765 2.711 -25.164 203 HZ1 LYS 28 3HZ LYS 28 -1.393 5.622 -25.104 204 HZ2 LYS 28 1HZ LYS 28 -2.793 4.723 -25.410 205 HZ3 LYS 28 2HZ LYS 28 -1.598 4.858 -26.599 206 H PHE 29 H PHE 29 -0.570 0.373 -18.910 207 HA PHE 29 HA PHE 29 0.827 2.264 -17.134 208 HB2 PHE 29 2HB PHE 29 -1.629 1.005 -16.704 209 HB3 PHE 29 3HB PHE 29 -0.482 0.088 -15.732 210 HD1 PHE 29 HD1 PHE 29 1.049 1.428 -14.164 211 HD2 PHE 29 HD2 PHE 29 -2.497 3.001 -15.915 212 HE1 PHE 29 HE1 PHE 29 0.966 3.166 -12.425 213 HE2 PHE 29 HE2 PHE 29 -2.585 4.743 -14.180 214 HZ PHE 29 HZ PHE 29 -0.852 4.828 -12.432 215 H PHE 30 H PHE 30 1.065 -0.593 -18.852 216 HA PHE 30 HA PHE 30 2.912 -1.888 -17.012 217 HB2 PHE 30 2HB PHE 30 2.879 -3.749 -18.506 218 HB3 PHE 30 3HB PHE 30 1.221 -3.170 -18.384 219 HD1 PHE 30 HD1 PHE 30 4.191 -3.345 -20.538 220 HD2 PHE 30 HD2 PHE 30 0.087 -2.251 -20.270 221 HE1 PHE 30 HE1 PHE 30 4.088 -3.145 -22.988 222 HE2 PHE 30 HE2 PHE 30 -0.023 -2.050 -22.719 223 HZ PHE 30 HZ PHE 30 1.979 -2.498 -24.082 224 H GLN 31 H GLN 31 3.006 0.348 -19.556 225 HA GLN 31 HA GLN 31 5.663 -0.329 -20.472 226 HB2 GLN 31 2HB GLN 31 4.366 2.292 -21.085 227 HB3 GLN 31 3HB GLN 31 5.378 1.280 -22.107 228 HG2 GLN 31 2HG GLN 31 3.501 -0.344 -22.249 229 HG3 GLN 31 3HG GLN 31 2.500 0.812 -21.371 230 HE21 GLN 31 1HE2 GLN 31 3.308 3.176 -22.510 231 HE22 GLN 31 2HE2 GLN 31 2.842 3.203 -24.174 232 H ILE 32 H ILE 32 4.158 1.964 -18.290 233 HA ILE 32 HA ILE 32 6.671 3.358 -17.834 234 HB ILE 32 HB ILE 32 3.998 3.766 -16.487 235 HG12 ILE 32 2HG1 ILE 32 4.503 5.945 -18.119 236 HG13 ILE 32 3HG1 ILE 32 5.034 4.580 -19.095 237 HG21 ILE 32 1HG2 ILE 32 5.659 4.665 -15.085 238 HG22 ILE 32 2HG2 ILE 32 6.577 5.305 -16.447 239 HG23 ILE 32 3HG2 ILE 32 5.034 6.035 -16.002 240 HD11 ILE 32 3HD1 ILE 32 2.499 4.023 -17.859 241 HD12 ILE 32 1HD1 ILE 32 2.440 5.526 -18.781 242 HD13 ILE 32 2HD1 ILE 32 2.945 4.028 -19.565 243 H SER 33 H SER 33 4.610 0.994 -16.296 244 HA SER 33 HA SER 33 6.174 1.061 -13.838 245 HB2 SER 33 2HB SER 33 3.586 0.742 -14.033 246 HB3 SER 33 3HB SER 33 4.000 -0.935 -14.389 247 HG SER 33 HG SER 33 3.691 -0.037 -12.054 248 H GLY 34 H GLY 34 5.014 -1.631 -15.872 249 HA2 GLY 34 2HA GLY 34 6.808 -2.952 -17.021 250 HA3 GLY 34 3HA GLY 34 7.655 -2.899 -15.482 251 H MET 35 H MET 35 4.192 -3.317 -15.690 252 HA MET 35 HA MET 35 4.207 -5.626 -14.083 253 HB2 MET 35 2HB MET 35 2.002 -4.721 -15.939 254 HB3 MET 35 3HB MET 35 1.834 -5.760 -14.531 255 HG2 MET 35 2HG MET 35 2.247 -3.989 -13.043 256 HG3 MET 35 3HG MET 35 2.848 -2.946 -14.330 257 HE1 MET 35 3HE MET 35 -1.578 -4.108 -13.744 258 HE2 MET 35 1HE MET 35 -0.392 -5.246 -14.386 259 HE3 MET 35 2HE MET 35 -0.248 -4.664 -12.727 260 H SER 36 H SER 36 3.687 -5.227 -17.580 261 HA SER 36 HA SER 36 3.225 -7.874 -18.250 262 HB2 SER 36 2HB SER 36 4.810 -5.946 -19.955 263 HB3 SER 36 3HB SER 36 3.802 -7.286 -20.501 264 HG SER 36 HG SER 36 2.227 -5.913 -20.545 265 H LYS 37 H LYS 37 6.255 -6.216 -17.630 266 HA LYS 37 HA LYS 37 7.984 -8.233 -18.595 267 HB2 LYS 37 2HB LYS 37 8.622 -6.323 -16.351 268 HB3 LYS 37 3HB LYS 37 9.737 -7.054 -17.499 269 HG2 LYS 37 2HG LYS 37 7.665 -4.950 -18.080 270 HG3 LYS 37 3HG LYS 37 9.418 -4.746 -18.063 271 HD2 LYS 37 2HD LYS 37 9.246 -6.726 -19.847 272 HD3 LYS 37 3HD LYS 37 7.662 -5.989 -20.103 273 HE2 LYS 37 2HE LYS 37 8.727 -3.828 -20.495 274 HE3 LYS 37 3HE LYS 37 10.311 -4.547 -20.209 275 HZ1 LYS 37 3HZ LYS 37 10.115 -5.855 -22.151 276 HZ2 LYS 37 1HZ LYS 37 9.665 -4.285 -22.595 277 HZ3 LYS 37 2HZ LYS 37 8.480 -5.467 -22.351 278 H LYS 38 H LYS 38 5.956 -8.128 -15.893 279 HA LYS 38 HA LYS 38 7.557 -9.946 -14.285 280 HB2 LYS 38 2HB LYS 38 4.737 -8.987 -13.783 281 HB3 LYS 38 3HB LYS 38 5.822 -9.740 -12.622 282 HG2 LYS 38 2HG LYS 38 6.264 -7.063 -13.930 283 HG3 LYS 38 3HG LYS 38 5.633 -7.317 -12.301 284 HD2 LYS 38 2HD LYS 38 7.756 -7.225 -11.613 285 HD3 LYS 38 3HD LYS 38 7.949 -8.822 -12.339 286 HE2 LYS 38 2HE LYS 38 8.290 -7.296 -14.518 287 HE3 LYS 38 3HE LYS 38 8.863 -6.173 -13.286 288 HZ1 LYS 38 3HZ LYS 38 10.218 -8.218 -12.498 289 HZ2 LYS 38 1HZ LYS 38 10.765 -7.314 -13.819 290 HZ3 LYS 38 2HZ LYS 38 9.965 -8.782 -14.073 291 H SER 39 H SER 39 6.743 -12.013 -13.578 292 HA SER 39 HA SER 39 5.654 -13.533 -15.741 293 HB2 SER 39 2HB SER 39 6.472 -14.223 -12.922 294 HB3 SER 39 3HB SER 39 5.740 -15.414 -13.997 295 HG SER 39 HG SER 39 7.455 -15.082 -15.441 296 H SER 40 H SER 40 3.815 -15.055 -15.431 297 HA SER 40 HA SER 40 1.457 -13.649 -14.833 298 HB2 SER 40 2HB SER 40 0.436 -15.399 -15.827 299 HB3 SER 40 3HB SER 40 2.065 -15.984 -16.161 300 HG SER 40 HG SER 40 0.693 -17.533 -15.100 301 H SER 41 H SER 41 3.632 -15.315 -12.816 302 HA SER 41 HA SER 41 1.680 -15.867 -10.738 303 HB2 SER 41 2HB SER 41 3.473 -16.913 -9.541 304 HB3 SER 41 3HB SER 41 3.641 -17.386 -11.232 305 HG SER 41 HG SER 41 5.230 -15.743 -11.440 306 H GLN 42 H GLN 42 4.168 -13.527 -11.492 307 HA GLN 42 HA GLN 42 4.218 -12.310 -8.909 308 HB2 GLN 42 2HB GLN 42 5.335 -11.665 -11.598 309 HB3 GLN 42 3HB GLN 42 5.239 -10.375 -10.407 310 HG2 GLN 42 2HG GLN 42 6.455 -11.967 -8.833 311 HG3 GLN 42 3HG GLN 42 6.798 -12.930 -10.270 312 HE21 GLN 42 1HE2 GLN 42 7.184 -9.737 -8.839 313 HE22 GLN 42 2HE2 GLN 42 8.625 -9.325 -9.698 314 H LEU 43 H LEU 43 2.370 -11.850 -11.839 315 HA LEU 43 HA LEU 43 1.267 -9.320 -11.080 316 HB2 LEU 43 2HB LEU 43 0.230 -11.306 -13.096 317 HB3 LEU 43 3HB LEU 43 -0.205 -9.601 -12.979 318 HG LEU 43 HG LEU 43 2.652 -10.312 -13.441 319 HD11 LEU 43 1HD1 LEU 43 0.432 -10.602 -15.434 320 HD12 LEU 43 2HD1 LEU 43 1.763 -11.705 -15.086 321 HD13 LEU 43 3HD1 LEU 43 2.072 -10.190 -15.933 322 HD21 LEU 43 3HD2 LEU 43 0.801 -8.037 -13.994 323 HD22 LEU 43 1HD2 LEU 43 2.242 -8.249 -14.989 324 HD23 LEU 43 2HD2 LEU 43 2.399 -8.034 -13.245 325 H LYS 44 H LYS 44 0.619 -12.566 -10.256 326 HA LYS 44 HA LYS 44 -2.162 -12.341 -9.706 327 HB2 LYS 44 2HB LYS 44 -0.010 -14.306 -9.140 328 HB3 LYS 44 3HB LYS 44 -1.419 -14.354 -8.088 329 HG2 LYS 44 2HG LYS 44 -2.707 -14.321 -10.389 330 HG3 LYS 44 3HG LYS 44 -1.183 -14.988 -10.978 331 HD2 LYS 44 2HD LYS 44 -2.380 -16.163 -8.520 332 HD3 LYS 44 3HD LYS 44 -3.125 -16.542 -10.074 333 HE2 LYS 44 2HE LYS 44 -1.587 -18.242 -9.888 334 HE3 LYS 44 3HE LYS 44 -0.665 -17.046 -10.797 335 HZ1 LYS 44 3HZ LYS 44 0.097 -18.231 -8.461 336 HZ2 LYS 44 1HZ LYS 44 -0.407 -16.691 -7.974 337 HZ3 LYS 44 2HZ LYS 44 0.796 -16.854 -9.152 338 H GLU 45 H GLU 45 0.727 -11.514 -7.968 339 HA GLU 45 HA GLU 45 -0.299 -11.452 -5.353 340 HB2 GLU 45 2HB GLU 45 1.930 -9.907 -6.673 341 HB3 GLU 45 3HB GLU 45 1.561 -9.770 -4.960 342 HG2 GLU 45 2HG GLU 45 2.505 -12.200 -6.449 343 HG3 GLU 45 3HG GLU 45 3.349 -11.307 -5.185 344 H ILE 46 H ILE 46 -0.098 -8.920 -7.835 345 HA ILE 46 HA ILE 46 -1.157 -6.819 -6.333 346 HB ILE 46 HB ILE 46 -1.484 -7.277 -9.301 347 HG12 ILE 46 2HG1 ILE 46 0.534 -5.355 -8.508 348 HG13 ILE 46 3HG1 ILE 46 0.866 -6.939 -7.815 349 HG21 ILE 46 1HG2 ILE 46 -2.972 -5.565 -8.695 350 HG22 ILE 46 2HG2 ILE 46 -1.830 -4.862 -7.550 351 HG23 ILE 46 3HG2 ILE 46 -1.534 -4.730 -9.284 352 HD11 ILE 46 3HD1 ILE 46 0.172 -7.416 -10.477 353 HD12 ILE 46 1HD1 ILE 46 1.233 -6.008 -10.500 354 HD13 ILE 46 2HD1 ILE 46 1.775 -7.508 -9.747 355 H PHE 47 H PHE 47 -2.717 -9.492 -7.940 356 HA PHE 47 HA PHE 47 -5.342 -8.450 -7.997 357 HB2 PHE 47 2HB PHE 47 -5.244 -10.292 -9.341 358 HB3 PHE 47 3HB PHE 47 -4.090 -11.120 -8.302 359 HD1 PHE 47 HD1 PHE 47 -4.863 -12.387 -6.351 360 HD2 PHE 47 HD2 PHE 47 -7.595 -10.588 -9.074 361 HE1 PHE 47 HE1 PHE 47 -6.675 -13.788 -5.453 362 HE2 PHE 47 HE2 PHE 47 -9.412 -11.985 -8.179 363 HZ PHE 47 HZ PHE 47 -8.953 -13.588 -6.366 364 H ARG 48 H ARG 48 -3.404 -9.791 -5.476 365 HA ARG 48 HA ARG 48 -5.581 -10.487 -3.740 366 HB2 ARG 48 2HB ARG 48 -2.788 -10.908 -3.792 367 HB3 ARG 48 3HB ARG 48 -3.130 -10.021 -2.313 368 HG2 ARG 48 2HG ARG 48 -4.539 -12.550 -3.138 369 HG3 ARG 48 3HG ARG 48 -3.154 -12.484 -2.045 370 HD2 ARG 48 2HD ARG 48 -5.451 -10.725 -1.418 371 HD3 ARG 48 3HD ARG 48 -5.687 -12.457 -1.190 372 HE ARG 48 HE ARG 48 -3.363 -12.032 0.081 373 HH11 ARG 48 1HH1 ARG 48 -6.431 -10.393 0.219 374 HH12 ARG 48 2HH1 ARG 48 -6.247 -9.914 1.874 375 HH21 ARG 48 1HH2 ARG 48 -3.110 -11.407 2.260 376 HH22 ARG 48 2HH2 ARG 48 -4.358 -10.490 3.034 377 H ILE 49 H ILE 49 -4.437 -7.578 -4.768 378 HA ILE 49 HA ILE 49 -5.054 -6.227 -2.226 379 HB ILE 49 HB ILE 49 -3.656 -5.021 -4.611 380 HG12 ILE 49 2HG1 ILE 49 -2.343 -6.894 -3.671 381 HG13 ILE 49 3HG1 ILE 49 -1.562 -5.340 -3.402 382 HG21 ILE 49 1HG2 ILE 49 -2.858 -3.550 -2.544 383 HG22 ILE 49 2HG2 ILE 49 -4.339 -3.202 -3.435 384 HG23 ILE 49 3HG2 ILE 49 -4.415 -4.079 -1.907 385 HD11 ILE 49 3HD1 ILE 49 -3.294 -6.606 -1.314 386 HD12 ILE 49 1HD1 ILE 49 -1.588 -7.017 -1.484 387 HD13 ILE 49 2HD1 ILE 49 -2.064 -5.356 -1.126 388 H LEU 50 H LEU 50 -6.219 -6.851 -5.347 389 HA LEU 50 HA LEU 50 -7.880 -4.462 -5.462 390 HB2 LEU 50 2HB LEU 50 -7.263 -6.710 -7.321 391 HB3 LEU 50 3HB LEU 50 -8.745 -5.787 -7.558 392 HG LEU 50 HG LEU 50 -7.107 -3.736 -7.498 393 HD11 LEU 50 1HD1 LEU 50 -5.281 -5.937 -8.446 394 HD12 LEU 50 2HD1 LEU 50 -5.143 -5.108 -6.896 395 HD13 LEU 50 3HD1 LEU 50 -4.925 -4.210 -8.398 396 HD21 LEU 50 3HD2 LEU 50 -6.937 -3.849 -9.914 397 HD22 LEU 50 1HD2 LEU 50 -8.519 -4.426 -9.389 398 HD23 LEU 50 2HD2 LEU 50 -7.278 -5.580 -9.879 399 H ASP 51 H ASP 51 -8.081 -7.799 -4.567 400 HA ASP 51 HA ASP 51 -10.908 -8.069 -4.747 401 HB2 ASP 51 2HB ASP 51 -9.038 -9.894 -4.549 402 HB3 ASP 51 3HB ASP 51 -9.257 -9.663 -2.817 403 H ASN 52 H ASN 52 -12.362 -7.075 -3.530 404 HA ASN 52 HA ASN 52 -11.575 -6.113 -0.870 405 HB2 ASN 52 2HB ASN 52 -13.266 -5.063 -2.997 406 HB3 ASN 52 3HB ASN 52 -14.084 -5.057 -1.437 407 HD21 ASN 52 1HD2 ASN 52 -10.826 -4.375 -2.681 408 HD22 ASN 52 2HD2 ASN 52 -10.632 -2.884 -1.830 409 H ASP 53 H ASP 53 -12.946 -8.756 -2.139 410 HA ASP 53 HA ASP 53 -14.576 -9.209 0.259 411 HB2 ASP 53 2HB ASP 53 -15.720 -10.635 -1.953 412 HB3 ASP 53 3HB ASP 53 -16.476 -9.449 -0.893 413 H GLN 54 H GLN 54 -11.988 -10.114 -1.477 414 HA GLN 54 HA GLN 54 -10.727 -12.001 -1.688 415 HB2 GLN 54 2HB GLN 54 -12.113 -13.053 0.760 416 HB3 GLN 54 3HB GLN 54 -10.435 -13.251 0.275 417 HG2 GLN 54 2HG GLN 54 -11.606 -10.597 1.051 418 HG3 GLN 54 3HG GLN 54 -10.864 -11.699 2.209 419 HE21 GLN 54 1HE2 GLN 54 -10.338 -9.177 0.089 420 HE22 GLN 54 2HE2 GLN 54 -8.614 -9.246 0.016 421 H SER 55 H SER 55 -13.547 -11.977 -2.775 422 HA SER 55 HA SER 55 -14.544 -14.638 -2.593 423 HB2 SER 55 2HB SER 55 -15.791 -13.838 -4.764 424 HB3 SER 55 3HB SER 55 -16.201 -13.132 -3.201 425 HG SER 55 HG SER 55 -15.117 -11.313 -3.723 426 H GLY 56 H GLY 56 -12.005 -13.201 -4.355 427 HA2 GLY 56 2HA GLY 56 -10.416 -14.711 -5.413 428 HA3 GLY 56 3HA GLY 56 -11.786 -15.643 -5.999 429 H PHE 57 H PHE 57 -13.031 -12.823 -6.497 430 HA PHE 57 HA PHE 57 -11.571 -12.238 -8.981 431 HB2 PHE 57 2HB PHE 57 -14.583 -12.231 -8.790 432 HB3 PHE 57 3HB PHE 57 -13.594 -12.095 -10.240 433 HD1 PHE 57 HD1 PHE 57 -14.762 -14.392 -7.613 434 HD2 PHE 57 HD2 PHE 57 -12.751 -14.018 -11.345 435 HE1 PHE 57 HE1 PHE 57 -14.894 -16.829 -7.924 436 HE2 PHE 57 HE2 PHE 57 -12.880 -16.454 -11.663 437 HZ PHE 57 HZ PHE 57 -13.953 -17.863 -9.951 438 H ILE 58 H ILE 58 -12.102 -10.091 -9.893 439 HA ILE 58 HA ILE 58 -12.740 -8.168 -7.750 440 HB ILE 58 HB ILE 58 -10.860 -7.772 -10.082 441 HG12 ILE 58 2HG1 ILE 58 -9.942 -7.608 -7.263 442 HG13 ILE 58 3HG1 ILE 58 -10.305 -9.216 -7.882 443 HG21 ILE 58 1HG2 ILE 58 -12.003 -5.716 -9.484 444 HG22 ILE 58 2HG2 ILE 58 -11.568 -5.944 -7.791 445 HG23 ILE 58 3HG2 ILE 58 -10.312 -5.641 -8.990 446 HD11 ILE 58 3HD1 ILE 58 -7.923 -8.517 -8.086 447 HD12 ILE 58 1HD1 ILE 58 -8.682 -8.999 -9.603 448 HD13 ILE 58 2HD1 ILE 58 -8.442 -7.289 -9.241 449 H GLU 59 H GLU 59 -14.812 -7.616 -8.133 450 HA GLU 59 HA GLU 59 -15.874 -7.327 -10.780 451 HB2 GLU 59 2HB GLU 59 -17.135 -6.333 -8.228 452 HB3 GLU 59 3HB GLU 59 -17.939 -6.777 -9.727 453 HG2 GLU 59 2HG GLU 59 -18.374 -8.656 -8.564 454 HG3 GLU 59 3HG GLU 59 -16.788 -9.113 -9.184 455 H GLU 60 H GLU 60 -16.998 -5.295 -11.457 456 HA GLU 60 HA GLU 60 -15.215 -3.203 -11.771 457 HB2 GLU 60 2HB GLU 60 -18.213 -3.329 -11.999 458 HB3 GLU 60 3HB GLU 60 -17.329 -1.846 -12.328 459 HG2 GLU 60 2HG GLU 60 -16.346 -2.686 -14.225 460 HG3 GLU 60 3HG GLU 60 -16.511 -4.360 -13.698 461 H ASP 61 H ASP 61 -17.447 -3.841 -9.181 462 HA ASP 61 HA ASP 61 -17.550 -1.262 -8.048 463 HB2 ASP 61 2HB ASP 61 -18.091 -4.030 -7.062 464 HB3 ASP 61 3HB ASP 61 -17.972 -2.725 -5.885 465 H GLU 62 H GLU 62 -15.119 -3.712 -8.034 466 HA GLU 62 HA GLU 62 -13.606 -2.219 -5.995 467 HB2 GLU 62 2HB GLU 62 -12.232 -4.514 -6.142 468 HB3 GLU 62 3HB GLU 62 -13.600 -4.290 -5.060 469 HG2 GLU 62 2HG GLU 62 -15.046 -5.244 -6.896 470 HG3 GLU 62 3HG GLU 62 -13.550 -5.695 -7.712 471 H LEU 63 H LEU 63 -13.784 -2.999 -9.280 472 HA LEU 63 HA LEU 63 -10.977 -2.889 -9.868 473 HB2 LEU 63 2HB LEU 63 -13.150 -3.811 -11.203 474 HB3 LEU 63 3HB LEU 63 -12.889 -2.270 -12.016 475 HG LEU 63 HG LEU 63 -10.913 -4.540 -11.794 476 HD11 LEU 63 1HD1 LEU 63 -12.993 -3.913 -13.674 477 HD12 LEU 63 2HD1 LEU 63 -11.922 -5.311 -13.612 478 HD13 LEU 63 3HD1 LEU 63 -11.414 -3.849 -14.456 479 HD21 LEU 63 3HD2 LEU 63 -9.797 -2.365 -11.708 480 HD22 LEU 63 1HD2 LEU 63 -10.647 -1.869 -13.171 481 HD23 LEU 63 2HD2 LEU 63 -9.482 -3.191 -13.235 482 H LYS 64 H LYS 64 -13.568 -0.601 -9.567 483 HA LYS 64 HA LYS 64 -12.461 1.529 -11.046 484 HB2 LYS 64 2HB LYS 64 -13.942 2.947 -9.522 485 HB3 LYS 64 3HB LYS 64 -14.742 1.722 -10.498 486 HG2 LYS 64 2HG LYS 64 -15.419 0.554 -8.707 487 HG3 LYS 64 3HG LYS 64 -13.913 0.828 -7.828 488 HD2 LYS 64 2HD LYS 64 -15.608 1.949 -6.612 489 HD3 LYS 64 3HD LYS 64 -14.701 3.201 -7.465 490 HE2 LYS 64 2HE LYS 64 -16.422 3.654 -8.909 491 HE3 LYS 64 3HE LYS 64 -17.091 2.027 -8.794 492 HZ1 LYS 64 3HZ LYS 64 -18.339 2.573 -7.025 493 HZ2 LYS 64 1HZ LYS 64 -18.151 4.155 -7.593 494 HZ3 LYS 64 2HZ LYS 64 -17.162 3.581 -6.348 495 H TYR 65 H TYR 65 -11.433 0.085 -8.186 496 HA TYR 65 HA TYR 65 -10.127 2.506 -7.191 497 HB2 TYR 65 2HB TYR 65 -10.548 -0.241 -6.030 498 HB3 TYR 65 3HB TYR 65 -9.416 0.901 -5.313 499 HD1 TYR 65 HD1 TYR 65 -10.857 3.446 -5.594 500 HD2 TYR 65 HD2 TYR 65 -12.298 -0.406 -4.505 501 HE1 TYR 65 HE1 TYR 65 -12.700 4.495 -4.347 502 HE2 TYR 65 HE2 TYR 65 -14.146 0.632 -3.256 503 HH TYR 65 HH TYR 65 -15.226 3.535 -3.644 504 H PHE 66 H PHE 66 -9.378 0.952 -9.667 505 HA PHE 66 HA PHE 66 -7.021 -0.481 -9.318 506 HB2 PHE 66 2HB PHE 66 -8.043 -0.542 -11.457 507 HB3 PHE 66 3HB PHE 66 -8.015 1.212 -11.604 508 HD1 PHE 66 HD1 PHE 66 -5.700 -1.685 -11.250 509 HD2 PHE 66 HD2 PHE 66 -6.359 2.200 -12.860 510 HE1 PHE 66 HE1 PHE 66 -3.561 -1.826 -12.458 511 HE2 PHE 66 HE2 PHE 66 -4.222 2.064 -14.071 512 HZ PHE 66 HZ PHE 66 -2.820 0.049 -13.872 513 H LEU 67 H LEU 67 -7.612 2.927 -9.155 514 HA LEU 67 HA LEU 67 -4.803 3.624 -9.351 515 HB2 LEU 67 2HB LEU 67 -6.896 5.533 -8.425 516 HB3 LEU 67 3HB LEU 67 -5.465 5.828 -9.412 517 HG LEU 67 HG LEU 67 -8.137 4.748 -10.251 518 HD11 LEU 67 1HD1 LEU 67 -6.783 6.682 -11.934 519 HD12 LEU 67 2HD1 LEU 67 -7.011 7.269 -10.287 520 HD13 LEU 67 3HD1 LEU 67 -8.399 6.728 -11.230 521 HD21 LEU 67 3HD2 LEU 67 -6.735 3.219 -11.322 522 HD22 LEU 67 1HD2 LEU 67 -5.478 4.423 -11.600 523 HD23 LEU 67 2HD2 LEU 67 -6.979 4.487 -12.524 524 H GLN 68 H GLN 68 -6.939 2.593 -6.949 525 HA GLN 68 HA GLN 68 -5.567 3.959 -4.777 526 HB2 GLN 68 2HB GLN 68 -8.093 2.536 -5.113 527 HB3 GLN 68 3HB GLN 68 -7.257 2.093 -3.631 528 HG2 GLN 68 2HG GLN 68 -8.154 3.893 -2.709 529 HG3 GLN 68 3HG GLN 68 -7.066 4.852 -3.712 530 HE21 GLN 68 1HE2 GLN 68 -8.053 4.731 -6.157 531 HE22 GLN 68 2HE2 GLN 68 -9.666 5.344 -6.229 532 H ARG 69 H ARG 69 -4.488 1.706 -6.626 533 HA ARG 69 HA ARG 69 -3.587 -0.101 -4.484 534 HB2 ARG 69 2HB ARG 69 -2.945 -0.962 -7.186 535 HB3 ARG 69 3HB ARG 69 -3.789 -1.822 -5.906 536 HG2 ARG 69 2HG ARG 69 -5.285 0.315 -7.301 537 HG3 ARG 69 3HG ARG 69 -4.946 -1.162 -8.205 538 HD2 ARG 69 2HD ARG 69 -7.105 -1.297 -7.077 539 HD3 ARG 69 3HD ARG 69 -5.976 -2.489 -6.435 540 HE ARG 69 HE ARG 69 -5.655 -0.452 -4.727 541 HH11 ARG 69 1HH1 ARG 69 -8.511 -2.006 -5.972 542 HH12 ARG 69 2HH1 ARG 69 -9.455 -1.701 -4.551 543 HH21 ARG 69 1HH2 ARG 69 -6.888 -0.044 -2.851 544 HH22 ARG 69 2HH2 ARG 69 -8.531 -0.584 -2.777 545 H PHE 70 H PHE 70 -2.550 1.977 -7.115 546 HA PHE 70 HA PHE 70 0.259 1.425 -6.531 547 HB2 PHE 70 2HB PHE 70 -1.132 2.944 -8.733 548 HB3 PHE 70 3HB PHE 70 0.612 3.020 -8.502 549 HD1 PHE 70 HD2 PHE 70 1.914 0.835 -8.562 550 HD2 PHE 70 HD1 PHE 70 -2.100 1.200 -9.929 551 HE1 PHE 70 HE2 PHE 70 2.179 -1.227 -9.878 552 HE2 PHE 70 HE1 PHE 70 -1.842 -0.862 -11.247 553 HZ PHE 70 HZ PHE 70 0.300 -2.077 -11.224 554 H GLU 71 H GLU 71 -2.184 3.817 -6.020 555 HA GLU 71 HA GLU 71 -0.167 5.662 -4.924 556 HB2 GLU 71 2HB GLU 71 -1.946 6.285 -6.817 557 HB3 GLU 71 3HB GLU 71 -2.955 6.577 -5.408 558 HG2 GLU 71 2HG GLU 71 -0.337 7.890 -6.083 559 HG3 GLU 71 3HG GLU 71 -1.935 8.633 -6.043 560 H SER 72 H SER 72 -3.148 3.941 -4.292 561 HA SER 72 HA SER 72 -4.255 3.445 -2.367 562 HB2 SER 72 2HB SER 72 -1.833 4.446 -0.867 563 HB3 SER 72 3HB SER 72 -3.010 3.242 -0.345 564 HG SER 72 HG SER 72 -1.393 2.016 -1.065 565 H GLY 73 H GLY 73 -5.277 5.591 -3.318 566 HA2 GLY 73 2HA GLY 73 -6.543 6.987 -1.417 567 HA3 GLY 73 3HA GLY 73 -5.019 7.856 -1.516 568 H ALA 74 H ALA 74 -5.008 7.060 -4.487 569 HA ALA 74 HA ALA 74 -5.932 9.492 -5.511 570 HB1 ALA 74 1HB ALA 74 -5.914 8.005 -7.727 571 HB2 ALA 74 2HB ALA 74 -4.438 8.580 -6.951 572 HB3 ALA 74 3HB ALA 74 -4.999 6.933 -6.666 573 H ARG 75 H ARG 75 -7.508 9.348 -7.559 574 HA ARG 75 HA ARG 75 -10.098 8.856 -6.448 575 HB2 ARG 75 2HB ARG 75 -10.967 9.814 -8.459 576 HB3 ARG 75 3HB ARG 75 -9.543 10.741 -8.009 577 HG2 ARG 75 2HG ARG 75 -8.253 9.309 -9.643 578 HG3 ARG 75 3HG ARG 75 -9.816 8.718 -10.210 579 HD2 ARG 75 2HD ARG 75 -8.687 11.494 -10.348 580 HD3 ARG 75 3HD ARG 75 -9.291 10.481 -11.659 581 HE ARG 75 HE ARG 75 -11.507 10.819 -10.242 582 HH11 ARG 75 1HH1 ARG 75 -9.068 13.122 -11.177 583 HH12 ARG 75 2HH1 ARG 75 -10.168 14.459 -11.235 584 HH21 ARG 75 1HH2 ARG 75 -12.964 12.572 -10.315 585 HH22 ARG 75 2HH2 ARG 75 -12.384 14.146 -10.744 586 H VAL 76 H VAL 76 -11.743 7.818 -8.154 587 HA VAL 76 HA VAL 76 -10.768 5.082 -8.550 588 HB VAL 76 HB VAL 76 -13.012 4.340 -8.476 589 HG11 VAL 76 1HG1 VAL 76 -13.747 5.042 -6.324 590 HG12 VAL 76 2HG1 VAL 76 -11.983 5.099 -6.314 591 HG13 VAL 76 3HG1 VAL 76 -12.914 6.589 -6.476 592 HG21 VAL 76 3HG2 VAL 76 -13.591 7.052 -9.369 593 HG22 VAL 76 1HG2 VAL 76 -14.506 5.562 -9.602 594 HG23 VAL 76 2HG2 VAL 76 -14.693 6.488 -8.113 595 H LEU 77 H LEU 77 -12.548 4.124 -10.382 596 HA LEU 77 HA LEU 77 -11.713 5.537 -12.818 597 HB2 LEU 77 2HB LEU 77 -12.745 2.719 -12.574 598 HB3 LEU 77 3HB LEU 77 -11.980 3.458 -13.979 599 HG LEU 77 HG LEU 77 -10.671 2.673 -11.380 600 HD11 LEU 77 1HD1 LEU 77 -10.597 1.653 -14.194 601 HD12 LEU 77 2HD1 LEU 77 -10.835 0.764 -12.690 602 HD13 LEU 77 3HD1 LEU 77 -9.239 1.393 -13.098 603 HD21 LEU 77 3HD2 LEU 77 -9.820 4.545 -13.510 604 HD22 LEU 77 1HD2 LEU 77 -8.612 3.409 -12.908 605 HD23 LEU 77 2HD2 LEU 77 -9.415 4.515 -11.793 606 H THR 78 H THR 78 -13.160 6.223 -14.320 607 HA THR 78 HA THR 78 -15.887 6.539 -13.480 608 HB THR 78 HB THR 78 -14.729 8.327 -14.710 609 HG1 THR 78 HG1 THR 78 -16.455 8.591 -16.333 610 HG21 THR 78 3HG2 THR 78 -14.979 7.333 -17.374 611 HG22 THR 78 1HG2 THR 78 -13.993 6.208 -16.440 612 HG23 THR 78 2HG2 THR 78 -13.534 7.908 -16.542 613 H ALA 79 H ALA 79 -17.506 6.299 -15.536 614 HA ALA 79 HA ALA 79 -17.855 3.484 -15.818 615 HB1 ALA 79 1HB ALA 79 -19.811 4.816 -15.643 616 HB2 ALA 79 2HB ALA 79 -19.319 5.836 -16.995 617 HB3 ALA 79 3HB ALA 79 -19.787 4.159 -17.280 618 H SER 80 H SER 80 -15.940 5.664 -17.468 619 HA SER 80 HA SER 80 -16.047 4.113 -19.965 620 HB2 SER 80 2HB SER 80 -16.296 6.329 -20.608 621 HB3 SER 80 3HB SER 80 -15.244 6.928 -19.326 622 HG SER 80 HG SER 80 -13.774 6.961 -20.821 623 H GLU 81 H GLU 81 -14.292 4.437 -17.141 624 HA GLU 81 HA GLU 81 -11.736 3.715 -18.363 625 HB2 GLU 81 2HB GLU 81 -12.527 4.492 -15.560 626 HB3 GLU 81 3HB GLU 81 -10.934 3.854 -15.944 627 HG2 GLU 81 2HG GLU 81 -10.446 5.705 -17.357 628 HG3 GLU 81 3HG GLU 81 -12.107 6.287 -17.262 629 H THR 82 H THR 82 -13.666 2.556 -15.593 630 HA THR 82 HA THR 82 -12.437 0.121 -15.225 631 HB THR 82 HB THR 82 -15.111 -0.451 -14.732 632 HG1 THR 82 HG1 THR 82 -16.002 1.486 -14.928 633 HG21 THR 82 3HG2 THR 82 -12.786 -0.306 -13.321 634 HG22 THR 82 1HG2 THR 82 -14.366 -0.637 -12.613 635 HG23 THR 82 2HG2 THR 82 -13.717 1.003 -12.593 636 H LYS 83 H LYS 83 -15.199 0.844 -17.344 637 HA LYS 83 HA LYS 83 -15.789 -1.663 -18.286 638 HB2 LYS 83 2HB LYS 83 -15.951 1.070 -19.455 639 HB3 LYS 83 3HB LYS 83 -16.182 -0.294 -20.541 640 HG2 LYS 83 2HG LYS 83 -17.877 -1.099 -18.744 641 HG3 LYS 83 3HG LYS 83 -17.850 0.589 -18.230 642 HD2 LYS 83 2HD LYS 83 -18.413 1.255 -20.551 643 HD3 LYS 83 3HD LYS 83 -18.547 -0.453 -20.975 644 HE2 LYS 83 2HE LYS 83 -20.219 -0.538 -18.984 645 HE3 LYS 83 3HE LYS 83 -20.300 1.209 -19.210 646 HZ1 LYS 83 3HZ LYS 83 -20.546 0.036 -21.720 647 HZ2 LYS 83 1HZ LYS 83 -21.731 0.867 -20.844 648 HZ3 LYS 83 2HZ LYS 83 -21.584 -0.811 -20.687 649 H THR 84 H THR 84 -13.296 0.550 -19.509 650 HA THR 84 HA THR 84 -12.394 -1.035 -21.630 651 HB THR 84 HB THR 84 -10.702 0.836 -19.963 652 HG1 THR 84 HG1 THR 84 -12.323 1.386 -22.246 653 HG21 THR 84 3HG2 THR 84 -9.705 -0.788 -21.753 654 HG22 THR 84 1HG2 THR 84 -9.199 0.901 -21.719 655 HG23 THR 84 2HG2 THR 84 -10.393 0.362 -22.899 656 H PHE 85 H PHE 85 -10.890 -0.658 -18.413 657 HA PHE 85 HA PHE 85 -8.953 -2.606 -18.644 658 HB2 PHE 85 2HB PHE 85 -9.388 -0.933 -16.729 659 HB3 PHE 85 3HB PHE 85 -10.447 -2.174 -16.067 660 HD1 PHE 85 HD2 PHE 85 -9.427 -4.497 -15.682 661 HD2 PHE 85 HD1 PHE 85 -7.114 -0.975 -16.291 662 HE1 PHE 85 HE2 PHE 85 -7.488 -5.594 -14.638 663 HE2 PHE 85 HE1 PHE 85 -5.171 -2.067 -15.249 664 HZ PHE 85 HZ PHE 85 -5.356 -4.379 -14.420 665 H LEU 86 H LEU 86 -12.279 -2.986 -17.452 666 HA LEU 86 HA LEU 86 -12.104 -5.741 -16.901 667 HB2 LEU 86 2HB LEU 86 -13.877 -4.454 -15.957 668 HB3 LEU 86 3HB LEU 86 -14.447 -3.967 -17.552 669 HG LEU 86 HG LEU 86 -14.934 -6.463 -17.920 670 HD11 LEU 86 1HD1 LEU 86 -14.320 -6.381 -15.001 671 HD12 LEU 86 2HD1 LEU 86 -13.902 -7.599 -16.204 672 HD13 LEU 86 3HD1 LEU 86 -15.557 -7.483 -15.606 673 HD21 LEU 86 3HD2 LEU 86 -16.967 -5.584 -17.751 674 HD22 LEU 86 1HD2 LEU 86 -16.408 -4.368 -16.603 675 HD23 LEU 86 2HD2 LEU 86 -16.921 -5.954 -16.026 676 H ALA 87 H ALA 87 -12.938 -3.956 -19.817 677 HA ALA 87 HA ALA 87 -13.680 -6.328 -21.280 678 HB1 ALA 87 1HB ALA 87 -14.822 -4.360 -21.909 679 HB2 ALA 87 2HB ALA 87 -13.319 -3.451 -22.076 680 HB3 ALA 87 3HB ALA 87 -13.714 -4.721 -23.233 681 H ALA 88 H ALA 88 -10.799 -5.328 -20.207 682 HA ALA 88 HA ALA 88 -9.359 -6.207 -22.624 683 HB1 ALA 88 1HB ALA 88 -8.731 -3.968 -22.091 684 HB2 ALA 88 2HB ALA 88 -8.469 -4.385 -20.397 685 HB3 ALA 88 3HB ALA 88 -7.391 -5.022 -21.639 686 H ALA 89 H ALA 89 -10.140 -6.962 -19.399 687 HA ALA 89 HA ALA 89 -8.010 -8.999 -19.308 688 HB1 ALA 89 1HB ALA 89 -9.040 -7.163 -17.287 689 HB2 ALA 89 2HB ALA 89 -8.954 -8.838 -16.740 690 HB3 ALA 89 3HB ALA 89 -7.508 -8.036 -17.354 691 H ASP 90 H ASP 90 -11.336 -8.407 -18.154 692 HA ASP 90 HA ASP 90 -11.968 -11.083 -17.634 693 HB2 ASP 90 2HB ASP 90 -13.351 -9.335 -16.733 694 HB3 ASP 90 3HB ASP 90 -13.737 -8.738 -18.344 695 H HIS 91 H HIS 91 -13.370 -9.197 -20.309 696 HA HIS 91 HA HIS 91 -14.004 -9.783 -22.414 697 HB2 HIS 91 2HB HIS 91 -11.417 -10.323 -22.334 698 HB3 HIS 91 3HB HIS 91 -11.983 -11.984 -22.485 699 HD1 HIS 91 HD1 HIS 91 -10.331 -10.684 -24.725 700 HD2 HIS 91 HD2 HIS 91 -14.485 -10.728 -24.620 701 HE1 HIS 91 HE1 HIS 91 -11.067 -10.398 -27.112 702 H ASP 92 H ASP 92 -14.744 -11.484 -19.887 703 HA ASP 92 HA ASP 92 -15.802 -13.821 -21.323 704 HB2 ASP 92 2HB ASP 92 -15.877 -13.506 -18.338 705 HB3 ASP 92 3HB ASP 92 -15.866 -14.984 -19.296 706 H GLY 93 H GLY 93 -16.686 -10.856 -19.854 707 HA2 GLY 93 2HA GLY 93 -18.748 -9.790 -19.965 708 HA3 GLY 93 3HA GLY 93 -19.451 -11.276 -20.587 709 H ASP 94 H ASP 94 -17.571 -11.296 -17.663 710 HA ASP 94 HA ASP 94 -19.990 -12.006 -16.172 711 HB2 ASP 94 2HB ASP 94 -17.330 -12.234 -14.884 712 HB3 ASP 94 3HB ASP 94 -18.698 -13.344 -14.854 713 H GLY 95 H GLY 95 -17.328 -9.711 -16.212 714 HA2 GLY 95 2HA GLY 95 -17.577 -7.482 -15.417 715 HA3 GLY 95 3HA GLY 95 -18.833 -8.043 -14.324 716 H LYS 96 H LYS 96 -16.628 -10.336 -13.958 717 HA LYS 96 HA LYS 96 -15.186 -8.870 -11.846 718 HB2 LYS 96 2HB LYS 96 -15.165 -10.917 -10.536 719 HB3 LYS 96 3HB LYS 96 -16.819 -10.492 -10.958 720 HG2 LYS 96 2HG LYS 96 -15.952 -12.162 -13.014 721 HG3 LYS 96 3HG LYS 96 -15.338 -12.891 -11.529 722 HD2 LYS 96 2HD LYS 96 -18.102 -11.939 -11.344 723 HD3 LYS 96 3HD LYS 96 -17.861 -13.228 -12.525 724 HE2 LYS 96 2HE LYS 96 -16.593 -13.555 -9.864 725 HE3 LYS 96 3HE LYS 96 -18.347 -13.709 -9.949 726 HZ1 LYS 96 3HZ LYS 96 -17.998 -15.359 -11.754 727 HZ2 LYS 96 1HZ LYS 96 -17.398 -15.852 -10.251 728 HZ3 LYS 96 2HZ LYS 96 -16.336 -15.297 -11.444 729 H ILE 97 H ILE 97 -13.016 -8.984 -11.814 730 HA ILE 97 HA ILE 97 -11.701 -10.366 -14.004 731 HB ILE 97 HB ILE 97 -10.627 -8.479 -11.906 732 HG12 ILE 97 2HG1 ILE 97 -12.114 -7.476 -13.616 733 HG13 ILE 97 3HG1 ILE 97 -10.459 -6.890 -13.741 734 HG21 ILE 97 1HG2 ILE 97 -9.266 -10.239 -13.808 735 HG22 ILE 97 2HG2 ILE 97 -8.753 -8.554 -13.884 736 HG23 ILE 97 3HG2 ILE 97 -8.653 -9.439 -12.362 737 HD11 ILE 97 3HD1 ILE 97 -12.081 -8.192 -15.705 738 HD12 ILE 97 1HD1 ILE 97 -10.505 -7.422 -15.884 739 HD13 ILE 97 2HD1 ILE 97 -10.609 -9.121 -15.421 740 H GLY 98 H GLY 98 -10.421 -12.124 -13.834 741 HA2 GLY 98 2HA GLY 98 -10.016 -13.222 -11.119 742 HA3 GLY 98 3HA GLY 98 -10.354 -14.222 -12.524 743 H ALA 99 H ALA 99 -8.133 -14.546 -10.793 744 HA ALA 99 HA ALA 99 -5.773 -13.376 -11.796 745 HB1 ALA 99 1HB ALA 99 -6.254 -15.911 -10.247 746 HB2 ALA 99 2HB ALA 99 -4.644 -15.317 -10.657 747 HB3 ALA 99 3HB ALA 99 -5.707 -14.349 -9.635 748 H GLU 100 H GLU 100 -7.850 -15.610 -13.198 749 HA GLU 100 HA GLU 100 -5.783 -16.957 -14.749 750 HB2 GLU 100 2HB GLU 100 -7.942 -18.040 -13.786 751 HB3 GLU 100 3HB GLU 100 -8.734 -17.304 -15.173 752 HG2 GLU 100 2HG GLU 100 -8.237 -19.466 -15.869 753 HG3 GLU 100 3HG GLU 100 -6.968 -18.476 -16.588 754 H GLU 101 H GLU 101 -7.663 -14.172 -14.940 755 HA GLU 101 HA GLU 101 -7.166 -13.990 -17.837 756 HB2 GLU 101 2HB GLU 101 -9.232 -12.908 -18.209 757 HB3 GLU 101 3HB GLU 101 -9.606 -14.293 -17.192 758 HG2 GLU 101 2HG GLU 101 -9.249 -12.482 -15.279 759 HG3 GLU 101 3HG GLU 101 -9.730 -11.401 -16.586 760 H PHE 102 H PHE 102 -6.343 -12.840 -14.890 761 HA PHE 102 HA PHE 102 -6.271 -10.024 -15.434 762 HB2 PHE 102 2HB PHE 102 -6.416 -10.972 -13.131 763 HB3 PHE 102 3HB PHE 102 -4.774 -11.579 -13.315 764 HD1 PHE 102 HD2 PHE 102 -6.707 -8.402 -13.558 765 HD2 PHE 102 HD1 PHE 102 -3.023 -10.290 -12.566 766 HE1 PHE 102 HE2 PHE 102 -5.826 -6.252 -12.750 767 HE2 PHE 102 HE1 PHE 102 -2.137 -8.143 -11.755 768 HZ PHE 102 HZ PHE 102 -3.539 -6.120 -11.848 769 H GLN 103 H GLN 103 -3.559 -12.210 -14.689 770 HA GLN 103 HA GLN 103 -1.539 -10.640 -15.711 771 HB2 GLN 103 2HB GLN 103 -0.202 -12.693 -15.868 772 HB3 GLN 103 3HB GLN 103 -1.113 -12.629 -14.366 773 HG2 GLN 103 2HG GLN 103 -2.807 -13.965 -16.074 774 HG3 GLN 103 3HG GLN 103 -1.212 -14.561 -16.528 775 HE21 GLN 103 1HE2 GLN 103 -2.554 -13.570 -13.405 776 HE22 GLN 103 2HE2 GLN 103 -2.259 -15.072 -12.604 777 H GLU 104 H GLU 104 -3.687 -12.842 -17.403 778 HA GLU 104 HA GLU 104 -2.349 -13.026 -19.842 779 HB2 GLU 104 2HB GLU 104 -5.348 -12.885 -19.555 780 HB3 GLU 104 3HB GLU 104 -4.422 -13.730 -20.788 781 HG2 GLU 104 2HG GLU 104 -4.611 -14.440 -17.871 782 HG3 GLU 104 3HG GLU 104 -5.323 -15.315 -19.226 783 H MET 105 H MET 105 -4.136 -10.410 -18.444 784 HA MET 105 HA MET 105 -4.370 -8.978 -20.958 785 HB2 MET 105 2HB MET 105 -5.770 -7.514 -19.867 786 HB3 MET 105 3HB MET 105 -6.015 -8.966 -18.906 787 HG2 MET 105 2HG MET 105 -5.621 -7.629 -17.167 788 HG3 MET 105 3HG MET 105 -3.926 -7.825 -17.609 789 HE1 MET 105 3HE MET 105 -6.472 -5.001 -19.715 790 HE2 MET 105 1HE MET 105 -7.069 -6.139 -18.507 791 HE3 MET 105 2HE MET 105 -6.790 -4.453 -18.068 792 H VAL 106 H VAL 106 -2.137 -9.289 -18.398 793 HA VAL 106 HA VAL 106 -0.938 -6.685 -18.684 794 HB VAL 106 HB VAL 106 0.294 -9.093 -17.353 795 HG11 VAL 106 1HG1 VAL 106 1.161 -6.438 -17.771 796 HG12 VAL 106 2HG1 VAL 106 0.788 -6.603 -16.054 797 HG13 VAL 106 3HG1 VAL 106 1.938 -7.702 -16.818 798 HG21 VAL 106 3HG2 VAL 106 -2.156 -8.057 -16.679 799 HG22 VAL 106 1HG2 VAL 106 -1.082 -8.941 -15.595 800 HG23 VAL 106 2HG2 VAL 106 -1.059 -7.178 -15.615 801 H GLN 107 H GLN 107 0.712 -9.817 -18.922 802 HA GLN 107 HA GLN 107 2.799 -9.013 -20.510 803 HB2 GLN 107 2HB GLN 107 1.413 -11.685 -20.337 804 HB3 GLN 107 3HB GLN 107 2.878 -11.439 -21.278 805 HG2 GLN 107 2HG GLN 107 4.172 -11.514 -19.474 806 HG3 GLN 107 3HG GLN 107 3.120 -10.426 -18.571 807 HE21 GLN 107 1HE2 GLN 107 1.065 -11.444 -17.780 808 HE22 GLN 107 2HE2 GLN 107 1.178 -13.047 -17.144 809 H SER 108 H SER 108 -0.455 -9.873 -21.476 810 HA SER 108 HA SER 108 -0.199 -10.309 -24.170 811 HB2 SER 108 2HB SER 108 -2.379 -10.543 -23.427 812 HB3 SER 108 3HB SER 108 -2.336 -9.041 -22.503 813 HG SER 108 HG SER 108 -3.511 -8.489 -24.222 Start of MODEL 20 1 H1 SER 1 H SER 1 3.163 -0.002 0.807 2 HA SER 1 HA SER 1 1.285 -0.205 -1.454 3 HB2 SER 1 2HB SER 1 4.083 0.939 -1.437 4 HB3 SER 1 3HB SER 1 3.229 0.501 -2.916 5 HG SER 1 HG SER 1 1.525 1.954 -2.107 6 H LEU 2 H LEU 2 1.807 -1.774 -3.059 7 HA LEU 2 HA LEU 2 2.559 -4.255 -2.113 8 HB2 LEU 2 2HB LEU 2 1.702 -3.175 -4.544 9 HB3 LEU 2 3HB LEU 2 3.216 -4.001 -4.909 10 HG LEU 2 HG LEU 2 0.740 -5.221 -3.691 11 HD11 LEU 2 1HD1 LEU 2 0.247 -5.150 -5.916 12 HD12 LEU 2 2HD1 LEU 2 1.162 -6.656 -5.865 13 HD13 LEU 2 3HD1 LEU 2 1.941 -5.170 -6.408 14 HD21 LEU 2 3HD2 LEU 2 1.892 -7.287 -3.589 15 HD22 LEU 2 1HD2 LEU 2 2.930 -6.100 -2.799 16 HD23 LEU 2 2HD2 LEU 2 3.290 -6.632 -4.442 17 H THR 3 H THR 3 4.509 -2.466 -4.498 18 HA THR 3 HA THR 3 6.753 -2.450 -4.906 19 HB THR 3 HB THR 3 7.915 -2.701 -2.361 20 HG1 THR 3 HG1 THR 3 5.606 -1.048 -2.200 21 HG21 THR 3 3HG2 THR 3 7.570 -0.742 -4.430 22 HG22 THR 3 1HG2 THR 3 8.867 -0.891 -3.245 23 HG23 THR 3 2HG2 THR 3 7.411 0.024 -2.850 24 H ASP 4 H ASP 4 5.353 -5.083 -4.598 25 HA ASP 4 HA ASP 4 7.656 -6.759 -3.858 26 HB2 ASP 4 2HB ASP 4 5.185 -6.996 -2.881 27 HB3 ASP 4 3HB ASP 4 4.973 -7.958 -4.342 28 H ILE 5 H ILE 5 5.948 -5.550 -6.491 29 HA ILE 5 HA ILE 5 7.067 -7.644 -8.238 30 HB ILE 5 HB ILE 5 4.544 -6.064 -8.749 31 HG12 ILE 5 2HG1 ILE 5 3.682 -8.587 -8.632 32 HG13 ILE 5 3HG1 ILE 5 5.059 -8.741 -7.546 33 HG21 ILE 5 1HG2 ILE 5 6.104 -6.939 -10.665 34 HG22 ILE 5 2HG2 ILE 5 5.354 -8.487 -10.281 35 HG23 ILE 5 3HG2 ILE 5 4.354 -7.122 -10.777 36 HD11 ILE 5 3HD1 ILE 5 3.531 -8.161 -6.007 37 HD12 ILE 5 1HD1 ILE 5 3.930 -6.528 -6.540 38 HD13 ILE 5 2HD1 ILE 5 2.500 -7.339 -7.179 39 H LEU 6 H LEU 6 6.144 -4.233 -7.977 40 HA LEU 6 HA LEU 6 8.254 -3.604 -9.932 41 HB2 LEU 6 2HB LEU 6 5.487 -2.451 -9.712 42 HB3 LEU 6 3HB LEU 6 6.790 -1.622 -10.560 43 HG LEU 6 HG LEU 6 6.209 -4.415 -11.371 44 HD11 LEU 6 1HD1 LEU 6 4.137 -4.104 -12.113 45 HD12 LEU 6 2HD1 LEU 6 4.544 -2.536 -12.811 46 HD13 LEU 6 3HD1 LEU 6 4.088 -2.653 -11.111 47 HD21 LEU 6 3HD2 LEU 6 7.560 -2.082 -12.379 48 HD22 LEU 6 1HD2 LEU 6 6.376 -2.671 -13.546 49 HD23 LEU 6 2HD2 LEU 6 7.632 -3.753 -12.942 50 H SER 7 H SER 7 9.184 -1.459 -9.706 51 HA SER 7 HA SER 7 9.640 -0.808 -6.950 52 HB2 SER 7 2HB SER 7 10.975 -0.372 -9.432 53 HB3 SER 7 3HB SER 7 10.728 1.196 -8.664 54 HG SER 7 HG SER 7 12.611 -0.465 -8.107 55 HA PRO 8 HA PRO 8 6.847 2.517 -6.333 56 HB2 PRO 8 2HB PRO 8 8.348 4.298 -4.937 57 HB3 PRO 8 3HB PRO 8 7.766 2.780 -4.243 58 HG2 PRO 8 2HG PRO 8 10.461 3.439 -5.368 59 HG3 PRO 8 3HG PRO 8 10.053 2.533 -3.899 60 HD2 PRO 8 2HD PRO 8 10.763 1.315 -6.211 61 HD3 PRO 8 3HD PRO 8 9.615 0.593 -5.065 62 H SER 9 H SER 9 10.068 3.766 -7.234 63 HA SER 9 HA SER 9 9.262 6.226 -8.238 64 HB2 SER 9 2HB SER 9 11.377 6.161 -9.568 65 HB3 SER 9 3HB SER 9 11.606 5.737 -7.872 66 HG SER 9 HG SER 9 12.660 4.322 -9.426 67 H ASP 10 H ASP 10 9.164 3.057 -9.704 68 HA ASP 10 HA ASP 10 8.631 3.998 -12.358 69 HB2 ASP 10 2HB ASP 10 8.302 1.275 -11.083 70 HB3 ASP 10 3HB ASP 10 8.040 1.602 -12.794 71 H ILE 11 H ILE 11 6.699 2.985 -9.605 72 HA ILE 11 HA ILE 11 4.217 2.902 -11.008 73 HB ILE 11 HB ILE 11 4.897 3.030 -8.078 74 HG12 ILE 11 2HG1 ILE 11 3.467 0.846 -9.580 75 HG13 ILE 11 3HG1 ILE 11 5.225 0.931 -9.536 76 HG21 ILE 11 1HG2 ILE 11 2.866 3.999 -7.857 77 HG22 ILE 11 2HG2 ILE 11 2.301 3.427 -9.426 78 HG23 ILE 11 3HG2 ILE 11 2.307 2.336 -8.041 79 HD11 ILE 11 3HD1 ILE 11 3.340 0.549 -7.230 80 HD12 ILE 11 1HD1 ILE 11 4.548 -0.578 -7.847 81 HD13 ILE 11 2HD1 ILE 11 5.057 0.903 -7.035 82 H ALA 12 H ALA 12 5.575 5.241 -8.682 83 HA ALA 12 HA ALA 12 3.575 7.140 -8.760 84 HB1 ALA 12 1HB ALA 12 5.993 8.570 -8.624 85 HB2 ALA 12 2HB ALA 12 4.969 8.040 -7.289 86 HB3 ALA 12 3HB ALA 12 6.286 7.011 -7.853 87 H ALA 13 H ALA 13 6.410 6.872 -10.889 88 HA ALA 13 HA ALA 13 5.966 9.158 -12.425 89 HB1 ALA 13 1HB ALA 13 7.485 6.646 -12.772 90 HB2 ALA 13 2HB ALA 13 7.139 7.574 -14.232 91 HB3 ALA 13 3HB ALA 13 8.016 8.324 -12.898 92 H ALA 14 H ALA 14 4.251 6.192 -12.335 93 HA ALA 14 HA ALA 14 2.991 6.702 -14.934 94 HB1 ALA 14 1HB ALA 14 2.515 4.304 -13.188 95 HB2 ALA 14 2HB ALA 14 2.242 4.475 -14.923 96 HB3 ALA 14 3HB ALA 14 3.888 4.410 -14.291 97 H LEU 15 H LEU 15 2.466 7.050 -11.577 98 HA LEU 15 HA LEU 15 -0.394 6.928 -11.623 99 HB2 LEU 15 2HB LEU 15 1.664 7.806 -9.645 100 HB3 LEU 15 3HB LEU 15 -0.030 8.216 -9.383 101 HG LEU 15 HG LEU 15 1.097 5.427 -9.630 102 HD11 LEU 15 1HD1 LEU 15 1.455 5.483 -7.445 103 HD12 LEU 15 2HD1 LEU 15 -0.204 6.003 -7.152 104 HD13 LEU 15 3HD1 LEU 15 1.056 7.201 -7.446 105 HD21 LEU 15 3HD2 LEU 15 -1.182 4.758 -8.888 106 HD22 LEU 15 1HD2 LEU 15 -1.136 5.472 -10.500 107 HD23 LEU 15 2HD2 LEU 15 -1.703 6.426 -9.129 108 H ARG 16 H ARG 16 1.894 9.636 -11.211 109 HA ARG 16 HA ARG 16 -0.153 11.600 -11.612 110 HB2 ARG 16 2HB ARG 16 2.000 13.099 -11.826 111 HB3 ARG 16 3HB ARG 16 1.510 12.447 -10.268 112 HG2 ARG 16 2HG ARG 16 3.927 12.242 -10.689 113 HG3 ARG 16 3HG ARG 16 3.138 10.684 -10.439 114 HD2 ARG 16 2HD ARG 16 4.774 10.688 -12.308 115 HD3 ARG 16 3HD ARG 16 3.140 10.237 -12.795 116 HE ARG 16 HE ARG 16 3.171 12.870 -13.304 117 HH11 ARG 16 1HH1 ARG 16 5.400 10.318 -14.099 118 HH12 ARG 16 2HH1 ARG 16 5.938 11.067 -15.566 119 HH21 ARG 16 1HH2 ARG 16 3.871 13.867 -15.232 120 HH22 ARG 16 2HH2 ARG 16 5.068 13.086 -16.209 121 H ASP 17 H ASP 17 1.373 9.577 -13.712 122 HA ASP 17 HA ASP 17 1.843 11.390 -15.889 123 HB2 ASP 17 2HB ASP 17 3.180 9.461 -15.961 124 HB3 ASP 17 3HB ASP 17 1.821 8.396 -15.612 125 H CYS 18 H CYS 18 -0.729 9.165 -14.943 126 HA CYS 18 HA CYS 18 -2.482 10.478 -16.898 127 HB2 CYS 18 2HB CYS 18 -2.084 7.520 -16.503 128 HB3 CYS 18 3HB CYS 18 -3.572 8.163 -17.188 129 HG CYS 18 HG CYS 18 -1.369 9.623 -18.935 130 H GLN 19 H GLN 19 -2.052 10.658 -13.948 131 HA GLN 19 HA GLN 19 -3.983 9.423 -12.431 132 HB2 GLN 19 2HB GLN 19 -3.969 11.618 -11.084 133 HB3 GLN 19 3HB GLN 19 -2.454 10.740 -11.250 134 HG2 GLN 19 2HG GLN 19 -1.660 12.258 -12.896 135 HG3 GLN 19 3HG GLN 19 -3.237 13.035 -13.024 136 HE21 GLN 19 1HE2 GLN 19 -1.383 12.075 -10.172 137 HE22 GLN 19 2HE2 GLN 19 -1.263 13.661 -9.497 138 H ALA 20 H ALA 20 -4.324 12.245 -14.522 139 HA ALA 20 HA ALA 20 -6.840 13.126 -13.824 140 HB1 ALA 20 1HB ALA 20 -6.976 14.147 -15.959 141 HB2 ALA 20 2HB ALA 20 -5.271 14.147 -15.507 142 HB3 ALA 20 3HB ALA 20 -5.875 12.966 -16.670 143 HA PRO 21 HA PRO 21 -9.717 9.987 -14.902 144 HB2 PRO 21 2HB PRO 21 -11.868 11.489 -15.601 145 HB3 PRO 21 3HB PRO 21 -11.327 11.306 -13.928 146 HG2 PRO 21 2HG PRO 21 -10.832 13.552 -15.844 147 HG3 PRO 21 3HG PRO 21 -11.260 13.622 -14.124 148 HD2 PRO 21 2HD PRO 21 -8.723 13.962 -15.009 149 HD3 PRO 21 3HD PRO 21 -9.096 13.219 -13.440 150 H ASP 22 H ASP 22 -10.417 8.830 -16.646 151 HA ASP 22 HA ASP 22 -10.629 8.159 -18.809 152 HB2 ASP 22 2HB ASP 22 -11.988 10.514 -18.669 153 HB3 ASP 22 3HB ASP 22 -10.826 10.874 -19.943 154 H SER 23 H SER 23 -8.023 9.307 -17.645 155 HA SER 23 HA SER 23 -6.617 9.680 -20.207 156 HB2 SER 23 2HB SER 23 -6.584 11.422 -18.166 157 HB3 SER 23 3HB SER 23 -5.260 10.376 -17.654 158 HG SER 23 HG SER 23 -5.468 12.027 -19.904 159 H PHE 24 H PHE 24 -7.021 7.651 -17.497 160 HA PHE 24 HA PHE 24 -4.463 6.305 -17.859 161 HB2 PHE 24 2HB PHE 24 -5.901 6.766 -15.621 162 HB3 PHE 24 3HB PHE 24 -6.494 5.160 -16.032 163 HD1 PHE 24 HD1 PHE 24 -4.982 3.244 -16.053 164 HD2 PHE 24 HD2 PHE 24 -3.654 7.112 -14.876 165 HE1 PHE 24 HE1 PHE 24 -2.978 2.242 -15.035 166 HE2 PHE 24 HE2 PHE 24 -1.648 6.118 -13.857 167 HZ PHE 24 HZ PHE 24 -1.307 3.680 -13.936 168 H SER 25 H SER 25 -4.414 3.937 -18.092 169 HA SER 25 HA SER 25 -6.744 2.699 -19.305 170 HB2 SER 25 2HB SER 25 -4.589 3.795 -20.886 171 HB3 SER 25 3HB SER 25 -4.679 2.047 -21.100 172 HG SER 25 HG SER 25 -6.038 3.274 -22.545 173 HA PRO 26 HA PRO 26 -5.134 -0.948 -17.473 174 HB2 PRO 26 2HB PRO 26 -5.989 -2.857 -19.203 175 HB3 PRO 26 3HB PRO 26 -7.078 -1.994 -18.110 176 HG2 PRO 26 2HG PRO 26 -6.538 -1.515 -21.015 177 HG3 PRO 26 3HG PRO 26 -8.085 -1.513 -20.150 178 HD2 PRO 26 2HD PRO 26 -6.783 0.767 -20.810 179 HD3 PRO 26 3HD PRO 26 -7.777 0.625 -19.346 180 H LYS 27 H LYS 27 -4.352 -0.304 -20.825 181 HA LYS 27 HA LYS 27 -1.975 -2.027 -20.589 182 HB2 LYS 27 2HB LYS 27 -1.936 -2.128 -23.016 183 HB3 LYS 27 3HB LYS 27 -3.513 -2.631 -22.421 184 HG2 LYS 27 2HG LYS 27 -3.251 0.226 -23.081 185 HG3 LYS 27 3HG LYS 27 -3.150 -0.895 -24.441 186 HD2 LYS 27 2HD LYS 27 -5.380 -0.767 -22.411 187 HD3 LYS 27 3HD LYS 27 -5.451 -0.160 -24.067 188 HE2 LYS 27 2HE LYS 27 -6.249 -2.169 -24.619 189 HE3 LYS 27 3HE LYS 27 -4.607 -2.765 -24.379 190 HZ1 LYS 27 3HZ LYS 27 -5.380 -2.942 -21.920 191 HZ2 LYS 27 1HZ LYS 27 -5.806 -4.149 -23.026 192 HZ3 LYS 27 2HZ LYS 27 -6.931 -2.963 -22.595 193 H LYS 28 H LYS 28 -2.430 0.817 -19.689 194 HA LYS 28 HA LYS 28 -0.182 2.020 -21.167 195 HB2 LYS 28 2HB LYS 28 -2.717 3.259 -20.143 196 HB3 LYS 28 3HB LYS 28 -1.269 4.236 -20.341 197 HG2 LYS 28 2HG LYS 28 -2.537 2.612 -22.535 198 HG3 LYS 28 3HG LYS 28 -2.819 4.333 -22.269 199 HD2 LYS 28 2HD LYS 28 -0.236 4.522 -22.389 200 HD3 LYS 28 3HD LYS 28 -0.323 2.939 -23.166 201 HE2 LYS 28 2HE LYS 28 -1.468 3.762 -25.003 202 HE3 LYS 28 3HE LYS 28 -2.061 5.174 -24.128 203 HZ1 LYS 28 3HZ LYS 28 0.480 4.765 -25.486 204 HZ2 LYS 28 1HZ LYS 28 0.542 5.632 -24.035 205 HZ3 LYS 28 2HZ LYS 28 -0.436 6.175 -25.303 206 H PHE 29 H PHE 29 -0.560 0.404 -18.564 207 HA PHE 29 HA PHE 29 0.862 2.292 -16.804 208 HB2 PHE 29 2HB PHE 29 -1.225 1.697 -15.779 209 HB3 PHE 29 3HB PHE 29 -0.961 -0.012 -16.105 210 HD1 PHE 29 HD1 PHE 29 1.254 2.595 -14.629 211 HD2 PHE 29 HD2 PHE 29 -0.788 -1.100 -14.085 212 HE1 PHE 29 HE1 PHE 29 2.307 2.343 -12.420 213 HE2 PHE 29 HE2 PHE 29 0.261 -1.357 -11.874 214 HZ PHE 29 HZ PHE 29 1.810 0.365 -11.039 215 H PHE 30 H PHE 30 1.003 -0.654 -18.516 216 HA PHE 30 HA PHE 30 3.117 -1.818 -16.926 217 HB2 PHE 30 2HB PHE 30 2.968 -3.682 -18.323 218 HB3 PHE 30 3HB PHE 30 1.320 -3.064 -18.324 219 HD1 PHE 30 HD2 PHE 30 0.381 -2.020 -20.293 220 HD2 PHE 30 HD1 PHE 30 4.363 -3.524 -20.287 221 HE1 PHE 30 HE2 PHE 30 0.431 -1.889 -22.749 222 HE2 PHE 30 HE1 PHE 30 4.420 -3.395 -22.743 223 HZ PHE 30 HZ PHE 30 2.452 -2.577 -23.978 224 H GLN 31 H GLN 31 2.939 0.591 -19.230 225 HA GLN 31 HA GLN 31 5.506 0.053 -20.471 226 HB2 GLN 31 2HB GLN 31 4.045 2.646 -20.773 227 HB3 GLN 31 3HB GLN 31 5.029 1.779 -21.945 228 HG2 GLN 31 2HG GLN 31 3.254 0.075 -22.123 229 HG3 GLN 31 3HG GLN 31 2.263 1.034 -21.025 230 HE21 GLN 31 1HE2 GLN 31 2.698 3.565 -21.906 231 HE22 GLN 31 2HE2 GLN 31 2.100 3.745 -23.516 232 H ILE 32 H ILE 32 4.108 2.301 -18.136 233 HA ILE 32 HA ILE 32 6.651 3.651 -17.759 234 HB ILE 32 HB ILE 32 4.071 4.024 -16.234 235 HG12 ILE 32 2HG1 ILE 32 4.429 6.232 -17.853 236 HG13 ILE 32 3HG1 ILE 32 4.925 4.901 -18.893 237 HG21 ILE 32 1HG2 ILE 32 5.793 4.924 -14.930 238 HG22 ILE 32 2HG2 ILE 32 6.656 5.543 -16.337 239 HG23 ILE 32 3HG2 ILE 32 5.151 6.305 -15.820 240 HD11 ILE 32 3HD1 ILE 32 2.499 4.220 -17.541 241 HD12 ILE 32 1HD1 ILE 32 2.328 5.780 -18.344 242 HD13 ILE 32 2HD1 ILE 32 2.818 4.361 -19.270 243 H SER 33 H SER 33 4.727 1.186 -16.236 244 HA SER 33 HA SER 33 6.427 1.190 -13.857 245 HB2 SER 33 2HB SER 33 3.860 0.952 -13.799 246 HB3 SER 33 3HB SER 33 4.132 -0.696 -14.365 247 HG SER 33 HG SER 33 5.588 0.220 -12.158 248 H GLY 34 H GLY 34 5.082 -1.413 -15.895 249 HA2 GLY 34 2HA GLY 34 6.730 -2.751 -17.200 250 HA3 GLY 34 3HA GLY 34 7.730 -2.719 -15.755 251 H MET 35 H MET 35 4.370 -3.559 -16.616 252 HA MET 35 HA MET 35 4.410 -5.705 -14.655 253 HB2 MET 35 2HB MET 35 2.155 -4.992 -16.526 254 HB3 MET 35 3HB MET 35 2.060 -5.892 -15.018 255 HG2 MET 35 2HG MET 35 2.822 -3.794 -13.854 256 HG3 MET 35 3HG MET 35 2.579 -2.958 -15.387 257 HE1 MET 35 3HE MET 35 -0.785 -5.029 -13.003 258 HE2 MET 35 1HE MET 35 0.356 -5.940 -13.993 259 HE3 MET 35 2HE MET 35 0.924 -5.069 -12.568 260 H SER 36 H SER 36 3.816 -5.355 -18.150 261 HA SER 36 HA SER 36 3.491 -8.020 -18.804 262 HB2 SER 36 2HB SER 36 3.849 -7.404 -21.037 263 HB3 SER 36 3HB SER 36 3.314 -5.899 -20.288 264 HG SER 36 HG SER 36 5.616 -6.411 -21.543 265 H LYS 37 H LYS 37 6.437 -6.228 -18.182 266 HA LYS 37 HA LYS 37 8.277 -8.112 -19.184 267 HB2 LYS 37 2HB LYS 37 8.807 -6.303 -16.834 268 HB3 LYS 37 3HB LYS 37 9.949 -6.886 -18.039 269 HG2 LYS 37 2HG LYS 37 7.778 -4.839 -18.408 270 HG3 LYS 37 3HG LYS 37 9.524 -4.593 -18.490 271 HD2 LYS 37 2HD LYS 37 9.189 -6.522 -20.366 272 HD3 LYS 37 3HD LYS 37 7.660 -5.652 -20.508 273 HE2 LYS 37 2HE LYS 37 9.072 -3.531 -20.607 274 HE3 LYS 37 3HE LYS 37 10.453 -4.598 -20.857 275 HZ1 LYS 37 3HZ LYS 37 8.683 -3.664 -22.769 276 HZ2 LYS 37 1HZ LYS 37 8.348 -5.314 -22.599 277 HZ3 LYS 37 2HZ LYS 37 9.915 -4.804 -22.980 278 H LYS 38 H LYS 38 6.397 -8.011 -16.286 279 HA LYS 38 HA LYS 38 8.010 -9.872 -14.809 280 HB2 LYS 38 2HB LYS 38 5.113 -9.219 -14.293 281 HB3 LYS 38 3HB LYS 38 6.317 -9.782 -13.141 282 HG2 LYS 38 2HG LYS 38 6.406 -7.110 -14.525 283 HG3 LYS 38 3HG LYS 38 5.752 -7.384 -12.909 284 HD2 LYS 38 2HD LYS 38 7.815 -7.025 -12.140 285 HD3 LYS 38 3HD LYS 38 8.254 -8.583 -12.844 286 HE2 LYS 38 2HE LYS 38 8.502 -7.108 -15.029 287 HE3 LYS 38 3HE LYS 38 8.756 -5.828 -13.844 288 HZ1 LYS 38 3HZ LYS 38 10.529 -7.166 -12.859 289 HZ2 LYS 38 1HZ LYS 38 10.848 -6.814 -14.483 290 HZ3 LYS 38 2HZ LYS 38 10.304 -8.354 -14.043 291 H SER 39 H SER 39 6.058 -11.604 -13.787 292 HA SER 39 HA SER 39 5.409 -13.238 -16.153 293 HB2 SER 39 2HB SER 39 7.212 -14.334 -15.039 294 HB3 SER 39 3HB SER 39 6.472 -14.091 -13.457 295 HG SER 39 HG SER 39 6.158 -16.220 -14.213 296 H SER 40 H SER 40 3.596 -14.710 -15.895 297 HA SER 40 HA SER 40 1.287 -13.478 -14.981 298 HB2 SER 40 2HB SER 40 0.760 -16.238 -14.890 299 HB3 SER 40 3HB SER 40 0.473 -15.143 -16.243 300 HG SER 40 HG SER 40 1.857 -17.052 -16.634 301 H SER 41 H SER 41 3.589 -15.423 -13.269 302 HA SER 41 HA SER 41 1.885 -16.010 -11.036 303 HB2 SER 41 2HB SER 41 4.883 -16.062 -10.885 304 HB3 SER 41 3HB SER 41 3.712 -17.131 -10.113 305 HG SER 41 HG SER 41 4.616 -18.248 -11.803 306 H GLN 42 H GLN 42 4.027 -13.431 -11.945 307 HA GLN 42 HA GLN 42 4.091 -12.303 -9.272 308 HB2 GLN 42 2HB GLN 42 5.446 -11.774 -11.847 309 HB3 GLN 42 3HB GLN 42 5.170 -10.371 -10.824 310 HG2 GLN 42 2HG GLN 42 6.291 -11.591 -8.966 311 HG3 GLN 42 3HG GLN 42 6.692 -12.866 -10.116 312 HE21 GLN 42 1HE2 GLN 42 6.979 -9.363 -9.672 313 HE22 GLN 42 2HE2 GLN 42 8.543 -9.225 -10.390 314 H LEU 43 H LEU 43 2.456 -11.798 -12.325 315 HA LEU 43 HA LEU 43 1.312 -9.274 -11.596 316 HB2 LEU 43 2HB LEU 43 0.343 -11.164 -13.727 317 HB3 LEU 43 3HB LEU 43 0.076 -9.425 -13.628 318 HG LEU 43 HG LEU 43 2.878 -10.399 -13.851 319 HD11 LEU 43 1HD1 LEU 43 0.800 -10.608 -15.988 320 HD12 LEU 43 2HD1 LEU 43 2.097 -11.727 -15.570 321 HD13 LEU 43 3HD1 LEU 43 2.469 -10.220 -16.407 322 HD21 LEU 43 3HD2 LEU 43 1.307 -7.963 -14.389 323 HD22 LEU 43 1HD2 LEU 43 2.596 -8.320 -15.538 324 HD23 LEU 43 2HD2 LEU 43 2.968 -8.145 -13.822 325 H LYS 44 H LYS 44 0.540 -12.569 -11.017 326 HA LYS 44 HA LYS 44 -2.268 -12.215 -10.586 327 HB2 LYS 44 2HB LYS 44 -2.273 -14.472 -9.810 328 HB3 LYS 44 3HB LYS 44 -1.158 -14.396 -11.168 329 HG2 LYS 44 2HG LYS 44 0.506 -15.156 -9.922 330 HG3 LYS 44 3HG LYS 44 0.239 -13.902 -8.708 331 HD2 LYS 44 2HD LYS 44 -0.065 -15.910 -7.543 332 HD3 LYS 44 3HD LYS 44 -1.705 -15.363 -7.900 333 HE2 LYS 44 2HE LYS 44 -1.808 -17.594 -8.482 334 HE3 LYS 44 3HE LYS 44 -1.444 -16.831 -10.029 335 HZ1 LYS 44 3HZ LYS 44 -0.020 -18.840 -8.801 336 HZ2 LYS 44 1HZ LYS 44 0.940 -17.458 -8.622 337 HZ3 LYS 44 2HZ LYS 44 0.447 -17.952 -10.163 338 H GLU 45 H GLU 45 0.525 -11.504 -8.780 339 HA GLU 45 HA GLU 45 -0.533 -11.832 -6.160 340 HB2 GLU 45 2HB GLU 45 1.820 -10.377 -7.316 341 HB3 GLU 45 3HB GLU 45 1.368 -10.122 -5.637 342 HG2 GLU 45 2HG GLU 45 1.703 -12.904 -6.641 343 HG3 GLU 45 3HG GLU 45 3.131 -11.932 -6.291 344 H ILE 46 H ILE 46 -0.196 -9.031 -8.316 345 HA ILE 46 HA ILE 46 -1.135 -7.036 -6.661 346 HB ILE 46 HB ILE 46 -1.690 -7.317 -9.617 347 HG12 ILE 46 2HG1 ILE 46 0.380 -5.443 -8.943 348 HG13 ILE 46 3HG1 ILE 46 0.753 -7.005 -8.221 349 HG21 ILE 46 1HG2 ILE 46 -3.032 -5.559 -9.151 350 HG22 ILE 46 2HG2 ILE 46 -2.189 -5.174 -7.651 351 HG23 ILE 46 3HG2 ILE 46 -1.508 -4.673 -9.199 352 HD11 ILE 46 3HD1 ILE 46 -0.129 -7.369 -10.918 353 HD12 ILE 46 1HD1 ILE 46 1.176 -6.184 -10.861 354 HD13 ILE 46 2HD1 ILE 46 1.413 -7.792 -10.176 355 H PHE 47 H PHE 47 -2.938 -9.489 -8.401 356 HA PHE 47 HA PHE 47 -5.505 -8.432 -8.234 357 HB2 PHE 47 2HB PHE 47 -5.545 -10.318 -9.514 358 HB3 PHE 47 3HB PHE 47 -4.350 -11.145 -8.519 359 HD1 PHE 47 HD1 PHE 47 -5.023 -12.378 -6.531 360 HD2 PHE 47 HD2 PHE 47 -7.891 -10.491 -9.047 361 HE1 PHE 47 HE1 PHE 47 -6.811 -13.701 -5.479 362 HE2 PHE 47 HE2 PHE 47 -9.684 -11.810 -7.998 363 HZ PHE 47 HZ PHE 47 -9.146 -13.416 -6.211 364 H ARG 48 H ARG 48 -3.535 -9.985 -5.807 365 HA ARG 48 HA ARG 48 -5.634 -10.446 -3.934 366 HB2 ARG 48 2HB ARG 48 -2.877 -11.039 -4.127 367 HB3 ARG 48 3HB ARG 48 -3.089 -10.116 -2.645 368 HG2 ARG 48 2HG ARG 48 -4.695 -12.559 -3.358 369 HG3 ARG 48 3HG ARG 48 -3.246 -12.575 -2.349 370 HD2 ARG 48 2HD ARG 48 -5.387 -10.667 -1.610 371 HD3 ARG 48 3HD ARG 48 -5.715 -12.379 -1.346 372 HE ARG 48 HE ARG 48 -3.301 -12.094 -0.218 373 HH11 ARG 48 1HH1 ARG 48 -6.235 -10.243 0.071 374 HH12 ARG 48 2HH1 ARG 48 -5.921 -9.755 1.704 375 HH21 ARG 48 1HH2 ARG 48 -2.876 -11.458 1.931 376 HH22 ARG 48 2HH2 ARG 48 -4.010 -10.446 2.760 377 H ILE 49 H ILE 49 -4.300 -7.633 -5.054 378 HA ILE 49 HA ILE 49 -4.704 -6.210 -2.512 379 HB ILE 49 HB ILE 49 -3.413 -5.095 -4.998 380 HG12 ILE 49 2HG1 ILE 49 -2.113 -7.023 -4.262 381 HG13 ILE 49 3HG1 ILE 49 -1.249 -5.536 -3.887 382 HG21 ILE 49 1HG2 ILE 49 -2.349 -3.759 -2.913 383 HG22 ILE 49 2HG2 ILE 49 -3.786 -3.231 -3.787 384 HG23 ILE 49 3HG2 ILE 49 -3.952 -4.119 -2.272 385 HD11 ILE 49 3HD1 ILE 49 -2.781 -7.280 -1.978 386 HD12 ILE 49 1HD1 ILE 49 -1.036 -7.032 -2.044 387 HD13 ILE 49 2HD1 ILE 49 -2.098 -5.709 -1.561 388 H LEU 50 H LEU 50 -6.103 -6.800 -5.544 389 HA LEU 50 HA LEU 50 -7.645 -4.322 -5.553 390 HB2 LEU 50 2HB LEU 50 -7.167 -6.532 -7.485 391 HB3 LEU 50 3HB LEU 50 -8.667 -5.616 -7.623 392 HG LEU 50 HG LEU 50 -6.816 -3.618 -7.497 393 HD11 LEU 50 1HD1 LEU 50 -5.559 -5.601 -9.345 394 HD12 LEU 50 2HD1 LEU 50 -5.099 -5.555 -7.644 395 HD13 LEU 50 3HD1 LEU 50 -4.883 -4.126 -8.654 396 HD21 LEU 50 3HD2 LEU 50 -7.153 -3.437 -9.929 397 HD22 LEU 50 1HD2 LEU 50 -8.658 -3.747 -9.064 398 HD23 LEU 50 2HD2 LEU 50 -7.858 -5.054 -9.937 399 H ASP 51 H ASP 51 -7.944 -7.666 -4.713 400 HA ASP 51 HA ASP 51 -10.770 -7.860 -4.784 401 HB2 ASP 51 2HB ASP 51 -8.883 -9.702 -4.551 402 HB3 ASP 51 3HB ASP 51 -9.170 -9.459 -2.831 403 H ASN 52 H ASN 52 -12.184 -6.835 -3.546 404 HA ASN 52 HA ASN 52 -11.312 -5.807 -0.939 405 HB2 ASN 52 2HB ASN 52 -13.047 -4.801 -3.043 406 HB3 ASN 52 3HB ASN 52 -13.848 -4.775 -1.475 407 HD21 ASN 52 1HD2 ASN 52 -10.575 -4.135 -2.700 408 HD22 ASN 52 2HD2 ASN 52 -10.391 -2.615 -1.899 409 H ASP 53 H ASP 53 -12.852 -8.428 -2.173 410 HA ASP 53 HA ASP 53 -14.337 -8.845 0.329 411 HB2 ASP 53 2HB ASP 53 -15.670 -10.283 -1.721 412 HB3 ASP 53 3HB ASP 53 -16.288 -8.948 -0.753 413 H GLN 54 H GLN 54 -11.880 -9.827 -1.575 414 HA GLN 54 HA GLN 54 -10.677 -11.745 -1.840 415 HB2 GLN 54 2HB GLN 54 -11.914 -12.719 0.720 416 HB3 GLN 54 3HB GLN 54 -10.282 -12.980 0.119 417 HG2 GLN 54 2HG GLN 54 -11.302 -10.270 0.910 418 HG3 GLN 54 3HG GLN 54 -10.539 -11.376 2.050 419 HE21 GLN 54 1HE2 GLN 54 -10.012 -8.859 -0.011 420 HE22 GLN 54 2HE2 GLN 54 -8.308 -9.029 -0.239 421 H SER 55 H SER 55 -13.562 -11.672 -2.733 422 HA SER 55 HA SER 55 -14.638 -14.280 -2.427 423 HB2 SER 55 2HB SER 55 -15.892 -13.479 -4.630 424 HB3 SER 55 3HB SER 55 -16.287 -12.801 -3.051 425 HG SER 55 HG SER 55 -15.547 -11.472 -5.148 426 H GLY 56 H GLY 56 -12.130 -13.014 -4.366 427 HA2 GLY 56 2HA GLY 56 -10.668 -14.714 -5.381 428 HA3 GLY 56 3HA GLY 56 -12.127 -15.498 -5.967 429 H PHE 57 H PHE 57 -13.170 -12.652 -6.503 430 HA PHE 57 HA PHE 57 -11.588 -12.093 -8.917 431 HB2 PHE 57 2HB PHE 57 -14.608 -12.074 -8.869 432 HB3 PHE 57 3HB PHE 57 -13.557 -11.887 -10.269 433 HD1 PHE 57 HD1 PHE 57 -14.878 -14.264 -7.799 434 HD2 PHE 57 HD2 PHE 57 -12.605 -13.779 -11.365 435 HE1 PHE 57 HE1 PHE 57 -14.982 -16.691 -8.191 436 HE2 PHE 57 HE2 PHE 57 -12.707 -16.204 -11.764 437 HZ PHE 57 HZ PHE 57 -13.897 -17.664 -10.176 438 H ILE 58 H ILE 58 -12.197 -9.937 -9.888 439 HA ILE 58 HA ILE 58 -12.790 -8.014 -7.733 440 HB ILE 58 HB ILE 58 -10.967 -7.621 -10.109 441 HG12 ILE 58 2HG1 ILE 58 -10.005 -7.428 -7.303 442 HG13 ILE 58 3HG1 ILE 58 -10.348 -9.041 -7.920 443 HG21 ILE 58 1HG2 ILE 58 -12.156 -5.577 -9.466 444 HG22 ILE 58 2HG2 ILE 58 -11.582 -5.769 -7.810 445 HG23 ILE 58 3HG2 ILE 58 -10.432 -5.466 -9.113 446 HD11 ILE 58 3HD1 ILE 58 -7.982 -8.298 -8.155 447 HD12 ILE 58 1HD1 ILE 58 -8.752 -8.795 -9.661 448 HD13 ILE 58 2HD1 ILE 58 -8.540 -7.081 -9.303 449 H GLU 59 H GLU 59 -14.889 -7.513 -8.074 450 HA GLU 59 HA GLU 59 -16.019 -7.228 -10.686 451 HB2 GLU 59 2HB GLU 59 -17.219 -6.201 -8.120 452 HB3 GLU 59 3HB GLU 59 -18.055 -6.695 -9.585 453 HG2 GLU 59 2HG GLU 59 -18.432 -8.552 -8.370 454 HG3 GLU 59 3HG GLU 59 -16.850 -8.999 -9.005 455 H GLU 60 H GLU 60 -17.089 -5.234 -11.432 456 HA GLU 60 HA GLU 60 -15.326 -3.125 -11.735 457 HB2 GLU 60 2HB GLU 60 -18.282 -3.402 -12.115 458 HB3 GLU 60 3HB GLU 60 -17.537 -1.818 -12.280 459 HG2 GLU 60 2HG GLU 60 -16.273 -2.468 -14.124 460 HG3 GLU 60 3HG GLU 60 -16.488 -4.184 -13.783 461 H ASP 61 H ASP 61 -17.641 -3.731 -9.206 462 HA ASP 61 HA ASP 61 -17.820 -1.147 -8.120 463 HB2 ASP 61 2HB ASP 61 -18.191 -3.900 -6.965 464 HB3 ASP 61 3HB ASP 61 -18.330 -2.465 -5.954 465 H GLU 62 H GLU 62 -15.337 -3.557 -7.957 466 HA GLU 62 HA GLU 62 -13.899 -1.956 -5.948 467 HB2 GLU 62 2HB GLU 62 -12.450 -4.169 -5.938 468 HB3 GLU 62 3HB GLU 62 -13.926 -4.038 -4.992 469 HG2 GLU 62 2HG GLU 62 -15.137 -5.111 -6.904 470 HG3 GLU 62 3HG GLU 62 -13.563 -5.412 -7.639 471 H LEU 63 H LEU 63 -13.956 -2.914 -9.213 472 HA LEU 63 HA LEU 63 -11.168 -2.740 -9.771 473 HB2 LEU 63 2HB LEU 63 -13.309 -3.667 -11.131 474 HB3 LEU 63 3HB LEU 63 -13.077 -2.111 -11.926 475 HG LEU 63 HG LEU 63 -11.024 -4.313 -11.711 476 HD11 LEU 63 1HD1 LEU 63 -13.180 -3.869 -13.537 477 HD12 LEU 63 2HD1 LEU 63 -11.992 -5.172 -13.509 478 HD13 LEU 63 3HD1 LEU 63 -11.641 -3.678 -14.378 479 HD21 LEU 63 3HD2 LEU 63 -9.958 -2.144 -11.705 480 HD22 LEU 63 1HD2 LEU 63 -10.928 -1.631 -13.086 481 HD23 LEU 63 2HD2 LEU 63 -9.731 -2.912 -13.276 482 H LYS 64 H LYS 64 -13.779 -0.442 -9.579 483 HA LYS 64 HA LYS 64 -12.607 1.681 -11.004 484 HB2 LYS 64 2HB LYS 64 -14.141 3.109 -9.549 485 HB3 LYS 64 3HB LYS 64 -14.910 1.874 -10.538 486 HG2 LYS 64 2HG LYS 64 -15.560 0.645 -8.749 487 HG3 LYS 64 3HG LYS 64 -14.160 1.111 -7.779 488 HD2 LYS 64 2HD LYS 64 -16.132 2.091 -6.812 489 HD3 LYS 64 3HD LYS 64 -15.157 3.375 -7.530 490 HE2 LYS 64 2HE LYS 64 -16.667 3.775 -9.196 491 HE3 LYS 64 3HE LYS 64 -17.250 2.112 -9.217 492 HZ1 LYS 64 3HZ LYS 64 -18.612 4.147 -8.168 493 HZ2 LYS 64 1HZ LYS 64 -17.799 3.599 -6.789 494 HZ3 LYS 64 2HZ LYS 64 -18.792 2.543 -7.660 495 H TYR 65 H TYR 65 -11.811 0.293 -8.003 496 HA TYR 65 HA TYR 65 -10.403 2.701 -7.101 497 HB2 TYR 65 2HB TYR 65 -11.071 0.103 -5.714 498 HB3 TYR 65 3HB TYR 65 -10.021 1.326 -5.007 499 HD1 TYR 65 HD1 TYR 65 -11.221 3.828 -5.372 500 HD2 TYR 65 HD2 TYR 65 -13.167 0.092 -4.770 501 HE1 TYR 65 HE1 TYR 65 -13.187 5.003 -4.476 502 HE2 TYR 65 HE2 TYR 65 -15.139 1.257 -3.874 503 HH TYR 65 HH TYR 65 -16.158 3.622 -4.136 504 H PHE 66 H PHE 66 -9.367 1.474 -9.373 505 HA PHE 66 HA PHE 66 -7.213 -0.288 -8.651 506 HB2 PHE 66 2HB PHE 66 -8.109 -0.584 -10.836 507 HB3 PHE 66 3HB PHE 66 -7.956 1.131 -11.207 508 HD1 PHE 66 HD1 PHE 66 -5.927 -1.880 -10.409 509 HD2 PHE 66 HD2 PHE 66 -6.093 1.910 -12.339 510 HE1 PHE 66 HE1 PHE 66 -3.723 -2.301 -11.418 511 HE2 PHE 66 HE2 PHE 66 -3.890 1.494 -13.352 512 HZ PHE 66 HZ PHE 66 -2.702 -0.614 -12.893 513 H LEU 67 H LEU 67 -7.684 3.114 -8.851 514 HA LEU 67 HA LEU 67 -4.834 3.693 -8.970 515 HB2 LEU 67 2HB LEU 67 -7.030 5.689 -8.524 516 HB3 LEU 67 3HB LEU 67 -5.424 5.957 -9.199 517 HG LEU 67 HG LEU 67 -7.857 4.804 -10.512 518 HD11 LEU 67 1HD1 LEU 67 -6.084 6.556 -12.006 519 HD12 LEU 67 2HD1 LEU 67 -6.684 7.293 -10.521 520 HD13 LEU 67 3HD1 LEU 67 -7.820 6.675 -11.720 521 HD21 LEU 67 3HD2 LEU 67 -6.045 3.201 -10.901 522 HD22 LEU 67 1HD2 LEU 67 -5.019 4.509 -11.490 523 HD23 LEU 67 2HD2 LEU 67 -6.478 4.066 -12.376 524 H GLN 68 H GLN 68 -6.961 2.790 -6.623 525 HA GLN 68 HA GLN 68 -5.825 4.486 -4.532 526 HB2 GLN 68 2HB GLN 68 -8.288 2.965 -4.871 527 HB3 GLN 68 3HB GLN 68 -7.536 2.679 -3.308 528 HG2 GLN 68 2HG GLN 68 -8.544 4.525 -2.616 529 HG3 GLN 68 3HG GLN 68 -7.393 5.418 -3.608 530 HE21 GLN 68 1HE2 GLN 68 -8.173 5.105 -6.099 531 HE22 GLN 68 2HE2 GLN 68 -9.787 5.669 -6.349 532 H ARG 69 H ARG 69 -4.926 1.765 -6.072 533 HA ARG 69 HA ARG 69 -3.936 0.402 -3.671 534 HB2 ARG 69 2HB ARG 69 -3.465 -0.765 -6.355 535 HB3 ARG 69 3HB ARG 69 -3.923 -1.550 -4.849 536 HG2 ARG 69 2HG ARG 69 -5.751 0.037 -6.639 537 HG3 ARG 69 3HG ARG 69 -5.689 -1.722 -6.508 538 HD2 ARG 69 2HD ARG 69 -6.575 0.275 -4.443 539 HD3 ARG 69 3HD ARG 69 -7.510 -1.029 -5.173 540 HE ARG 69 HE ARG 69 -5.508 -2.345 -3.931 541 HH11 ARG 69 1HH1 ARG 69 -7.765 0.089 -2.880 542 HH12 ARG 69 2HH1 ARG 69 -7.801 -0.468 -1.239 543 HH21 ARG 69 1HH2 ARG 69 -5.548 -3.087 -1.774 544 HH22 ARG 69 2HH2 ARG 69 -6.539 -2.273 -0.611 545 H PHE 70 H PHE 70 -2.910 2.119 -6.531 546 HA PHE 70 HA PHE 70 -0.095 1.621 -5.879 547 HB2 PHE 70 2HB PHE 70 -1.375 2.858 -8.324 548 HB3 PHE 70 3HB PHE 70 0.360 2.672 -8.093 549 HD1 PHE 70 HD1 PHE 70 -2.814 0.795 -8.409 550 HD2 PHE 70 HD2 PHE 70 1.435 0.657 -8.610 551 HE1 PHE 70 HE1 PHE 70 -2.936 -1.466 -9.372 552 HE2 PHE 70 HE2 PHE 70 1.320 -1.603 -9.574 553 HZ PHE 70 HZ PHE 70 -0.868 -2.668 -9.957 554 H GLU 71 H GLU 71 -2.543 3.983 -5.612 555 HA GLU 71 HA GLU 71 -0.534 6.044 -4.978 556 HB2 GLU 71 2HB GLU 71 -2.151 6.466 -6.914 557 HB3 GLU 71 3HB GLU 71 -3.409 6.594 -5.693 558 HG2 GLU 71 2HG GLU 71 -2.628 8.786 -6.298 559 HG3 GLU 71 3HG GLU 71 -2.173 8.430 -4.633 560 H SER 72 H SER 72 -3.513 4.473 -3.977 561 HA SER 72 HA SER 72 -4.559 4.311 -1.963 562 HB2 SER 72 2HB SER 72 -2.061 5.444 -0.703 563 HB3 SER 72 3HB SER 72 -3.240 4.346 0.015 564 HG SER 72 HG SER 72 -1.488 3.131 -0.598 565 H GLY 73 H GLY 73 -5.618 6.287 -3.132 566 HA2 GLY 73 2HA GLY 73 -6.784 7.993 -1.488 567 HA3 GLY 73 3HA GLY 73 -5.220 8.777 -1.653 568 H ALA 74 H ALA 74 -5.302 7.545 -4.520 569 HA ALA 74 HA ALA 74 -6.094 9.919 -5.829 570 HB1 ALA 74 1HB ALA 74 -5.996 8.273 -7.885 571 HB2 ALA 74 2HB ALA 74 -4.529 8.790 -7.053 572 HB3 ALA 74 3HB ALA 74 -5.231 7.210 -6.703 573 H ARG 75 H ARG 75 -7.611 9.571 -7.894 574 HA ARG 75 HA ARG 75 -10.238 9.183 -6.807 575 HB2 ARG 75 2HB ARG 75 -11.053 10.027 -8.877 576 HB3 ARG 75 3HB ARG 75 -9.608 10.952 -8.492 577 HG2 ARG 75 2HG ARG 75 -8.316 9.553 -10.041 578 HG3 ARG 75 3HG ARG 75 -9.790 8.672 -10.449 579 HD2 ARG 75 2HD ARG 75 -9.072 11.523 -11.040 580 HD3 ARG 75 3HD ARG 75 -9.563 10.252 -12.159 581 HE ARG 75 HE ARG 75 -11.286 11.956 -10.594 582 HH11 ARG 75 1HH1 ARG 75 -11.005 8.974 -12.369 583 HH12 ARG 75 2HH1 ARG 75 -12.707 8.838 -12.663 584 HH21 ARG 75 1HH2 ARG 75 -13.528 11.788 -10.975 585 HH22 ARG 75 2HH2 ARG 75 -14.141 10.439 -11.871 586 H VAL 76 H VAL 76 -11.819 8.050 -8.553 587 HA VAL 76 HA VAL 76 -10.858 5.283 -8.689 588 HB VAL 76 HB VAL 76 -13.115 4.568 -8.692 589 HG11 VAL 76 1HG1 VAL 76 -13.890 5.330 -6.614 590 HG12 VAL 76 2HG1 VAL 76 -12.141 5.556 -6.547 591 HG13 VAL 76 3HG1 VAL 76 -13.199 6.936 -6.847 592 HG21 VAL 76 3HG2 VAL 76 -13.604 7.210 -9.806 593 HG22 VAL 76 1HG2 VAL 76 -14.542 5.724 -9.961 594 HG23 VAL 76 2HG2 VAL 76 -14.771 6.770 -8.559 595 H LEU 77 H LEU 77 -12.558 4.215 -10.542 596 HA LEU 77 HA LEU 77 -11.570 5.434 -13.024 597 HB2 LEU 77 2HB LEU 77 -12.663 2.655 -12.651 598 HB3 LEU 77 3HB LEU 77 -11.785 3.284 -14.044 599 HG LEU 77 HG LEU 77 -10.692 2.625 -11.316 600 HD11 LEU 77 1HD1 LEU 77 -10.285 1.537 -14.087 601 HD12 LEU 77 2HD1 LEU 77 -10.834 0.686 -12.643 602 HD13 LEU 77 3HD1 LEU 77 -9.159 1.223 -12.766 603 HD21 LEU 77 3HD2 LEU 77 -9.609 4.360 -13.475 604 HD22 LEU 77 1HD2 LEU 77 -8.496 3.299 -12.612 605 HD23 LEU 77 2HD2 LEU 77 -9.442 4.494 -11.724 606 H THR 78 H THR 78 -12.927 6.178 -14.545 607 HA THR 78 HA THR 78 -15.710 6.450 -13.906 608 HB THR 78 HB THR 78 -14.470 8.254 -15.045 609 HG1 THR 78 HG1 THR 78 -16.715 8.190 -15.339 610 HG21 THR 78 3HG2 THR 78 -14.586 7.225 -17.722 611 HG22 THR 78 1HG2 THR 78 -13.596 6.167 -16.718 612 HG23 THR 78 2HG2 THR 78 -13.207 7.883 -16.843 613 H ALA 79 H ALA 79 -17.241 6.161 -15.963 614 HA ALA 79 HA ALA 79 -17.554 3.375 -16.301 615 HB1 ALA 79 1HB ALA 79 -19.518 4.658 -16.365 616 HB2 ALA 79 2HB ALA 79 -18.867 5.750 -17.588 617 HB3 ALA 79 3HB ALA 79 -19.290 4.093 -18.020 618 H SER 80 H SER 80 -15.544 5.582 -17.873 619 HA SER 80 HA SER 80 -15.407 3.969 -20.320 620 HB2 SER 80 2HB SER 80 -15.628 6.354 -20.706 621 HB3 SER 80 3HB SER 80 -14.246 6.687 -19.662 622 HG SER 80 HG SER 80 -13.755 6.676 -21.940 623 H GLU 81 H GLU 81 -13.898 4.314 -17.344 624 HA GLU 81 HA GLU 81 -11.286 3.433 -18.330 625 HB2 GLU 81 2HB GLU 81 -12.229 4.378 -15.625 626 HB3 GLU 81 3HB GLU 81 -10.630 3.699 -15.894 627 HG2 GLU 81 2HG GLU 81 -11.684 6.085 -17.385 628 HG3 GLU 81 3HG GLU 81 -10.761 6.200 -15.888 629 H THR 82 H THR 82 -13.534 2.516 -15.714 630 HA THR 82 HA THR 82 -12.422 0.047 -15.118 631 HB THR 82 HB THR 82 -15.149 -0.347 -14.745 632 HG1 THR 82 HG1 THR 82 -15.677 1.747 -15.318 633 HG21 THR 82 3HG2 THR 82 -12.849 -0.160 -13.218 634 HG22 THR 82 1HG2 THR 82 -14.460 -0.563 -12.626 635 HG23 THR 82 2HG2 THR 82 -13.888 1.105 -12.562 636 H LYS 83 H LYS 83 -15.040 0.799 -17.405 637 HA LYS 83 HA LYS 83 -15.699 -1.731 -18.251 638 HB2 LYS 83 2HB LYS 83 -15.741 0.959 -19.511 639 HB3 LYS 83 3HB LYS 83 -15.927 -0.423 -20.583 640 HG2 LYS 83 2HG LYS 83 -17.796 -1.205 -19.123 641 HG3 LYS 83 3HG LYS 83 -17.668 0.321 -18.245 642 HD2 LYS 83 2HD LYS 83 -18.263 1.577 -20.172 643 HD3 LYS 83 3HD LYS 83 -18.091 0.169 -21.223 644 HE2 LYS 83 2HE LYS 83 -20.001 -0.886 -20.178 645 HE3 LYS 83 3HE LYS 83 -20.136 0.438 -19.022 646 HZ1 LYS 83 3HZ LYS 83 -20.907 0.341 -21.833 647 HZ2 LYS 83 1HZ LYS 83 -20.285 1.808 -21.263 648 HZ3 LYS 83 2HZ LYS 83 -21.651 1.128 -20.533 649 H THR 84 H THR 84 -13.160 0.365 -19.607 650 HA THR 84 HA THR 84 -12.216 -1.294 -21.598 651 HB THR 84 HB THR 84 -10.468 0.438 -19.842 652 HG1 THR 84 HG1 THR 84 -11.826 1.918 -20.586 653 HG21 THR 84 3HG2 THR 84 -9.529 -1.233 -21.625 654 HG22 THR 84 1HG2 THR 84 -8.896 0.410 -21.535 655 HG23 THR 84 2HG2 THR 84 -10.081 -0.012 -22.771 656 H PHE 85 H PHE 85 -11.064 -1.134 -18.228 657 HA PHE 85 HA PHE 85 -9.165 -3.161 -18.387 658 HB2 PHE 85 2HB PHE 85 -9.658 -1.509 -16.464 659 HB3 PHE 85 3HB PHE 85 -10.829 -2.707 -15.921 660 HD1 PHE 85 HD2 PHE 85 -10.059 -4.965 -15.251 661 HD2 PHE 85 HD1 PHE 85 -7.337 -1.813 -16.133 662 HE1 PHE 85 HE2 PHE 85 -8.267 -6.192 -14.094 663 HE2 PHE 85 HE1 PHE 85 -5.541 -3.036 -14.979 664 HZ PHE 85 HZ PHE 85 -6.005 -5.228 -13.957 665 H LEU 86 H LEU 86 -12.614 -3.349 -17.595 666 HA LEU 86 HA LEU 86 -12.633 -6.138 -17.084 667 HB2 LEU 86 2HB LEU 86 -14.357 -4.523 -16.310 668 HB3 LEU 86 3HB LEU 86 -14.923 -4.393 -17.973 669 HG LEU 86 HG LEU 86 -15.228 -6.987 -17.751 670 HD11 LEU 86 1HD1 LEU 86 -15.176 -6.048 -14.895 671 HD12 LEU 86 2HD1 LEU 86 -14.246 -7.354 -15.629 672 HD13 LEU 86 3HD1 LEU 86 -15.988 -7.526 -15.413 673 HD21 LEU 86 3HD2 LEU 86 -17.237 -6.072 -18.133 674 HD22 LEU 86 1HD2 LEU 86 -16.922 -4.699 -17.072 675 HD23 LEU 86 2HD2 LEU 86 -17.469 -6.231 -16.391 676 H ALA 87 H ALA 87 -12.443 -4.333 -19.955 677 HA ALA 87 HA ALA 87 -13.534 -6.487 -21.604 678 HB1 ALA 87 1HB ALA 87 -14.298 -4.628 -22.623 679 HB2 ALA 87 2HB ALA 87 -12.994 -3.618 -21.998 680 HB3 ALA 87 3HB ALA 87 -12.713 -4.653 -23.398 681 H ALA 88 H ALA 88 -10.557 -5.350 -20.410 682 HA ALA 88 HA ALA 88 -9.032 -6.676 -22.536 683 HB1 ALA 88 1HB ALA 88 -8.080 -4.598 -22.184 684 HB2 ALA 88 2HB ALA 88 -8.327 -4.664 -20.439 685 HB3 ALA 88 3HB ALA 88 -7.070 -5.647 -21.189 686 H ALA 89 H ALA 89 -10.164 -7.151 -19.357 687 HA ALA 89 HA ALA 89 -8.372 -9.472 -19.053 688 HB1 ALA 89 1HB ALA 89 -9.183 -7.407 -17.064 689 HB2 ALA 89 2HB ALA 89 -8.894 -9.058 -16.515 690 HB3 ALA 89 3HB ALA 89 -7.611 -8.163 -17.330 691 H ASP 90 H ASP 90 -11.560 -8.102 -18.365 692 HA ASP 90 HA ASP 90 -12.586 -10.807 -17.861 693 HB2 ASP 90 2HB ASP 90 -13.139 -9.304 -16.081 694 HB3 ASP 90 3HB ASP 90 -13.704 -8.077 -17.211 695 H HIS 91 H HIS 91 -11.951 -9.646 -20.518 696 HA HIS 91 HA HIS 91 -14.127 -8.803 -21.971 697 HB2 HIS 91 2HB HIS 91 -11.638 -9.301 -22.667 698 HB3 HIS 91 3HB HIS 91 -12.304 -10.851 -23.173 699 HD1 HIS 91 HD1 HIS 91 -11.177 -9.174 -25.355 700 HD2 HIS 91 HD2 HIS 91 -15.115 -8.791 -24.089 701 HE1 HIS 91 HE1 HIS 91 -12.404 -8.128 -27.284 702 H ASP 92 H ASP 92 -13.746 -11.766 -20.376 703 HA ASP 92 HA ASP 92 -15.251 -13.478 -22.035 704 HB2 ASP 92 2HB ASP 92 -15.689 -14.283 -19.377 705 HB3 ASP 92 3HB ASP 92 -14.482 -14.908 -20.497 706 H GLY 93 H GLY 93 -16.156 -11.016 -19.749 707 HA2 GLY 93 2HA GLY 93 -18.257 -9.957 -19.709 708 HA3 GLY 93 3HA GLY 93 -18.942 -11.334 -20.559 709 H ASP 94 H ASP 94 -17.042 -11.226 -17.563 710 HA ASP 94 HA ASP 94 -19.232 -12.665 -16.234 711 HB2 ASP 94 2HB ASP 94 -16.402 -12.373 -15.226 712 HB3 ASP 94 3HB ASP 94 -17.620 -13.538 -14.713 713 H GLY 95 H GLY 95 -17.350 -9.745 -16.161 714 HA2 GLY 95 2HA GLY 95 -17.990 -7.747 -15.122 715 HA3 GLY 95 3HA GLY 95 -19.161 -8.645 -14.168 716 H LYS 96 H LYS 96 -16.042 -10.012 -14.234 717 HA LYS 96 HA LYS 96 -14.989 -8.538 -11.997 718 HB2 LYS 96 2HB LYS 96 -14.928 -10.486 -10.466 719 HB3 LYS 96 3HB LYS 96 -16.563 -9.930 -10.799 720 HG2 LYS 96 2HG LYS 96 -15.626 -12.020 -12.615 721 HG3 LYS 96 3HG LYS 96 -15.723 -12.516 -10.924 722 HD2 LYS 96 2HD LYS 96 -18.028 -10.975 -11.896 723 HD3 LYS 96 3HD LYS 96 -17.810 -12.549 -12.665 724 HE2 LYS 96 2HE LYS 96 -18.425 -13.655 -10.818 725 HE3 LYS 96 3HE LYS 96 -17.464 -12.615 -9.768 726 HZ1 LYS 96 3HZ LYS 96 -20.268 -12.500 -10.389 727 HZ2 LYS 96 1HZ LYS 96 -19.496 -11.002 -10.536 728 HZ3 LYS 96 2HZ LYS 96 -19.424 -11.850 -9.075 729 H ILE 97 H ILE 97 -12.820 -8.671 -11.948 730 HA ILE 97 HA ILE 97 -11.478 -10.149 -13.999 731 HB ILE 97 HB ILE 97 -10.311 -8.564 -11.708 732 HG12 ILE 97 2HG1 ILE 97 -11.732 -7.202 -13.177 733 HG13 ILE 97 3HG1 ILE 97 -10.035 -6.772 -13.363 734 HG21 ILE 97 1HG2 ILE 97 -9.122 -10.128 -13.880 735 HG22 ILE 97 2HG2 ILE 97 -8.485 -8.492 -13.725 736 HG23 ILE 97 3HG2 ILE 97 -8.426 -9.596 -12.350 737 HD11 ILE 97 3HD1 ILE 97 -11.926 -7.784 -15.310 738 HD12 ILE 97 1HD1 ILE 97 -10.386 -6.956 -15.546 739 HD13 ILE 97 2HD1 ILE 97 -10.419 -8.701 -15.288 740 H GLY 98 H GLY 98 -10.020 -11.846 -13.787 741 HA2 GLY 98 2HA GLY 98 -10.047 -13.215 -11.168 742 HA3 GLY 98 3HA GLY 98 -10.252 -14.088 -12.680 743 H ALA 99 H ALA 99 -8.250 -14.608 -10.726 744 HA ALA 99 HA ALA 99 -5.759 -13.464 -11.451 745 HB1 ALA 99 1HB ALA 99 -6.359 -16.059 -10.038 746 HB2 ALA 99 2HB ALA 99 -4.773 -15.294 -10.139 747 HB3 ALA 99 3HB ALA 99 -6.086 -14.490 -9.279 748 H GLU 100 H GLU 100 -7.748 -15.518 -13.140 749 HA GLU 100 HA GLU 100 -5.536 -16.886 -14.498 750 HB2 GLU 100 2HB GLU 100 -7.289 -18.375 -13.792 751 HB3 GLU 100 3HB GLU 100 -8.517 -17.362 -14.538 752 HG2 GLU 100 2HG GLU 100 -7.703 -17.909 -16.735 753 HG3 GLU 100 3HG GLU 100 -6.357 -18.815 -16.047 754 H GLU 101 H GLU 101 -7.909 -14.411 -14.897 755 HA GLU 101 HA GLU 101 -7.243 -14.201 -17.758 756 HB2 GLU 101 2HB GLU 101 -9.316 -12.998 -18.061 757 HB3 GLU 101 3HB GLU 101 -9.646 -14.514 -17.235 758 HG2 GLU 101 2HG GLU 101 -9.606 -13.213 -15.079 759 HG3 GLU 101 3HG GLU 101 -9.585 -11.751 -16.063 760 H PHE 102 H PHE 102 -6.353 -12.971 -14.877 761 HA PHE 102 HA PHE 102 -6.344 -10.166 -15.459 762 HB2 PHE 102 2HB PHE 102 -6.371 -10.957 -13.146 763 HB3 PHE 102 3HB PHE 102 -4.819 -11.753 -13.383 764 HD1 PHE 102 HD1 PHE 102 -2.770 -10.428 -13.631 765 HD2 PHE 102 HD2 PHE 102 -6.520 -8.609 -12.766 766 HE1 PHE 102 HE1 PHE 102 -1.609 -8.374 -12.933 767 HE2 PHE 102 HE2 PHE 102 -5.365 -6.553 -12.066 768 HZ PHE 102 HZ PHE 102 -2.906 -6.433 -12.150 769 H GLN 103 H GLN 103 -3.604 -12.388 -14.928 770 HA GLN 103 HA GLN 103 -1.618 -10.798 -15.983 771 HB2 GLN 103 2HB GLN 103 -0.343 -12.879 -16.352 772 HB3 GLN 103 3HB GLN 103 -1.122 -12.843 -14.775 773 HG2 GLN 103 2HG GLN 103 -2.994 -14.073 -16.374 774 HG3 GLN 103 3HG GLN 103 -1.461 -14.696 -16.983 775 HE21 GLN 103 1HE2 GLN 103 -2.511 -13.780 -13.727 776 HE22 GLN 103 2HE2 GLN 103 -2.191 -15.315 -13.003 777 H GLU 104 H GLU 104 -3.889 -12.886 -17.662 778 HA GLU 104 HA GLU 104 -2.704 -12.967 -20.178 779 HB2 GLU 104 2HB GLU 104 -5.678 -12.751 -19.737 780 HB3 GLU 104 3HB GLU 104 -4.834 -13.583 -21.035 781 HG2 GLU 104 2HG GLU 104 -4.999 -14.387 -18.145 782 HG3 GLU 104 3HG GLU 104 -5.677 -15.224 -19.540 783 H MET 105 H MET 105 -4.385 -10.391 -18.567 784 HA MET 105 HA MET 105 -4.697 -8.823 -20.984 785 HB2 MET 105 2HB MET 105 -5.973 -7.363 -19.734 786 HB3 MET 105 3HB MET 105 -6.232 -8.867 -18.861 787 HG2 MET 105 2HG MET 105 -5.693 -7.682 -17.055 788 HG3 MET 105 3HG MET 105 -4.032 -7.882 -17.606 789 HE1 MET 105 3HE MET 105 -6.649 -4.722 -19.216 790 HE2 MET 105 1HE MET 105 -7.171 -6.081 -18.221 791 HE3 MET 105 2HE MET 105 -6.844 -4.517 -17.475 792 H VAL 106 H VAL 106 -2.323 -9.329 -18.592 793 HA VAL 106 HA VAL 106 -1.071 -6.744 -18.802 794 HB VAL 106 HB VAL 106 0.152 -9.269 -17.695 795 HG11 VAL 106 1HG1 VAL 106 1.052 -6.566 -17.979 796 HG12 VAL 106 2HG1 VAL 106 0.924 -6.972 -16.267 797 HG13 VAL 106 3HG1 VAL 106 1.913 -7.965 -17.338 798 HG21 VAL 106 3HG2 VAL 106 -2.190 -8.242 -16.793 799 HG22 VAL 106 1HG2 VAL 106 -1.024 -9.099 -15.784 800 HG23 VAL 106 2HG2 VAL 106 -1.030 -7.336 -15.822 801 H GLN 107 H GLN 107 0.478 -9.890 -19.334 802 HA GLN 107 HA GLN 107 2.331 -8.857 -21.197 803 HB2 GLN 107 2HB GLN 107 1.522 -11.744 -20.820 804 HB3 GLN 107 3HB GLN 107 3.016 -11.156 -21.540 805 HG2 GLN 107 2HG GLN 107 3.999 -10.941 -19.562 806 HG3 GLN 107 3HG GLN 107 2.608 -10.106 -18.872 807 HE21 GLN 107 1HE2 GLN 107 0.729 -11.552 -18.351 808 HE22 GLN 107 2HE2 GLN 107 1.092 -13.081 -17.636 809 H SER 108 H SER 108 -0.779 -10.448 -21.547 810 HA SER 108 HA SER 108 -0.570 -10.112 -24.468 811 HB2 SER 108 2HB SER 108 -0.854 -12.426 -24.055 812 HB3 SER 108 3HB SER 108 -2.063 -12.138 -22.804 813 HG SER 108 HG SER 108 -3.354 -12.553 -24.439
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