NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
282745 | 2kou | 16534 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 ILE 1 H ILE 1 35.724 -11.039 -1.186 2 HA ILE 1 HA ILE 1 34.856 -10.576 1.557 3 HB ILE 1 HB ILE 1 32.461 -10.514 0.387 4 HG13 ILE 1 2HG1 ILE 1 33.808 -10.471 -1.880 5 HG21 ILE 1 1HG2 ILE 1 32.381 -8.183 0.885 6 HG22 ILE 1 2HG2 ILE 1 33.465 -8.950 2.070 7 HG23 ILE 1 3HG2 ILE 1 34.146 -8.022 0.713 8 HD11 ILE 1 3HD1 ILE 1 31.942 -9.313 -2.916 9 HD12 ILE 1 1HD1 ILE 1 31.301 -10.237 -1.536 10 HD13 ILE 1 2HD1 ILE 1 31.549 -8.481 -1.392 11 H SER 2 H SER 2 35.068 -12.606 2.361 12 HA SER 2 HA SER 2 34.290 -14.785 0.613 13 HB3 SER 2 2HB SER 2 35.380 -15.460 3.283 14 HG SER 2 HG SER 2 36.284 -17.040 2.128 15 H GLY 3 H GLY 3 32.046 -14.988 0.743 16 HA2 GLY 3 1HA GLY 3 30.870 -15.071 3.453 17 HA3 GLY 3 2HA GLY 3 30.025 -14.617 1.986 18 H GLY 4 H GLY 4 28.596 -16.427 3.122 19 HA2 GLY 4 1HA GLY 4 28.350 -18.580 1.488 20 HA3 GLY 4 2HA GLY 4 29.488 -19.134 2.700 21 H SER 5 H SER 5 28.843 -18.860 5.060 22 HA SER 5 HA SER 5 26.365 -20.004 5.450 23 HB3 SER 5 2HB SER 5 26.900 -19.075 7.928 24 HG SER 5 HG SER 5 28.189 -20.932 8.231 25 H SER 6 H SER 6 27.453 -16.615 5.359 26 HA SER 6 HA SER 6 25.259 -15.520 6.670 27 HB3 SER 6 2HB SER 6 25.979 -13.431 5.241 28 HG SER 6 HG SER 6 28.082 -13.380 6.505 29 H ILE 7 H ILE 7 25.842 -16.617 3.332 30 HA ILE 7 HA ILE 7 23.645 -15.272 2.175 31 HB ILE 7 HB ILE 7 25.209 -17.705 1.310 32 HG13 ILE 7 2HG1 ILE 7 26.820 -16.137 1.134 33 HG21 ILE 7 1HG2 ILE 7 24.253 -17.488 -0.853 34 HG22 ILE 7 2HG2 ILE 7 22.905 -17.514 0.308 35 HG23 ILE 7 3HG2 ILE 7 23.427 -15.973 -0.413 36 HD11 ILE 7 3HD1 ILE 7 26.854 -15.009 -1.029 37 HD12 ILE 7 1HD1 ILE 7 26.099 -16.606 -1.243 38 HD13 ILE 7 2HD1 ILE 7 25.085 -15.145 -1.173 39 H SER 8 H SER 8 24.135 -18.587 3.535 40 HA SER 8 HA SER 8 21.843 -19.757 2.884 41 HB3 SER 8 2HB SER 8 22.936 -19.828 5.726 42 HG SER 8 HG SER 8 21.271 -21.469 4.146 43 H MET 9 H MET 9 22.292 -17.054 5.153 44 HA MET 9 HA MET 9 19.645 -17.307 6.196 45 HB3 MET 9 2HB MET 9 20.495 -14.826 6.998 46 HG3 MET 9 2HG MET 9 21.842 -16.129 8.839 47 HE1 MET 9 3HE MET 9 20.804 -17.506 10.644 48 HE2 MET 9 1HE MET 9 20.206 -15.937 11.235 49 HE3 MET 9 2HE MET 9 19.110 -17.339 11.167 50 H MET 10 H MET 10 21.420 -15.232 3.846 51 HA MET 10 HA MET 10 19.235 -13.502 3.450 52 HB3 MET 10 2HB MET 10 20.730 -13.104 1.230 53 HG3 MET 10 2HG MET 10 20.725 -12.032 3.853 54 HE1 MET 10 3HE MET 10 22.705 -10.094 3.806 55 HE2 MET 10 1HE MET 10 23.780 -10.635 5.117 56 HE3 MET 10 2HE MET 10 24.405 -10.492 3.456 57 H TYR 11 H TYR 11 20.453 -16.479 1.849 58 HA TYR 11 HA TYR 11 18.800 -16.328 -0.414 59 HB3 TYR 11 2HB TYR 11 19.251 -19.018 0.074 60 HD1 TYR 11 2HD TYR 11 20.877 -15.827 -0.740 61 HD2 TYR 11 1HD TYR 11 21.037 -20.074 -1.236 62 HE1 TYR 11 2HE TYR 11 22.534 -15.549 -2.648 63 HE2 TYR 11 1HE TYR 11 22.694 -19.782 -3.142 64 HH TYR 11 HH TYR 11 24.496 -17.549 -3.634 65 H LYS 12 H LYS 12 18.329 -17.657 2.891 66 HA LYS 12 HA LYS 12 16.097 -19.185 2.455 67 HB3 LYS 12 2HB LYS 12 15.823 -17.782 4.943 68 HG3 LYS 12 2HG LYS 12 16.347 -20.503 3.885 69 HD3 LYS 12 2HD LYS 12 18.293 -19.813 5.604 70 HE3 LYS 12 2HE LYS 12 16.621 -19.043 7.343 71 HZ1 LYS 12 2HZ LYS 12 15.403 -21.470 6.736 72 HZ3 LYS 12 1HZ LYS 12 14.943 -20.412 7.886 73 H TYR 13 H TYR 13 16.414 -15.623 2.754 74 HA TYR 13 HA TYR 13 13.669 -15.079 2.916 75 HB3 TYR 13 2HB TYR 13 15.587 -13.279 1.420 76 HD1 TYR 13 2HD TYR 13 13.272 -12.166 1.179 77 HD2 TYR 13 1HD TYR 13 15.277 -12.628 4.931 78 HE1 TYR 13 2HE TYR 13 11.827 -10.332 2.187 79 HE2 TYR 13 1HE TYR 13 13.825 -10.794 5.925 80 HH TYR 13 HH TYR 13 12.047 -9.548 5.625 81 H CYS 14 H CYS 14 15.920 -15.506 0.135 82 HA CYS 14 HA CYS 14 13.990 -14.692 -1.769 83 HB3 CYS 14 2HB CYS 14 16.455 -16.376 -2.292 84 HG CYS 14 HG CYS 14 14.529 -16.193 -4.187 85 H SER 15 H SER 15 14.926 -17.700 -0.111 86 HA SER 15 HA SER 15 13.907 -19.545 -1.837 87 HB3 SER 15 2HB SER 15 13.719 -19.681 1.203 88 HG SER 15 HG SER 15 14.046 -21.678 -0.870 89 H ARG 16 H ARG 16 12.262 -17.075 -0.045 90 HA ARG 16 HA ARG 16 9.843 -18.404 0.359 91 HB3 ARG 16 2HB ARG 16 9.014 -15.858 0.337 92 HG3 ARG 16 2HG ARG 16 11.023 -17.007 2.328 93 HD3 ARG 16 2HD ARG 16 9.049 -15.098 3.368 94 HE ARG 16 HE ARG 16 11.951 -15.611 3.662 95 HH11 ARG 16 2HH2 ARG 16 9.144 -13.718 4.707 96 HH12 ARG 16 1HH2 ARG 16 9.884 -13.205 6.186 97 HH22 ARG 16 1HH ARG 16 12.109 -13.932 6.699 98 H LEU 17 H LEU 17 11.413 -17.652 -2.501 99 HA LEU 17 HA LEU 17 9.446 -16.471 -4.073 100 HB3 LEU 17 2HB LEU 17 10.995 -18.294 -5.619 101 HG LEU 17 HG LEU 17 10.357 -15.643 -5.805 102 HD11 LEU 17 1HD1 LEU 17 12.432 -15.470 -4.098 103 HD12 LEU 17 2HD1 LEU 17 13.309 -15.409 -5.645 104 HD13 LEU 17 3HD1 LEU 17 12.034 -14.217 -5.299 105 HD21 LEU 17 3HD2 LEU 17 12.730 -16.511 -7.370 106 HD22 LEU 17 1HD2 LEU 17 11.278 -17.536 -7.465 107 HD23 LEU 17 2HD2 LEU 17 11.183 -15.814 -7.907 108 HA PRO 18 HA PRO 18 6.633 -19.649 -4.853 109 HB3 PRO 18 2HB PRO 18 5.277 -18.285 -6.118 110 HG3 PRO 18 2HG PRO 18 6.355 -16.499 -7.103 111 HD3 PRO 18 2HD PRO 18 8.154 -16.279 -5.689 112 H HIS 19 H HIS 19 8.901 -19.426 -7.547 113 HA HIS 19 HA HIS 19 8.562 -21.966 -8.492 114 HB3 HIS 19 2HB HIS 19 11.352 -21.009 -8.470 115 HD1 HIS 19 1HD HIS 19 10.516 -23.613 -9.658 116 HD2 HIS 19 2HD HIS 19 10.138 -20.002 -11.760 117 HE1 HIS 19 1HE HIS 19 10.426 -24.232 -12.133 118 H ASP 20 H ASP 20 9.886 -20.915 -5.444 119 HA ASP 20 HA ASP 20 11.515 -23.184 -5.045 120 HB3 ASP 20 2HB ASP 20 10.283 -21.304 -2.977 121 HD2 ASP 20 HD ASP 20 11.828 -22.685 -0.525 122 H GLU 21 H GLU 21 10.853 -25.211 -4.271 123 HA GLU 21 HA GLU 21 8.065 -25.598 -3.878 124 HB3 GLU 21 2HB GLU 21 9.388 -27.275 -5.082 125 HG3 GLU 21 2HG GLU 21 10.834 -28.726 -3.276 126 HE2 GLU 21 HE GLU 21 13.042 -26.805 -3.210 127 H PHE 22 H PHE 22 10.818 -24.862 -1.885 128 HA PHE 22 HA PHE 22 9.541 -25.953 0.491 129 HB3 PHE 22 2HB PHE 22 11.957 -24.371 0.924 130 HD1 PHE 22 2HD PHE 22 12.076 -27.837 -0.320 131 HD2 PHE 22 1HD PHE 22 11.906 -25.337 3.104 132 HE1 PHE 22 2HE PHE 22 12.614 -29.805 1.143 133 HE2 PHE 22 1HE PHE 22 12.443 -27.304 4.568 134 HZ PHE 22 HZ PHE 22 12.790 -29.515 3.570 135 H PHE 23 H PHE 23 8.938 -23.336 -1.321 136 HA PHE 23 HA PHE 23 9.191 -21.287 0.672 137 HB3 PHE 23 2HB PHE 23 8.497 -21.670 -2.187 138 HD1 PHE 23 1HD PHE 23 7.607 -18.757 -0.038 139 HD2 PHE 23 2HD PHE 23 6.337 -21.503 -3.014 140 HE1 PHE 23 1HE PHE 23 5.456 -17.487 -0.294 141 HE2 PHE 23 2HE PHE 23 4.187 -20.233 -3.269 142 HZ PHE 23 HZ PHE 23 3.773 -18.240 -1.906 143 H GLN 24 H GLN 24 7.686 -20.683 2.172 144 HA GLN 24 HA GLN 24 5.214 -22.171 2.136 145 HB3 GLN 24 2HB GLN 24 5.037 -20.863 4.458 146 HG3 GLN 24 2HG GLN 24 7.162 -22.722 4.941 147 HE21 GLN 24 1HE2 GLN 24 6.512 -23.270 6.867 148 HE22 GLN 24 2HE2 GLN 24 4.907 -23.701 7.356 149 HA PRO 25 HA PRO 25 2.833 -18.742 0.953 150 HB3 PRO 25 2HB PRO 25 0.965 -20.044 0.614 151 HG3 PRO 25 2HG PRO 25 0.943 -22.025 1.796 152 HD3 PRO 25 2HD PRO 25 3.199 -22.329 2.122 153 H LYS 26 H LYS 26 3.036 -16.662 1.456 154 HA LYS 26 HA LYS 26 1.815 -15.456 3.524 155 HB3 LYS 26 2HB LYS 26 4.227 -15.322 4.917 156 HG3 LYS 26 2HG LYS 26 1.561 -16.702 5.329 157 HD3 LYS 26 2HD LYS 26 2.495 -16.874 7.807 158 HE3 LYS 26 2HE LYS 26 3.484 -18.932 5.788 159 HZ1 LYS 26 2HZ LYS 26 2.389 -20.238 7.814 160 HZ3 LYS 26 1HZ LYS 26 2.830 -18.902 8.633 161 HA PRO 27 HA PRO 27 5.420 -12.904 1.853 162 HB3 PRO 27 2HB PRO 27 7.532 -13.793 2.077 163 HG3 PRO 27 2HG PRO 27 7.592 -16.087 2.310 164 HD3 PRO 27 2HD PRO 27 5.484 -16.467 3.144 165 H GLU 28 H GLU 28 6.038 -11.821 -0.244 166 HA GLU 28 HA GLU 28 4.496 -13.001 -2.394 167 HB3 GLU 28 2HB GLU 28 4.075 -10.137 -2.416 168 HG3 GLU 28 2HG GLU 28 1.622 -11.095 -2.026 169 HE2 GLU 28 HE GLU 28 1.568 -10.404 -5.376 170 H PHE 29 H PHE 29 5.175 -12.290 -4.533 171 HA PHE 29 HA PHE 29 7.597 -10.651 -4.528 172 HB3 PHE 29 2HB PHE 29 7.770 -13.337 -4.625 173 HD1 PHE 29 2HD PHE 29 5.314 -13.752 -5.748 174 HD2 PHE 29 1HD PHE 29 8.938 -13.066 -7.847 175 HE1 PHE 29 2HE PHE 29 4.367 -14.914 -7.762 176 HE2 PHE 29 1HE PHE 29 7.991 -14.230 -9.861 177 HZ PHE 29 HZ PHE 29 5.717 -15.139 -9.794 178 H GLN 30 H GLN 30 7.680 -9.165 -6.183 179 HA GLN 30 HA GLN 30 5.994 -9.635 -8.475 180 HB3 GLN 30 2HB GLN 30 5.610 -6.883 -7.841 181 HG3 GLN 30 2HG GLN 30 3.202 -7.801 -7.379 182 HE21 GLN 30 1HE2 GLN 30 2.735 -6.335 -8.901 183 HE22 GLN 30 2HE2 GLN 30 2.952 -6.550 -10.606 184 H PHE 31 H PHE 31 6.949 -8.900 -10.367 185 HA PHE 31 HA PHE 31 9.354 -7.256 -9.994 186 HB3 PHE 31 2HB PHE 31 10.181 -8.509 -12.011 187 HD1 PHE 31 1HD PHE 31 10.348 -8.767 -8.948 188 HD2 PHE 31 2HD PHE 31 9.415 -11.546 -12.018 189 HE1 PHE 31 1HE PHE 31 11.166 -10.645 -7.497 190 HE2 PHE 31 2HE PHE 31 10.232 -13.424 -10.567 191 HZ PHE 31 HZ PHE 31 11.098 -12.951 -8.324 192 H LYS 32 H LYS 32 9.617 -5.437 -11.285 193 HA LYS 32 HA LYS 32 7.451 -4.956 -13.212 194 HB3 LYS 32 2HB LYS 32 8.537 -3.266 -11.014 195 HG3 LYS 32 2HG LYS 32 9.099 -2.136 -13.291 196 HD3 LYS 32 2HD LYS 32 7.013 -2.770 -14.477 197 HE3 LYS 32 2HE LYS 32 5.794 -1.800 -12.013 198 HZ1 LYS 32 2HZ LYS 32 4.864 -0.560 -14.547 199 HZ3 LYS 32 1HZ LYS 32 5.378 0.234 -13.221 200 HA PRO 33 HA PRO 33 10.998 -4.820 -15.797 201 HB3 PRO 33 2HB PRO 33 10.194 -6.455 -17.205 202 HG3 PRO 33 2HG PRO 33 7.954 -6.938 -16.941 203 HD3 PRO 33 2HD PRO 33 7.643 -6.255 -14.769 204 H VAL 34 H VAL 34 12.161 -3.083 -16.317 205 HA VAL 34 HA VAL 34 10.622 -0.905 -17.523 206 HB VAL 34 HB VAL 34 12.666 -0.538 -15.328 207 HG11 VAL 34 1HG1 VAL 34 10.871 1.330 -16.882 208 HG12 VAL 34 2HG1 VAL 34 11.509 1.767 -15.279 209 HG13 VAL 34 3HG1 VAL 34 12.630 1.422 -16.619 210 HG21 VAL 34 3HG2 VAL 34 9.634 -0.479 -15.155 211 HG22 VAL 34 1HG2 VAL 34 10.725 -1.652 -14.379 212 HG23 VAL 34 2HG2 VAL 34 10.747 0.054 -13.871 213 H ASP 35 H ASP 35 12.214 0.778 -18.494 214 HA ASP 35 HA ASP 35 13.811 -0.586 -20.291 215 HB3 ASP 35 2HB ASP 35 14.803 1.955 -20.433 216 HD2 ASP 35 HD ASP 35 14.225 0.396 -22.289 217 H GLU 36 H GLU 36 16.280 0.012 -20.594 218 HA GLU 36 HA GLU 36 17.644 -0.857 -18.347 219 HB3 GLU 36 2HB GLU 36 18.373 -1.070 -20.765 220 HG3 GLU 36 2HG GLU 36 18.368 1.835 -20.532 221 HE2 GLU 36 HE GLU 36 21.418 -0.140 -21.538 222 H PHE 37 H PHE 37 16.329 2.217 -19.077 223 HA PHE 37 HA PHE 37 18.321 3.863 -17.951 224 HB3 PHE 37 2HB PHE 37 15.958 5.231 -17.648 225 HD1 PHE 37 2HD PHE 37 16.947 3.538 -20.829 226 HD2 PHE 37 1HD PHE 37 16.732 7.164 -18.635 227 HE1 PHE 37 2HE PHE 37 17.806 4.796 -22.825 228 HE2 PHE 37 1HE PHE 37 17.591 8.422 -20.630 229 HZ PHE 37 HZ PHE 37 18.118 7.223 -22.701 230 H GLY 38 H GLY 38 16.408 1.473 -16.524 231 HA2 GLY 38 1HA GLY 38 17.061 2.376 -13.880 232 HA3 GLY 38 2HA GLY 38 15.348 2.502 -14.227 233 H GLY 39 H GLY 39 17.555 0.043 -15.644 234 HA2 GLY 39 1HA GLY 39 17.248 -2.210 -15.740 235 HA3 GLY 39 2HA GLY 39 17.483 -2.054 -14.011 236 H THR 40 H THR 40 15.978 -3.181 -12.868 237 HA THR 40 HA THR 40 13.194 -3.019 -13.808 238 HB THR 40 HB THR 40 14.669 -5.479 -12.723 239 HG1 THR 40 1HG THR 40 14.449 -6.083 -14.992 240 HG21 THR 40 3HG2 THR 40 12.671 -6.672 -12.986 241 HG22 THR 40 1HG2 THR 40 12.001 -5.097 -12.493 242 HG23 THR 40 2HG2 THR 40 12.046 -5.545 -14.215 243 H ILE 41 H ILE 41 11.565 -3.138 -12.167 244 HA ILE 41 HA ILE 41 12.629 -2.222 -9.598 245 HB ILE 41 HB ILE 41 9.756 -1.965 -10.321 246 HG13 ILE 41 2HG1 ILE 41 10.334 0.216 -11.497 247 HG21 ILE 41 1HG2 ILE 41 9.741 -0.490 -8.651 248 HG22 ILE 41 2HG2 ILE 41 11.363 -1.097 -8.243 249 HG23 ILE 41 3HG2 ILE 41 11.187 0.350 -9.264 250 HD11 ILE 41 3HD1 ILE 41 12.513 0.759 -11.766 251 HD12 ILE 41 1HD1 ILE 41 12.999 -0.733 -10.926 252 HD13 ILE 41 2HD1 ILE 41 12.760 -0.741 -12.691 253 H CYS 42 H CYS 42 12.648 -3.628 -7.934 254 HA CYS 42 HA CYS 42 11.047 -6.033 -8.223 255 HB3 CYS 42 2HB CYS 42 13.254 -6.609 -7.707 256 HG CYS 42 HG CYS 42 12.964 -4.171 -5.486 257 H ARG 43 H ARG 43 9.184 -6.331 -7.022 258 HA ARG 43 HA ARG 43 8.788 -4.439 -4.844 259 HB3 ARG 43 2HB ARG 43 6.671 -5.636 -6.703 260 HG3 ARG 43 2HG ARG 43 6.300 -3.342 -4.746 261 HD3 ARG 43 2HD ARG 43 4.700 -4.347 -6.783 262 HE ARG 43 HE ARG 43 4.318 -6.117 -4.546 263 HH11 ARG 43 2HH2 ARG 43 2.461 -4.271 -6.933 264 HH12 ARG 43 1HH2 ARG 43 1.097 -5.337 -6.880 265 HH22 ARG 43 1HH ARG 43 1.154 -7.244 -5.429 266 H ILE 44 H ILE 44 8.971 -5.575 -2.931 267 HA ILE 44 HA ILE 44 7.740 -8.243 -2.872 268 HB ILE 44 HB ILE 44 10.410 -7.653 -2.568 269 HG13 ILE 44 2HG1 ILE 44 9.012 -9.847 -2.951 270 HG21 ILE 44 1HG2 ILE 44 11.044 -7.787 -0.317 271 HG22 ILE 44 2HG2 ILE 44 9.723 -6.595 -0.340 272 HG23 ILE 44 3HG2 ILE 44 9.411 -8.258 0.213 273 HD11 ILE 44 3HD1 ILE 44 11.475 -10.419 -1.359 274 HD12 ILE 44 1HD1 ILE 44 11.035 -10.940 -3.004 275 HD13 ILE 44 2HD1 ILE 44 11.678 -9.302 -2.731 276 H THR 45 H THR 45 6.308 -8.673 -1.212 277 HA THR 45 HA THR 45 6.100 -6.707 0.936 278 HB THR 45 HB THR 45 4.593 -5.976 -0.964 279 HG1 THR 45 1HG THR 45 2.658 -6.117 0.562 280 HG21 THR 45 3HG2 THR 45 2.521 -7.331 -1.328 281 HG22 THR 45 1HG2 THR 45 3.965 -8.223 -1.866 282 HG23 THR 45 2HG2 THR 45 3.197 -8.626 -0.311 283 H LEU 46 H LEU 46 5.831 -7.642 2.872 284 HA LEU 46 HA LEU 46 5.333 -10.513 2.843 285 HB3 LEU 46 2HB LEU 46 5.953 -10.010 5.384 286 HG LEU 46 HG LEU 46 8.139 -9.944 3.292 287 HD11 LEU 46 1HD1 LEU 46 8.378 -11.390 5.889 288 HD12 LEU 46 2HD1 LEU 46 9.612 -10.548 4.920 289 HD13 LEU 46 3HD1 LEU 46 8.465 -9.612 5.909 290 HD21 LEU 46 3HD2 LEU 46 6.850 -11.766 2.596 291 HD22 LEU 46 1HD2 LEU 46 8.102 -12.486 3.637 292 HD23 LEU 46 2HD2 LEU 46 6.453 -12.246 4.264 293 HA PRO 47 HA PRO 47 1.421 -10.135 4.628 294 HB3 PRO 47 2HB PRO 47 1.094 -12.413 4.685 295 HG3 PRO 47 2HG PRO 47 3.031 -13.662 4.783 296 HD3 PRO 47 2HD PRO 47 4.522 -12.175 3.860 297 H ALA 48 H ALA 48 0.007 -9.678 6.499 298 HA ALA 48 HA ALA 48 1.122 -7.670 8.017 299 HB1 ALA 48 1HB ALA 48 -0.957 -8.289 9.533 300 HB2 ALA 48 2HB ALA 48 -1.199 -7.645 7.892 301 HB3 ALA 48 3HB ALA 48 -1.342 -9.393 8.192 302 H ASN 49 H ASN 49 1.452 -11.125 8.296 303 HA ASN 49 HA ASN 49 1.823 -11.275 11.048 304 HB3 ASN 49 2HB ASN 49 3.405 -13.313 10.061 305 HD21 ASN 49 1HD2 ASN 49 0.153 -13.137 8.774 306 HD22 ASN 49 2HD2 ASN 49 -0.635 -14.120 9.963 307 H ALA 50 H ALA 50 3.684 -9.887 8.473 308 HA ALA 50 HA ALA 50 6.087 -9.890 10.169 309 HB1 ALA 50 1HB ALA 50 7.397 -10.306 8.343 310 HB2 ALA 50 2HB ALA 50 5.905 -11.054 7.724 311 HB3 ALA 50 3HB ALA 50 6.336 -9.396 7.241 312 HA PRO 51 HA PRO 51 5.544 -5.591 10.163 313 HB3 PRO 51 2HB PRO 51 6.674 -5.381 12.158 314 HG3 PRO 51 2HG PRO 51 8.056 -7.154 12.674 315 HD3 PRO 51 2HD PRO 51 7.055 -8.821 11.447 316 H ILE 52 H ILE 52 8.970 -5.754 9.426 317 HA ILE 52 HA ILE 52 8.333 -4.256 6.989 318 HB ILE 52 HB ILE 52 10.897 -3.801 7.192 319 HG13 ILE 52 2HG1 ILE 52 10.204 -4.416 10.080 320 HG21 ILE 52 1HG2 ILE 52 10.043 -2.023 9.107 321 HG22 ILE 52 2HG2 ILE 52 9.848 -1.834 7.348 322 HG23 ILE 52 3HG2 ILE 52 8.521 -2.509 8.323 323 HD11 ILE 52 3HD1 ILE 52 12.099 -5.761 8.099 324 HD12 ILE 52 1HD1 ILE 52 12.062 -6.088 9.848 325 HD13 ILE 52 2HD1 ILE 52 10.652 -6.489 8.837 326 H SER 53 H SER 53 10.047 -4.680 5.169 327 HA SER 53 HA SER 53 11.597 -6.680 4.765 328 HB3 SER 53 2HB SER 53 8.836 -7.839 5.079 329 HG SER 53 HG SER 53 10.884 -8.819 3.282 330 H GLU 54 H GLU 54 8.873 -4.790 3.756 331 HA GLU 54 HA GLU 54 8.840 -5.523 1.056 332 HB3 GLU 54 2HB GLU 54 6.927 -4.401 2.037 333 HG3 GLU 54 2HG GLU 54 7.842 -1.690 2.259 334 HE2 GLU 54 HE GLU 54 7.437 -2.204 5.625 335 H ILE 55 H ILE 55 9.963 -4.723 -0.737 336 HA ILE 55 HA ILE 55 11.741 -2.464 -0.315 337 HB ILE 55 HB ILE 55 12.788 -5.088 -1.370 338 HG13 ILE 55 2HG1 ILE 55 13.786 -5.555 0.711 339 HG21 ILE 55 1HG2 ILE 55 13.981 -2.380 -0.833 340 HG22 ILE 55 2HG2 ILE 55 14.988 -3.847 -0.789 341 HG23 ILE 55 3HG2 ILE 55 14.112 -3.413 -2.276 342 HD11 ILE 55 3HD1 ILE 55 12.977 -2.714 1.418 343 HD12 ILE 55 1HD1 ILE 55 13.316 -3.920 2.683 344 HD13 ILE 55 2HD1 ILE 55 14.587 -3.469 1.521 345 H GLU 56 H GLU 56 11.176 -1.082 -1.901 346 HA GLU 56 HA GLU 56 10.680 -2.281 -4.512 347 HB3 GLU 56 2HB GLU 56 9.077 -0.227 -4.808 348 HG3 GLU 56 2HG GLU 56 8.546 -2.713 -3.151 349 HE2 GLU 56 HE GLU 56 6.374 -0.542 -1.716 350 H SER 57 H SER 57 12.374 -1.708 -5.806 351 HA SER 57 HA SER 57 12.863 0.849 -6.542 352 HB3 SER 57 2HB SER 57 15.344 0.431 -5.103 353 HG SER 57 HG SER 57 14.293 2.513 -4.045 354 H SER 58 H SER 58 14.298 0.848 -8.333 355 HA SER 58 HA SER 58 15.040 -1.746 -9.205 356 HB3 SER 58 2HB SER 58 14.933 -0.775 -11.246 357 HG SER 58 HG SER 58 14.307 1.579 -11.254 358 H LEU 59 H LEU 59 17.358 -2.049 -10.210 359 HA LEU 59 HA LEU 59 19.511 -0.557 -9.314 360 HB3 LEU 59 2HB LEU 59 19.056 -2.991 -7.589 361 HG LEU 59 HG LEU 59 21.192 -0.881 -7.676 362 HD11 LEU 59 1HD1 LEU 59 19.812 -1.109 -5.382 363 HD12 LEU 59 2HD1 LEU 59 20.960 -2.452 -5.167 364 HD13 LEU 59 3HD1 LEU 59 21.565 -0.801 -5.446 365 HD21 LEU 59 3HD2 LEU 59 21.531 -3.747 -6.849 366 HD22 LEU 59 1HD2 LEU 59 21.341 -3.325 -8.568 367 HD23 LEU 59 2HD2 LEU 59 22.687 -2.640 -7.627 368 H LEU 60 H LEU 60 18.087 -3.702 -10.217 369 HA LEU 60 HA LEU 60 20.516 -4.198 -11.796 370 HB3 LEU 60 2HB LEU 60 19.498 -6.646 -11.609 371 HG LEU 60 HG LEU 60 21.106 -7.241 -10.085 372 HD11 LEU 60 1HD1 LEU 60 22.019 -5.769 -11.954 373 HD12 LEU 60 2HD1 LEU 60 22.176 -4.491 -10.725 374 HD13 LEU 60 3HD1 LEU 60 23.066 -6.020 -10.537 375 HD21 LEU 60 3HD2 LEU 60 20.671 -6.497 -8.013 376 HD22 LEU 60 1HD2 LEU 60 21.874 -5.243 -8.401 377 HD23 LEU 60 2HD2 LEU 60 20.137 -4.897 -8.582 378 HA PRO 61 HA PRO 61 17.848 -3.947 -15.190 379 HB3 PRO 61 2HB PRO 61 19.572 -3.314 -16.577 380 HG3 PRO 61 2HG PRO 61 21.678 -3.855 -15.807 381 HD3 PRO 61 2HD PRO 61 21.264 -3.985 -13.549 382 H SER 62 H SER 62 18.514 -6.672 -13.585 383 HA SER 62 HA SER 62 16.864 -8.190 -15.452 384 HB3 SER 62 2HB SER 62 18.336 -9.813 -13.495 385 HG SER 62 HG SER 62 19.195 -10.506 -15.813 386 H THR 63 H THR 63 15.168 -9.524 -14.512 387 HA THR 63 HA THR 63 14.037 -8.380 -12.159 388 HB THR 63 HB THR 63 13.344 -10.564 -14.154 389 HG1 THR 63 1HG THR 63 11.996 -8.875 -14.734 390 HG21 THR 63 3HG2 THR 63 12.096 -11.612 -12.522 391 HG22 THR 63 1HG2 THR 63 12.306 -10.263 -11.378 392 HG23 THR 63 2HG2 THR 63 11.049 -10.177 -12.636 393 H GLU 64 H GLU 64 15.629 -11.522 -12.941 394 HA GLU 64 HA GLU 64 15.167 -12.685 -10.496 395 HB3 GLU 64 2HB GLU 64 17.543 -13.813 -11.197 396 HG3 GLU 64 2HG GLU 64 14.765 -14.155 -12.382 397 HE2 GLU 64 HE GLU 64 17.336 -17.019 -12.964 398 H ALA 65 H ALA 65 17.800 -10.491 -11.605 399 HA ALA 65 HA ALA 65 19.198 -10.688 -9.111 400 HB1 ALA 65 1HB ALA 65 20.180 -10.250 -11.440 401 HB2 ALA 65 2HB ALA 65 19.539 -8.597 -11.284 402 HB3 ALA 65 3HB ALA 65 20.751 -9.194 -10.127 403 H ALA 66 H ALA 66 17.106 -8.253 -10.791 404 HA ALA 66 HA ALA 66 17.240 -6.239 -8.951 405 HB1 ALA 66 1HB ALA 66 14.828 -5.789 -9.765 406 HB2 ALA 66 2HB ALA 66 16.112 -5.851 -10.996 407 HB3 ALA 66 3HB ALA 66 15.033 -7.247 -10.766 408 H LYS 67 H LYS 67 15.285 -9.261 -8.882 409 HA LYS 67 HA LYS 67 13.841 -8.527 -6.564 410 HB3 LYS 67 2HB LYS 67 13.069 -10.177 -8.245 411 HG3 LYS 67 2HG LYS 67 15.540 -11.588 -7.281 412 HD3 LYS 67 2HD LYS 67 13.050 -13.106 -8.180 413 HE3 LYS 67 2HE LYS 67 14.976 -14.721 -6.811 414 HZ1 LYS 67 2HZ LYS 67 13.415 -15.183 -8.785 415 HZ3 LYS 67 1HZ LYS 67 14.857 -15.939 -8.796 416 H LYS 68 H LYS 68 16.958 -10.157 -7.208 417 HA LYS 68 HA LYS 68 17.350 -11.195 -4.654 418 HB3 LYS 68 2HB LYS 68 19.447 -10.231 -6.621 419 HG3 LYS 68 2HG LYS 68 19.601 -12.586 -4.712 420 HD3 LYS 68 2HD LYS 68 21.235 -12.054 -6.722 421 HE3 LYS 68 2HE LYS 68 23.149 -10.639 -5.299 422 HZ1 LYS 68 2HZ LYS 68 21.821 -8.774 -6.813 423 HZ3 LYS 68 1HZ LYS 68 21.457 -10.177 -7.556 424 H ASP 69 H ASP 69 17.761 -7.923 -6.017 425 HA ASP 69 HA ASP 69 19.329 -6.913 -3.978 426 HB3 ASP 69 2HB ASP 69 17.187 -5.331 -5.450 427 HD2 ASP 69 HD ASP 69 18.387 -2.709 -5.547 428 H ALA 70 H ALA 70 15.761 -6.437 -4.613 429 HA ALA 70 HA ALA 70 15.165 -5.287 -2.167 430 HB1 ALA 70 1HB ALA 70 12.827 -6.459 -2.841 431 HB2 ALA 70 2HB ALA 70 13.457 -5.017 -3.671 432 HB3 ALA 70 3HB ALA 70 13.688 -6.629 -4.389 433 H CYS 71 H CYS 71 15.495 -8.708 -3.164 434 HA CYS 71 HA CYS 71 14.304 -9.798 -0.879 435 HB3 CYS 71 2HB CYS 71 15.991 -11.765 -1.638 436 HG CYS 71 HG CYS 71 14.240 -12.770 -3.267 437 H LEU 72 H LEU 72 17.716 -8.987 -1.805 438 HA LEU 72 HA LEU 72 18.846 -9.912 0.599 439 HB3 LEU 72 2HB LEU 72 20.718 -8.282 -0.205 440 HG LEU 72 HG LEU 72 20.084 -10.366 -2.269 441 HD11 LEU 72 1HD1 LEU 72 22.358 -8.810 -1.501 442 HD12 LEU 72 2HD1 LEU 72 22.723 -10.533 -1.243 443 HD13 LEU 72 3HD1 LEU 72 22.186 -9.966 -2.843 444 HD21 LEU 72 3HD2 LEU 72 20.699 -10.869 0.636 445 HD22 LEU 72 1HD2 LEU 72 19.476 -11.632 -0.410 446 HD23 LEU 72 2HD2 LEU 72 21.199 -12.017 -0.630 447 H LYS 73 H LYS 73 17.730 -6.664 -0.533 448 HA LYS 73 HA LYS 73 18.515 -5.324 1.805 449 HB3 LYS 73 2HB LYS 73 16.332 -3.952 0.668 450 HG3 LYS 73 2HG LYS 73 18.703 -3.098 -0.617 451 HD3 LYS 73 2HD LYS 73 17.079 -2.315 1.776 452 HE3 LYS 73 2HE LYS 73 19.989 -1.852 1.595 453 HZ1 LYS 73 2HZ LYS 73 19.982 0.438 1.784 454 HZ3 LYS 73 1HZ LYS 73 18.434 0.542 2.276 455 H ALA 74 H ALA 74 15.669 -7.264 0.913 456 HA ALA 74 HA ALA 74 13.996 -6.374 2.985 457 HB1 ALA 74 1HB ALA 74 12.781 -8.510 2.490 458 HB2 ALA 74 2HB ALA 74 13.146 -7.554 1.034 459 HB3 ALA 74 3HB ALA 74 14.127 -8.986 1.427 460 H VAL 75 H VAL 75 16.436 -9.022 2.722 461 HA VAL 75 HA VAL 75 15.911 -10.207 5.178 462 HB VAL 75 HB VAL 75 18.629 -9.977 3.897 463 HG11 VAL 75 1HG1 VAL 75 19.188 -11.536 5.387 464 HG12 VAL 75 2HG1 VAL 75 17.542 -11.493 6.061 465 HG13 VAL 75 3HG1 VAL 75 17.933 -12.617 4.738 466 HG21 VAL 75 3HG2 VAL 75 16.180 -10.992 2.705 467 HG22 VAL 75 1HG2 VAL 75 17.796 -10.784 1.988 468 HG23 VAL 75 2HG2 VAL 75 17.401 -12.277 2.872 469 H HIS 76 H HIS 76 18.146 -7.509 4.268 470 HA HIS 76 HA HIS 76 19.231 -7.192 6.806 471 HB3 HIS 76 2HB HIS 76 19.272 -4.672 5.641 472 HD1 HIS 76 1HD HIS 76 21.744 -4.210 4.534 473 HD2 HIS 76 2HD HIS 76 21.153 -7.916 6.411 474 HE1 HIS 76 1HE HIS 76 24.068 -5.164 4.984 475 H GLU 77 H GLU 77 16.379 -5.644 5.203 476 HA GLU 77 HA GLU 77 15.788 -3.907 7.243 477 HB3 GLU 77 2HB GLU 77 13.355 -4.210 6.272 478 HG3 GLU 77 2HG GLU 77 13.960 -2.893 4.287 479 HE2 GLU 77 HE GLU 77 13.261 -1.943 6.445 480 H LEU 78 H LEU 78 15.224 -7.396 6.912 481 HA LEU 78 HA LEU 78 13.432 -7.417 9.190 482 HB3 LEU 78 2HB LEU 78 14.517 -9.675 7.501 483 HG LEU 78 HG LEU 78 12.399 -10.829 8.219 484 HD11 LEU 78 1HD1 LEU 78 13.737 -12.022 9.523 485 HD12 LEU 78 2HD1 LEU 78 14.926 -10.697 9.464 486 HD13 LEU 78 3HD1 LEU 78 13.721 -10.754 10.773 487 HD21 LEU 78 3HD2 LEU 78 12.388 -8.733 10.408 488 HD22 LEU 78 1HD2 LEU 78 11.217 -8.849 9.073 489 HD23 LEU 78 2HD2 LEU 78 11.315 -10.148 10.286 490 H HIS 79 H HIS 79 16.832 -7.943 8.351 491 HA HIS 79 HA HIS 79 17.438 -9.369 10.725 492 HB3 HIS 79 2HB HIS 79 19.559 -7.857 9.285 493 HD1 HIS 79 1HD HIS 79 20.175 -9.076 11.897 494 HD2 HIS 79 2HD HIS 79 20.050 -11.393 8.402 495 HE1 HIS 79 1HE HIS 79 21.552 -11.170 12.377 496 H ASN 80 H ASN 80 17.726 -5.932 9.639 497 HA ASN 80 HA ASN 80 19.027 -4.989 11.849 498 HB3 ASN 80 2HB ASN 80 16.821 -3.438 10.417 499 HD21 ASN 80 1HD2 ASN 80 20.111 -2.644 10.039 500 HD22 ASN 80 2HD2 ASN 80 20.228 -1.351 11.186 501 H LEU 81 H LEU 81 15.561 -5.696 11.215 502 HA LEU 81 HA LEU 81 14.832 -4.654 13.837 503 HB3 LEU 81 2HB LEU 81 12.808 -5.868 12.054 504 HG LEU 81 HG LEU 81 12.809 -3.074 13.185 505 HD11 LEU 81 1HD1 LEU 81 10.326 -3.491 13.157 506 HD12 LEU 81 2HD1 LEU 81 11.111 -3.427 11.560 507 HD13 LEU 81 3HD1 LEU 81 10.661 -4.998 12.269 508 HD21 LEU 81 3HD2 LEU 81 12.402 -5.651 14.637 509 HD22 LEU 81 1HD2 LEU 81 13.089 -4.108 15.200 510 HD23 LEU 81 2HD2 LEU 81 11.326 -4.285 15.018 511 H GLY 82 H GLY 82 13.718 -7.571 12.003 512 HA2 GLY 82 1HA GLY 82 13.436 -9.703 12.657 513 HA3 GLY 82 2HA GLY 82 14.895 -9.508 13.607 514 H VAL 83 H VAL 83 11.448 -8.334 13.734 515 HA VAL 83 HA VAL 83 11.526 -8.871 16.618 516 HB VAL 83 HB VAL 83 11.115 -6.561 16.016 517 HG11 VAL 83 1HG1 VAL 83 9.521 -7.725 13.924 518 HG12 VAL 83 2HG1 VAL 83 8.515 -6.616 14.887 519 HG13 VAL 83 3HG1 VAL 83 10.025 -6.032 14.145 520 HG21 VAL 83 3HG2 VAL 83 9.783 -7.905 17.872 521 HG22 VAL 83 1HG2 VAL 83 9.407 -6.203 17.512 522 HG23 VAL 83 2HG2 VAL 83 8.392 -7.501 16.839 523 H LEU 84 H LEU 84 10.444 -10.064 13.599 524 HA LEU 84 HA LEU 84 8.312 -11.567 14.953 525 HB3 LEU 84 2HB LEU 84 7.769 -11.836 12.304 526 HG LEU 84 HG LEU 84 6.027 -10.160 12.508 527 HD11 LEU 84 1HD1 LEU 84 4.752 -11.347 13.953 528 HD12 LEU 84 2HD1 LEU 84 6.148 -12.449 13.905 529 HD13 LEU 84 3HD1 LEU 84 5.968 -11.298 15.251 530 HD21 LEU 84 3HD2 LEU 84 6.392 -9.239 15.193 531 HD22 LEU 84 1HD2 LEU 84 7.859 -8.876 14.252 532 HD23 LEU 84 2HD2 LEU 84 6.273 -8.299 13.685 533 H ASN 85 H ASN 85 11.222 -12.112 14.997 534 HA ASN 85 HA ASN 85 11.945 -13.957 13.107 535 HB3 ASN 85 2HB ASN 85 13.532 -12.993 14.750 536 HD21 ASN 85 1HD2 ASN 85 12.916 -11.833 16.472 537 HD22 ASN 85 2HD2 ASN 85 12.458 -12.483 18.011 538 H ASP 86 H ASP 86 9.536 -14.090 15.594 539 HA ASP 86 HA ASP 86 9.722 -16.869 16.104 540 HB3 ASP 86 2HB ASP 86 7.289 -15.086 16.538 541 HD2 ASP 86 HD ASP 86 7.981 -17.361 19.539 542 H PHE 87 H PHE 87 8.301 -14.758 13.683 543 HA PHE 87 HA PHE 87 6.312 -16.691 12.871 544 HB3 PHE 87 2HB PHE 87 7.203 -13.866 12.254 545 HD1 PHE 87 1HD PHE 87 4.216 -15.389 10.786 546 HD2 PHE 87 2HD PHE 87 8.118 -13.914 10.008 547 HE1 PHE 87 1HE PHE 87 3.718 -15.366 8.327 548 HE2 PHE 87 2HE PHE 87 7.620 -13.891 7.549 549 HZ PHE 87 HZ PHE 87 5.425 -14.618 6.737 550 H LEU 88 H LEU 88 9.633 -15.803 12.151 551 HA LEU 88 HA LEU 88 9.488 -17.349 9.663 552 HB3 LEU 88 2HB LEU 88 10.265 -15.031 9.463 553 HG LEU 88 HG LEU 88 11.740 -15.417 11.772 554 HD11 LEU 88 1HD1 LEU 88 13.321 -16.474 9.699 555 HD12 LEU 88 2HD1 LEU 88 14.007 -14.874 10.075 556 HD13 LEU 88 3HD1 LEU 88 13.815 -16.086 11.364 557 HD21 LEU 88 3HD2 LEU 88 12.213 -13.314 9.642 558 HD22 LEU 88 1HD2 LEU 88 10.891 -13.293 10.832 559 HD23 LEU 88 2HD2 LEU 88 12.582 -13.183 11.378 560 H LEU 89 H LEU 89 11.178 -18.947 9.254 561 HA LEU 89 HA LEU 89 11.635 -20.549 11.518 562 HB3 LEU 89 2HB LEU 89 12.465 -22.100 10.052 563 HG LEU 89 HG LEU 89 11.072 -22.271 8.266 564 HD11 LEU 89 1HD1 LEU 89 9.075 -21.715 9.087 565 HD12 LEU 89 2HD1 LEU 89 9.968 -20.931 10.413 566 HD13 LEU 89 3HD1 LEU 89 9.428 -19.972 9.013 567 HD21 LEU 89 3HD2 LEU 89 12.361 -20.003 7.367 568 HD22 LEU 89 1HD2 LEU 89 11.109 -20.918 6.492 569 HD23 LEU 89 2HD2 LEU 89 10.659 -19.492 7.456 570 HA PRO 90 HA PRO 90 15.277 -18.673 12.936 571 HB3 PRO 90 2HB PRO 90 14.768 -19.187 15.122 572 HG3 PRO 90 2HG PRO 90 13.201 -20.860 15.378 573 HD3 PRO 90 2HD PRO 90 12.106 -20.705 13.362 574 H ASP 91 H ASP 91 17.541 -19.940 13.976 575 HA ASP 91 HA ASP 91 18.874 -20.388 11.606 576 HB3 ASP 91 2HB ASP 91 19.845 -19.758 13.884 577 HD2 ASP 91 HD ASP 91 21.438 -22.482 14.210 578 H SER 92 H SER 92 16.816 -22.418 13.566 579 HA SER 92 HA SER 92 17.921 -24.889 13.230 580 HB3 SER 92 2HB SER 92 15.167 -25.334 13.042 581 HG SER 92 HG SER 92 16.883 -25.980 14.727 582 H LYS 93 H LYS 93 15.759 -22.990 11.046 583 HA LYS 93 HA LYS 93 15.753 -25.107 9.091 584 HB3 LYS 93 2HB LYS 93 14.630 -22.940 7.862 585 HG3 LYS 93 2HG LYS 93 12.474 -23.891 9.169 586 HD3 LYS 93 2HD LYS 93 14.007 -24.708 6.836 587 HE3 LYS 93 2HE LYS 93 12.519 -27.022 6.989 588 HZ1 LYS 93 2HZ LYS 93 15.336 -26.373 7.369 589 HZ3 LYS 93 1HZ LYS 93 14.651 -27.368 6.278 590 H ASP 94 H ASP 94 17.833 -22.542 10.041 591 HA ASP 94 HA ASP 94 18.766 -21.922 7.443 592 HB3 ASP 94 2HB ASP 94 20.132 -21.498 10.141 593 HD2 ASP 94 HD ASP 94 22.240 -19.147 8.813 594 H GLU 95 H GLU 95 19.040 -24.621 9.492 595 HA GLU 95 HA GLU 95 21.767 -25.198 9.210 596 HB3 GLU 95 2HB GLU 95 20.590 -27.651 9.626 597 HG3 GLU 95 2HG GLU 95 21.276 -25.363 11.497 598 HE2 GLU 95 HE GLU 95 19.885 -26.793 14.261 599 H ILE 96 H ILE 96 21.508 -24.471 6.741 600 HA ILE 96 HA ILE 96 21.532 -26.959 5.248 601 HB ILE 96 HB ILE 96 20.151 -25.979 3.450 602 HG13 ILE 96 2HG1 ILE 96 20.497 -23.583 4.736 603 HG21 ILE 96 1HG2 ILE 96 18.003 -26.425 4.508 604 HG22 ILE 96 2HG2 ILE 96 19.229 -27.596 5.048 605 HG23 ILE 96 3HG2 ILE 96 18.741 -26.260 6.119 606 HD11 ILE 96 3HD1 ILE 96 18.263 -24.420 2.829 607 HD12 ILE 96 1HD1 ILE 96 18.759 -22.741 3.148 608 HD13 ILE 96 2HD1 ILE 96 19.891 -23.869 2.364 609 H GLU 97 H GLU 97 22.333 -26.400 2.879 610 HA GLU 97 HA GLU 97 24.769 -25.035 3.281 611 HB3 GLU 97 2HB GLU 97 24.450 -25.477 0.511 612 HG3 GLU 97 2HG GLU 97 25.736 -27.669 1.144 613 HE2 GLU 97 HE GLU 97 27.551 -25.542 3.201 614 H ASP 98 H ASP 98 25.562 -23.162 2.037 615 HA ASP 98 HA ASP 98 23.788 -21.069 2.096 616 HB3 ASP 98 2HB ASP 98 26.421 -21.161 2.004 617 HD2 ASP 98 HD ASP 98 27.177 -22.604 0.618 618 H GLU 99 H GLU 99 24.875 -23.275 -0.535 619 HA GLU 99 HA GLU 99 23.561 -21.784 -2.558 620 HB3 GLU 99 2HB GLU 99 24.344 -24.675 -2.916 621 HG3 GLU 99 2HG GLU 99 24.911 -22.188 -4.591 622 HE2 GLU 99 HE GLU 99 25.251 -25.097 -7.009 623 H LEU 100 H LEU 100 22.819 -24.575 -0.454 624 HA LEU 100 HA LEU 100 20.625 -25.561 -1.843 625 HB3 LEU 100 2HB LEU 100 20.910 -25.539 1.155 626 HG LEU 100 HG LEU 100 19.450 -27.210 -0.795 627 HD11 LEU 100 1HD1 LEU 100 20.048 -29.284 -0.149 628 HD12 LEU 100 2HD1 LEU 100 21.595 -28.490 0.233 629 HD13 LEU 100 3HD1 LEU 100 20.403 -28.785 1.522 630 HD21 LEU 100 3HD2 LEU 100 19.081 -27.133 2.191 631 HD22 LEU 100 1HD2 LEU 100 18.558 -25.777 1.162 632 HD23 LEU 100 2HD2 LEU 100 17.878 -27.402 0.908 633 H SER 101 H SER 101 20.851 -23.024 0.733 634 HA SER 101 HA SER 101 18.173 -22.555 0.961 635 HB3 SER 101 2HB SER 101 20.275 -20.361 1.085 636 HG SER 101 HG SER 101 18.571 -19.373 1.930 637 H ASP 102 H ASP 102 17.113 -20.309 0.266 638 HA ASP 102 HA ASP 102 16.297 -19.073 -1.316 639 HB3 ASP 102 2HB ASP 102 19.150 -19.335 -2.297 640 HD2 ASP 102 HD ASP 102 19.143 -16.794 -3.554 Start of MODEL 2 1 H1 ILE 1 H ILE 1 33.615 -23.070 8.498 2 HA ILE 1 HA ILE 1 31.238 -23.584 7.179 3 HB ILE 1 HB ILE 1 30.336 -23.432 9.519 4 HG13 ILE 1 2HG1 ILE 1 29.332 -22.459 7.068 5 HG21 ILE 1 1HG2 ILE 1 31.935 -21.405 9.988 6 HG22 ILE 1 2HG2 ILE 1 30.586 -20.453 9.321 7 HG23 ILE 1 3HG2 ILE 1 30.326 -21.489 10.745 8 HD11 ILE 1 3HD1 ILE 1 27.869 -23.029 9.686 9 HD12 ILE 1 1HD1 ILE 1 27.169 -23.078 8.050 10 HD13 ILE 1 2HD1 ILE 1 28.396 -24.276 8.530 11 H SER 2 H SER 2 31.691 -22.503 5.345 12 HA SER 2 HA SER 2 32.366 -19.723 5.588 13 HB3 SER 2 2HB SER 2 34.574 -20.897 5.601 14 HG SER 2 HG SER 2 34.438 -21.544 2.880 15 H GLY 3 H GLY 3 32.519 -18.755 3.206 16 HA2 GLY 3 1HA GLY 3 31.892 -19.256 0.890 17 HA3 GLY 3 2HA GLY 3 30.546 -20.182 1.523 18 H GLY 4 H GLY 4 29.182 -18.807 3.283 19 HA2 GLY 4 1HA GLY 4 29.052 -16.007 2.979 20 HA3 GLY 4 2HA GLY 4 27.915 -16.754 1.874 21 H SER 5 H SER 5 28.879 -16.464 5.321 22 HA SER 5 HA SER 5 26.711 -17.970 6.273 23 HB3 SER 5 2HB SER 5 28.620 -17.744 7.699 24 HG SER 5 HG SER 5 29.049 -15.462 8.562 25 H SER 6 H SER 6 27.277 -14.528 5.484 26 HA SER 6 HA SER 6 25.105 -13.480 6.828 27 HB3 SER 6 2HB SER 6 25.472 -11.964 4.446 28 HG SER 6 HG SER 6 25.567 -11.535 7.006 29 H ILE 7 H ILE 7 25.415 -15.207 3.731 30 HA ILE 7 HA ILE 7 22.935 -14.420 2.656 31 HB ILE 7 HB ILE 7 24.842 -16.688 2.147 32 HG13 ILE 7 2HG1 ILE 7 25.686 -15.413 0.483 33 HG21 ILE 7 1HG2 ILE 7 22.821 -17.732 1.598 34 HG22 ILE 7 2HG2 ILE 7 22.113 -16.235 0.946 35 HG23 ILE 7 3HG2 ILE 7 23.409 -17.068 0.054 36 HD11 ILE 7 3HD1 ILE 7 24.190 -13.595 -0.659 37 HD12 ILE 7 1HD1 ILE 7 23.882 -15.305 -1.047 38 HD13 ILE 7 2HD1 ILE 7 22.833 -14.452 0.110 39 H SER 8 H SER 8 23.979 -16.960 4.942 40 HA SER 8 HA SER 8 21.991 -18.697 4.905 41 HB3 SER 8 2HB SER 8 23.967 -18.427 6.570 42 HG SER 8 HG SER 8 22.673 -16.382 7.447 43 H MET 9 H MET 9 21.782 -15.288 5.878 44 HA MET 9 HA MET 9 19.083 -15.712 6.839 45 HB3 MET 9 2HB MET 9 19.503 -13.037 7.148 46 HG3 MET 9 2HG MET 9 20.844 -13.735 9.334 47 HE1 MET 9 3HE MET 9 17.252 -15.912 10.449 48 HE2 MET 9 1HE MET 9 18.166 -16.503 9.040 49 HE3 MET 9 2HE MET 9 19.007 -16.181 10.576 50 H MET 10 H MET 10 20.958 -14.127 4.226 51 HA MET 10 HA MET 10 18.795 -12.694 3.186 52 HB3 MET 10 2HB MET 10 20.303 -12.439 1.203 53 HG3 MET 10 2HG MET 10 21.560 -12.320 3.967 54 HE1 MET 10 3HE MET 10 23.934 -9.633 1.618 55 HE2 MET 10 1HE MET 10 22.391 -9.531 2.500 56 HE3 MET 10 2HE MET 10 23.902 -9.843 3.385 57 H TYR 11 H TYR 11 19.922 -16.042 2.838 58 HA TYR 11 HA TYR 11 18.553 -16.619 0.440 59 HB3 TYR 11 2HB TYR 11 19.558 -18.181 2.892 60 HD1 TYR 11 2HD TYR 11 17.410 -18.463 0.013 61 HD2 TYR 11 1HD TYR 11 20.098 -20.649 2.523 62 HE1 TYR 11 2HE TYR 11 16.411 -20.650 -0.811 63 HE2 TYR 11 1HE TYR 11 19.089 -22.830 1.690 64 HH TYR 11 HH TYR 11 17.284 -23.058 -1.024 65 H LYS 12 H LYS 12 17.757 -17.270 3.929 66 HA LYS 12 HA LYS 12 15.459 -18.594 3.726 67 HB3 LYS 12 2HB LYS 12 14.732 -17.395 5.796 68 HG3 LYS 12 2HG LYS 12 16.836 -17.957 7.107 69 HD3 LYS 12 2HD LYS 12 16.855 -20.372 6.488 70 HE3 LYS 12 2HE LYS 12 14.539 -18.815 7.185 71 HZ1 LYS 12 2HZ LYS 12 14.079 -20.872 5.134 72 HZ3 LYS 12 1HZ LYS 12 13.319 -19.446 5.330 73 H TYR 13 H TYR 13 15.965 -15.142 2.925 74 HA TYR 13 HA TYR 13 13.181 -14.637 2.538 75 HB3 TYR 13 2HB TYR 13 15.588 -13.171 1.331 76 HD1 TYR 13 1HD TYR 13 13.860 -12.205 -0.229 77 HD2 TYR 13 2HD TYR 13 13.650 -11.684 4.013 78 HE1 TYR 13 1HE TYR 13 12.246 -10.266 -0.540 79 HE2 TYR 13 2HE TYR 13 12.037 -9.747 3.687 80 HH TYR 13 HH TYR 13 11.088 -8.418 2.258 81 H CYS 14 H CYS 14 16.023 -15.328 0.408 82 HA CYS 14 HA CYS 14 14.608 -14.988 -1.981 83 HB3 CYS 14 2HB CYS 14 16.527 -16.370 -2.947 84 HG CYS 14 HG CYS 14 17.250 -14.176 -3.483 85 H SER 15 H SER 15 15.250 -17.773 0.217 86 HA SER 15 HA SER 15 14.436 -19.824 -1.321 87 HB3 SER 15 2HB SER 15 13.431 -19.762 1.512 88 HG SER 15 HG SER 15 13.684 -21.716 0.022 89 H ARG 16 H ARG 16 12.538 -17.138 -0.137 90 HA ARG 16 HA ARG 16 10.059 -18.424 -0.118 91 HB3 ARG 16 2HB ARG 16 9.167 -16.030 -0.239 92 HG3 ARG 16 2HG ARG 16 11.435 -16.613 1.723 93 HD3 ARG 16 2HD ARG 16 9.488 -14.337 1.477 94 HE ARG 16 HE ARG 16 8.692 -14.725 3.631 95 HH11 ARG 16 2HH2 ARG 16 12.024 -15.920 3.460 96 HH12 ARG 16 1HH2 ARG 16 12.085 -16.355 5.135 97 HH22 ARG 16 1HH ARG 16 10.162 -15.982 6.516 98 H LEU 17 H LEU 17 12.170 -17.950 -2.652 99 HA LEU 17 HA LEU 17 10.511 -16.890 -4.657 100 HB3 LEU 17 2HB LEU 17 12.288 -18.393 -6.022 101 HG LEU 17 HG LEU 17 14.004 -16.443 -5.435 102 HD11 LEU 17 1HD1 LEU 17 12.782 -16.926 -7.590 103 HD12 LEU 17 2HD1 LEU 17 11.498 -15.835 -7.015 104 HD13 LEU 17 3HD1 LEU 17 13.145 -15.212 -7.274 105 HD21 LEU 17 3HD2 LEU 17 11.484 -14.935 -4.873 106 HD22 LEU 17 1HD2 LEU 17 12.293 -15.789 -3.537 107 HD23 LEU 17 2HD2 LEU 17 13.171 -14.546 -4.461 108 HA PRO 18 HA PRO 18 8.080 -20.281 -5.753 109 HB3 PRO 18 2HB PRO 18 6.889 -19.058 -7.297 110 HG3 PRO 18 2HG PRO 18 8.011 -17.233 -8.154 111 HD3 PRO 18 2HD PRO 18 9.508 -16.840 -6.454 112 H HIS 19 H HIS 19 7.785 -22.320 -7.061 113 HA HIS 19 HA HIS 19 8.633 -24.257 -7.645 114 HB3 HIS 19 2HB HIS 19 11.102 -23.298 -8.903 115 HD1 HIS 19 1HD HIS 19 10.818 -26.051 -9.139 116 HD2 HIS 19 2HD HIS 19 8.235 -23.625 -11.384 117 HE1 HIS 19 1HE HIS 19 9.874 -27.532 -10.991 118 H ASP 20 H ASP 20 9.671 -22.622 -5.165 119 HA ASP 20 HA ASP 20 12.128 -24.108 -4.767 120 HB3 ASP 20 2HB ASP 20 10.809 -21.852 -3.187 121 HD2 ASP 20 HD ASP 20 14.256 -22.225 -3.292 122 H GLU 21 H GLU 21 12.258 -25.717 -3.113 123 HA GLU 21 HA GLU 21 9.755 -26.697 -2.199 124 HB3 GLU 21 2HB GLU 21 12.088 -27.943 -0.951 125 HG3 GLU 21 2HG GLU 21 9.819 -28.698 -2.794 126 HE2 GLU 21 HE GLU 21 11.189 -31.001 -4.484 127 H PHE 22 H PHE 22 12.530 -24.894 -0.847 128 HA PHE 22 HA PHE 22 11.571 -25.159 1.845 129 HB3 PHE 22 2HB PHE 22 13.456 -23.238 1.973 130 HD1 PHE 22 1HD PHE 22 14.060 -26.316 -0.058 131 HD2 PHE 22 2HD PHE 22 14.661 -24.301 3.628 132 HE1 PHE 22 1HE PHE 22 15.526 -28.194 0.730 133 HE2 PHE 22 2HE PHE 22 16.127 -26.180 4.417 134 HZ PHE 22 HZ PHE 22 16.542 -28.104 2.958 135 H PHE 23 H PHE 23 10.191 -23.628 -0.655 136 HA PHE 23 HA PHE 23 9.874 -21.031 0.583 137 HB3 PHE 23 2HB PHE 23 9.357 -22.445 -2.012 138 HD1 PHE 23 2HD PHE 23 7.781 -19.549 -0.252 139 HD2 PHE 23 1HD PHE 23 7.477 -22.443 -3.340 140 HE1 PHE 23 2HE PHE 23 5.472 -18.726 -0.796 141 HE2 PHE 23 1HE PHE 23 5.168 -21.621 -3.884 142 HZ PHE 23 HZ PHE 23 4.194 -19.772 -2.605 143 H GLN 24 H GLN 24 8.185 -20.448 1.877 144 HA GLN 24 HA GLN 24 6.003 -22.377 2.027 145 HB3 GLN 24 2HB GLN 24 5.809 -20.793 4.310 146 HG3 GLN 24 2HG GLN 24 6.446 -23.518 3.605 147 HE21 GLN 24 1HE2 GLN 24 8.813 -23.249 3.318 148 HE22 GLN 24 2HE2 GLN 24 9.849 -23.504 4.683 149 HA PRO 25 HA PRO 25 3.288 -19.229 0.785 150 HB3 PRO 25 2HB PRO 25 1.573 -20.725 0.436 151 HG3 PRO 25 2HG PRO 25 1.750 -22.688 1.635 152 HD3 PRO 25 2HD PRO 25 4.021 -22.747 1.987 153 H LYS 26 H LYS 26 3.348 -17.141 1.292 154 HA LYS 26 HA LYS 26 1.952 -16.012 3.280 155 HB3 LYS 26 2HB LYS 26 4.306 -15.747 4.787 156 HG3 LYS 26 2HG LYS 26 1.594 -17.006 5.081 157 HD3 LYS 26 2HD LYS 26 3.019 -17.197 7.590 158 HE3 LYS 26 2HE LYS 26 1.225 -18.789 5.879 159 HZ1 LYS 26 2HZ LYS 26 3.554 -20.079 6.421 160 HZ3 LYS 26 1HZ LYS 26 2.131 -20.826 6.156 161 HA PRO 27 HA PRO 27 5.480 -13.238 1.810 162 HB3 PRO 27 2HB PRO 27 7.628 -13.986 2.173 163 HG3 PRO 27 2HG PRO 27 7.822 -16.270 2.429 164 HD3 PRO 27 2HD PRO 27 5.694 -16.783 3.133 165 H GLU 28 H GLU 28 5.983 -12.032 -0.178 166 HA GLU 28 HA GLU 28 4.855 -13.362 -2.483 167 HB3 GLU 28 2HB GLU 28 3.654 -11.003 -2.885 168 HG3 GLU 28 2HG GLU 28 2.519 -13.052 -0.924 169 HE2 GLU 28 HE GLU 28 -0.216 -12.975 -2.180 170 H PHE 29 H PHE 29 5.832 -12.736 -4.432 171 HA PHE 29 HA PHE 29 7.636 -10.440 -4.284 172 HB3 PHE 29 2HB PHE 29 8.561 -12.972 -3.994 173 HD1 PHE 29 1HD PHE 29 6.593 -14.112 -5.550 174 HD2 PHE 29 2HD PHE 29 10.315 -12.586 -6.903 175 HE1 PHE 29 1HE PHE 29 6.476 -15.610 -7.561 176 HE2 PHE 29 2HE PHE 29 10.198 -14.085 -8.913 177 HZ PHE 29 HZ PHE 29 8.280 -15.578 -9.218 178 H GLN 30 H GLN 30 7.644 -9.169 -6.119 179 HA GLN 30 HA GLN 30 6.621 -10.330 -8.548 180 HB3 GLN 30 2HB GLN 30 5.382 -7.719 -8.190 181 HG3 GLN 30 2HG GLN 30 3.364 -9.623 -8.253 182 HE21 GLN 30 1HE2 GLN 30 2.815 -10.193 -10.675 183 HE22 GLN 30 2HE2 GLN 30 3.006 -8.887 -11.796 184 H PHE 31 H PHE 31 7.410 -9.280 -10.438 185 HA PHE 31 HA PHE 31 9.348 -7.151 -9.858 186 HB3 PHE 31 2HB PHE 31 10.645 -8.143 -11.703 187 HD1 PHE 31 1HD PHE 31 10.437 -8.709 -8.718 188 HD2 PHE 31 2HD PHE 31 10.273 -11.258 -12.108 189 HE1 PHE 31 1HE PHE 31 11.283 -10.617 -7.324 190 HE2 PHE 31 2HE PHE 31 11.119 -13.166 -10.714 191 HZ PHE 31 HZ PHE 31 11.613 -12.823 -8.339 192 H LYS 32 H LYS 32 9.318 -5.283 -11.114 193 HA LYS 32 HA LYS 32 7.101 -5.148 -13.032 194 HB3 LYS 32 2HB LYS 32 8.055 -3.351 -10.902 195 HG3 LYS 32 2HG LYS 32 7.366 -2.327 -13.692 196 HD3 LYS 32 2HD LYS 32 7.442 -0.046 -12.500 197 HE3 LYS 32 2HE LYS 32 5.053 -0.342 -11.551 198 HZ1 LYS 32 2HZ LYS 32 4.178 -0.555 -13.737 199 HZ3 LYS 32 1HZ LYS 32 5.434 -1.440 -14.278 200 HA PRO 33 HA PRO 33 10.405 -4.789 -15.884 201 HB3 PRO 33 2HB PRO 33 9.574 -6.461 -17.232 202 HG3 PRO 33 2HG PRO 33 7.385 -7.047 -16.800 203 HD3 PRO 33 2HD PRO 33 7.207 -6.376 -14.609 204 H VAL 34 H VAL 34 11.201 -2.754 -15.674 205 HA VAL 34 HA VAL 34 9.513 -0.686 -16.869 206 HB VAL 34 HB VAL 34 11.970 -0.450 -15.122 207 HG11 VAL 34 1HG1 VAL 34 10.994 1.894 -14.773 208 HG12 VAL 34 2HG1 VAL 34 11.768 1.561 -16.342 209 HG13 VAL 34 3HG1 VAL 34 9.993 1.565 -16.209 210 HG21 VAL 34 3HG2 VAL 34 10.623 -1.116 -13.458 211 HG22 VAL 34 1HG2 VAL 34 9.799 0.450 -13.654 212 HG23 VAL 34 2HG2 VAL 34 9.166 -0.998 -14.473 213 H ASP 35 H ASP 35 10.867 1.104 -18.036 214 HA ASP 35 HA ASP 35 11.996 -0.103 -20.249 215 HB3 ASP 35 2HB ASP 35 12.824 2.702 -19.628 216 HD2 ASP 35 HD ASP 35 11.871 4.061 -21.347 217 H GLU 36 H GLU 36 14.336 0.443 -21.058 218 HA GLU 36 HA GLU 36 16.150 -0.531 -19.194 219 HB3 GLU 36 2HB GLU 36 16.286 -0.729 -21.721 220 HG3 GLU 36 2HG GLU 36 16.417 2.161 -21.479 221 HE2 GLU 36 HE GLU 36 17.817 1.797 -24.166 222 H PHE 37 H PHE 37 14.782 2.571 -19.525 223 HA PHE 37 HA PHE 37 17.132 4.014 -18.681 224 HB3 PHE 37 2HB PHE 37 14.521 5.354 -18.411 225 HD1 PHE 37 2HD PHE 37 16.801 6.724 -17.919 226 HD2 PHE 37 1HD PHE 37 15.333 5.669 -21.757 227 HE1 PHE 37 2HE PHE 37 18.111 8.608 -18.937 228 HE2 PHE 37 1HE PHE 37 16.643 7.552 -22.776 229 HZ PHE 37 HZ PHE 37 18.017 8.998 -21.354 230 H GLY 38 H GLY 38 15.633 1.784 -17.033 231 HA2 GLY 38 1HA GLY 38 16.081 2.963 -14.495 232 HA3 GLY 38 2HA GLY 38 14.363 2.905 -14.836 233 H GLY 39 H GLY 39 16.739 0.545 -16.123 234 HA2 GLY 39 1HA GLY 39 16.607 -1.730 -16.047 235 HA3 GLY 39 2HA GLY 39 16.916 -1.421 -14.349 236 H THR 40 H THR 40 15.637 -2.823 -13.202 237 HA THR 40 HA THR 40 12.757 -2.699 -13.759 238 HB THR 40 HB THR 40 14.558 -5.153 -13.518 239 HG1 THR 40 1HG THR 40 12.366 -4.310 -15.279 240 HG21 THR 40 3HG2 THR 40 11.885 -5.961 -13.969 241 HG22 THR 40 1HG2 THR 40 12.829 -6.245 -12.487 242 HG23 THR 40 2HG2 THR 40 11.778 -4.814 -12.612 243 H ILE 41 H ILE 41 11.390 -2.962 -11.954 244 HA ILE 41 HA ILE 41 12.842 -2.659 -9.420 245 HB ILE 41 HB ILE 41 11.256 -1.173 -8.684 246 HG13 ILE 41 2HG1 ILE 41 9.341 -2.746 -9.394 247 HG21 ILE 41 1HG2 ILE 41 10.723 -0.098 -11.297 248 HG22 ILE 41 2HG2 ILE 41 11.845 0.478 -10.042 249 HG23 ILE 41 3HG2 ILE 41 12.386 -0.729 -11.232 250 HD11 ILE 41 3HD1 ILE 41 8.711 0.190 -9.815 251 HD12 ILE 41 1HD1 ILE 41 7.750 -1.049 -8.970 252 HD13 ILE 41 2HD1 ILE 41 9.231 -0.405 -8.220 253 H CYS 42 H CYS 42 12.415 -4.059 -7.747 254 HA CYS 42 HA CYS 42 10.552 -6.206 -8.418 255 HB3 CYS 42 2HB CYS 42 13.000 -6.096 -6.650 256 HG CYS 42 HG CYS 42 10.329 -7.986 -6.691 257 H ARG 43 H ARG 43 8.686 -6.441 -7.196 258 HA ARG 43 HA ARG 43 8.465 -4.628 -4.938 259 HB3 ARG 43 2HB ARG 43 6.415 -5.840 -6.836 260 HG3 ARG 43 2HG ARG 43 5.873 -4.356 -4.220 261 HD3 ARG 43 2HD ARG 43 4.393 -3.985 -6.421 262 HE ARG 43 HE ARG 43 3.967 -6.781 -5.914 263 HH11 ARG 43 2HH2 ARG 43 2.153 -3.837 -6.685 264 HH12 ARG 43 1HH2 ARG 43 0.860 -4.688 -7.464 265 HH22 ARG 43 1HH ARG 43 0.946 -7.079 -7.602 266 H ILE 44 H ILE 44 8.859 -5.691 -3.013 267 HA ILE 44 HA ILE 44 7.747 -8.399 -2.764 268 HB ILE 44 HB ILE 44 10.400 -7.648 -2.636 269 HG13 ILE 44 2HG1 ILE 44 8.771 -10.035 -1.966 270 HG21 ILE 44 1HG2 ILE 44 11.157 -7.704 -0.418 271 HG22 ILE 44 2HG2 ILE 44 9.778 -6.579 -0.398 272 HG23 ILE 44 3HG2 ILE 44 9.578 -8.242 0.205 273 HD11 ILE 44 3HD1 ILE 44 9.549 -9.903 -4.211 274 HD12 ILE 44 1HD1 ILE 44 11.153 -9.318 -3.711 275 HD13 ILE 44 2HD1 ILE 44 10.694 -11.014 -3.421 276 H THR 45 H THR 45 6.450 -8.834 -0.996 277 HA THR 45 HA THR 45 6.297 -6.840 1.117 278 HB THR 45 HB THR 45 4.702 -6.136 -0.742 279 HG1 THR 45 1HG THR 45 3.033 -5.890 0.883 280 HG21 THR 45 3HG2 THR 45 2.848 -7.463 -1.339 281 HG22 THR 45 1HG2 THR 45 4.109 -8.712 -1.190 282 HG23 THR 45 2HG2 THR 45 2.954 -8.448 0.139 283 H LEU 46 H LEU 46 6.382 -7.870 3.003 284 HA LEU 46 HA LEU 46 5.822 -10.705 3.019 285 HB3 LEU 46 2HB LEU 46 6.511 -10.131 5.552 286 HG LEU 46 HG LEU 46 8.476 -10.328 3.252 287 HD11 LEU 46 1HD1 LEU 46 9.026 -9.571 5.870 288 HD12 LEU 46 2HD1 LEU 46 9.399 -11.311 5.832 289 HD13 LEU 46 3HD1 LEU 46 10.182 -10.207 4.676 290 HD21 LEU 46 3HD2 LEU 46 7.357 -12.465 5.088 291 HD22 LEU 46 1HD2 LEU 46 6.962 -12.236 3.367 292 HD23 LEU 46 2HD2 LEU 46 8.612 -12.701 3.846 293 HA PRO 47 HA PRO 47 1.989 -10.441 4.990 294 HB3 PRO 47 2HB PRO 47 1.766 -12.727 5.153 295 HG3 PRO 47 2HG PRO 47 3.759 -13.887 5.218 296 HD3 PRO 47 2HD PRO 47 5.143 -12.378 4.174 297 H ALA 48 H ALA 48 0.643 -10.108 6.996 298 HA ALA 48 HA ALA 48 1.708 -7.938 8.355 299 HB1 ALA 48 1HB ALA 48 -0.322 -9.340 9.890 300 HB2 ALA 48 2HB ALA 48 -0.437 -7.795 9.012 301 HB3 ALA 48 3HB ALA 48 -0.742 -9.328 8.160 302 H ASN 49 H ASN 49 2.350 -11.320 8.678 303 HA ASN 49 HA ASN 49 2.812 -11.412 11.419 304 HB3 ASN 49 2HB ASN 49 4.611 -13.235 10.201 305 HD21 ASN 49 1HD2 ASN 49 1.341 -13.952 9.474 306 HD22 ASN 49 2HD2 ASN 49 0.935 -14.862 10.892 307 H ALA 50 H ALA 50 4.482 -9.927 8.747 308 HA ALA 50 HA ALA 50 6.890 -9.620 10.408 309 HB1 ALA 50 1HB ALA 50 6.518 -10.485 7.626 310 HB2 ALA 50 2HB ALA 50 7.644 -9.114 7.776 311 HB3 ALA 50 3HB ALA 50 7.946 -10.618 8.680 312 HA PRO 51 HA PRO 51 5.922 -5.401 10.170 313 HB3 PRO 51 2HB PRO 51 7.001 -4.976 12.159 314 HG3 PRO 51 2HG PRO 51 8.539 -6.578 12.783 315 HD3 PRO 51 2HD PRO 51 7.719 -8.397 11.642 316 H ILE 52 H ILE 52 9.359 -5.418 9.406 317 HA ILE 52 HA ILE 52 8.627 -4.014 6.938 318 HB ILE 52 HB ILE 52 11.165 -3.444 7.076 319 HG13 ILE 52 2HG1 ILE 52 10.587 -4.032 9.994 320 HG21 ILE 52 1HG2 ILE 52 9.938 -1.558 7.192 321 HG22 ILE 52 2HG2 ILE 52 8.791 -2.242 8.369 322 HG23 ILE 52 3HG2 ILE 52 10.369 -1.627 8.918 323 HD11 ILE 52 3HD1 ILE 52 11.077 -6.129 8.894 324 HD12 ILE 52 1HD1 ILE 52 12.366 -5.382 7.920 325 HD13 ILE 52 2HD1 ILE 52 12.583 -5.590 9.673 326 H SER 53 H SER 53 10.181 -4.457 5.051 327 HA SER 53 HA SER 53 11.857 -6.358 4.642 328 HB3 SER 53 2HB SER 53 10.150 -8.361 3.944 329 HG SER 53 HG SER 53 11.647 -7.794 6.287 330 H GLU 54 H GLU 54 8.910 -4.757 3.731 331 HA GLU 54 HA GLU 54 8.827 -5.626 1.061 332 HB3 GLU 54 2HB GLU 54 6.917 -4.598 2.392 333 HG3 GLU 54 2HG GLU 54 7.900 -1.897 1.507 334 HE2 GLU 54 HE GLU 54 6.645 -2.218 4.990 335 H ILE 55 H ILE 55 9.753 -4.758 -0.811 336 HA ILE 55 HA ILE 55 11.193 -2.254 -0.587 337 HB ILE 55 HB ILE 55 12.627 -4.749 -1.486 338 HG13 ILE 55 2HG1 ILE 55 13.732 -4.886 0.601 339 HG21 ILE 55 1HG2 ILE 55 14.566 -3.014 -0.894 340 HG22 ILE 55 2HG2 ILE 55 13.796 -3.086 -2.497 341 HG23 ILE 55 3HG2 ILE 55 13.288 -1.851 -1.319 342 HD11 ILE 55 3HD1 ILE 55 12.787 -3.201 2.451 343 HD12 ILE 55 1HD1 ILE 55 14.166 -2.750 1.419 344 HD13 ILE 55 2HD1 ILE 55 12.533 -2.157 1.033 345 H GLU 56 H GLU 56 10.726 -1.066 -2.356 346 HA GLU 56 HA GLU 56 10.319 -2.517 -4.832 347 HB3 GLU 56 2HB GLU 56 8.310 -1.087 -5.337 348 HG3 GLU 56 2HG GLU 56 8.489 -3.269 -3.402 349 HE2 GLU 56 HE GLU 56 5.589 -1.566 -4.042 350 H SER 57 H SER 57 11.651 -1.649 -6.358 351 HA SER 57 HA SER 57 11.718 0.874 -7.178 352 HB3 SER 57 2HB SER 57 14.210 1.217 -5.867 353 HG SER 57 HG SER 57 12.425 2.714 -4.583 354 H SER 58 H SER 58 13.282 1.149 -8.893 355 HA SER 58 HA SER 58 14.398 -1.311 -9.733 356 HB3 SER 58 2HB SER 58 13.542 1.055 -10.969 357 HG SER 58 HG SER 58 16.337 0.633 -11.582 358 H LEU 59 H LEU 59 16.774 -1.381 -10.559 359 HA LEU 59 HA LEU 59 18.688 0.371 -9.563 360 HB3 LEU 59 2HB LEU 59 18.454 -2.116 -7.873 361 HG LEU 59 HG LEU 59 20.219 0.325 -7.741 362 HD11 LEU 59 1HD1 LEU 59 19.370 -1.463 -5.456 363 HD12 LEU 59 2HD1 LEU 59 20.859 -0.487 -5.430 364 HD13 LEU 59 3HD1 LEU 59 19.274 0.311 -5.571 365 HD21 LEU 59 3HD2 LEU 59 21.912 -1.071 -8.145 366 HD22 LEU 59 1HD2 LEU 59 21.307 -2.289 -6.996 367 HD23 LEU 59 2HD2 LEU 59 20.667 -2.235 -8.656 368 H LEU 60 H LEU 60 17.724 -2.947 -10.493 369 HA LEU 60 HA LEU 60 20.284 -3.150 -11.922 370 HB3 LEU 60 2HB LEU 60 19.494 -5.686 -11.848 371 HG LEU 60 HG LEU 60 21.012 -6.157 -10.190 372 HD11 LEU 60 1HD1 LEU 60 21.882 -3.318 -10.737 373 HD12 LEU 60 2HD1 LEU 60 22.886 -4.766 -10.479 374 HD13 LEU 60 3HD1 LEU 60 21.940 -4.594 -11.976 375 HD21 LEU 60 3HD2 LEU 60 20.405 -5.476 -8.149 376 HD22 LEU 60 1HD2 LEU 60 21.435 -4.060 -8.467 377 HD23 LEU 60 2HD2 LEU 60 19.681 -3.968 -8.759 378 HA PRO 61 HA PRO 61 17.915 -3.125 -15.536 379 HB3 PRO 61 2HB PRO 61 19.715 -2.420 -16.787 380 HG3 PRO 61 2HG PRO 61 21.773 -2.847 -15.838 381 HD3 PRO 61 2HD PRO 61 21.182 -2.972 -13.619 382 H SER 62 H SER 62 18.546 -5.781 -13.826 383 HA SER 62 HA SER 62 17.031 -7.364 -15.749 384 HB3 SER 62 2HB SER 62 18.460 -9.139 -15.586 385 HG SER 62 HG SER 62 20.350 -7.451 -14.241 386 H THR 63 H THR 63 15.400 -8.757 -14.828 387 HA THR 63 HA THR 63 14.338 -7.791 -12.363 388 HB THR 63 HB THR 63 13.592 -9.641 -14.598 389 HG1 THR 63 1HG THR 63 11.574 -8.367 -14.028 390 HG21 THR 63 3HG2 THR 63 13.205 -11.094 -12.564 391 HG22 THR 63 1HG2 THR 63 12.254 -9.773 -11.845 392 HG23 THR 63 2HG2 THR 63 11.684 -10.573 -13.329 393 H GLU 64 H GLU 64 16.125 -10.727 -13.400 394 HA GLU 64 HA GLU 64 15.724 -12.169 -11.095 395 HB3 GLU 64 2HB GLU 64 18.217 -12.990 -11.859 396 HG3 GLU 64 2HG GLU 64 15.575 -13.503 -13.304 397 HE2 GLU 64 HE GLU 64 15.713 -15.004 -14.816 398 H ALA 65 H ALA 65 18.228 -9.705 -11.931 399 HA ALA 65 HA ALA 65 19.539 -10.014 -9.397 400 HB1 ALA 65 1HB ALA 65 20.460 -9.282 -11.765 401 HB2 ALA 65 2HB ALA 65 19.921 -7.667 -11.246 402 HB3 ALA 65 3HB ALA 65 21.123 -8.556 -10.280 403 H ALA 66 H ALA 66 17.396 -7.574 -11.006 404 HA ALA 66 HA ALA 66 17.341 -5.693 -9.023 405 HB1 ALA 66 1HB ALA 66 15.180 -6.664 -10.929 406 HB2 ALA 66 2HB ALA 66 15.037 -5.189 -9.943 407 HB3 ALA 66 3HB ALA 66 16.318 -5.317 -11.172 408 H LYS 67 H LYS 67 15.530 -8.796 -9.280 409 HA LYS 67 HA LYS 67 13.910 -8.320 -7.028 410 HB3 LYS 67 2HB LYS 67 13.429 -9.943 -8.857 411 HG3 LYS 67 2HG LYS 67 15.936 -11.135 -7.787 412 HD3 LYS 67 2HD LYS 67 13.440 -12.613 -7.586 413 HE3 LYS 67 2HE LYS 67 14.207 -14.645 -8.856 414 HZ1 LYS 67 2HZ LYS 67 13.905 -13.426 -11.147 415 HZ3 LYS 67 1HZ LYS 67 13.516 -12.141 -10.224 416 H LYS 68 H LYS 68 17.193 -9.646 -7.512 417 HA LYS 68 HA LYS 68 17.435 -10.695 -4.904 418 HB3 LYS 68 2HB LYS 68 20.004 -10.126 -5.807 419 HG3 LYS 68 2HG LYS 68 18.130 -12.500 -6.170 420 HD3 LYS 68 2HD LYS 68 21.036 -12.155 -6.995 421 HE3 LYS 68 2HE LYS 68 20.007 -14.911 -7.074 422 HZ1 LYS 68 2HZ LYS 68 22.223 -15.189 -5.920 423 HZ3 LYS 68 1HZ LYS 68 22.441 -13.579 -6.030 424 H ASP 69 H ASP 69 17.901 -7.485 -6.382 425 HA ASP 69 HA ASP 69 19.416 -6.378 -4.365 426 HB3 ASP 69 2HB ASP 69 17.254 -4.926 -5.949 427 HD2 ASP 69 HD ASP 69 17.335 -2.934 -4.931 428 H ALA 70 H ALA 70 15.845 -5.963 -5.029 429 HA ALA 70 HA ALA 70 15.236 -4.760 -2.608 430 HB1 ALA 70 1HB ALA 70 12.884 -5.778 -3.225 431 HB2 ALA 70 2HB ALA 70 13.620 -4.544 -4.275 432 HB3 ALA 70 3HB ALA 70 13.707 -6.263 -4.728 433 H CYS 71 H CYS 71 15.523 -8.204 -3.559 434 HA CYS 71 HA CYS 71 14.331 -9.247 -1.257 435 HB3 CYS 71 2HB CYS 71 15.889 -11.280 -1.938 436 HG CYS 71 HG CYS 71 13.511 -11.791 -2.148 437 H LEU 72 H LEU 72 17.752 -8.479 -2.186 438 HA LEU 72 HA LEU 72 18.845 -9.360 0.262 439 HB3 LEU 72 2HB LEU 72 20.778 -7.845 -0.588 440 HG LEU 72 HG LEU 72 20.096 -9.928 -2.629 441 HD11 LEU 72 1HD1 LEU 72 22.251 -9.721 -3.100 442 HD12 LEU 72 2HD1 LEU 72 22.406 -8.479 -1.836 443 HD13 LEU 72 3HD1 LEU 72 22.682 -10.192 -1.439 444 HD21 LEU 72 3HD2 LEU 72 20.565 -10.446 0.301 445 HD22 LEU 72 1HD2 LEU 72 19.334 -11.133 -0.785 446 HD23 LEU 72 2HD2 LEU 72 21.036 -11.630 -0.940 447 H LYS 73 H LYS 73 17.852 -6.128 -1.025 448 HA LYS 73 HA LYS 73 18.665 -4.691 1.228 449 HB3 LYS 73 2HB LYS 73 16.326 -3.680 -0.272 450 HG3 LYS 73 2HG LYS 73 19.139 -2.721 0.410 451 HD3 LYS 73 2HD LYS 73 17.350 -1.822 -1.712 452 HE3 LYS 73 2HE LYS 73 17.335 -0.223 0.746 453 HZ1 LYS 73 2HZ LYS 73 18.559 1.523 0.088 454 HZ3 LYS 73 1HZ LYS 73 17.761 1.642 -1.327 455 H ALA 74 H ALA 74 15.770 -6.628 0.493 456 HA ALA 74 HA ALA 74 14.182 -5.612 2.585 457 HB1 ALA 74 1HB ALA 74 13.133 -6.763 0.773 458 HB2 ALA 74 2HB ALA 74 14.186 -8.184 0.971 459 HB3 ALA 74 3HB ALA 74 12.947 -7.816 2.196 460 H VAL 75 H VAL 75 16.424 -8.439 2.292 461 HA VAL 75 HA VAL 75 15.960 -9.510 4.797 462 HB VAL 75 HB VAL 75 18.573 -9.441 3.280 463 HG11 VAL 75 1HG1 VAL 75 18.045 -10.508 5.756 464 HG12 VAL 75 2HG1 VAL 75 17.751 -11.898 4.683 465 HG13 VAL 75 3HG1 VAL 75 19.324 -11.064 4.649 466 HG21 VAL 75 3HG2 VAL 75 17.656 -10.636 1.637 467 HG22 VAL 75 1HG2 VAL 75 17.035 -11.826 2.806 468 HG23 VAL 75 2HG2 VAL 75 16.059 -10.398 2.386 469 H HIS 76 H HIS 76 18.096 -6.818 3.737 470 HA HIS 76 HA HIS 76 19.448 -6.532 6.151 471 HB3 HIS 76 2HB HIS 76 19.311 -3.988 5.042 472 HD1 HIS 76 1HD HIS 76 21.425 -5.271 6.712 473 HD2 HIS 76 2HD HIS 76 21.547 -5.383 2.520 474 HE1 HIS 76 1HE HIS 76 23.862 -5.684 6.078 475 H GLU 77 H GLU 77 16.404 -5.027 4.900 476 HA GLU 77 HA GLU 77 16.006 -3.346 7.039 477 HB3 GLU 77 2HB GLU 77 13.480 -3.708 6.306 478 HG3 GLU 77 2HG GLU 77 14.313 -2.599 3.951 479 HE2 GLU 77 HE GLU 77 14.261 0.437 5.062 480 H LEU 78 H LEU 78 15.465 -6.834 6.661 481 HA LEU 78 HA LEU 78 13.896 -6.961 9.089 482 HB3 LEU 78 2HB LEU 78 14.911 -9.165 7.287 483 HG LEU 78 HG LEU 78 13.895 -9.615 9.722 484 HD11 LEU 78 1HD1 LEU 78 11.811 -8.815 9.888 485 HD12 LEU 78 2HD1 LEU 78 11.619 -8.664 8.124 486 HD13 LEU 78 3HD1 LEU 78 11.352 -10.235 8.918 487 HD21 LEU 78 3HD2 LEU 78 14.245 -11.077 7.335 488 HD22 LEU 78 1HD2 LEU 78 14.090 -11.700 8.996 489 HD23 LEU 78 2HD2 LEU 78 12.644 -11.524 7.974 490 H HIS 79 H HIS 79 17.224 -7.413 7.937 491 HA HIS 79 HA HIS 79 18.067 -8.833 10.240 492 HB3 HIS 79 2HB HIS 79 20.029 -7.284 8.632 493 HD1 HIS 79 1HD HIS 79 21.891 -8.132 10.172 494 HD2 HIS 79 2HD HIS 79 19.470 -11.199 8.645 495 HE1 HIS 79 1HE HIS 79 23.054 -10.324 10.766 496 H ASN 80 H ASN 80 18.197 -5.388 9.149 497 HA ASN 80 HA ASN 80 19.658 -4.459 11.283 498 HB3 ASN 80 2HB ASN 80 17.446 -2.740 10.156 499 HD21 ASN 80 1HD2 ASN 80 18.311 -0.655 9.543 500 HD22 ASN 80 2HD2 ASN 80 19.696 -0.010 10.358 501 H LEU 81 H LEU 81 16.178 -5.184 10.833 502 HA LEU 81 HA LEU 81 15.538 -4.052 13.435 503 HB3 LEU 81 2HB LEU 81 13.423 -5.424 11.950 504 HG LEU 81 HG LEU 81 13.567 -2.476 12.556 505 HD11 LEU 81 1HD1 LEU 81 11.686 -2.852 11.278 506 HD12 LEU 81 2HD1 LEU 81 11.408 -4.472 11.962 507 HD13 LEU 81 3HD1 LEU 81 11.036 -3.022 12.926 508 HD21 LEU 81 3HD2 LEU 81 12.315 -3.146 14.715 509 HD22 LEU 81 1HD2 LEU 81 13.081 -4.736 14.483 510 HD23 LEU 81 2HD2 LEU 81 14.089 -3.281 14.674 511 H GLY 82 H GLY 82 14.417 -7.100 11.837 512 HA2 GLY 82 1HA GLY 82 14.207 -9.188 12.640 513 HA3 GLY 82 2HA GLY 82 15.750 -8.925 13.431 514 H VAL 83 H VAL 83 12.306 -7.802 13.833 515 HA VAL 83 HA VAL 83 12.645 -8.325 16.707 516 HB VAL 83 HB VAL 83 12.408 -5.939 16.034 517 HG11 VAL 83 1HG1 VAL 83 10.575 -6.803 14.217 518 HG12 VAL 83 2HG1 VAL 83 9.506 -6.227 15.519 519 HG13 VAL 83 3HG1 VAL 83 10.701 -5.123 14.795 520 HG21 VAL 83 3HG2 VAL 83 10.395 -5.518 17.609 521 HG22 VAL 83 1HG2 VAL 83 10.364 -7.287 17.798 522 HG23 VAL 83 2HG2 VAL 83 11.818 -6.368 18.257 523 H LEU 84 H LEU 84 11.277 -9.416 13.815 524 HA LEU 84 HA LEU 84 9.032 -10.620 15.281 525 HB3 LEU 84 2HB LEU 84 8.661 -10.828 12.477 526 HG LEU 84 HG LEU 84 6.651 -9.650 12.776 527 HD11 LEU 84 1HD1 LEU 84 7.147 -11.823 14.237 528 HD12 LEU 84 2HD1 LEU 84 6.818 -10.684 15.566 529 HD13 LEU 84 3HD1 LEU 84 5.592 -10.958 14.305 530 HD21 LEU 84 3HD2 LEU 84 6.447 -8.464 15.207 531 HD22 LEU 84 1HD2 LEU 84 8.165 -8.177 14.842 532 HD23 LEU 84 2HD2 LEU 84 6.910 -7.620 13.710 533 H ASN 85 H ASN 85 11.853 -11.500 15.296 534 HA ASN 85 HA ASN 85 12.406 -13.440 13.487 535 HB3 ASN 85 2HB ASN 85 13.944 -12.644 15.316 536 HD21 ASN 85 1HD2 ASN 85 12.896 -11.565 16.991 537 HD22 ASN 85 2HD2 ASN 85 12.436 -12.347 18.467 538 H ASP 86 H ASP 86 9.931 -13.312 15.958 539 HA ASP 86 HA ASP 86 9.691 -15.998 16.557 540 HB3 ASP 86 2HB ASP 86 7.146 -15.193 16.858 541 HD2 ASP 86 HD ASP 86 7.267 -13.104 18.686 542 H PHE 87 H PHE 87 8.924 -14.099 13.709 543 HA PHE 87 HA PHE 87 7.013 -16.049 12.725 544 HB3 PHE 87 2HB PHE 87 8.177 -13.358 11.827 545 HD1 PHE 87 1HD PHE 87 5.589 -15.856 10.797 546 HD2 PHE 87 2HD PHE 87 8.215 -12.740 9.613 547 HE1 PHE 87 1HE PHE 87 4.885 -16.170 8.409 548 HE2 PHE 87 2HE PHE 87 7.511 -13.053 7.225 549 HZ PHE 87 HZ PHE 87 5.855 -14.765 6.651 550 H LEU 88 H LEU 88 10.415 -15.431 12.686 551 HA LEU 88 HA LEU 88 10.828 -16.600 10.081 552 HB3 LEU 88 2HB LEU 88 13.254 -16.370 10.793 553 HG LEU 88 HG LEU 88 11.567 -13.851 10.803 554 HD11 LEU 88 1HD1 LEU 88 14.272 -14.133 11.496 555 HD12 LEU 88 2HD1 LEU 88 14.264 -13.510 9.829 556 HD13 LEU 88 3HD1 LEU 88 13.395 -12.632 11.110 557 HD21 LEU 88 3HD2 LEU 88 11.156 -14.543 8.699 558 HD22 LEU 88 1HD2 LEU 88 12.787 -13.902 8.389 559 HD23 LEU 88 2HD2 LEU 88 12.554 -15.643 8.668 560 H LEU 89 H LEU 89 12.060 -18.591 9.745 561 HA LEU 89 HA LEU 89 11.098 -20.667 11.378 562 HB3 LEU 89 2HB LEU 89 12.782 -22.008 9.977 563 HG LEU 89 HG LEU 89 10.349 -20.633 9.036 564 HD11 LEU 89 1HD1 LEU 89 11.905 -20.040 7.216 565 HD12 LEU 89 2HD1 LEU 89 12.281 -21.766 6.994 566 HD13 LEU 89 3HD1 LEU 89 10.632 -21.168 6.688 567 HD21 LEU 89 3HD2 LEU 89 10.702 -23.302 8.048 568 HD22 LEU 89 1HD2 LEU 89 11.181 -23.238 9.761 569 HD23 LEU 89 2HD2 LEU 89 9.560 -22.690 9.268 570 HA PRO 90 HA PRO 90 14.212 -21.035 14.341 571 HB3 PRO 90 2HB PRO 90 13.087 -22.698 15.466 572 HG3 PRO 90 2HG PRO 90 11.614 -23.911 14.170 573 HD3 PRO 90 2HD PRO 90 11.185 -22.385 12.505 574 H ASP 91 H ASP 91 16.123 -22.978 14.922 575 HA ASP 91 HA ASP 91 18.052 -22.138 13.047 576 HB3 ASP 91 2HB ASP 91 18.874 -24.426 14.675 577 HD2 ASP 91 HD ASP 91 19.138 -20.831 15.275 578 H SER 92 H SER 92 15.808 -24.803 13.358 579 HA SER 92 HA SER 92 17.198 -26.855 12.199 580 HB3 SER 92 2HB SER 92 14.958 -27.056 13.267 581 HG SER 92 HG SER 92 13.751 -26.233 10.806 582 H LYS 93 H LYS 93 15.522 -24.035 10.756 583 HA LYS 93 HA LYS 93 15.869 -25.042 8.081 584 HB3 LYS 93 2HB LYS 93 15.100 -22.468 7.756 585 HG3 LYS 93 2HG LYS 93 12.697 -23.444 8.051 586 HD3 LYS 93 2HD LYS 93 14.793 -24.740 6.253 587 HE3 LYS 93 2HE LYS 93 12.608 -25.202 4.848 588 HZ1 LYS 93 2HZ LYS 93 13.297 -27.252 5.406 589 HZ3 LYS 93 1HZ LYS 93 12.425 -27.186 6.779 590 H ASP 94 H ASP 94 17.914 -23.746 10.411 591 HA ASP 94 HA ASP 94 19.322 -21.893 8.871 592 HB3 ASP 94 2HB ASP 94 20.544 -23.606 11.066 593 HD2 ASP 94 HD ASP 94 21.505 -19.749 10.532 594 H GLU 95 H GLU 95 19.037 -25.341 8.794 595 HA GLU 95 HA GLU 95 21.683 -25.915 7.982 596 HB3 GLU 95 2HB GLU 95 20.562 -28.143 7.274 597 HG3 GLU 95 2HG GLU 95 19.764 -28.333 9.918 598 HE2 GLU 95 HE GLU 95 22.849 -27.910 10.671 599 H ILE 96 H ILE 96 21.383 -23.887 6.390 600 HA ILE 96 HA ILE 96 20.619 -25.037 3.798 601 HB ILE 96 HB ILE 96 20.219 -22.486 3.282 602 HG13 ILE 96 2HG1 ILE 96 19.920 -22.664 6.278 603 HG21 ILE 96 1HG2 ILE 96 17.869 -22.850 3.548 604 HG22 ILE 96 2HG2 ILE 96 18.619 -24.394 3.077 605 HG23 ILE 96 3HG2 ILE 96 18.145 -24.113 4.769 606 HD11 ILE 96 3HD1 ILE 96 20.873 -20.320 4.617 607 HD12 ILE 96 1HD1 ILE 96 21.282 -20.746 6.297 608 HD13 ILE 96 2HD1 ILE 96 21.976 -21.678 4.949 609 H GLU 97 H GLU 97 21.733 -23.642 1.958 610 HA GLU 97 HA GLU 97 24.457 -23.138 2.876 611 HB3 GLU 97 2HB GLU 97 25.210 -23.992 0.626 612 HG3 GLU 97 2HG GLU 97 23.542 -25.916 2.315 613 HE2 GLU 97 HE GLU 97 23.087 -27.203 0.602 614 H ASP 98 H ASP 98 25.662 -21.483 1.663 615 HA ASP 98 HA ASP 98 24.080 -19.275 1.119 616 HB3 ASP 98 2HB ASP 98 26.229 -18.647 1.711 617 HD2 ASP 98 HD ASP 98 27.425 -20.125 2.706 618 H GLU 99 H GLU 99 25.618 -21.820 -0.902 619 HA GLU 99 HA GLU 99 25.085 -20.482 -3.338 620 HB3 GLU 99 2HB GLU 99 26.954 -22.111 -3.038 621 HG3 GLU 99 2HG GLU 99 24.791 -24.257 -3.129 622 HE2 GLU 99 HE GLU 99 27.150 -25.507 -1.218 623 H LEU 100 H LEU 100 23.412 -22.828 -1.247 624 HA LEU 100 HA LEU 100 21.513 -23.599 -3.218 625 HB3 LEU 100 2HB LEU 100 21.417 -23.838 -0.208 626 HG LEU 100 HG LEU 100 19.266 -24.340 -1.536 627 HD11 LEU 100 1HD1 LEU 100 19.282 -26.699 -2.490 628 HD12 LEU 100 2HD1 LEU 100 20.062 -25.430 -3.466 629 HD13 LEU 100 3HD1 LEU 100 21.057 -26.564 -2.521 630 HD21 LEU 100 3HD2 LEU 100 18.920 -26.493 -0.229 631 HD22 LEU 100 1HD2 LEU 100 20.606 -26.318 0.313 632 HD23 LEU 100 2HD2 LEU 100 19.410 -25.060 0.706 633 H SER 101 H SER 101 22.106 -20.655 -1.763 634 HA SER 101 HA SER 101 19.681 -19.814 -0.852 635 HB3 SER 101 2HB SER 101 21.827 -18.538 -0.713 636 HG SER 101 HG SER 101 22.803 -18.392 -2.647 637 H ASP 102 H ASP 102 17.863 -18.730 -1.835 638 HA ASP 102 HA ASP 102 16.365 -18.347 -3.354 639 HB3 ASP 102 2HB ASP 102 18.767 -18.280 -5.237 640 HD2 ASP 102 HD ASP 102 16.302 -18.561 -7.653 Start of MODEL 3 1 H1 ILE 1 H ILE 1 25.092 -26.415 6.817 2 HA ILE 1 HA ILE 1 24.965 -24.790 9.050 3 HB ILE 1 HB ILE 1 24.789 -27.100 10.137 4 HG13 ILE 1 2HG1 ILE 1 26.577 -24.832 10.897 5 HG21 ILE 1 1HG2 ILE 1 26.539 -28.186 8.784 6 HG22 ILE 1 2HG2 ILE 1 27.757 -27.126 9.529 7 HG23 ILE 1 3HG2 ILE 1 26.862 -28.294 10.530 8 HD11 ILE 1 3HD1 ILE 1 24.249 -24.529 11.370 9 HD12 ILE 1 1HD1 ILE 1 24.078 -26.196 11.970 10 HD13 ILE 1 2HD1 ILE 1 24.985 -24.997 12.921 11 H SER 2 H SER 2 26.578 -23.313 8.807 12 HA SER 2 HA SER 2 28.479 -22.423 8.217 13 HB3 SER 2 2HB SER 2 29.548 -25.108 7.274 14 HG SER 2 HG SER 2 30.605 -22.607 7.628 15 H GLY 3 H GLY 3 29.362 -21.480 6.260 16 HA2 GLY 3 1HA GLY 3 29.720 -21.843 3.851 17 HA3 GLY 3 2HA GLY 3 28.097 -22.499 3.784 18 H GLY 4 H GLY 4 30.011 -19.669 3.496 19 HA2 GLY 4 1HA GLY 4 29.541 -17.454 3.407 20 HA3 GLY 4 2HA GLY 4 28.172 -18.007 2.461 21 H SER 5 H SER 5 29.271 -16.818 5.608 22 HA SER 5 HA SER 5 26.835 -17.258 6.936 23 HB3 SER 5 2HB SER 5 29.030 -16.925 8.084 24 HG SER 5 HG SER 5 29.618 -15.035 6.626 25 H SER 6 H SER 6 28.243 -14.602 4.982 26 HA SER 6 HA SER 6 26.417 -12.649 5.680 27 HB3 SER 6 2HB SER 6 28.255 -11.811 4.525 28 HG SER 6 HG SER 6 27.877 -13.956 2.614 29 H ILE 7 H ILE 7 26.298 -15.354 3.345 30 HA ILE 7 HA ILE 7 24.015 -14.432 1.957 31 HB ILE 7 HB ILE 7 25.452 -17.057 2.197 32 HG13 ILE 7 2HG1 ILE 7 26.498 -16.471 0.295 33 HG21 ILE 7 1HG2 ILE 7 23.119 -17.660 1.988 34 HG22 ILE 7 2HG2 ILE 7 22.912 -16.524 0.634 35 HG23 ILE 7 3HG2 ILE 7 23.957 -17.954 0.446 36 HD11 ILE 7 3HD1 ILE 7 23.858 -15.208 -0.554 37 HD12 ILE 7 1HD1 ILE 7 25.345 -15.097 -1.527 38 HD13 ILE 7 2HD1 ILE 7 24.612 -16.686 -1.198 39 H SER 8 H SER 8 24.582 -16.253 4.962 40 HA SER 8 HA SER 8 22.363 -17.584 5.391 41 HB3 SER 8 2HB SER 8 23.503 -15.604 7.413 42 HG SER 8 HG SER 8 21.722 -17.777 7.561 43 H MET 9 H MET 9 22.627 -14.050 5.117 44 HA MET 9 HA MET 9 19.873 -13.756 5.954 45 HB3 MET 9 2HB MET 9 20.429 -11.283 5.719 46 HG3 MET 9 2HG MET 9 21.067 -12.821 7.795 47 HE1 MET 9 3HE MET 9 22.594 -14.400 8.758 48 HE2 MET 9 1HE MET 9 24.345 -14.133 8.927 49 HE3 MET 9 2HE MET 9 23.196 -12.959 9.612 50 H MET 10 H MET 10 22.022 -12.970 3.132 51 HA MET 10 HA MET 10 20.000 -12.001 1.524 52 HB3 MET 10 2HB MET 10 22.722 -13.285 1.030 53 HG3 MET 10 2HG MET 10 20.709 -12.312 -1.044 54 HE1 MET 10 3HE MET 10 22.725 -13.014 -3.938 55 HE2 MET 10 1HE MET 10 21.189 -12.392 -3.287 56 HE3 MET 10 2HE MET 10 22.423 -11.261 -3.893 57 H TYR 11 H TYR 11 20.753 -15.258 2.521 58 HA TYR 11 HA TYR 11 19.701 -16.602 0.255 59 HB3 TYR 11 2HB TYR 11 20.527 -17.098 3.129 60 HD1 TYR 11 2HD TYR 11 18.622 -18.921 0.462 61 HD2 TYR 11 1HD TYR 11 19.810 -18.788 4.570 62 HE1 TYR 11 2HE TYR 11 17.120 -20.908 0.968 63 HE2 TYR 11 1HE TYR 11 18.304 -20.775 5.062 64 HH TYR 11 HH TYR 11 17.352 -22.658 3.838 65 H LYS 12 H LYS 12 18.384 -15.919 3.576 66 HA LYS 12 HA LYS 12 16.005 -17.097 3.480 67 HB3 LYS 12 2HB LYS 12 15.704 -14.337 4.395 68 HG3 LYS 12 2HG LYS 12 14.884 -16.919 5.130 69 HD3 LYS 12 2HD LYS 12 16.116 -16.045 7.648 70 HE3 LYS 12 2HE LYS 12 16.784 -18.487 7.684 71 HZ1 LYS 12 2HZ LYS 12 14.068 -18.775 6.896 72 HZ3 LYS 12 1HZ LYS 12 14.234 -17.424 7.790 73 H TYR 13 H TYR 13 16.862 -14.033 1.776 74 HA TYR 13 HA TYR 13 14.346 -13.430 0.804 75 HB3 TYR 13 2HB TYR 13 17.224 -12.883 0.332 76 HD1 TYR 13 1HD TYR 13 14.246 -12.815 -1.949 77 HD2 TYR 13 2HD TYR 13 18.503 -12.585 -1.590 78 HE1 TYR 13 1HE TYR 13 14.464 -12.766 -4.482 79 HE2 TYR 13 2HE TYR 13 18.707 -12.537 -4.124 80 HH TYR 13 HH TYR 13 16.845 -11.684 -6.062 81 H CYS 14 H CYS 14 16.995 -15.355 -0.779 82 HA CYS 14 HA CYS 14 15.591 -15.930 -3.080 83 HB3 CYS 14 2HB CYS 14 17.216 -17.667 -3.471 84 HG CYS 14 HG CYS 14 17.890 -15.112 -3.753 85 H SER 15 H SER 15 15.715 -17.537 0.146 86 HA SER 15 HA SER 15 14.406 -19.835 -0.445 87 HB3 SER 15 2HB SER 15 13.631 -18.469 2.105 88 HG SER 15 HG SER 15 13.456 -20.552 2.550 89 H ARG 16 H ARG 16 13.228 -16.575 -0.606 90 HA ARG 16 HA ARG 16 10.524 -17.203 -0.088 91 HB3 ARG 16 2HB ARG 16 10.081 -14.897 -0.700 92 HG3 ARG 16 2HG ARG 16 12.502 -13.888 0.224 93 HD3 ARG 16 2HD ARG 16 9.974 -13.948 1.160 94 HE ARG 16 HE ARG 16 10.639 -16.396 2.065 95 HH11 ARG 16 2HH2 ARG 16 10.434 -13.348 3.859 96 HH12 ARG 16 1HH2 ARG 16 10.024 -14.114 5.358 97 HH22 ARG 16 1HH ARG 16 9.831 -16.501 5.442 98 H LEU 17 H LEU 17 12.453 -18.303 -2.478 99 HA LEU 17 HA LEU 17 11.238 -17.597 -4.869 100 HB3 LEU 17 2HB LEU 17 12.135 -20.333 -4.875 101 HG LEU 17 HG LEU 17 12.398 -18.256 -6.589 102 HD11 LEU 17 1HD1 LEU 17 14.267 -17.042 -6.405 103 HD12 LEU 17 2HD1 LEU 17 14.287 -17.588 -4.711 104 HD13 LEU 17 3HD1 LEU 17 15.251 -18.448 -5.935 105 HD21 LEU 17 3HD2 LEU 17 14.411 -19.764 -7.501 106 HD22 LEU 17 1HD2 LEU 17 13.756 -20.885 -6.283 107 HD23 LEU 17 2HD2 LEU 17 12.707 -20.271 -7.584 108 HA PRO 18 HA PRO 18 7.378 -19.538 -4.172 109 HB3 PRO 18 2HB PRO 18 6.200 -17.652 -4.768 110 HG3 PRO 18 2HG PRO 18 7.440 -16.048 -5.868 111 HD3 PRO 18 2HD PRO 18 9.548 -16.578 -5.119 112 H HIS 19 H HIS 19 6.234 -21.346 -4.857 113 HA HIS 19 HA HIS 19 5.746 -23.010 -6.264 114 HB3 HIS 19 2HB HIS 19 7.940 -22.310 -8.191 115 HD1 HIS 19 1HD HIS 19 7.503 -23.386 -10.461 116 HD2 HIS 19 2HD HIS 19 4.311 -23.846 -7.779 117 HE1 HIS 19 1HE HIS 19 5.886 -25.033 -11.549 118 H ASP 20 H ASP 20 8.820 -22.145 -4.950 119 HA ASP 20 HA ASP 20 10.046 -24.655 -5.446 120 HB3 ASP 20 2HB ASP 20 10.699 -22.337 -3.574 121 HD2 ASP 20 HD ASP 20 11.886 -25.282 -4.847 122 H GLU 21 H GLU 21 9.737 -26.511 -4.192 123 HA GLU 21 HA GLU 21 7.846 -26.587 -2.206 124 HB3 GLU 21 2HB GLU 21 8.543 -28.570 -3.473 125 HG3 GLU 21 2HG GLU 21 11.011 -28.980 -1.844 126 HE2 GLU 21 HE GLU 21 12.627 -29.806 -3.596 127 H PHE 22 H PHE 22 11.227 -25.649 -2.106 128 HA PHE 22 HA PHE 22 11.467 -26.077 0.728 129 HB3 PHE 22 2HB PHE 22 13.433 -24.278 -0.464 130 HD1 PHE 22 1HD PHE 22 14.383 -24.828 1.748 131 HD2 PHE 22 2HD PHE 22 13.823 -27.806 -1.223 132 HE1 PHE 22 1HE PHE 22 15.936 -26.359 2.990 133 HE2 PHE 22 2HE PHE 22 15.377 -29.338 0.020 134 HZ PHE 22 HZ PHE 22 16.415 -28.595 2.111 135 H PHE 23 H PHE 23 9.571 -24.000 -0.887 136 HA PHE 23 HA PHE 23 10.220 -21.773 0.914 137 HB3 PHE 23 2HB PHE 23 9.611 -22.042 -1.996 138 HD1 PHE 23 2HD PHE 23 7.063 -22.109 -1.878 139 HD2 PHE 23 1HD PHE 23 9.334 -18.707 -0.745 140 HE1 PHE 23 2HE PHE 23 5.026 -20.665 -2.133 141 HE2 PHE 23 1HE PHE 23 7.296 -17.263 -1.000 142 HZ PHE 23 HZ PHE 23 5.168 -18.259 -1.691 143 H GLN 24 H GLN 24 8.605 -21.052 2.265 144 HA GLN 24 HA GLN 24 6.159 -22.571 2.155 145 HB3 GLN 24 2HB GLN 24 7.419 -22.314 4.304 146 HG3 GLN 24 2HG GLN 24 6.453 -19.661 4.970 147 HE21 GLN 24 1HE2 GLN 24 9.583 -19.764 3.620 148 HE22 GLN 24 2HE2 GLN 24 10.502 -20.074 5.056 149 HA PRO 25 HA PRO 25 3.833 -19.265 0.576 150 HB3 PRO 25 2HB PRO 25 2.061 -20.648 0.075 151 HG3 PRO 25 2HG PRO 25 1.983 -22.598 1.302 152 HD3 PRO 25 2HD PRO 25 4.198 -22.806 1.878 153 H LYS 26 H LYS 26 4.046 -17.189 1.086 154 HA LYS 26 HA LYS 26 2.518 -16.023 3.039 155 HB3 LYS 26 2HB LYS 26 4.912 -15.683 4.474 156 HG3 LYS 26 2HG LYS 26 2.172 -16.717 4.859 157 HD3 LYS 26 2HD LYS 26 4.058 -18.540 5.682 158 HE3 LYS 26 2HE LYS 26 4.256 -16.305 7.518 159 HZ1 LYS 26 2HZ LYS 26 2.512 -17.288 8.802 160 HZ3 LYS 26 1HZ LYS 26 3.893 -17.723 9.547 161 HA PRO 27 HA PRO 27 5.931 -13.173 1.472 162 HB3 PRO 27 2HB PRO 27 8.101 -13.786 1.942 163 HG3 PRO 27 2HG PRO 27 8.405 -16.040 2.322 164 HD3 PRO 27 2HD PRO 27 6.284 -16.631 2.984 165 H GLU 28 H GLU 28 6.024 -11.921 -0.415 166 HA GLU 28 HA GLU 28 5.375 -13.440 -2.793 167 HB3 GLU 28 2HB GLU 28 3.692 -11.360 -3.200 168 HG3 GLU 28 2HG GLU 28 2.718 -13.603 -1.413 169 HE2 GLU 28 HE GLU 28 0.488 -11.620 -1.979 170 H PHE 29 H PHE 29 6.334 -12.606 -4.655 171 HA PHE 29 HA PHE 29 7.496 -9.930 -4.425 172 HB3 PHE 29 2HB PHE 29 8.978 -12.187 -4.059 173 HD1 PHE 29 2HD PHE 29 7.533 -13.762 -5.755 174 HD2 PHE 29 1HD PHE 29 10.770 -11.240 -6.837 175 HE1 PHE 29 2HE PHE 29 7.953 -15.174 -7.789 176 HE2 PHE 29 1HE PHE 29 11.190 -12.651 -8.871 177 HZ PHE 29 HZ PHE 29 9.776 -14.600 -9.322 178 H GLN 30 H GLN 30 7.625 -8.763 -6.389 179 HA GLN 30 HA GLN 30 6.758 -10.169 -8.759 180 HB3 GLN 30 2HB GLN 30 5.395 -7.643 -8.767 181 HG3 GLN 30 2HG GLN 30 3.373 -9.346 -8.578 182 HE21 GLN 30 1HE2 GLN 30 4.673 -11.335 -10.676 183 HE22 GLN 30 2HE2 GLN 30 4.616 -10.438 -12.156 184 H PHE 31 H PHE 31 7.729 -9.380 -10.642 185 HA PHE 31 HA PHE 31 9.423 -7.014 -10.242 186 HB3 PHE 31 2HB PHE 31 10.494 -9.347 -10.551 187 HD1 PHE 31 1HD PHE 31 9.836 -8.147 -14.003 188 HD2 PHE 31 2HD PHE 31 9.524 -11.362 -11.251 189 HE1 PHE 31 1HE PHE 31 9.122 -9.672 -15.864 190 HE2 PHE 31 2HE PHE 31 8.811 -12.886 -13.112 191 HZ PHE 31 HZ PHE 31 8.618 -12.023 -15.396 192 H LYS 32 H LYS 32 9.396 -5.388 -11.805 193 HA LYS 32 HA LYS 32 7.394 -5.775 -13.918 194 HB3 LYS 32 2HB LYS 32 7.991 -3.543 -12.066 195 HG3 LYS 32 2HG LYS 32 7.250 -3.110 -14.999 196 HD3 LYS 32 2HD LYS 32 6.773 -0.834 -14.462 197 HE3 LYS 32 2HE LYS 32 5.676 -2.208 -11.984 198 HZ1 LYS 32 2HZ LYS 32 5.185 0.206 -12.935 199 HZ3 LYS 32 1HZ LYS 32 4.008 -0.672 -12.228 200 HA PRO 33 HA PRO 33 10.989 -5.533 -16.420 201 HB3 PRO 33 2HB PRO 33 10.533 -7.520 -17.489 202 HG3 PRO 33 2HG PRO 33 8.390 -8.312 -17.174 203 HD3 PRO 33 2HD PRO 33 7.862 -7.283 -15.187 204 H VAL 34 H VAL 34 11.208 -3.274 -16.239 205 HA VAL 34 HA VAL 34 9.633 -1.830 -18.233 206 HB VAL 34 HB VAL 34 11.169 -1.064 -15.765 207 HG11 VAL 34 1HG1 VAL 34 10.151 0.837 -17.905 208 HG12 VAL 34 2HG1 VAL 34 10.765 1.310 -16.303 209 HG13 VAL 34 3HG1 VAL 34 11.854 0.538 -17.480 210 HG21 VAL 34 3HG2 VAL 34 9.144 -0.542 -14.858 211 HG22 VAL 34 1HG2 VAL 34 8.452 -0.025 -16.413 212 HG23 VAL 34 2HG2 VAL 34 8.590 -1.758 -16.033 213 H ASP 35 H ASP 35 10.875 -0.052 -19.444 214 HA ASP 35 HA ASP 35 12.844 -1.276 -20.935 215 HB3 ASP 35 2HB ASP 35 13.289 1.370 -21.447 216 HD2 ASP 35 HD ASP 35 10.645 -0.806 -21.604 217 H GLU 36 H GLU 36 15.180 -0.511 -21.172 218 HA GLU 36 HA GLU 36 16.420 -0.450 -18.673 219 HB3 GLU 36 2HB GLU 36 17.367 -1.403 -20.826 220 HG3 GLU 36 2HG GLU 36 17.064 1.364 -21.647 221 HE2 GLU 36 HE GLU 36 19.642 1.592 -23.516 222 H PHE 37 H PHE 37 14.833 1.995 -20.412 223 HA PHE 37 HA PHE 37 16.511 4.181 -20.093 224 HB3 PHE 37 2HB PHE 37 13.517 4.396 -19.671 225 HD1 PHE 37 1HD PHE 37 15.991 4.991 -22.415 226 HD2 PHE 37 2HD PHE 37 13.109 6.655 -19.782 227 HE1 PHE 37 1HE PHE 37 16.314 7.239 -23.482 228 HE2 PHE 37 2HE PHE 37 13.432 8.904 -20.849 229 HZ PHE 37 HZ PHE 37 15.031 9.169 -22.687 230 H GLY 38 H GLY 38 15.121 2.197 -17.690 231 HA2 GLY 38 1HA GLY 38 15.728 4.208 -15.651 232 HA3 GLY 38 2HA GLY 38 14.109 3.538 -15.678 233 H GLY 39 H GLY 39 14.664 0.848 -16.491 234 HA2 GLY 39 1HA GLY 39 16.367 -0.822 -15.700 235 HA3 GLY 39 2HA GLY 39 16.135 -0.112 -14.114 236 H THR 40 H THR 40 15.250 -1.948 -13.094 237 HA THR 40 HA THR 40 12.606 -2.744 -14.126 238 HB THR 40 HB THR 40 14.910 -4.374 -12.963 239 HG1 THR 40 1HG THR 40 14.513 -3.864 -15.337 240 HG21 THR 40 3HG2 THR 40 13.328 -5.715 -11.967 241 HG22 THR 40 1HG2 THR 40 11.988 -4.852 -12.760 242 HG23 THR 40 2HG2 THR 40 12.850 -6.145 -13.627 243 H ILE 41 H ILE 41 10.908 -2.861 -12.701 244 HA ILE 41 HA ILE 41 11.527 -1.785 -10.045 245 HB ILE 41 HB ILE 41 8.745 -1.834 -11.046 246 HG13 ILE 41 2HG1 ILE 41 9.139 0.249 -12.387 247 HG21 ILE 41 1HG2 ILE 41 9.002 0.587 -10.116 248 HG22 ILE 41 2HG2 ILE 41 8.944 -0.793 -8.993 249 HG23 ILE 41 3HG2 ILE 41 10.505 -0.043 -9.400 250 HD11 ILE 41 3HD1 ILE 41 11.778 -0.250 -13.274 251 HD12 ILE 41 1HD1 ILE 41 11.213 1.159 -12.344 252 HD13 ILE 41 2HD1 ILE 41 11.873 -0.260 -11.497 253 H CYS 42 H CYS 42 11.465 -3.166 -8.361 254 HA CYS 42 HA CYS 42 10.045 -5.680 -8.792 255 HB3 CYS 42 2HB CYS 42 12.277 -4.946 -6.875 256 HG CYS 42 HG CYS 42 10.923 -6.377 -5.364 257 H ARG 43 H ARG 43 8.759 -6.520 -6.910 258 HA ARG 43 HA ARG 43 8.045 -4.486 -4.998 259 HB3 ARG 43 2HB ARG 43 6.081 -5.839 -6.906 260 HG3 ARG 43 2HG ARG 43 5.688 -5.005 -4.123 261 HD3 ARG 43 2HD ARG 43 3.787 -3.782 -6.174 262 HE ARG 43 HE ARG 43 3.546 -4.233 -3.382 263 HH11 ARG 43 2HH2 ARG 43 3.228 -1.530 -5.652 264 HH12 ARG 43 1HH2 ARG 43 2.072 -0.686 -4.676 265 HH22 ARG 43 1HH ARG 43 1.377 -1.638 -2.590 266 H ILE 44 H ILE 44 8.479 -5.572 -3.095 267 HA ILE 44 HA ILE 44 7.494 -8.334 -2.916 268 HB ILE 44 HB ILE 44 10.124 -7.496 -2.805 269 HG13 ILE 44 2HG1 ILE 44 10.613 -9.758 -2.389 270 HG21 ILE 44 1HG2 ILE 44 10.916 -7.583 -0.608 271 HG22 ILE 44 2HG2 ILE 44 9.476 -6.540 -0.511 272 HG23 ILE 44 3HG2 ILE 44 9.385 -8.237 0.021 273 HD11 ILE 44 3HD1 ILE 44 8.009 -9.724 -0.846 274 HD12 ILE 44 1HD1 ILE 44 8.624 -11.253 -1.518 275 HD13 ILE 44 2HD1 ILE 44 9.603 -10.339 -0.344 276 H THR 45 H THR 45 6.194 -8.832 -1.179 277 HA THR 45 HA THR 45 6.025 -6.898 0.997 278 HB THR 45 HB THR 45 4.291 -5.981 -0.326 279 HG1 THR 45 1HG THR 45 3.037 -8.329 0.895 280 HG21 THR 45 3HG2 THR 45 4.026 -8.810 -1.348 281 HG22 THR 45 1HG2 THR 45 2.559 -7.805 -1.307 282 HG23 THR 45 2HG2 THR 45 3.971 -7.278 -2.253 283 H LEU 46 H LEU 46 6.170 -7.948 2.868 284 HA LEU 46 HA LEU 46 5.728 -10.807 2.842 285 HB3 LEU 46 2HB LEU 46 6.470 -10.312 5.350 286 HG LEU 46 HG LEU 46 8.490 -10.083 3.104 287 HD11 LEU 46 1HD1 LEU 46 10.130 -10.460 4.612 288 HD12 LEU 46 2HD1 LEU 46 8.956 -9.723 5.729 289 HD13 LEU 46 3HD1 LEU 46 9.109 -11.494 5.640 290 HD21 LEU 46 3HD2 LEU 46 7.089 -12.496 4.249 291 HD22 LEU 46 1HD2 LEU 46 7.285 -12.013 2.547 292 HD23 LEU 46 2HD2 LEU 46 8.685 -12.610 3.469 293 HA PRO 47 HA PRO 47 1.917 -10.708 4.866 294 HB3 PRO 47 2HB PRO 47 1.741 -13.004 4.906 295 HG3 PRO 47 2HG PRO 47 3.756 -14.124 4.867 296 HD3 PRO 47 2HD PRO 47 5.090 -12.534 3.881 297 H ALA 48 H ALA 48 0.604 -10.493 6.902 298 HA ALA 48 HA ALA 48 1.585 -8.368 8.340 299 HB1 ALA 48 1HB ALA 48 -0.796 -9.131 8.160 300 HB2 ALA 48 2HB ALA 48 -0.413 -10.468 9.272 301 HB3 ALA 48 3HB ALA 48 -0.293 -8.783 9.832 302 H ASN 49 H ASN 49 2.390 -11.760 8.539 303 HA ASN 49 HA ASN 49 3.108 -11.820 11.231 304 HB3 ASN 49 2HB ASN 49 4.537 -13.824 10.457 305 HD21 ASN 49 1HD2 ASN 49 2.566 -14.769 8.136 306 HD22 ASN 49 2HD2 ASN 49 1.191 -15.351 9.014 307 H ALA 50 H ALA 50 4.456 -10.282 8.433 308 HA ALA 50 HA ALA 50 7.035 -9.973 9.814 309 HB1 ALA 50 1HB ALA 50 6.453 -11.001 7.211 310 HB2 ALA 50 2HB ALA 50 7.237 -9.417 7.002 311 HB3 ALA 50 3HB ALA 50 8.045 -10.692 7.943 312 HA PRO 51 HA PRO 51 5.806 -5.797 9.817 313 HB3 PRO 51 2HB PRO 51 6.707 -5.458 11.909 314 HG3 PRO 51 2HG PRO 51 8.229 -7.059 12.573 315 HD3 PRO 51 2HD PRO 51 7.551 -8.830 11.274 316 H ILE 52 H ILE 52 9.289 -5.910 9.225 317 HA ILE 52 HA ILE 52 8.750 -4.234 6.880 318 HB ILE 52 HB ILE 52 11.329 -3.877 7.175 319 HG13 ILE 52 2HG1 ILE 52 10.507 -4.639 9.994 320 HG21 ILE 52 1HG2 ILE 52 10.078 -1.963 7.289 321 HG22 ILE 52 2HG2 ILE 52 9.015 -2.594 8.569 322 HG23 ILE 52 3HG2 ILE 52 10.665 -2.058 8.967 323 HD11 ILE 52 3HD1 ILE 52 12.496 -6.235 9.674 324 HD12 ILE 52 1HD1 ILE 52 11.006 -6.666 8.801 325 HD13 ILE 52 2HD1 ILE 52 12.358 -5.902 7.931 326 H SER 53 H SER 53 10.172 -4.633 4.953 327 HA SER 53 HA SER 53 11.815 -6.508 4.369 328 HB3 SER 53 2HB SER 53 10.099 -8.478 3.631 329 HG SER 53 HG SER 53 11.710 -8.025 5.895 330 H GLU 54 H GLU 54 8.887 -4.805 3.670 331 HA GLU 54 HA GLU 54 8.660 -5.543 0.965 332 HB3 GLU 54 2HB GLU 54 6.962 -3.863 0.838 333 HG3 GLU 54 2HG GLU 54 6.957 -4.528 3.805 334 HE2 GLU 54 HE GLU 54 3.909 -4.741 4.019 335 H ILE 55 H ILE 55 9.621 -4.685 -0.870 336 HA ILE 55 HA ILE 55 11.011 -2.160 -0.660 337 HB ILE 55 HB ILE 55 12.540 -4.608 -1.519 338 HG13 ILE 55 2HG1 ILE 55 13.560 -4.781 0.592 339 HG21 ILE 55 1HG2 ILE 55 13.472 -2.690 -2.505 340 HG22 ILE 55 2HG2 ILE 55 13.248 -1.715 -1.032 341 HG23 ILE 55 3HG2 ILE 55 14.473 -3.006 -1.067 342 HD11 ILE 55 3HD1 ILE 55 12.412 -2.032 1.004 343 HD12 ILE 55 1HD1 ILE 55 12.571 -3.086 2.429 344 HD13 ILE 55 2HD1 ILE 55 14.007 -2.676 1.460 345 H GLU 56 H GLU 56 10.432 -1.023 -2.425 346 HA GLU 56 HA GLU 56 10.276 -2.460 -4.924 347 HB3 GLU 56 2HB GLU 56 7.976 -2.573 -4.301 348 HG3 GLU 56 2HG GLU 56 7.689 0.376 -3.823 349 HE2 GLU 56 HE GLU 56 5.683 0.602 -2.708 350 H SER 57 H SER 57 11.213 -1.287 -6.565 351 HA SER 57 HA SER 57 10.976 1.213 -7.242 352 HB3 SER 57 2HB SER 57 13.266 2.106 -5.997 353 HG SER 57 HG SER 57 10.936 2.530 -4.477 354 H SER 58 H SER 58 12.380 1.696 -9.003 355 HA SER 58 HA SER 58 13.947 -0.483 -9.849 356 HB3 SER 58 2HB SER 58 12.664 1.663 -11.072 357 HG SER 58 HG SER 58 14.659 2.939 -10.668 358 H LEU 59 H LEU 59 16.297 -0.266 -10.542 359 HA LEU 59 HA LEU 59 17.914 1.813 -9.671 360 HB3 LEU 59 2HB LEU 59 17.905 -0.519 -7.751 361 HG LEU 59 HG LEU 59 19.528 2.013 -7.893 362 HD11 LEU 59 1HD1 LEU 59 18.111 1.369 -5.618 363 HD12 LEU 59 2HD1 LEU 59 19.695 0.610 -5.331 364 HD13 LEU 59 3HD1 LEU 59 19.595 2.351 -5.688 365 HD21 LEU 59 3HD2 LEU 59 20.664 -0.476 -6.796 366 HD22 LEU 59 1HD2 LEU 59 20.148 -0.568 -8.497 367 HD23 LEU 59 2HD2 LEU 59 21.323 0.669 -7.989 368 H LEU 60 H LEU 60 17.389 -1.621 -10.433 369 HA LEU 60 HA LEU 60 20.057 -1.648 -11.664 370 HB3 LEU 60 2HB LEU 60 19.463 -4.234 -11.574 371 HG LEU 60 HG LEU 60 20.838 -4.543 -9.747 372 HD11 LEU 60 1HD1 LEU 60 22.643 -3.032 -9.940 373 HD12 LEU 60 2HD1 LEU 60 21.844 -3.044 -11.530 374 HD13 LEU 60 3HD1 LEU 60 21.574 -1.688 -10.409 375 HD21 LEU 60 3HD2 LEU 60 19.998 -3.795 -7.812 376 HD22 LEU 60 1HD2 LEU 60 20.995 -2.351 -8.113 377 HD23 LEU 60 2HD2 LEU 60 19.274 -2.355 -8.567 378 HA PRO 61 HA PRO 61 17.970 -1.858 -15.447 379 HB3 PRO 61 2HB PRO 61 19.757 -0.918 -16.554 380 HG3 PRO 61 2HG PRO 61 21.771 -1.075 -15.441 381 HD3 PRO 61 2HD PRO 61 21.026 -1.288 -13.277 382 H SER 62 H SER 62 18.827 -4.422 -13.684 383 HA SER 62 HA SER 62 17.764 -6.197 -15.743 384 HB3 SER 62 2HB SER 62 19.211 -7.629 -13.664 385 HG SER 62 HG SER 62 18.754 -8.214 -15.999 386 H THR 63 H THR 63 16.252 -7.846 -15.000 387 HA THR 63 HA THR 63 14.645 -6.958 -12.816 388 HB THR 63 HB THR 63 14.564 -9.474 -14.565 389 HG1 THR 63 1HG THR 63 13.031 -8.035 -15.707 390 HG21 THR 63 3HG2 THR 63 12.335 -9.782 -13.852 391 HG22 THR 63 1HG2 THR 63 13.104 -9.261 -12.334 392 HG23 THR 63 2HG2 THR 63 12.176 -8.095 -13.307 393 H GLU 64 H GLU 64 16.690 -9.895 -13.392 394 HA GLU 64 HA GLU 64 16.207 -11.075 -10.988 395 HB3 GLU 64 2HB GLU 64 18.871 -11.701 -11.489 396 HG3 GLU 64 2HG GLU 64 16.250 -12.766 -12.601 397 HE2 GLU 64 HE GLU 64 16.869 -14.838 -14.358 398 H ALA 65 H ALA 65 18.517 -8.454 -11.833 399 HA ALA 65 HA ALA 65 19.701 -8.458 -9.222 400 HB1 ALA 65 1HB ALA 65 20.721 -7.779 -11.524 401 HB2 ALA 65 2HB ALA 65 19.884 -6.230 -11.259 402 HB3 ALA 65 3HB ALA 65 21.108 -6.791 -10.095 403 H ALA 66 H ALA 66 17.377 -6.386 -11.079 404 HA ALA 66 HA ALA 66 16.993 -4.449 -9.161 405 HB1 ALA 66 1HB ALA 66 14.692 -4.272 -10.296 406 HB2 ALA 66 2HB ALA 66 16.119 -4.128 -11.350 407 HB3 ALA 66 3HB ALA 66 15.204 -5.653 -11.296 408 H LYS 67 H LYS 67 15.316 -7.630 -9.601 409 HA LYS 67 HA LYS 67 13.626 -7.239 -7.368 410 HB3 LYS 67 2HB LYS 67 13.185 -8.734 -9.342 411 HG3 LYS 67 2HG LYS 67 15.582 -10.058 -8.218 412 HD3 LYS 67 2HD LYS 67 13.073 -11.679 -8.856 413 HE3 LYS 67 2HE LYS 67 15.992 -12.516 -8.534 414 HZ1 LYS 67 2HZ LYS 67 14.214 -13.923 -7.344 415 HZ3 LYS 67 1HZ LYS 67 15.228 -14.711 -8.346 416 H LYS 68 H LYS 68 16.883 -8.610 -7.881 417 HA LYS 68 HA LYS 68 17.046 -9.840 -5.343 418 HB3 LYS 68 2HB LYS 68 19.147 -8.982 -7.350 419 HG3 LYS 68 2HG LYS 68 20.090 -11.082 -5.694 420 HD3 LYS 68 2HD LYS 68 21.475 -8.926 -4.780 421 HE3 LYS 68 2HE LYS 68 22.026 -9.462 -7.656 422 HZ1 LYS 68 2HZ LYS 68 23.483 -9.647 -5.091 423 HZ3 LYS 68 1HZ LYS 68 23.805 -8.677 -6.358 424 H ASP 69 H ASP 69 17.655 -6.558 -6.605 425 HA ASP 69 HA ASP 69 19.151 -5.630 -4.491 426 HB3 ASP 69 2HB ASP 69 17.068 -3.921 -5.887 427 HD2 ASP 69 HD ASP 69 17.397 -2.102 -4.925 428 H ALA 70 H ALA 70 15.593 -5.158 -5.183 429 HA ALA 70 HA ALA 70 14.952 -4.043 -2.727 430 HB1 ALA 70 1HB ALA 70 12.620 -5.148 -3.441 431 HB2 ALA 70 2HB ALA 70 13.303 -3.754 -4.312 432 HB3 ALA 70 3HB ALA 70 13.496 -5.396 -4.972 433 H CYS 71 H CYS 71 15.259 -7.452 -3.796 434 HA CYS 71 HA CYS 71 14.050 -8.575 -1.540 435 HB3 CYS 71 2HB CYS 71 15.803 -10.507 -2.362 436 HG CYS 71 HG CYS 71 13.767 -10.752 -4.520 437 H LEU 72 H LEU 72 17.485 -7.811 -2.429 438 HA LEU 72 HA LEU 72 18.605 -8.794 -0.061 439 HB3 LEU 72 2HB LEU 72 20.517 -7.265 -0.740 440 HG LEU 72 HG LEU 72 20.125 -8.586 -3.272 441 HD11 LEU 72 1HD1 LEU 72 22.244 -9.242 -2.919 442 HD12 LEU 72 2HD1 LEU 72 22.186 -8.075 -1.576 443 HD13 LEU 72 3HD1 LEU 72 21.910 -9.806 -1.264 444 HD21 LEU 72 3HD2 LEU 72 19.821 -10.884 -2.516 445 HD22 LEU 72 1HD2 LEU 72 19.581 -10.319 -0.844 446 HD23 LEU 72 2HD2 LEU 72 18.403 -9.888 -2.108 447 H LYS 73 H LYS 73 17.424 -5.520 -1.031 448 HA LYS 73 HA LYS 73 18.225 -4.205 1.281 449 HB3 LYS 73 2HB LYS 73 15.840 -3.004 0.366 450 HG3 LYS 73 2HG LYS 73 17.899 -1.798 -1.043 451 HD3 LYS 73 2HD LYS 73 16.871 -1.527 1.791 452 HE3 LYS 73 2HE LYS 73 18.227 0.589 1.972 453 HZ1 LYS 73 2HZ LYS 73 19.217 -2.065 2.201 454 HZ3 LYS 73 1HZ LYS 73 19.538 -0.784 3.152 455 H ALA 74 H ALA 74 15.456 -6.333 0.583 456 HA ALA 74 HA ALA 74 14.001 -5.624 2.910 457 HB1 ALA 74 1HB ALA 74 12.849 -6.580 1.030 458 HB2 ALA 74 2HB ALA 74 13.934 -7.990 1.002 459 HB3 ALA 74 3HB ALA 74 12.782 -7.780 2.342 460 H VAL 75 H VAL 75 16.539 -8.017 2.090 461 HA VAL 75 HA VAL 75 16.309 -9.630 4.329 462 HB VAL 75 HB VAL 75 18.523 -8.880 2.451 463 HG11 VAL 75 1HG1 VAL 75 19.902 -9.225 4.272 464 HG12 VAL 75 2HG1 VAL 75 18.783 -10.374 5.044 465 HG13 VAL 75 3HG1 VAL 75 19.752 -10.881 3.639 466 HG21 VAL 75 3HG2 VAL 75 18.234 -11.599 2.392 467 HG22 VAL 75 1HG2 VAL 75 16.579 -11.078 2.792 468 HG23 VAL 75 2HG2 VAL 75 17.376 -10.462 1.324 469 H HIS 76 H HIS 76 18.204 -6.589 3.802 470 HA HIS 76 HA HIS 76 19.347 -6.594 6.352 471 HB3 HIS 76 2HB HIS 76 19.639 -4.094 5.823 472 HD1 HIS 76 1HD HIS 76 20.176 -5.949 2.574 473 HD2 HIS 76 2HD HIS 76 22.292 -5.002 6.071 474 HE1 HIS 76 1HE HIS 76 22.614 -6.545 2.118 475 H GLU 77 H GLU 77 16.346 -5.094 5.010 476 HA GLU 77 HA GLU 77 15.657 -3.645 7.219 477 HB3 GLU 77 2HB GLU 77 13.249 -4.021 6.335 478 HG3 GLU 77 2HG GLU 77 14.034 -3.000 3.977 479 HE2 GLU 77 HE GLU 77 13.532 -0.897 4.043 480 H LEU 78 H LEU 78 15.530 -7.132 6.644 481 HA LEU 78 HA LEU 78 13.842 -7.537 8.974 482 HB3 LEU 78 2HB LEU 78 15.050 -9.516 7.037 483 HG LEU 78 HG LEU 78 14.168 -10.336 9.362 484 HD11 LEU 78 1HD1 LEU 78 11.873 -8.973 8.410 485 HD12 LEU 78 2HD1 LEU 78 11.500 -10.714 8.388 486 HD13 LEU 78 3HD1 LEU 78 12.053 -9.942 9.894 487 HD21 LEU 78 3HD2 LEU 78 12.977 -11.664 6.928 488 HD22 LEU 78 1HD2 LEU 78 14.728 -11.665 7.252 489 HD23 LEU 78 2HD2 LEU 78 13.607 -12.408 8.417 490 H HIS 79 H HIS 79 17.225 -7.724 7.893 491 HA HIS 79 HA HIS 79 18.080 -9.211 10.155 492 HB3 HIS 79 2HB HIS 79 19.981 -7.502 8.620 493 HD1 HIS 79 1HD HIS 79 19.128 -11.086 9.703 494 HD2 HIS 79 2HD HIS 79 22.443 -8.588 9.090 495 HE1 HIS 79 1HE HIS 79 21.175 -12.419 10.440 496 H ASN 80 H ASN 80 18.117 -5.721 9.193 497 HA ASN 80 HA ASN 80 19.468 -4.821 11.409 498 HB3 ASN 80 2HB ASN 80 17.212 -3.296 10.022 499 HD21 ASN 80 1HD2 ASN 80 16.997 -1.852 11.651 500 HD22 ASN 80 2HD2 ASN 80 18.242 -0.772 12.184 501 H LEU 81 H LEU 81 16.026 -5.636 10.808 502 HA LEU 81 HA LEU 81 15.251 -4.617 13.415 503 HB3 LEU 81 2HB LEU 81 13.352 -6.061 11.648 504 HG LEU 81 HG LEU 81 12.910 -3.276 12.620 505 HD11 LEU 81 1HD1 LEU 81 10.691 -4.885 13.132 506 HD12 LEU 81 2HD1 LEU 81 10.929 -3.786 11.751 507 HD13 LEU 81 3HD1 LEU 81 11.357 -5.507 11.604 508 HD21 LEU 81 3HD2 LEU 81 13.661 -3.951 14.680 509 HD22 LEU 81 1HD2 LEU 81 11.954 -4.446 14.772 510 HD23 LEU 81 2HD2 LEU 81 13.212 -5.654 14.414 511 H GLY 82 H GLY 82 14.428 -7.692 11.681 512 HA2 GLY 82 1HA GLY 82 14.345 -9.816 12.409 513 HA3 GLY 82 2HA GLY 82 15.756 -9.444 13.379 514 H VAL 83 H VAL 83 12.209 -8.602 13.396 515 HA VAL 83 HA VAL 83 12.257 -9.167 16.280 516 HB VAL 83 HB VAL 83 11.858 -6.790 15.481 517 HG11 VAL 83 1HG1 VAL 83 9.472 -6.325 14.795 518 HG12 VAL 83 2HG1 VAL 83 10.472 -7.131 13.563 519 HG13 VAL 83 3HG1 VAL 83 9.289 -8.071 14.504 520 HG21 VAL 83 3HG2 VAL 83 11.257 -6.986 17.671 521 HG22 VAL 83 1HG2 VAL 83 9.636 -6.722 16.986 522 HG23 VAL 83 2HG2 VAL 83 10.180 -8.372 17.369 523 H LEU 84 H LEU 84 11.680 -10.710 13.517 524 HA LEU 84 HA LEU 84 9.153 -11.856 14.484 525 HB3 LEU 84 2HB LEU 84 8.745 -10.755 12.422 526 HG LEU 84 HG LEU 84 11.028 -10.648 11.471 527 HD11 LEU 84 1HD1 LEU 84 11.789 -12.681 10.144 528 HD12 LEU 84 2HD1 LEU 84 11.960 -12.766 11.913 529 HD13 LEU 84 3HD1 LEU 84 10.622 -13.618 11.107 530 HD21 LEU 84 3HD2 LEU 84 9.969 -11.822 9.144 531 HD22 LEU 84 1HD2 LEU 84 8.575 -11.219 10.071 532 HD23 LEU 84 2HD2 LEU 84 9.900 -10.113 9.637 533 H ASN 85 H ASN 85 11.944 -12.440 15.354 534 HA ASN 85 HA ASN 85 12.986 -14.624 14.101 535 HB3 ASN 85 2HB ASN 85 12.971 -14.456 17.132 536 HD21 ASN 85 1HD2 ASN 85 13.508 -16.734 16.328 537 HD22 ASN 85 2HD2 ASN 85 15.179 -17.084 16.034 538 H ASP 86 H ASP 86 10.028 -14.244 15.908 539 HA ASP 86 HA ASP 86 9.876 -16.935 16.799 540 HB3 ASP 86 2HB ASP 86 7.471 -16.279 17.312 541 HD2 ASP 86 HD ASP 86 10.084 -15.404 19.707 542 H PHE 87 H PHE 87 9.187 -15.096 13.890 543 HA PHE 87 HA PHE 87 7.332 -17.106 12.897 544 HB3 PHE 87 2HB PHE 87 7.264 -15.391 10.968 545 HD1 PHE 87 2HD PHE 87 4.959 -15.561 11.772 546 HD2 PHE 87 1HD PHE 87 7.812 -13.163 13.801 547 HE1 PHE 87 2HE PHE 87 3.107 -14.401 13.006 548 HE2 PHE 87 1HE PHE 87 5.960 -12.003 15.035 549 HZ PHE 87 HZ PHE 87 3.629 -12.636 14.623 550 H LEU 88 H LEU 88 10.706 -16.316 12.879 551 HA LEU 88 HA LEU 88 11.181 -17.510 10.290 552 HB3 LEU 88 2HB LEU 88 12.401 -15.507 11.322 553 HG LEU 88 HG LEU 88 13.039 -16.663 13.479 554 HD11 LEU 88 1HD1 LEU 88 13.773 -18.774 13.160 555 HD12 LEU 88 2HD1 LEU 88 14.424 -18.425 11.540 556 HD13 LEU 88 3HD1 LEU 88 15.350 -17.965 12.990 557 HD21 LEU 88 3HD2 LEU 88 15.091 -15.520 13.665 558 HD22 LEU 88 1HD2 LEU 88 15.444 -15.695 11.930 559 HD23 LEU 88 2HD2 LEU 88 14.143 -14.607 12.468 560 H LEU 89 H LEU 89 12.491 -19.438 9.985 561 HA LEU 89 HA LEU 89 11.703 -21.509 11.722 562 HB3 LEU 89 2HB LEU 89 13.267 -22.865 10.302 563 HG LEU 89 HG LEU 89 10.913 -21.419 9.343 564 HD11 LEU 89 1HD1 LEU 89 12.546 -20.712 7.606 565 HD12 LEU 89 2HD1 LEU 89 12.838 -22.428 7.234 566 HD13 LEU 89 3HD1 LEU 89 11.223 -21.725 6.978 567 HD21 LEU 89 3HD2 LEU 89 10.125 -23.523 8.855 568 HD22 LEU 89 1HD2 LEU 89 11.738 -24.160 8.454 569 HD23 LEU 89 2HD2 LEU 89 11.288 -23.883 10.154 570 HA PRO 90 HA PRO 90 14.890 -21.007 14.644 571 HB3 PRO 90 2HB PRO 90 13.455 -21.417 16.397 572 HG3 PRO 90 2HG PRO 90 11.466 -22.420 15.800 573 HD3 PRO 90 2HD PRO 90 11.328 -21.775 13.598 574 H ASP 91 H ASP 91 14.458 -24.410 15.075 575 HA ASP 91 HA ASP 91 17.199 -24.788 14.558 576 HB3 ASP 91 2HB ASP 91 15.650 -27.257 14.486 577 HD2 ASP 91 HD ASP 91 18.657 -27.872 15.883 578 H SER 92 H SER 92 14.214 -24.857 12.701 579 HA SER 92 HA SER 92 14.870 -26.714 10.774 580 HB3 SER 92 2HB SER 92 13.369 -24.678 9.493 581 HG SER 92 HG SER 92 13.069 -27.195 10.004 582 H LYS 93 H LYS 93 15.526 -23.168 11.016 583 HA LYS 93 HA LYS 93 16.822 -23.104 8.466 584 HB3 LYS 93 2HB LYS 93 15.607 -21.239 10.067 585 HG3 LYS 93 2HG LYS 93 18.615 -20.703 10.114 586 HD3 LYS 93 2HD LYS 93 16.375 -19.147 11.469 587 HE3 LYS 93 2HE LYS 93 19.259 -19.057 11.527 588 HZ1 LYS 93 2HZ LYS 93 18.584 -16.376 10.941 589 HZ3 LYS 93 1HZ LYS 93 18.238 -17.288 9.637 590 H ASP 94 H ASP 94 17.645 -24.562 11.327 591 HA ASP 94 HA ASP 94 20.257 -23.647 11.681 592 HB3 ASP 94 2HB ASP 94 19.251 -26.452 12.312 593 HD2 ASP 94 HD ASP 94 20.792 -23.738 13.819 594 H GLU 95 H GLU 95 18.740 -25.458 9.196 595 HA GLU 95 HA GLU 95 21.311 -26.618 8.444 596 HB3 GLU 95 2HB GLU 95 19.674 -28.376 9.018 597 HG3 GLU 95 2HG GLU 95 17.927 -28.014 6.700 598 HE2 GLU 95 HE GLU 95 15.418 -29.040 8.732 599 H ILE 96 H ILE 96 21.435 -24.244 7.585 600 HA ILE 96 HA ILE 96 20.294 -24.256 4.880 601 HB ILE 96 HB ILE 96 19.962 -21.889 4.997 602 HG13 ILE 96 2HG1 ILE 96 21.598 -22.110 7.435 603 HG21 ILE 96 1HG2 ILE 96 18.046 -23.085 5.652 604 HG22 ILE 96 2HG2 ILE 96 18.730 -23.479 7.247 605 HG23 ILE 96 3HG2 ILE 96 18.240 -21.808 6.877 606 HD11 ILE 96 3HD1 ILE 96 21.823 -20.764 5.106 607 HD12 ILE 96 1HD1 ILE 96 20.931 -19.538 6.038 608 HD13 ILE 96 2HD1 ILE 96 22.500 -20.136 6.628 609 H GLU 97 H GLU 97 21.690 -23.665 3.210 610 HA GLU 97 HA GLU 97 24.411 -23.094 4.094 611 HB3 GLU 97 2HB GLU 97 25.127 -24.381 1.990 612 HG3 GLU 97 2HG GLU 97 23.778 -25.661 4.387 613 HE2 GLU 97 HE GLU 97 26.309 -27.417 3.216 614 H ASP 98 H ASP 98 25.712 -21.777 2.586 615 HA ASP 98 HA ASP 98 24.293 -19.634 1.620 616 HB3 ASP 98 2HB ASP 98 27.101 -20.682 1.117 617 HD2 ASP 98 HD ASP 98 28.543 -19.053 0.460 618 H GLU 99 H GLU 99 25.641 -22.587 0.038 619 HA GLU 99 HA GLU 99 24.929 -21.705 -2.561 620 HB3 GLU 99 2HB GLU 99 25.472 -24.601 -1.927 621 HG3 GLU 99 2HG GLU 99 26.699 -22.761 -4.023 622 HE2 GLU 99 HE GLU 99 26.999 -26.238 -5.488 623 H LEU 100 H LEU 100 23.477 -23.688 0.023 624 HA LEU 100 HA LEU 100 21.491 -24.883 -1.578 625 HB3 LEU 100 2HB LEU 100 21.624 -24.344 1.392 626 HG LEU 100 HG LEU 100 19.356 -25.179 0.097 627 HD11 LEU 100 1HD1 LEU 100 19.558 -27.276 -0.605 628 HD12 LEU 100 2HD1 LEU 100 21.164 -27.440 0.143 629 HD13 LEU 100 3HD1 LEU 100 19.699 -27.766 1.099 630 HD21 LEU 100 3HD2 LEU 100 19.387 -24.463 2.380 631 HD22 LEU 100 1HD2 LEU 100 18.681 -26.096 2.324 632 HD23 LEU 100 2HD2 LEU 100 20.362 -25.870 2.868 633 H SER 101 H SER 101 22.041 -21.638 -0.680 634 HA SER 101 HA SER 101 19.543 -20.718 -0.096 635 HB3 SER 101 2HB SER 101 21.818 -19.426 -1.655 636 HG SER 101 HG SER 101 20.273 -17.965 -2.102 637 H ASP 102 H ASP 102 17.885 -19.653 -1.447 638 HA ASP 102 HA ASP 102 16.531 -19.516 -3.134 639 HB3 ASP 102 2HB ASP 102 18.803 -18.786 -4.281 640 HD2 ASP 102 HD ASP 102 18.265 -21.281 -7.103 Start of MODEL 4 1 H1 ILE 1 H ILE 1 26.131 -26.178 7.939 2 HA ILE 1 HA ILE 1 26.369 -26.568 10.820 3 HB ILE 1 HB ILE 1 28.474 -27.464 8.849 4 HG13 ILE 1 2HG1 ILE 1 27.902 -29.732 9.384 5 HG21 ILE 1 1HG2 ILE 1 29.440 -26.662 10.913 6 HG22 ILE 1 2HG2 ILE 1 28.307 -27.647 11.870 7 HG23 ILE 1 3HG2 ILE 1 29.541 -28.439 10.860 8 HD11 ILE 1 3HD1 ILE 1 26.361 -28.433 11.550 9 HD12 ILE 1 1HD1 ILE 1 25.448 -29.690 10.682 10 HD13 ILE 1 2HD1 ILE 1 27.004 -30.090 11.450 11 H SER 2 H SER 2 28.513 -25.556 8.068 12 HA SER 2 HA SER 2 28.343 -22.855 9.047 13 HB3 SER 2 2HB SER 2 31.148 -23.644 8.545 14 HG SER 2 HG SER 2 30.859 -21.664 9.516 15 H GLY 3 H GLY 3 29.260 -21.281 7.452 16 HA2 GLY 3 1HA GLY 3 30.479 -21.780 5.088 17 HA3 GLY 3 2HA GLY 3 28.810 -22.198 4.755 18 H GLY 4 H GLY 4 28.596 -20.407 3.268 19 HA2 GLY 4 1HA GLY 4 29.236 -17.779 3.703 20 HA3 GLY 4 2HA GLY 4 27.883 -18.339 2.741 21 H SER 5 H SER 5 28.922 -17.064 5.878 22 HA SER 5 HA SER 5 26.467 -17.411 7.175 23 HB3 SER 5 2HB SER 5 28.069 -15.084 8.040 24 HG SER 5 HG SER 5 26.949 -15.942 9.699 25 H SER 6 H SER 6 27.918 -14.814 5.156 26 HA SER 6 HA SER 6 26.096 -12.838 5.697 27 HB3 SER 6 2HB SER 6 26.709 -12.340 3.079 28 HG SER 6 HG SER 6 27.626 -11.558 5.456 29 H ILE 7 H ILE 7 25.921 -15.695 3.556 30 HA ILE 7 HA ILE 7 23.632 -14.846 2.132 31 HB ILE 7 HB ILE 7 25.049 -17.461 2.539 32 HG13 ILE 7 2HG1 ILE 7 26.074 -17.012 0.593 33 HG21 ILE 7 1HG2 ILE 7 22.719 -18.076 2.416 34 HG22 ILE 7 2HG2 ILE 7 22.474 -17.021 1.003 35 HG23 ILE 7 3HG2 ILE 7 23.513 -18.460 0.870 36 HD11 ILE 7 3HD1 ILE 7 23.411 -15.853 -0.327 37 HD12 ILE 7 1HD1 ILE 7 24.885 -15.801 -1.322 38 HD13 ILE 7 2HD1 ILE 7 24.180 -17.368 -0.858 39 H SER 8 H SER 8 24.212 -16.431 5.260 40 HA SER 8 HA SER 8 21.993 -17.715 5.814 41 HB3 SER 8 2HB SER 8 22.980 -15.581 7.740 42 HG SER 8 HG SER 8 22.595 -17.250 9.284 43 H MET 9 H MET 9 22.264 -14.217 5.246 44 HA MET 9 HA MET 9 19.516 -13.848 6.076 45 HB3 MET 9 2HB MET 9 20.041 -11.433 5.816 46 HG3 MET 9 2HG MET 9 21.123 -12.972 7.752 47 HE1 MET 9 3HE MET 9 23.246 -10.268 6.269 48 HE2 MET 9 1HE MET 9 24.127 -10.533 7.792 49 HE3 MET 9 2HE MET 9 24.901 -10.921 6.237 50 H MET 10 H MET 10 21.654 -13.266 3.194 51 HA MET 10 HA MET 10 19.621 -12.430 1.527 52 HB3 MET 10 2HB MET 10 21.273 -13.036 -0.296 53 HG3 MET 10 2HG MET 10 22.486 -11.804 2.226 54 HE1 MET 10 3HE MET 10 25.725 -10.470 1.029 55 HE2 MET 10 1HE MET 10 24.273 -9.445 0.938 56 HE3 MET 10 2HE MET 10 24.464 -10.601 2.278 57 H TYR 11 H TYR 11 20.391 -15.601 2.763 58 HA TYR 11 HA TYR 11 19.386 -17.138 0.619 59 HB3 TYR 11 2HB TYR 11 20.042 -17.368 3.576 60 HD1 TYR 11 2HD TYR 11 18.562 -19.581 0.921 61 HD2 TYR 11 1HD TYR 11 19.057 -18.808 5.099 62 HE1 TYR 11 2HE TYR 11 17.059 -21.556 1.472 63 HE2 TYR 11 1HE TYR 11 17.552 -20.786 5.636 64 HH TYR 11 HH TYR 11 15.886 -22.092 4.666 65 H LYS 12 H LYS 12 17.937 -16.267 3.843 66 HA LYS 12 HA LYS 12 15.539 -17.404 3.659 67 HB3 LYS 12 2HB LYS 12 14.819 -14.976 4.679 68 HG3 LYS 12 2HG LYS 12 15.429 -17.533 5.633 69 HD3 LYS 12 2HD LYS 12 17.769 -16.369 6.122 70 HE3 LYS 12 2HE LYS 12 16.647 -14.382 7.262 71 HZ1 LYS 12 2HZ LYS 12 15.451 -14.704 9.164 72 HZ3 LYS 12 1HZ LYS 12 16.315 -15.990 9.665 73 H TYR 13 H TYR 13 16.553 -14.401 1.938 74 HA TYR 13 HA TYR 13 14.109 -13.724 0.854 75 HB3 TYR 13 2HB TYR 13 17.037 -13.366 0.415 76 HD1 TYR 13 1HD TYR 13 14.052 -13.194 -1.841 77 HD2 TYR 13 2HD TYR 13 18.315 -13.023 -1.516 78 HE1 TYR 13 1HE TYR 13 14.250 -13.140 -4.375 79 HE2 TYR 13 2HE TYR 13 18.499 -12.970 -4.052 80 HH TYR 13 HH TYR 13 15.914 -13.741 -6.061 81 H CYS 14 H CYS 14 16.714 -15.810 -0.593 82 HA CYS 14 HA CYS 14 15.267 -16.408 -2.890 83 HB3 CYS 14 2HB CYS 14 16.997 -18.594 -2.254 84 HG CYS 14 HG CYS 14 18.197 -16.085 -3.873 85 H SER 15 H SER 15 15.543 -17.973 0.353 86 HA SER 15 HA SER 15 14.210 -20.283 -0.184 87 HB3 SER 15 2HB SER 15 15.247 -19.039 2.064 88 HG SER 15 HG SER 15 12.637 -19.733 2.924 89 H ARG 16 H ARG 16 13.033 -17.026 -0.264 90 HA ARG 16 HA ARG 16 10.407 -17.500 0.531 91 HB3 ARG 16 2HB ARG 16 11.732 -15.248 0.150 92 HG3 ARG 16 2HG ARG 16 11.696 -16.052 -2.482 93 HD3 ARG 16 2HD ARG 16 9.664 -13.836 -2.506 94 HE ARG 16 HE ARG 16 9.400 -15.969 -4.423 95 HH11 ARG 16 2HH2 ARG 16 11.547 -13.279 -3.581 96 HH12 ARG 16 1HH2 ARG 16 12.138 -13.082 -5.196 97 HH22 ARG 16 1HH ARG 16 11.320 -14.522 -6.929 98 H LEU 17 H LEU 17 12.141 -18.701 -2.108 99 HA LEU 17 HA LEU 17 10.389 -18.407 -4.243 100 HB3 LEU 17 2HB LEU 17 11.951 -20.921 -3.915 101 HG LEU 17 HG LEU 17 10.863 -20.109 -6.112 102 HD11 LEU 17 1HD1 LEU 17 11.611 -17.758 -5.900 103 HD12 LEU 17 2HD1 LEU 17 13.292 -18.298 -6.123 104 HD13 LEU 17 3HD1 LEU 17 12.106 -18.515 -7.433 105 HD21 LEU 17 3HD2 LEU 17 13.718 -20.567 -6.694 106 HD22 LEU 17 1HD2 LEU 17 12.976 -21.736 -5.576 107 HD23 LEU 17 2HD2 LEU 17 12.275 -21.482 -7.192 108 HA PRO 18 HA PRO 18 7.117 -20.848 -2.680 109 HB3 PRO 18 2HB PRO 18 5.541 -19.253 -3.205 110 HG3 PRO 18 2HG PRO 18 6.272 -17.620 -4.661 111 HD3 PRO 18 2HD PRO 18 8.537 -17.720 -4.283 112 H HIS 19 H HIS 19 8.036 -20.912 -6.069 113 HA HIS 19 HA HIS 19 6.842 -23.294 -6.713 114 HB3 HIS 19 2HB HIS 19 9.547 -22.582 -7.803 115 HD1 HIS 19 1HD HIS 19 9.910 -23.934 -9.866 116 HD2 HIS 19 2HD HIS 19 5.836 -23.503 -8.967 117 HE1 HIS 19 1HE HIS 19 8.645 -25.302 -11.610 118 H ASP 20 H ASP 20 9.469 -22.653 -4.523 119 HA ASP 20 HA ASP 20 10.691 -25.182 -4.786 120 HB3 ASP 20 2HB ASP 20 10.760 -23.114 -2.538 121 HD2 ASP 20 HD ASP 20 12.682 -25.927 -3.744 122 H GLU 21 H GLU 21 10.030 -27.110 -3.795 123 HA GLU 21 HA GLU 21 7.628 -27.062 -2.299 124 HB3 GLU 21 2HB GLU 21 8.219 -29.608 -2.103 125 HG3 GLU 21 2HG GLU 21 7.340 -27.963 -4.391 126 HE2 GLU 21 HE GLU 21 8.719 -31.474 -5.798 127 H PHE 22 H PHE 22 11.121 -27.409 -1.613 128 HA PHE 22 HA PHE 22 10.855 -28.338 1.014 129 HB3 PHE 22 2HB PHE 22 13.236 -27.735 1.095 130 HD1 PHE 22 2HD PHE 22 12.080 -30.103 -0.015 131 HD2 PHE 22 1HD PHE 22 14.209 -27.022 -2.011 132 HE1 PHE 22 2HE PHE 22 12.747 -31.726 -1.809 133 HE2 PHE 22 1HE PHE 22 14.875 -28.646 -3.806 134 HZ PHE 22 HZ PHE 22 14.136 -30.978 -3.683 135 H PHE 23 H PHE 23 9.946 -25.351 -0.362 136 HA PHE 23 HA PHE 23 10.034 -24.119 2.297 137 HB3 PHE 23 2HB PHE 23 10.345 -21.946 0.973 138 HD1 PHE 23 2HD PHE 23 11.976 -23.926 2.690 139 HD2 PHE 23 1HD PHE 23 12.627 -22.216 -1.139 140 HE1 PHE 23 2HE PHE 23 14.454 -24.173 3.001 141 HE2 PHE 23 1HE PHE 23 15.105 -22.463 -0.827 142 HZ PHE 23 HZ PHE 23 15.989 -23.438 1.239 143 H GLN 24 H GLN 24 8.087 -23.358 3.028 144 HA GLN 24 HA GLN 24 5.829 -23.836 1.378 145 HB3 GLN 24 2HB GLN 24 4.613 -22.838 3.439 146 HG3 GLN 24 2HG GLN 24 6.315 -25.011 4.519 147 HE21 GLN 24 1HE2 GLN 24 3.920 -26.553 3.094 148 HE22 GLN 24 2HE2 GLN 24 2.616 -26.365 4.218 149 HA PRO 25 HA PRO 25 5.257 -19.800 -0.109 150 HB3 PRO 25 2HB PRO 25 3.630 -20.480 -1.589 151 HG3 PRO 25 2HG PRO 25 2.549 -22.432 -1.003 152 HD3 PRO 25 2HD PRO 25 4.150 -23.399 0.336 153 H LYS 26 H LYS 26 4.399 -17.605 0.203 154 HA LYS 26 HA LYS 26 2.793 -16.830 2.203 155 HB3 LYS 26 2HB LYS 26 5.047 -16.319 3.804 156 HG3 LYS 26 2HG LYS 26 2.585 -18.070 3.949 157 HD3 LYS 26 2HD LYS 26 5.021 -18.212 5.706 158 HE3 LYS 26 2HE LYS 26 2.143 -18.272 6.730 159 HZ1 LYS 26 2HZ LYS 26 2.887 -19.459 8.500 160 HZ3 LYS 26 1HZ LYS 26 4.351 -18.750 8.542 161 HA PRO 27 HA PRO 27 5.904 -13.476 1.026 162 HB3 PRO 27 2HB PRO 27 8.131 -13.929 1.396 163 HG3 PRO 27 2HG PRO 27 8.652 -16.173 1.504 164 HD3 PRO 27 2HD PRO 27 6.611 -17.036 2.116 165 H GLU 28 H GLU 28 6.215 -12.062 -0.846 166 HA GLU 28 HA GLU 28 5.337 -13.384 -3.268 167 HB3 GLU 28 2HB GLU 28 3.800 -11.249 -3.577 168 HG3 GLU 28 2HG GLU 28 2.938 -13.382 -1.576 169 HE2 GLU 28 HE GLU 28 0.063 -13.528 -2.510 170 H PHE 29 H PHE 29 6.210 -12.476 -5.160 171 HA PHE 29 HA PHE 29 7.738 -10.005 -4.789 172 HB3 PHE 29 2HB PHE 29 8.988 -12.366 -4.740 173 HD1 PHE 29 2HD PHE 29 7.425 -14.022 -5.963 174 HD2 PHE 29 1HD PHE 29 10.072 -11.386 -7.975 175 HE1 PHE 29 2HE PHE 29 7.324 -15.478 -8.004 176 HE2 PHE 29 1HE PHE 29 9.972 -12.842 -10.016 177 HZ PHE 29 HZ PHE 29 8.599 -14.871 -10.006 178 H GLN 30 H GLN 30 7.780 -8.615 -6.584 179 HA GLN 30 HA GLN 30 6.614 -9.618 -9.024 180 HB3 GLN 30 2HB GLN 30 5.489 -6.992 -8.451 181 HG3 GLN 30 2HG GLN 30 3.336 -8.352 -8.781 182 HE21 GLN 30 1HE2 GLN 30 5.088 -10.256 -10.899 183 HE22 GLN 30 2HE2 GLN 30 5.129 -9.223 -12.288 184 H PHE 31 H PHE 31 7.267 -8.420 -10.904 185 HA PHE 31 HA PHE 31 9.381 -6.470 -10.318 186 HB3 PHE 31 2HB PHE 31 9.909 -8.759 -11.424 187 HD1 PHE 31 2HD PHE 31 9.230 -6.628 -14.346 188 HD2 PHE 31 1HD PHE 31 8.210 -10.201 -12.297 189 HE1 PHE 31 2HE PHE 31 7.952 -7.417 -16.357 190 HE2 PHE 31 1HE PHE 31 6.932 -10.990 -14.307 191 HZ PHE 31 HZ PHE 31 6.817 -9.589 -16.314 192 H LYS 32 H LYS 32 9.336 -4.468 -11.331 193 HA LYS 32 HA LYS 32 7.009 -4.020 -13.066 194 HB3 LYS 32 2HB LYS 32 8.143 -2.509 -10.784 195 HG3 LYS 32 2HG LYS 32 8.631 -1.029 -12.789 196 HD3 LYS 32 2HD LYS 32 6.618 -1.882 -14.124 197 HE3 LYS 32 2HE LYS 32 4.998 0.216 -12.680 198 HZ1 LYS 32 2HZ LYS 32 4.565 -1.967 -14.536 199 HZ3 LYS 32 1HZ LYS 32 3.722 -0.584 -14.363 200 HA PRO 33 HA PRO 33 10.227 -3.332 -15.967 201 HB3 PRO 33 2HB PRO 33 9.373 -4.857 -17.466 202 HG3 PRO 33 2HG PRO 33 7.209 -5.526 -17.031 203 HD3 PRO 33 2HD PRO 33 7.097 -5.107 -14.773 204 H VAL 34 H VAL 34 11.194 -1.421 -16.140 205 HA VAL 34 HA VAL 34 9.400 0.755 -16.965 206 HB VAL 34 HB VAL 34 11.706 0.920 -15.014 207 HG11 VAL 34 1HG1 VAL 34 9.745 2.964 -16.082 208 HG12 VAL 34 2HG1 VAL 34 10.655 3.205 -14.571 209 HG13 VAL 34 3HG1 VAL 34 11.524 3.009 -16.112 210 HG21 VAL 34 3HG2 VAL 34 10.238 0.050 -13.548 211 HG22 VAL 34 1HG2 VAL 34 9.444 1.641 -13.627 212 HG23 VAL 34 2HG2 VAL 34 8.853 0.301 -14.637 213 H ASP 35 H ASP 35 10.787 2.667 -17.877 214 HA ASP 35 HA ASP 35 12.112 1.673 -20.084 215 HB3 ASP 35 2HB ASP 35 12.874 4.102 -20.351 216 HD2 ASP 35 HD ASP 35 10.139 3.136 -21.848 217 H GLU 36 H GLU 36 14.492 2.340 -20.662 218 HA GLU 36 HA GLU 36 16.187 1.231 -18.763 219 HB3 GLU 36 2HB GLU 36 18.007 2.152 -20.350 220 HG3 GLU 36 2HG GLU 36 16.240 0.801 -22.235 221 HE2 GLU 36 HE GLU 36 19.521 0.378 -22.657 222 H PHE 37 H PHE 37 14.760 4.320 -18.895 223 HA PHE 37 HA PHE 37 16.974 5.790 -17.836 224 HB3 PHE 37 2HB PHE 37 14.450 7.050 -17.304 225 HD1 PHE 37 1HD PHE 37 16.568 6.391 -20.317 226 HD2 PHE 37 2HD PHE 37 14.813 9.275 -17.747 227 HE1 PHE 37 1HE PHE 37 17.668 8.227 -21.626 228 HE2 PHE 37 2HE PHE 37 15.913 11.112 -19.057 229 HZ PHE 37 HZ PHE 37 17.328 10.566 -20.981 230 H GLY 38 H GLY 38 15.395 3.288 -16.496 231 HA2 GLY 38 1HA GLY 38 15.955 4.120 -13.819 232 HA3 GLY 38 2HA GLY 38 14.232 4.074 -14.135 233 H GLY 39 H GLY 39 16.688 1.959 -15.700 234 HA2 GLY 39 1HA GLY 39 16.631 -0.306 -15.921 235 HA3 GLY 39 2HA GLY 39 16.865 -0.219 -14.187 236 H THR 40 H THR 40 15.530 -1.629 -13.148 237 HA THR 40 HA THR 40 12.706 -1.626 -13.952 238 HB THR 40 HB THR 40 14.696 -3.866 -13.965 239 HG1 THR 40 1HG THR 40 13.149 -4.429 -15.646 240 HG21 THR 40 3HG2 THR 40 13.314 -4.654 -12.087 241 HG22 THR 40 1HG2 THR 40 11.828 -4.156 -12.930 242 HG23 THR 40 2HG2 THR 40 12.798 -5.509 -13.560 243 H ILE 41 H ILE 41 11.201 -2.104 -12.279 244 HA ILE 41 HA ILE 41 12.378 -1.630 -9.636 245 HB ILE 41 HB ILE 41 9.525 -1.179 -10.497 246 HG13 ILE 41 2HG1 ILE 41 11.246 0.151 -11.827 247 HG21 ILE 41 1HG2 ILE 41 10.569 0.475 -8.352 248 HG22 ILE 41 2HG2 ILE 41 9.128 -0.568 -8.397 249 HG23 ILE 41 3HG2 ILE 41 10.713 -1.259 -7.975 250 HD11 ILE 41 3HD1 ILE 41 10.033 2.370 -11.294 251 HD12 ILE 41 1HD1 ILE 41 9.010 1.000 -11.786 252 HD13 ILE 41 2HD1 ILE 41 9.131 1.449 -10.068 253 H CYS 42 H CYS 42 11.716 -2.910 -7.840 254 HA CYS 42 HA CYS 42 10.351 -5.377 -8.644 255 HB3 CYS 42 2HB CYS 42 12.843 -4.998 -6.999 256 HG CYS 42 HG CYS 42 11.264 -6.089 -5.266 257 H ARG 43 H ARG 43 8.543 -5.849 -7.409 258 HA ARG 43 HA ARG 43 8.189 -4.172 -5.059 259 HB3 ARG 43 2HB ARG 43 6.087 -5.543 -6.813 260 HG3 ARG 43 2HG ARG 43 5.423 -3.328 -4.900 261 HD3 ARG 43 2HD ARG 43 3.638 -5.537 -4.729 262 HE ARG 43 HE ARG 43 2.474 -3.513 -4.916 263 HH11 ARG 43 2HH2 ARG 43 4.658 -3.832 -7.688 264 HH12 ARG 43 1HH2 ARG 43 4.027 -2.441 -8.503 265 HH22 ARG 43 1HH ARG 43 2.253 -1.189 -7.487 266 H ILE 44 H ILE 44 8.681 -5.339 -3.219 267 HA ILE 44 HA ILE 44 7.733 -8.120 -3.145 268 HB ILE 44 HB ILE 44 10.344 -7.230 -3.011 269 HG13 ILE 44 2HG1 ILE 44 8.862 -9.747 -2.505 270 HG21 ILE 44 1HG2 ILE 44 11.150 -7.324 -0.838 271 HG22 ILE 44 2HG2 ILE 44 9.636 -6.406 -0.656 272 HG23 ILE 44 3HG2 ILE 44 9.689 -8.130 -0.217 273 HD11 ILE 44 3HD1 ILE 44 9.618 -9.332 -4.746 274 HD12 ILE 44 1HD1 ILE 44 11.227 -8.817 -4.183 275 HD13 ILE 44 2HD1 ILE 44 10.750 -10.528 -4.070 276 H THR 45 H THR 45 6.519 -8.756 -1.375 277 HA THR 45 HA THR 45 6.307 -6.933 0.878 278 HB THR 45 HB THR 45 4.379 -7.058 -1.327 279 HG1 THR 45 1HG THR 45 4.546 -5.029 -0.459 280 HG21 THR 45 3HG2 THR 45 2.360 -7.085 0.194 281 HG22 THR 45 1HG2 THR 45 3.138 -8.681 0.071 282 HG23 THR 45 2HG2 THR 45 3.403 -7.672 1.512 283 H LEU 46 H LEU 46 6.661 -8.171 2.602 284 HA LEU 46 HA LEU 46 6.200 -10.993 2.431 285 HB3 LEU 46 2HB LEU 46 6.873 -10.645 4.977 286 HG LEU 46 HG LEU 46 8.940 -10.152 2.821 287 HD11 LEU 46 1HD1 LEU 46 9.474 -11.736 5.292 288 HD12 LEU 46 2HD1 LEU 46 10.554 -10.694 4.334 289 HD13 LEU 46 3HD1 LEU 46 9.361 -9.965 5.435 290 HD21 LEU 46 3HD2 LEU 46 7.861 -12.064 2.034 291 HD22 LEU 46 1HD2 LEU 46 9.216 -12.706 2.993 292 HD23 LEU 46 2HD2 LEU 46 7.570 -12.696 3.673 293 HA PRO 47 HA PRO 47 2.337 -11.145 4.347 294 HB3 PRO 47 2HB PRO 47 2.223 -13.440 4.197 295 HG3 PRO 47 2HG PRO 47 4.268 -14.503 4.117 296 HD3 PRO 47 2HD PRO 47 5.579 -12.802 3.295 297 H ALA 48 H ALA 48 1.002 -11.283 6.437 298 HA ALA 48 HA ALA 48 1.859 -9.200 8.043 299 HB1 ALA 48 1HB ALA 48 0.098 -11.151 9.367 300 HB2 ALA 48 2HB ALA 48 -0.208 -9.455 8.922 301 HB3 ALA 48 3HB ALA 48 -0.425 -10.745 7.714 302 H ASN 49 H ASN 49 2.881 -12.520 7.924 303 HA ASN 49 HA ASN 49 3.539 -12.840 10.609 304 HB3 ASN 49 2HB ASN 49 5.369 -14.435 9.319 305 HD21 ASN 49 1HD2 ASN 49 1.920 -14.468 8.489 306 HD22 ASN 49 2HD2 ASN 49 1.456 -15.793 9.503 307 H ALA 50 H ALA 50 4.842 -10.894 8.047 308 HA ALA 50 HA ALA 50 7.343 -10.542 9.555 309 HB1 ALA 50 1HB ALA 50 7.439 -9.693 6.762 310 HB2 ALA 50 2HB ALA 50 8.512 -10.803 7.648 311 HB3 ALA 50 3HB ALA 50 7.012 -11.415 6.910 312 HA PRO 51 HA PRO 51 5.861 -6.481 9.977 313 HB3 PRO 51 2HB PRO 51 6.854 -6.263 12.042 314 HG3 PRO 51 2HG PRO 51 8.536 -7.783 12.468 315 HD3 PRO 51 2HD PRO 51 7.925 -9.477 11.038 316 H ILE 52 H ILE 52 9.241 -6.584 8.932 317 HA ILE 52 HA ILE 52 8.434 -4.713 6.817 318 HB ILE 52 HB ILE 52 11.048 -4.133 7.167 319 HG13 ILE 52 2HG1 ILE 52 9.984 -4.660 9.957 320 HG21 ILE 52 1HG2 ILE 52 10.066 -2.204 8.663 321 HG22 ILE 52 2HG2 ILE 52 9.637 -2.339 6.941 322 HG23 ILE 52 3HG2 ILE 52 8.508 -2.921 8.187 323 HD11 ILE 52 3HD1 ILE 52 10.984 -6.681 9.803 324 HD12 ILE 52 1HD1 ILE 52 11.404 -6.353 8.104 325 HD13 ILE 52 2HD1 ILE 52 12.522 -5.876 9.405 326 H SER 53 H SER 53 10.083 -4.773 4.934 327 HA SER 53 HA SER 53 11.896 -6.432 4.288 328 HB3 SER 53 2HB SER 53 9.430 -8.110 4.707 329 HG SER 53 HG SER 53 9.941 -8.461 2.468 330 H GLU 54 H GLU 54 8.860 -4.965 3.589 331 HA GLU 54 HA GLU 54 8.666 -5.598 0.875 332 HB3 GLU 54 2HB GLU 54 6.750 -4.746 2.128 333 HG3 GLU 54 2HG GLU 54 7.463 -1.923 2.199 334 HE2 GLU 54 HE GLU 54 7.656 -3.969 5.116 335 H ILE 55 H ILE 55 9.459 -4.566 -0.987 336 HA ILE 55 HA ILE 55 11.009 -2.138 -0.620 337 HB ILE 55 HB ILE 55 12.229 -4.556 -1.942 338 HG13 ILE 55 2HG1 ILE 55 13.488 -5.021 -0.006 339 HG21 ILE 55 1HG2 ILE 55 13.120 -1.750 -1.376 340 HG22 ILE 55 2HG2 ILE 55 14.318 -3.064 -1.433 341 HG23 ILE 55 3HG2 ILE 55 13.295 -2.729 -2.851 342 HD11 ILE 55 3HD1 ILE 55 12.777 -3.476 2.104 343 HD12 ILE 55 1HD1 ILE 55 14.172 -3.095 1.067 344 HD13 ILE 55 2HD1 ILE 55 12.617 -2.271 0.805 345 H GLU 56 H GLU 56 10.560 -0.732 -2.238 346 HA GLU 56 HA GLU 56 9.800 -1.865 -4.790 347 HB3 GLU 56 2HB GLU 56 7.901 -0.115 -4.883 348 HG3 GLU 56 2HG GLU 56 7.918 -2.610 -3.172 349 HE2 GLU 56 HE GLU 56 5.657 -0.996 -1.289 350 H SER 57 H SER 57 11.315 -1.010 -6.150 351 HA SER 57 HA SER 57 11.416 1.524 -6.916 352 HB3 SER 57 2HB SER 57 12.899 1.203 -4.353 353 HG SER 57 HG SER 57 14.011 3.201 -5.965 354 H SER 58 H SER 58 12.845 1.690 -8.689 355 HA SER 58 HA SER 58 14.151 -0.724 -9.376 356 HB3 SER 58 2HB SER 58 13.291 0.291 -11.271 357 HG SER 58 HG SER 58 13.835 2.753 -11.540 358 H LEU 59 H LEU 59 16.518 -0.522 -10.366 359 HA LEU 59 HA LEU 59 18.265 1.415 -9.416 360 HB3 LEU 59 2HB LEU 59 18.308 -1.080 -7.718 361 HG LEU 59 HG LEU 59 19.770 0.201 -6.231 362 HD11 LEU 59 1HD1 LEU 59 21.382 0.472 -8.651 363 HD12 LEU 59 2HD1 LEU 59 21.576 -0.613 -7.253 364 HD13 LEU 59 3HD1 LEU 59 20.484 -1.064 -8.584 365 HD21 LEU 59 3HD2 LEU 59 20.653 2.329 -6.723 366 HD22 LEU 59 1HD2 LEU 59 20.046 2.290 -8.395 367 HD23 LEU 59 2HD2 LEU 59 18.906 2.454 -7.037 368 H LEU 60 H LEU 60 17.572 -1.931 -10.422 369 HA LEU 60 HA LEU 60 20.156 -1.934 -11.818 370 HB3 LEU 60 2HB LEU 60 19.472 -4.499 -11.903 371 HG LEU 60 HG LEU 60 20.922 -5.007 -10.165 372 HD11 LEU 60 1HD1 LEU 60 21.797 -2.173 -10.736 373 HD12 LEU 60 2HD1 LEU 60 22.801 -3.608 -10.423 374 HD13 LEU 60 3HD1 LEU 60 21.891 -3.475 -11.946 375 HD21 LEU 60 3HD2 LEU 60 20.309 -4.309 -8.136 376 HD22 LEU 60 1HD2 LEU 60 21.303 -2.869 -8.467 377 HD23 LEU 60 2HD2 LEU 60 19.549 -2.830 -8.773 378 HA PRO 61 HA PRO 61 17.847 -1.768 -15.471 379 HB3 PRO 61 2HB PRO 61 19.605 -0.815 -16.612 380 HG3 PRO 61 2HG PRO 61 21.672 -1.141 -15.644 381 HD3 PRO 61 2HD PRO 61 21.048 -1.495 -13.459 382 H SER 62 H SER 62 18.710 -4.501 -13.975 383 HA SER 62 HA SER 62 17.531 -6.084 -16.125 384 HB3 SER 62 2HB SER 62 18.805 -7.750 -14.145 385 HG SER 62 HG SER 62 18.906 -8.605 -16.141 386 H THR 63 H THR 63 15.881 -7.640 -15.534 387 HA THR 63 HA THR 63 14.284 -6.800 -13.326 388 HB THR 63 HB THR 63 14.087 -9.177 -15.252 389 HG1 THR 63 1HG THR 63 12.666 -6.630 -15.175 390 HG21 THR 63 3HG2 THR 63 12.516 -9.545 -13.424 391 HG22 THR 63 1HG2 THR 63 12.080 -7.820 -13.383 392 HG23 THR 63 2HG2 THR 63 11.588 -8.831 -14.764 393 H GLU 64 H GLU 64 16.156 -9.816 -14.056 394 HA GLU 64 HA GLU 64 15.532 -11.057 -11.683 395 HB3 GLU 64 2HB GLU 64 18.079 -11.992 -12.292 396 HG3 GLU 64 2HG GLU 64 15.323 -12.677 -13.386 397 HE2 GLU 64 HE GLU 64 17.889 -14.885 -12.802 398 H ALA 65 H ALA 65 18.020 -8.619 -12.496 399 HA ALA 65 HA ALA 65 19.364 -8.902 -9.980 400 HB1 ALA 65 1HB ALA 65 20.073 -7.973 -12.442 401 HB2 ALA 65 2HB ALA 65 19.708 -6.440 -11.614 402 HB3 ALA 65 3HB ALA 65 20.927 -7.548 -10.940 403 H ALA 66 H ALA 66 17.135 -6.494 -11.530 404 HA ALA 66 HA ALA 66 17.009 -4.664 -9.517 405 HB1 ALA 66 1HB ALA 66 14.894 -5.704 -11.435 406 HB2 ALA 66 2HB ALA 66 14.645 -4.283 -10.391 407 HB3 ALA 66 3HB ALA 66 15.931 -4.270 -11.621 408 H LYS 67 H LYS 67 15.273 -7.814 -9.811 409 HA LYS 67 HA LYS 67 13.755 -7.412 -7.454 410 HB3 LYS 67 2HB LYS 67 13.058 -8.891 -9.297 411 HG3 LYS 67 2HG LYS 67 15.600 -10.310 -8.504 412 HD3 LYS 67 2HD LYS 67 13.813 -12.010 -10.078 413 HE3 LYS 67 2HE LYS 67 15.174 -12.420 -7.372 414 HZ1 LYS 67 2HZ LYS 67 13.950 -14.268 -9.333 415 HZ3 LYS 67 1HZ LYS 67 13.655 -14.178 -7.734 416 H LYS 68 H LYS 68 16.954 -8.814 -8.225 417 HA LYS 68 HA LYS 68 17.361 -10.098 -5.782 418 HB3 LYS 68 2HB LYS 68 19.302 -8.935 -7.796 419 HG3 LYS 68 2HG LYS 68 19.990 -11.128 -5.841 420 HD3 LYS 68 2HD LYS 68 21.883 -8.939 -6.570 421 HE3 LYS 68 2HE LYS 68 21.885 -11.843 -5.968 422 HZ1 LYS 68 2HZ LYS 68 23.156 -12.514 -7.679 423 HZ3 LYS 68 1HZ LYS 68 24.188 -11.263 -7.524 424 H ASP 69 H ASP 69 17.667 -6.697 -6.815 425 HA ASP 69 HA ASP 69 19.171 -5.854 -4.644 426 HB3 ASP 69 2HB ASP 69 17.047 -4.189 -6.053 427 HD2 ASP 69 HD ASP 69 17.703 -1.856 -5.981 428 H ALA 70 H ALA 70 15.624 -5.330 -5.355 429 HA ALA 70 HA ALA 70 14.941 -4.457 -2.818 430 HB1 ALA 70 1HB ALA 70 12.617 -5.468 -3.674 431 HB2 ALA 70 2HB ALA 70 13.327 -4.009 -4.406 432 HB3 ALA 70 3HB ALA 70 13.517 -5.588 -5.204 433 H CYS 71 H CYS 71 15.409 -7.727 -4.154 434 HA CYS 71 HA CYS 71 14.079 -9.097 -2.106 435 HB3 CYS 71 2HB CYS 71 15.724 -10.989 -2.910 436 HG CYS 71 HG CYS 71 13.140 -10.980 -3.250 437 H LEU 72 H LEU 72 17.542 -8.168 -2.678 438 HA LEU 72 HA LEU 72 18.457 -9.291 -0.255 439 HB3 LEU 72 2HB LEU 72 20.470 -7.829 -0.760 440 HG LEU 72 HG LEU 72 20.154 -9.146 -3.334 441 HD11 LEU 72 1HD1 LEU 72 22.266 -9.823 -2.931 442 HD12 LEU 72 2HD1 LEU 72 22.197 -8.577 -1.661 443 HD13 LEU 72 3HD1 LEU 72 21.918 -10.286 -1.248 444 HD21 LEU 72 3HD2 LEU 72 19.865 -11.435 -2.528 445 HD22 LEU 72 1HD2 LEU 72 19.575 -10.827 -0.880 446 HD23 LEU 72 2HD2 LEU 72 18.428 -10.442 -2.185 447 H LYS 73 H LYS 73 17.469 -5.971 -1.282 448 HA LYS 73 HA LYS 73 18.137 -4.677 1.071 449 HB3 LYS 73 2HB LYS 73 15.936 -3.312 0.158 450 HG3 LYS 73 2HG LYS 73 18.871 -3.265 -0.240 451 HD3 LYS 73 2HD LYS 73 16.994 -1.967 -2.270 452 HE3 LYS 73 2HE LYS 73 19.644 -1.373 -2.965 453 HZ1 LYS 73 2HZ LYS 73 17.973 0.504 -1.420 454 HZ3 LYS 73 1HZ LYS 73 17.489 0.030 -2.901 455 H ALA 74 H ALA 74 15.380 -6.770 0.232 456 HA ALA 74 HA ALA 74 13.816 -6.041 2.481 457 HB1 ALA 74 1HB ALA 74 12.740 -6.985 0.556 458 HB2 ALA 74 2HB ALA 74 13.822 -8.399 0.564 459 HB3 ALA 74 3HB ALA 74 12.613 -8.196 1.854 460 H VAL 75 H VAL 75 16.389 -8.436 1.805 461 HA VAL 75 HA VAL 75 16.002 -10.005 4.084 462 HB VAL 75 HB VAL 75 18.333 -9.427 2.271 463 HG11 VAL 75 1HG1 VAL 75 19.620 -11.173 3.360 464 HG12 VAL 75 2HG1 VAL 75 19.211 -9.910 4.545 465 HG13 VAL 75 3HG1 VAL 75 18.315 -11.448 4.539 466 HG21 VAL 75 3HG2 VAL 75 17.741 -12.122 2.167 467 HG22 VAL 75 1HG2 VAL 75 16.141 -11.378 2.397 468 HG23 VAL 75 2HG2 VAL 75 17.162 -10.885 1.026 469 H HIS 76 H HIS 76 18.084 -7.107 3.461 470 HA HIS 76 HA HIS 76 19.146 -7.081 6.061 471 HB3 HIS 76 2HB HIS 76 19.641 -4.621 5.367 472 HD1 HIS 76 1HD HIS 76 21.554 -6.620 6.243 473 HD2 HIS 76 2HD HIS 76 21.005 -5.878 2.151 474 HE1 HIS 76 1HE HIS 76 23.660 -7.464 5.074 475 H GLU 77 H GLU 77 16.301 -5.526 4.501 476 HA GLU 77 HA GLU 77 15.669 -3.807 6.538 477 HB3 GLU 77 2HB GLU 77 13.260 -4.117 5.613 478 HG3 GLU 77 2HG GLU 77 14.461 -3.488 3.156 479 HE2 GLU 77 HE GLU 77 12.709 -1.081 3.325 480 H LEU 78 H LEU 78 15.314 -7.315 6.287 481 HA LEU 78 HA LEU 78 13.566 -7.366 8.616 482 HB3 LEU 78 2HB LEU 78 14.575 -9.622 6.878 483 HG LEU 78 HG LEU 78 12.505 -10.782 7.657 484 HD11 LEU 78 1HD1 LEU 78 15.023 -10.556 8.924 485 HD12 LEU 78 2HD1 LEU 78 13.800 -10.629 10.214 486 HD13 LEU 78 3HD1 LEU 78 13.873 -11.913 8.985 487 HD21 LEU 78 3HD2 LEU 78 11.412 -10.063 9.715 488 HD22 LEU 78 1HD2 LEU 78 12.444 -8.613 9.773 489 HD23 LEU 78 2HD2 LEU 78 11.272 -8.818 8.449 490 H HIS 79 H HIS 79 16.913 -7.968 7.567 491 HA HIS 79 HA HIS 79 17.629 -9.348 9.940 492 HB3 HIS 79 2HB HIS 79 19.689 -7.945 8.311 493 HD1 HIS 79 1HD HIS 79 21.716 -8.827 9.478 494 HD2 HIS 79 2HD HIS 79 18.773 -11.774 8.982 495 HE1 HIS 79 1HE HIS 79 22.732 -11.004 10.339 496 H ASN 80 H ASN 80 17.945 -5.955 8.731 497 HA ASN 80 HA ASN 80 19.421 -4.984 10.811 498 HB3 ASN 80 2HB ASN 80 17.202 -3.618 9.199 499 HD21 ASN 80 1HD2 ASN 80 17.091 -1.424 9.290 500 HD22 ASN 80 2HD2 ASN 80 17.848 -0.455 10.510 501 H LEU 81 H LEU 81 15.816 -5.172 10.352 502 HA LEU 81 HA LEU 81 15.379 -4.237 13.052 503 HB3 LEU 81 2HB LEU 81 13.331 -5.186 11.056 504 HG LEU 81 HG LEU 81 12.439 -2.888 12.370 505 HD11 LEU 81 1HD1 LEU 81 11.067 -4.912 13.593 506 HD12 LEU 81 2HD1 LEU 81 10.706 -4.253 11.979 507 HD13 LEU 81 3HD1 LEU 81 11.695 -5.724 12.139 508 HD21 LEU 81 3HD2 LEU 81 12.484 -3.611 14.777 509 HD22 LEU 81 1HD2 LEU 81 13.747 -4.784 14.330 510 HD23 LEU 81 2HD2 LEU 81 14.039 -3.041 14.126 511 H GLY 82 H GLY 82 14.046 -7.070 11.213 512 HA2 GLY 82 1HA GLY 82 13.406 -9.098 11.997 513 HA3 GLY 82 2HA GLY 82 15.069 -9.162 12.548 514 H VAL 83 H VAL 83 12.059 -7.394 13.597 515 HA VAL 83 HA VAL 83 12.797 -7.936 16.353 516 HB VAL 83 HB VAL 83 11.939 -5.709 15.247 517 HG11 VAL 83 1HG1 VAL 83 9.275 -6.703 16.217 518 HG12 VAL 83 2HG1 VAL 83 9.656 -5.363 15.110 519 HG13 VAL 83 3HG1 VAL 83 9.787 -7.047 14.547 520 HG21 VAL 83 3HG2 VAL 83 12.562 -5.858 17.566 521 HG22 VAL 83 1HG2 VAL 83 10.982 -5.045 17.466 522 HG23 VAL 83 2HG2 VAL 83 11.075 -6.752 17.961 523 H LEU 84 H LEU 84 11.120 -9.467 13.846 524 HA LEU 84 HA LEU 84 9.489 -10.908 15.817 525 HB3 LEU 84 2HB LEU 84 8.433 -10.990 13.116 526 HG LEU 84 HG LEU 84 7.317 -11.356 15.525 527 HD11 LEU 84 1HD1 LEU 84 6.033 -9.513 16.290 528 HD12 LEU 84 2HD1 LEU 84 7.704 -8.930 16.100 529 HD13 LEU 84 3HD1 LEU 84 6.476 -8.524 14.878 530 HD21 LEU 84 3HD2 LEU 84 6.325 -10.800 12.829 531 HD22 LEU 84 1HD2 LEU 84 5.857 -12.062 13.992 532 HD23 LEU 84 2HD2 LEU 84 5.138 -10.438 14.105 533 H ASN 85 H ASN 85 12.299 -11.282 14.777 534 HA ASN 85 HA ASN 85 12.258 -13.314 12.880 535 HB3 ASN 85 2HB ASN 85 14.488 -13.525 14.792 536 HD21 ASN 85 1HD2 ASN 85 16.255 -11.920 13.323 537 HD22 ASN 85 2HD2 ASN 85 16.448 -12.577 11.732 538 H ASP 86 H ASP 86 11.348 -13.178 16.218 539 HA ASP 86 HA ASP 86 12.119 -15.798 16.925 540 HB3 ASP 86 2HB ASP 86 10.369 -15.349 18.811 541 HD2 ASP 86 HD ASP 86 11.045 -14.105 20.624 542 H PHE 87 H PHE 87 9.489 -14.284 15.162 543 HA PHE 87 HA PHE 87 7.720 -16.557 15.564 544 HB3 PHE 87 2HB PHE 87 6.488 -14.856 13.784 545 HD1 PHE 87 1HD PHE 87 7.571 -13.265 16.935 546 HD2 PHE 87 2HD PHE 87 4.559 -15.534 14.990 547 HE1 PHE 87 1HE PHE 87 6.031 -12.890 18.882 548 HE2 PHE 87 2HE PHE 87 3.019 -15.160 16.937 549 HZ PHE 87 HZ PHE 87 3.774 -13.842 18.859 550 H LEU 88 H LEU 88 10.174 -15.416 13.396 551 HA LEU 88 HA LEU 88 9.099 -17.085 11.240 552 HB3 LEU 88 2HB LEU 88 10.678 -15.889 9.800 553 HG LEU 88 HG LEU 88 8.729 -14.243 11.390 554 HD11 LEU 88 1HD1 LEU 88 10.005 -12.428 11.012 555 HD12 LEU 88 2HD1 LEU 88 10.949 -13.221 9.728 556 HD13 LEU 88 3HD1 LEU 88 9.341 -12.549 9.365 557 HD21 LEU 88 3HD2 LEU 88 7.899 -15.826 9.693 558 HD22 LEU 88 1HD2 LEU 88 7.528 -14.132 9.287 559 HD23 LEU 88 2HD2 LEU 88 8.854 -14.977 8.453 560 H LEU 89 H LEU 89 10.480 -18.663 10.220 561 HA LEU 89 HA LEU 89 12.107 -20.016 12.110 562 HB3 LEU 89 2HB LEU 89 12.281 -21.707 10.489 563 HG LEU 89 HG LEU 89 9.638 -20.375 10.593 564 HD11 LEU 89 1HD1 LEU 89 10.517 -21.532 8.129 565 HD12 LEU 89 2HD1 LEU 89 9.268 -22.579 8.845 566 HD13 LEU 89 3HD1 LEU 89 8.925 -20.856 8.552 567 HD21 LEU 89 3HD2 LEU 89 10.099 -22.001 12.250 568 HD22 LEU 89 1HD2 LEU 89 8.960 -22.757 11.110 569 HD23 LEU 89 2HD2 LEU 89 10.690 -23.172 11.046 570 HA PRO 90 HA PRO 90 15.765 -17.873 11.123 571 HB3 PRO 90 2HB PRO 90 16.404 -17.785 13.333 572 HG3 PRO 90 2HG PRO 90 15.293 -19.259 14.717 573 HD3 PRO 90 2HD PRO 90 13.362 -19.574 13.510 574 H ASP 91 H ASP 91 18.346 -18.931 11.213 575 HA ASP 91 HA ASP 91 18.071 -20.676 8.909 576 HB3 ASP 91 2HB ASP 91 19.432 -18.468 8.874 577 HD2 ASP 91 HD ASP 91 21.919 -20.587 9.052 578 H SER 92 H SER 92 19.074 -20.450 12.266 579 HA SER 92 HA SER 92 20.940 -22.562 12.196 580 HB3 SER 92 2HB SER 92 21.236 -21.085 14.003 581 HG SER 92 HG SER 92 18.715 -21.358 15.211 582 H LYS 93 H LYS 93 17.478 -22.219 13.225 583 HA LYS 93 HA LYS 93 17.225 -24.957 13.910 584 HB3 LYS 93 2HB LYS 93 14.669 -24.092 13.549 585 HG3 LYS 93 2HG LYS 93 15.030 -23.142 15.995 586 HD3 LYS 93 2HD LYS 93 15.300 -25.961 14.969 587 HE3 LYS 93 2HE LYS 93 15.098 -25.828 17.899 588 HZ1 LYS 93 2HZ LYS 93 15.644 -27.909 17.182 589 HZ3 LYS 93 1HZ LYS 93 17.180 -27.378 17.288 590 H ASP 94 H ASP 94 17.316 -23.194 10.922 591 HA ASP 94 HA ASP 94 15.758 -25.180 9.550 592 HB3 ASP 94 2HB ASP 94 17.373 -23.223 7.982 593 HD2 ASP 94 HD ASP 94 15.182 -24.606 5.958 594 H GLU 95 H GLU 95 19.072 -24.400 10.415 595 HA GLU 95 HA GLU 95 21.039 -25.089 9.712 596 HB3 GLU 95 2HB GLU 95 20.745 -27.838 9.334 597 HG3 GLU 95 2HG GLU 95 21.093 -27.910 11.882 598 HE2 GLU 95 HE GLU 95 23.030 -25.724 12.313 599 H ILE 96 H ILE 96 20.799 -23.882 7.613 600 HA ILE 96 HA ILE 96 20.729 -25.789 5.380 601 HB ILE 96 HB ILE 96 19.721 -22.943 5.449 602 HG13 ILE 96 2HG1 ILE 96 17.700 -23.755 5.892 603 HG21 ILE 96 1HG2 ILE 96 20.722 -23.258 3.321 604 HG22 ILE 96 2HG2 ILE 96 20.042 -24.895 3.162 605 HG23 ILE 96 3HG2 ILE 96 18.970 -23.475 3.099 606 HD11 ILE 96 3HD1 ILE 96 16.795 -25.778 4.572 607 HD12 ILE 96 1HD1 ILE 96 17.218 -24.338 3.617 608 HD13 ILE 96 2HD1 ILE 96 18.325 -25.731 3.663 609 H GLU 97 H GLU 97 21.943 -24.759 3.389 610 HA GLU 97 HA GLU 97 24.386 -23.603 4.491 611 HB3 GLU 97 2HB GLU 97 25.399 -24.664 2.313 612 HG3 GLU 97 2HG GLU 97 25.203 -27.036 3.567 613 HE2 GLU 97 HE GLU 97 27.214 -26.084 2.672 614 H ASP 98 H ASP 98 25.567 -22.064 3.072 615 HA ASP 98 HA ASP 98 23.896 -20.140 2.071 616 HB3 ASP 98 2HB ASP 98 26.816 -20.731 2.024 617 HD2 ASP 98 HD ASP 98 27.917 -18.291 -0.077 618 H GLU 99 H GLU 99 25.597 -22.909 0.536 619 HA GLU 99 HA GLU 99 24.959 -22.058 -2.097 620 HB3 GLU 99 2HB GLU 99 25.685 -24.912 -1.563 621 HG3 GLU 99 2HG GLU 99 27.303 -23.030 -3.247 622 HE2 GLU 99 HE GLU 99 27.260 -25.659 -5.528 623 H LEU 100 H LEU 100 23.537 -24.158 0.402 624 HA LEU 100 HA LEU 100 21.696 -25.398 -1.398 625 HB3 LEU 100 2HB LEU 100 21.418 -25.297 1.589 626 HG LEU 100 HG LEU 100 20.415 -27.024 -0.552 627 HD11 LEU 100 1HD1 LEU 100 22.043 -28.615 -0.033 628 HD12 LEU 100 2HD1 LEU 100 21.995 -28.242 1.707 629 HD13 LEU 100 3HD1 LEU 100 20.638 -29.104 0.944 630 HD21 LEU 100 3HD2 LEU 100 19.690 -26.929 2.385 631 HD22 LEU 100 1HD2 LEU 100 19.073 -25.785 1.168 632 HD23 LEU 100 2HD2 LEU 100 18.700 -27.520 1.030 633 H SER 101 H SER 101 22.020 -22.252 -0.394 634 HA SER 101 HA SER 101 19.562 -21.541 0.551 635 HB3 SER 101 2HB SER 101 20.081 -19.280 -0.343 636 HG SER 101 HG SER 101 21.287 -20.045 1.536 637 H ASP 102 H ASP 102 17.709 -20.464 -0.579 638 HA ASP 102 HA ASP 102 16.136 -20.391 -2.069 639 HB3 ASP 102 2HB ASP 102 16.773 -19.664 -4.134 640 HD2 ASP 102 HD ASP 102 19.704 -20.751 -4.924 Start of MODEL 5 1 H1 ILE 1 H ILE 1 36.046 -22.274 -2.111 2 HA ILE 1 HA ILE 1 33.204 -21.817 -2.461 3 HB ILE 1 HB ILE 1 34.173 -24.068 -2.012 4 HG13 ILE 1 2HG1 ILE 1 31.824 -22.882 -1.061 5 HG21 ILE 1 1HG2 ILE 1 35.387 -24.587 -0.199 6 HG22 ILE 1 2HG2 ILE 1 35.695 -22.836 -0.116 7 HG23 ILE 1 3HG2 ILE 1 34.412 -23.563 0.880 8 HD11 ILE 1 3HD1 ILE 1 30.925 -24.952 -1.568 9 HD12 ILE 1 1HD1 ILE 1 32.506 -25.156 -2.359 10 HD13 ILE 1 2HD1 ILE 1 32.228 -25.837 -0.738 11 H SER 2 H SER 2 33.782 -19.394 -2.099 12 HA SER 2 HA SER 2 34.665 -18.390 0.226 13 HB3 SER 2 2HB SER 2 32.804 -16.540 -0.281 14 HG SER 2 HG SER 2 34.673 -15.778 -1.017 15 H GLY 3 H GLY 3 33.696 -17.729 2.255 16 HA2 GLY 3 1HA GLY 3 31.433 -19.423 3.027 17 HA3 GLY 3 2HA GLY 3 32.571 -18.620 4.090 18 H GLY 4 H GLY 4 29.451 -18.483 2.674 19 HA2 GLY 4 1HA GLY 4 29.186 -15.625 3.394 20 HA3 GLY 4 2HA GLY 4 28.285 -16.415 2.116 21 H SER 5 H SER 5 29.055 -17.104 5.611 22 HA SER 5 HA SER 5 26.703 -18.490 6.043 23 HB3 SER 5 2HB SER 5 28.578 -18.743 7.552 24 HG SER 5 HG SER 5 29.578 -16.727 7.570 25 H SER 6 H SER 6 27.506 -15.025 6.091 26 HA SER 6 HA SER 6 25.306 -14.191 7.579 27 HB3 SER 6 2HB SER 6 25.778 -11.951 6.456 28 HG SER 6 HG SER 6 27.173 -13.188 8.272 29 H ILE 7 H ILE 7 25.791 -15.067 4.163 30 HA ILE 7 HA ILE 7 23.466 -13.828 3.167 31 HB ILE 7 HB ILE 7 25.365 -15.936 2.221 32 HG13 ILE 7 2HG1 ILE 7 26.217 -14.306 0.902 33 HG21 ILE 7 1HG2 ILE 7 23.220 -16.786 1.491 34 HG22 ILE 7 2HG2 ILE 7 22.770 -15.189 0.846 35 HG23 ILE 7 3HG2 ILE 7 24.103 -16.104 0.104 36 HD11 ILE 7 3HD1 ILE 7 24.790 -12.372 0.031 37 HD12 ILE 7 1HD1 ILE 7 24.334 -13.982 -0.575 38 HD13 ILE 7 2HD1 ILE 7 23.379 -13.212 0.715 39 H SER 8 H SER 8 24.180 -17.058 4.579 40 HA SER 8 HA SER 8 22.017 -18.449 3.958 41 HB3 SER 8 2HB SER 8 24.010 -18.752 5.774 42 HG SER 8 HG SER 8 23.199 -17.731 7.557 43 H MET 9 H MET 9 22.158 -15.584 6.060 44 HA MET 9 HA MET 9 19.467 -16.010 6.971 45 HB3 MET 9 2HB MET 9 19.943 -13.719 8.089 46 HG3 MET 9 2HG MET 9 21.022 -16.323 8.682 47 HE1 MET 9 3HE MET 9 23.598 -14.383 11.405 48 HE2 MET 9 1HE MET 9 21.971 -15.106 11.375 49 HE3 MET 9 2HE MET 9 23.410 -16.144 11.230 50 H MET 10 H MET 10 21.310 -13.771 4.817 51 HA MET 10 HA MET 10 19.077 -12.179 4.235 52 HB3 MET 10 2HB MET 10 20.800 -11.863 2.080 53 HG3 MET 10 2HG MET 10 20.462 -10.630 4.741 54 HE1 MET 10 3HE MET 10 24.367 -9.505 2.667 55 HE2 MET 10 1HE MET 10 22.804 -9.884 1.904 56 HE3 MET 10 2HE MET 10 22.992 -8.389 2.853 57 H TYR 11 H TYR 11 20.837 -14.690 2.269 58 HA TYR 11 HA TYR 11 19.210 -14.704 0.079 59 HB3 TYR 11 2HB TYR 11 19.892 -17.412 0.718 60 HD1 TYR 11 1HD TYR 11 21.051 -14.159 -0.583 61 HD2 TYR 11 2HD TYR 11 21.506 -18.408 -0.793 62 HE1 TYR 11 1HE TYR 11 22.385 -13.916 -2.734 63 HE2 TYR 11 2HE TYR 11 22.840 -18.151 -2.942 64 HH TYR 11 HH TYR 11 22.767 -15.640 -4.818 65 H LYS 12 H LYS 12 18.696 -16.296 3.264 66 HA LYS 12 HA LYS 12 16.666 -17.998 2.650 67 HB3 LYS 12 2HB LYS 12 16.257 -16.487 5.147 68 HG3 LYS 12 2HG LYS 12 15.414 -18.837 4.550 69 HD3 LYS 12 2HD LYS 12 17.514 -20.440 5.354 70 HE3 LYS 12 2HE LYS 12 17.517 -20.010 2.434 71 HZ1 LYS 12 2HZ LYS 12 16.823 -22.196 4.299 72 HZ3 LYS 12 1HZ LYS 12 18.057 -22.139 3.239 73 H TYR 13 H TYR 13 16.444 -14.450 3.332 74 HA TYR 13 HA TYR 13 13.717 -14.185 3.235 75 HB3 TYR 13 2HB TYR 13 15.708 -12.304 1.861 76 HD1 TYR 13 1HD TYR 13 13.380 -11.524 0.948 77 HD2 TYR 13 2HD TYR 13 14.557 -11.238 5.052 78 HE1 TYR 13 1HE TYR 13 11.618 -9.733 1.337 79 HE2 TYR 13 2HE TYR 13 12.791 -9.449 5.427 80 HH TYR 13 HH TYR 13 11.536 -7.887 4.247 81 H CYS 14 H CYS 14 16.086 -14.239 0.501 82 HA CYS 14 HA CYS 14 14.220 -13.625 -1.474 83 HB3 CYS 14 2HB CYS 14 16.559 -15.389 -2.103 84 HG CYS 14 HG CYS 14 15.333 -12.507 -3.191 85 H SER 15 H SER 15 15.094 -16.595 0.282 86 HA SER 15 HA SER 15 14.064 -18.434 -1.497 87 HB3 SER 15 2HB SER 15 13.764 -18.933 1.449 88 HG SER 15 HG SER 15 15.480 -20.570 0.059 89 H ARG 16 H ARG 16 12.490 -15.972 0.308 90 HA ARG 16 HA ARG 16 10.132 -17.280 0.959 91 HB3 ARG 16 2HB ARG 16 9.197 -14.850 0.920 92 HG3 ARG 16 2HG ARG 16 10.871 -14.128 2.784 93 HD3 ARG 16 2HD ARG 16 9.114 -16.574 2.733 94 HE ARG 16 HE ARG 16 11.338 -16.552 4.450 95 HH11 ARG 16 2HH2 ARG 16 7.817 -16.567 4.838 96 HH12 ARG 16 1HH2 ARG 16 7.863 -17.401 6.355 97 HH22 ARG 16 1HH ARG 16 9.980 -18.028 7.286 98 H LEU 17 H LEU 17 11.480 -16.817 -2.059 99 HA LEU 17 HA LEU 17 9.440 -15.788 -3.620 100 HB3 LEU 17 2HB LEU 17 10.784 -17.807 -5.077 101 HG LEU 17 HG LEU 17 10.365 -15.081 -5.352 102 HD11 LEU 17 1HD1 LEU 17 13.200 -15.591 -4.576 103 HD12 LEU 17 2HD1 LEU 17 12.886 -14.454 -5.910 104 HD13 LEU 17 3HD1 LEU 17 12.169 -14.165 -4.306 105 HD21 LEU 17 3HD2 LEU 17 10.848 -17.202 -6.970 106 HD22 LEU 17 1HD2 LEU 17 10.772 -15.513 -7.523 107 HD23 LEU 17 2HD2 LEU 17 12.348 -16.270 -7.194 108 HA PRO 18 HA PRO 18 6.464 -18.928 -3.310 109 HB3 PRO 18 2HB PRO 18 4.745 -17.406 -3.477 110 HG3 PRO 18 2HG PRO 18 5.350 -15.361 -4.355 111 HD3 PRO 18 2HD PRO 18 7.595 -15.352 -3.858 112 H HIS 19 H HIS 19 7.755 -17.978 -6.406 113 HA HIS 19 HA HIS 19 6.801 -20.231 -7.771 114 HB3 HIS 19 2HB HIS 19 9.082 -18.315 -8.296 115 HD1 HIS 19 1HD HIS 19 6.995 -20.954 -10.165 116 HD2 HIS 19 2HD HIS 19 10.768 -19.126 -10.268 117 HE1 HIS 19 1HE HIS 19 8.264 -22.043 -12.092 118 H ASP 20 H ASP 20 9.070 -19.933 -5.246 119 HA ASP 20 HA ASP 20 10.678 -22.126 -6.193 120 HB3 ASP 20 2HB ASP 20 10.773 -20.636 -3.528 121 HD2 ASP 20 HD ASP 20 12.533 -23.346 -5.215 122 H GLU 21 H GLU 21 10.123 -24.243 -5.644 123 HA GLU 21 HA GLU 21 7.942 -24.651 -3.877 124 HB3 GLU 21 2HB GLU 21 8.310 -25.997 -5.956 125 HG3 GLU 21 2HG GLU 21 10.337 -27.690 -4.541 126 HE2 GLU 21 HE GLU 21 11.967 -28.105 -6.477 127 H PHE 22 H PHE 22 11.433 -24.569 -3.635 128 HA PHE 22 HA PHE 22 11.761 -26.325 -1.480 129 HB3 PHE 22 2HB PHE 22 13.703 -24.301 -1.267 130 HD1 PHE 22 2HD PHE 22 13.112 -26.363 -4.321 131 HD2 PHE 22 1HD PHE 22 15.378 -25.817 -0.776 132 HE1 PHE 22 2HE PHE 22 14.613 -28.262 -4.987 133 HE2 PHE 22 1HE PHE 22 16.879 -27.716 -1.442 134 HZ PHE 22 HZ PHE 22 16.479 -28.915 -3.540 135 H PHE 23 H PHE 23 10.062 -23.374 -1.666 136 HA PHE 23 HA PHE 23 10.257 -23.107 1.246 137 HB3 PHE 23 2HB PHE 23 9.746 -20.720 -0.552 138 HD1 PHE 23 2HD PHE 23 8.793 -19.713 1.467 139 HD2 PHE 23 1HD PHE 23 12.795 -21.120 1.404 140 HE1 PHE 23 2HE PHE 23 9.280 -18.420 3.561 141 HE2 PHE 23 1HE PHE 23 13.283 -19.827 3.498 142 HZ PHE 23 HZ PHE 23 11.519 -18.492 4.552 143 H GLN 24 H GLN 24 8.311 -22.399 2.300 144 HA GLN 24 HA GLN 24 5.992 -23.148 0.822 145 HB3 GLN 24 2HB GLN 24 4.995 -22.326 3.213 146 HG3 GLN 24 2HG GLN 24 6.414 -24.878 2.403 147 HE21 GLN 24 1HE2 GLN 24 4.563 -26.414 3.941 148 HE22 GLN 24 2HE2 GLN 24 5.071 -26.393 5.597 149 HA PRO 25 HA PRO 25 4.634 -19.138 -0.126 150 HB3 PRO 25 2HB PRO 25 3.019 -19.931 -1.562 151 HG3 PRO 25 2HG PRO 25 2.341 -22.097 -1.148 152 HD3 PRO 25 2HD PRO 25 4.194 -22.902 -0.053 153 H LYS 26 H LYS 26 3.544 -17.162 0.533 154 HA LYS 26 HA LYS 26 1.970 -16.868 2.679 155 HB3 LYS 26 2HB LYS 26 4.188 -16.263 4.272 156 HG3 LYS 26 2HG LYS 26 1.962 -18.269 4.211 157 HD3 LYS 26 2HD LYS 26 4.474 -18.551 5.909 158 HE3 LYS 26 2HE LYS 26 1.739 -19.809 6.436 159 HZ1 LYS 26 2HZ LYS 26 3.253 -21.268 7.343 160 HZ3 LYS 26 1HZ LYS 26 3.170 -20.232 8.597 161 HA PRO 27 HA PRO 27 4.531 -12.984 1.907 162 HB3 PRO 27 2HB PRO 27 6.796 -13.131 2.292 163 HG3 PRO 27 2HG PRO 27 7.659 -15.266 2.165 164 HD3 PRO 27 2HD PRO 27 5.768 -16.496 2.613 165 H GLU 28 H GLU 28 5.441 -11.568 -0.134 166 HA GLU 28 HA GLU 28 4.150 -12.696 -2.462 167 HB3 GLU 28 2HB GLU 28 3.250 -10.103 -2.627 168 HG3 GLU 28 2HG GLU 28 1.513 -11.975 -1.064 169 HE2 GLU 28 HE GLU 28 -0.555 -11.721 -1.858 170 H PHE 29 H PHE 29 5.229 -12.184 -4.361 171 HA PHE 29 HA PHE 29 7.124 -9.964 -4.242 172 HB3 PHE 29 2HB PHE 29 7.896 -12.577 -3.880 173 HD1 PHE 29 1HD PHE 29 6.104 -13.693 -5.575 174 HD2 PHE 29 2HD PHE 29 9.858 -12.051 -6.677 175 HE1 PHE 29 1HE PHE 29 6.118 -15.114 -7.643 176 HE2 PHE 29 2HE PHE 29 9.873 -13.473 -8.745 177 HZ PHE 29 HZ PHE 29 8.003 -14.988 -9.204 178 H GLN 30 H GLN 30 7.235 -8.773 -6.129 179 HA GLN 30 HA GLN 30 6.203 -9.993 -8.529 180 HB3 GLN 30 2HB GLN 30 5.074 -7.372 -8.488 181 HG3 GLN 30 2HG GLN 30 2.927 -8.987 -8.125 182 HE21 GLN 30 1HE2 GLN 30 2.239 -10.163 -10.241 183 HE22 GLN 30 2HE2 GLN 30 2.631 -9.346 -11.717 184 H PHE 31 H PHE 31 7.306 -9.293 -10.357 185 HA PHE 31 HA PHE 31 9.155 -7.056 -9.911 186 HB3 PHE 31 2HB PHE 31 9.979 -9.536 -10.215 187 HD1 PHE 31 2HD PHE 31 8.172 -10.983 -11.198 188 HD2 PHE 31 1HD PHE 31 10.557 -8.410 -13.584 189 HE1 PHE 31 2HE PHE 31 7.518 -12.278 -13.246 190 HE2 PHE 31 1HE PHE 31 9.905 -9.705 -15.632 191 HZ PHE 31 HZ PHE 31 8.393 -11.623 -15.439 192 H LYS 32 H LYS 32 9.285 -5.438 -11.477 193 HA LYS 32 HA LYS 32 7.291 -5.673 -13.616 194 HB3 LYS 32 2HB LYS 32 8.024 -3.537 -11.750 195 HG3 LYS 32 2HG LYS 32 7.594 -2.871 -14.701 196 HD3 LYS 32 2HD LYS 32 7.853 -0.541 -13.980 197 HE3 LYS 32 2HE LYS 32 5.901 -1.808 -12.015 198 HZ1 LYS 32 2HZ LYS 32 5.892 0.697 -13.612 199 HZ3 LYS 32 1HZ LYS 32 6.020 0.593 -11.991 200 HA PRO 33 HA PRO 33 10.830 -5.858 -16.175 201 HB3 PRO 33 2HB PRO 33 10.028 -7.681 -17.330 202 HG3 PRO 33 2HG PRO 33 7.779 -8.096 -17.029 203 HD3 PRO 33 2HD PRO 33 7.446 -7.086 -14.991 204 H VAL 34 H VAL 34 11.002 -3.516 -15.594 205 HA VAL 34 HA VAL 34 9.807 -1.753 -17.508 206 HB VAL 34 HB VAL 34 10.045 -0.966 -15.298 207 HG11 VAL 34 1HG1 VAL 34 12.808 -2.098 -15.495 208 HG12 VAL 34 2HG1 VAL 34 12.548 -0.687 -14.441 209 HG13 VAL 34 3HG1 VAL 34 11.625 -2.185 -14.167 210 HG21 VAL 34 3HG2 VAL 34 11.339 1.067 -15.565 211 HG22 VAL 34 1HG2 VAL 34 12.269 0.341 -16.899 212 HG23 VAL 34 2HG2 VAL 34 10.533 0.674 -17.102 213 H ASP 35 H ASP 35 11.275 -0.134 -18.717 214 HA ASP 35 HA ASP 35 12.811 -1.599 -20.489 215 HB3 ASP 35 2HB ASP 35 13.702 0.998 -20.825 216 HD2 ASP 35 HD ASP 35 11.110 2.054 -22.355 217 H GLU 36 H GLU 36 15.237 -0.789 -21.010 218 HA GLU 36 HA GLU 36 16.781 -1.508 -18.818 219 HB3 GLU 36 2HB GLU 36 17.376 -1.779 -21.267 220 HG3 GLU 36 2HG GLU 36 17.175 1.114 -21.169 221 HE2 GLU 36 HE GLU 36 20.289 2.151 -22.463 222 H PHE 37 H PHE 37 15.217 1.436 -19.543 223 HA PHE 37 HA PHE 37 17.134 3.294 -18.711 224 HB3 PHE 37 2HB PHE 37 14.605 4.295 -18.014 225 HD1 PHE 37 1HD PHE 37 15.829 3.083 -21.336 226 HD2 PHE 37 2HD PHE 37 14.804 6.403 -18.899 227 HE1 PHE 37 1HE PHE 37 16.339 4.638 -23.239 228 HE2 PHE 37 2HE PHE 37 15.316 7.957 -20.803 229 HZ PHE 37 HZ PHE 37 16.077 7.056 -22.950 230 H GLY 38 H GLY 38 15.632 0.793 -16.958 231 HA2 GLY 38 1HA GLY 38 16.614 1.842 -14.463 232 HA3 GLY 38 2HA GLY 38 14.865 1.781 -14.549 233 H GLY 39 H GLY 39 17.411 -0.418 -15.922 234 HA2 GLY 39 1HA GLY 39 17.446 -2.693 -15.939 235 HA3 GLY 39 2HA GLY 39 17.521 -2.450 -14.206 236 H THR 40 H THR 40 15.961 -3.416 -12.975 237 HA THR 40 HA THR 40 13.344 -3.874 -14.224 238 HB THR 40 HB THR 40 15.029 -5.931 -12.699 239 HG1 THR 40 1HG THR 40 14.094 -5.613 -15.466 240 HG21 THR 40 3HG2 THR 40 12.961 -7.128 -14.237 241 HG22 THR 40 1HG2 THR 40 13.047 -7.048 -12.461 242 HG23 THR 40 2HG2 THR 40 12.177 -5.787 -13.367 243 H ILE 41 H ILE 41 11.566 -3.826 -12.831 244 HA ILE 41 HA ILE 41 12.192 -2.544 -10.288 245 HB ILE 41 HB ILE 41 9.740 -2.673 -12.026 246 HG13 ILE 41 2HG1 ILE 41 10.020 -0.338 -12.275 247 HG21 ILE 41 1HG2 ILE 41 8.607 -1.287 -10.299 248 HG22 ILE 41 2HG2 ILE 41 8.914 -2.964 -9.787 249 HG23 ILE 41 3HG2 ILE 41 9.946 -1.647 -9.184 250 HD11 ILE 41 3HD1 ILE 41 12.327 0.468 -10.989 251 HD12 ILE 41 1HD1 ILE 41 10.678 0.773 -10.390 252 HD13 ILE 41 2HD1 ILE 41 11.603 -0.620 -9.780 253 H CYS 42 H CYS 42 11.790 -3.481 -8.321 254 HA CYS 42 HA CYS 42 10.625 -6.166 -8.456 255 HB3 CYS 42 2HB CYS 42 12.837 -5.029 -6.750 256 HG CYS 42 HG CYS 42 12.688 -6.498 -4.852 257 H ARG 43 H ARG 43 9.112 -6.737 -6.734 258 HA ARG 43 HA ARG 43 8.340 -4.561 -5.013 259 HB3 ARG 43 2HB ARG 43 6.410 -5.989 -6.911 260 HG3 ARG 43 2HG ARG 43 5.924 -4.030 -4.623 261 HD3 ARG 43 2HD ARG 43 4.490 -4.363 -7.173 262 HE ARG 43 HE ARG 43 3.213 -5.736 -5.142 263 HH11 ARG 43 2HH2 ARG 43 2.492 -2.722 -6.858 264 HH12 ARG 43 1HH2 ARG 43 0.778 -2.877 -6.666 265 HH22 ARG 43 1HH ARG 43 -0.106 -4.779 -5.505 266 H ILE 44 H ILE 44 8.624 -5.579 -3.038 267 HA ILE 44 HA ILE 44 7.398 -8.234 -2.764 268 HB ILE 44 HB ILE 44 10.126 -7.433 -2.394 269 HG13 ILE 44 2HG1 ILE 44 9.428 -9.459 -3.535 270 HG21 ILE 44 1HG2 ILE 44 8.967 -8.723 0.078 271 HG22 ILE 44 2HG2 ILE 44 10.607 -8.082 -0.185 272 HG23 ILE 44 3HG2 ILE 44 9.226 -6.967 -0.055 273 HD11 ILE 44 3HD1 ILE 44 10.791 -11.149 -2.187 274 HD12 ILE 44 1HD1 ILE 44 11.628 -9.621 -2.551 275 HD13 ILE 44 2HD1 ILE 44 10.948 -9.898 -0.930 276 H THR 45 H THR 45 6.013 -8.512 -1.046 277 HA THR 45 HA THR 45 5.996 -6.493 1.050 278 HB THR 45 HB THR 45 4.485 -5.465 -0.534 279 HG1 THR 45 1HG THR 45 2.907 -7.275 1.145 280 HG21 THR 45 3HG2 THR 45 4.041 -8.144 -1.441 281 HG22 THR 45 1HG2 THR 45 2.486 -7.571 -0.789 282 HG23 THR 45 2HG2 THR 45 3.301 -6.657 -2.081 283 H LEU 46 H LEU 46 5.674 -7.375 3.005 284 HA LEU 46 HA LEU 46 5.000 -10.203 3.030 285 HB3 LEU 46 2HB LEU 46 5.581 -9.621 5.586 286 HG LEU 46 HG LEU 46 7.642 -10.017 3.400 287 HD11 LEU 46 1HD1 LEU 46 8.143 -9.172 5.988 288 HD12 LEU 46 2HD1 LEU 46 8.367 -10.937 6.074 289 HD13 LEU 46 3HD1 LEU 46 9.294 -9.978 4.895 290 HD21 LEU 46 3HD2 LEU 46 5.992 -11.818 3.530 291 HD22 LEU 46 1HD2 LEU 46 7.597 -12.366 4.071 292 HD23 LEU 46 2HD2 LEU 46 6.327 -12.010 5.268 293 HA PRO 47 HA PRO 47 1.085 -9.613 4.751 294 HB3 PRO 47 2HB PRO 47 0.676 -11.872 4.920 295 HG3 PRO 47 2HG PRO 47 2.565 -13.180 5.118 296 HD3 PRO 47 2HD PRO 47 4.123 -11.796 4.146 297 H ALA 48 H ALA 48 -0.350 -9.170 6.682 298 HA ALA 48 HA ALA 48 0.782 -7.057 8.073 299 HB1 ALA 48 1HB ALA 48 -1.721 -8.645 8.106 300 HB2 ALA 48 2HB ALA 48 -1.326 -7.838 9.642 301 HB3 ALA 48 3HB ALA 48 -1.483 -6.881 8.149 302 H ASN 49 H ASN 49 1.179 -10.471 8.468 303 HA ASN 49 HA ASN 49 1.498 -10.549 11.230 304 HB3 ASN 49 2HB ASN 49 3.238 -12.414 9.732 305 HD21 ASN 49 1HD2 ASN 49 3.563 -12.933 11.933 306 HD22 ASN 49 2HD2 ASN 49 2.418 -13.874 12.830 307 H ALA 50 H ALA 50 3.380 -9.194 8.643 308 HA ALA 50 HA ALA 50 5.741 -9.069 10.395 309 HB1 ALA 50 1HB ALA 50 5.960 -8.727 7.422 310 HB2 ALA 50 2HB ALA 50 7.124 -9.413 8.580 311 HB3 ALA 50 3HB ALA 50 5.717 -10.371 8.061 312 HA PRO 51 HA PRO 51 5.088 -4.790 10.219 313 HB3 PRO 51 2HB PRO 51 6.170 -4.477 12.227 314 HG3 PRO 51 2HG PRO 51 7.587 -6.192 12.834 315 HD3 PRO 51 2HD PRO 51 6.657 -7.929 11.650 316 H ILE 52 H ILE 52 8.525 -5.012 9.497 317 HA ILE 52 HA ILE 52 7.914 -3.531 7.042 318 HB ILE 52 HB ILE 52 10.507 -3.156 7.249 319 HG13 ILE 52 2HG1 ILE 52 9.724 -3.667 10.134 320 HG21 ILE 52 1HG2 ILE 52 9.900 -1.165 8.834 321 HG22 ILE 52 2HG2 ILE 52 9.205 -1.256 7.197 322 HG23 ILE 52 3HG2 ILE 52 8.233 -1.746 8.605 323 HD11 ILE 52 3HD1 ILE 52 11.702 -5.043 8.259 324 HD12 ILE 52 1HD1 ILE 52 11.587 -5.337 10.011 325 HD13 ILE 52 2HD1 ILE 52 10.226 -5.763 8.945 326 H SER 53 H SER 53 9.510 -4.032 5.184 327 HA SER 53 HA SER 53 11.054 -6.068 4.816 328 HB3 SER 53 2HB SER 53 9.170 -7.852 3.938 329 HG SER 53 HG SER 53 10.502 -7.573 6.469 330 H GLU 54 H GLU 54 8.302 -4.193 3.791 331 HA GLU 54 HA GLU 54 8.053 -4.918 1.174 332 HB3 GLU 54 2HB GLU 54 6.486 -3.383 2.186 333 HG3 GLU 54 2HG GLU 54 8.545 -1.166 2.221 334 HE2 GLU 54 HE GLU 54 6.354 0.730 2.987 335 H ILE 55 H ILE 55 9.132 -4.443 -0.761 336 HA ILE 55 HA ILE 55 11.342 -2.568 -0.654 337 HB ILE 55 HB ILE 55 12.671 -4.490 -1.893 338 HG13 ILE 55 2HG1 ILE 55 10.466 -5.946 -1.152 339 HG21 ILE 55 1HG2 ILE 55 12.823 -4.864 1.022 340 HG22 ILE 55 2HG2 ILE 55 14.063 -4.342 -0.143 341 HG23 ILE 55 3HG2 ILE 55 12.883 -3.168 0.488 342 HD11 ILE 55 3HD1 ILE 55 12.004 -7.944 -1.516 343 HD12 ILE 55 1HD1 ILE 55 12.066 -6.714 -2.802 344 HD13 ILE 55 2HD1 ILE 55 13.363 -6.796 -1.586 345 H GLU 56 H GLU 56 11.004 -1.239 -2.345 346 HA GLU 56 HA GLU 56 10.291 -2.480 -4.855 347 HB3 GLU 56 2HB GLU 56 8.596 -0.555 -5.214 348 HG3 GLU 56 2HG GLU 56 8.226 -2.928 -3.374 349 HE2 GLU 56 HE GLU 56 6.252 -3.192 -2.405 350 H SER 57 H SER 57 11.999 -1.888 -6.127 351 HA SER 57 HA SER 57 12.397 0.618 -6.996 352 HB3 SER 57 2HB SER 57 13.324 1.721 -5.235 353 HG SER 57 HG SER 57 14.161 0.662 -3.367 354 H SER 58 H SER 58 13.532 0.304 -8.887 355 HA SER 58 HA SER 58 14.767 -2.206 -9.277 356 HB3 SER 58 2HB SER 58 13.533 -1.133 -11.095 357 HG SER 58 HG SER 58 14.613 1.110 -10.297 358 H LEU 59 H LEU 59 17.054 -2.221 -10.451 359 HA LEU 59 HA LEU 59 18.891 -0.202 -9.979 360 HB3 LEU 59 2HB LEU 59 18.867 -2.313 -7.817 361 HG LEU 59 HG LEU 59 20.608 -0.709 -6.793 362 HD11 LEU 59 1HD1 LEU 59 21.156 -2.984 -7.307 363 HD12 LEU 59 2HD1 LEU 59 21.298 -2.615 -9.042 364 HD13 LEU 59 3HD1 LEU 59 22.478 -1.945 -7.890 365 HD21 LEU 59 3HD2 LEU 59 21.929 0.630 -8.181 366 HD22 LEU 59 1HD2 LEU 59 21.303 -0.123 -9.668 367 HD23 LEU 59 2HD2 LEU 59 20.263 0.961 -8.713 368 H LEU 60 H LEU 60 18.078 -3.652 -10.313 369 HA LEU 60 HA LEU 60 20.565 -3.986 -11.840 370 HB3 LEU 60 2HB LEU 60 19.817 -6.500 -11.442 371 HG LEU 60 HG LEU 60 21.358 -6.753 -9.738 372 HD11 LEU 60 1HD1 LEU 60 23.236 -5.463 -10.306 373 HD12 LEU 60 2HD1 LEU 60 22.237 -5.496 -11.779 374 HD13 LEU 60 3HD1 LEU 60 22.246 -4.050 -10.743 375 HD21 LEU 60 3HD2 LEU 60 20.196 -4.237 -8.678 376 HD22 LEU 60 1HD2 LEU 60 20.670 -5.734 -7.840 377 HD23 LEU 60 2HD2 LEU 60 21.910 -4.546 -8.310 378 HA PRO 61 HA PRO 61 18.092 -4.440 -15.351 379 HB3 PRO 61 2HB PRO 61 19.867 -3.975 -16.743 380 HG3 PRO 61 2HG PRO 61 21.944 -4.326 -15.804 381 HD3 PRO 61 2HD PRO 61 21.424 -4.119 -13.573 382 H SER 62 H SER 62 18.736 -6.860 -13.312 383 HA SER 62 HA SER 62 17.150 -8.667 -14.963 384 HB3 SER 62 2HB SER 62 18.641 -10.336 -14.635 385 HG SER 62 HG SER 62 20.272 -8.750 -14.883 386 H THR 63 H THR 63 15.472 -9.855 -13.856 387 HA THR 63 HA THR 63 14.366 -8.476 -11.635 388 HB THR 63 HB THR 63 13.713 -10.919 -13.313 389 HG1 THR 63 1HG THR 63 12.576 -9.231 -14.175 390 HG21 THR 63 3HG2 THR 63 13.029 -11.282 -10.815 391 HG22 THR 63 1HG2 THR 63 11.944 -9.891 -11.052 392 HG23 THR 63 2HG2 THR 63 11.731 -11.363 -12.031 393 H GLU 64 H GLU 64 15.884 -11.742 -12.007 394 HA GLU 64 HA GLU 64 15.554 -12.538 -9.428 395 HB3 GLU 64 2HB GLU 64 16.370 -14.220 -10.801 396 HG3 GLU 64 2HG GLU 64 18.804 -13.424 -11.955 397 HE2 GLU 64 HE GLU 64 15.162 -13.404 -13.153 398 H ALA 65 H ALA 65 18.173 -10.515 -10.870 399 HA ALA 65 HA ALA 65 19.594 -10.333 -8.398 400 HB1 ALA 65 1HB ALA 65 20.247 -10.021 -11.023 401 HB2 ALA 65 2HB ALA 65 20.032 -8.320 -10.545 402 HB3 ALA 65 3HB ALA 65 21.201 -9.345 -9.681 403 H ALA 66 H ALA 66 17.449 -8.156 -10.351 404 HA ALA 66 HA ALA 66 17.576 -5.949 -8.712 405 HB1 ALA 66 1HB ALA 66 15.322 -7.070 -10.422 406 HB2 ALA 66 2HB ALA 66 15.311 -5.440 -9.707 407 HB3 ALA 66 3HB ALA 66 16.554 -5.880 -10.902 408 H LYS 67 H LYS 67 15.375 -8.822 -8.551 409 HA LYS 67 HA LYS 67 14.010 -7.854 -6.268 410 HB3 LYS 67 2HB LYS 67 13.143 -9.492 -7.986 411 HG3 LYS 67 2HG LYS 67 15.358 -11.067 -6.825 412 HD3 LYS 67 2HD LYS 67 13.114 -11.945 -5.715 413 HE3 LYS 67 2HE LYS 67 12.233 -12.010 -8.307 414 HZ1 LYS 67 2HZ LYS 67 13.284 -13.750 -9.285 415 HZ3 LYS 67 1HZ LYS 67 12.293 -14.703 -8.412 416 H LYS 68 H LYS 68 16.926 -9.831 -6.847 417 HA LYS 68 HA LYS 68 17.149 -10.772 -4.200 418 HB3 LYS 68 2HB LYS 68 19.119 -10.501 -6.482 419 HG3 LYS 68 2HG LYS 68 19.517 -12.122 -3.938 420 HD3 LYS 68 2HD LYS 68 20.760 -12.599 -6.172 421 HE3 LYS 68 2HE LYS 68 22.750 -10.527 -5.492 422 HZ1 LYS 68 2HZ LYS 68 23.156 -10.823 -7.681 423 HZ3 LYS 68 1HZ LYS 68 21.605 -10.606 -8.128 424 H ASP 69 H ASP 69 18.144 -7.791 -5.898 425 HA ASP 69 HA ASP 69 19.919 -6.906 -3.969 426 HB3 ASP 69 2HB ASP 69 18.120 -5.056 -5.572 427 HD2 ASP 69 HD ASP 69 21.479 -4.983 -3.919 428 H ALA 70 H ALA 70 16.474 -5.894 -4.654 429 HA ALA 70 HA ALA 70 16.149 -4.352 -2.372 430 HB1 ALA 70 1HB ALA 70 13.681 -5.632 -3.159 431 HB2 ALA 70 2HB ALA 70 14.210 -3.955 -3.432 432 HB3 ALA 70 3HB ALA 70 14.627 -5.224 -4.610 433 H CYS 71 H CYS 71 15.435 -7.849 -2.991 434 HA CYS 71 HA CYS 71 14.255 -8.430 -0.597 435 HB3 CYS 71 2HB CYS 71 15.877 -10.042 -2.547 436 HG CYS 71 HG CYS 71 16.617 -11.729 -1.068 437 H LEU 72 H LEU 72 17.741 -8.196 -1.510 438 HA LEU 72 HA LEU 72 18.799 -9.156 0.875 439 HB3 LEU 72 2HB LEU 72 20.706 -7.468 0.066 440 HG LEU 72 HG LEU 72 20.065 -9.843 -1.689 441 HD11 LEU 72 1HD1 LEU 72 22.329 -8.053 -1.357 442 HD12 LEU 72 2HD1 LEU 72 22.789 -9.755 -1.110 443 HD13 LEU 72 3HD1 LEU 72 21.996 -9.259 -2.624 444 HD21 LEU 72 3HD2 LEU 72 21.703 -10.904 0.183 445 HD22 LEU 72 1HD2 LEU 72 20.753 -9.784 1.188 446 HD23 LEU 72 2HD2 LEU 72 19.928 -11.029 0.222 447 H LYS 73 H LYS 73 17.735 -5.861 -0.122 448 HA LYS 73 HA LYS 73 18.589 -4.697 2.336 449 HB3 LYS 73 2HB LYS 73 16.651 -3.073 1.027 450 HG3 LYS 73 2HG LYS 73 19.706 -3.083 1.020 451 HD3 LYS 73 2HD LYS 73 17.858 -0.710 0.547 452 HE3 LYS 73 2HE LYS 73 20.538 -0.694 -0.647 453 HZ1 LYS 73 2HZ LYS 73 18.860 1.172 0.084 454 HZ3 LYS 73 1HZ LYS 73 20.462 1.461 0.142 455 H ALA 74 H ALA 74 15.666 -6.279 1.087 456 HA ALA 74 HA ALA 74 13.864 -5.296 2.983 457 HB1 ALA 74 1HB ALA 74 12.406 -6.810 2.032 458 HB2 ALA 74 2HB ALA 74 13.643 -6.761 0.755 459 HB3 ALA 74 3HB ALA 74 13.632 -8.095 1.932 460 H VAL 75 H VAL 75 15.897 -8.305 2.929 461 HA VAL 75 HA VAL 75 15.062 -9.276 5.386 462 HB VAL 75 HB VAL 75 16.254 -10.621 3.809 463 HG11 VAL 75 1HG1 VAL 75 18.735 -10.243 3.443 464 HG12 VAL 75 2HG1 VAL 75 17.651 -9.058 2.677 465 HG13 VAL 75 3HG1 VAL 75 18.514 -8.636 4.175 466 HG21 VAL 75 3HG2 VAL 75 16.645 -10.750 6.455 467 HG22 VAL 75 1HG2 VAL 75 17.439 -11.863 5.315 468 HG23 VAL 75 2HG2 VAL 75 18.327 -10.457 5.950 469 H HIS 76 H HIS 76 17.530 -6.825 4.508 470 HA HIS 76 HA HIS 76 18.726 -6.665 7.015 471 HB3 HIS 76 2HB HIS 76 18.938 -4.128 5.936 472 HD1 HIS 76 1HD HIS 76 20.368 -7.401 4.514 473 HD2 HIS 76 2HD HIS 76 21.565 -3.996 6.652 474 HE1 HIS 76 1HE HIS 76 22.889 -7.615 4.844 475 H GLU 77 H GLU 77 15.915 -4.918 5.562 476 HA GLU 77 HA GLU 77 15.520 -3.162 7.629 477 HB3 GLU 77 2HB GLU 77 13.061 -3.242 6.795 478 HG3 GLU 77 2HG GLU 77 13.735 -2.311 4.521 479 HE2 GLU 77 HE GLU 77 15.915 0.134 6.596 480 H LEU 78 H LEU 78 14.770 -6.619 7.343 481 HA LEU 78 HA LEU 78 13.120 -6.537 9.731 482 HB3 LEU 78 2HB LEU 78 13.909 -8.825 7.923 483 HG LEU 78 HG LEU 78 12.696 -8.968 10.457 484 HD11 LEU 78 1HD1 LEU 78 10.630 -8.076 9.509 485 HD12 LEU 78 2HD1 LEU 78 10.636 -9.353 8.267 486 HD13 LEU 78 3HD1 LEU 78 10.437 -9.781 9.985 487 HD21 LEU 78 3HD2 LEU 78 12.131 -11.364 9.500 488 HD22 LEU 78 1HD2 LEU 78 13.155 -10.815 8.151 489 HD23 LEU 78 2HD2 LEU 78 13.811 -10.857 9.804 490 H HIS 79 H HIS 79 16.383 -7.425 8.611 491 HA HIS 79 HA HIS 79 17.081 -8.913 10.880 492 HB3 HIS 79 2HB HIS 79 19.174 -7.389 9.410 493 HD1 HIS 79 1HD HIS 79 21.347 -8.631 9.651 494 HD2 HIS 79 2HD HIS 79 18.026 -11.033 10.543 495 HE1 HIS 79 1HE HIS 79 22.277 -10.838 10.531 496 H ASN 80 H ASN 80 17.420 -5.424 10.005 497 HA ASN 80 HA ASN 80 18.871 -4.707 12.232 498 HB3 ASN 80 2HB ASN 80 16.799 -3.062 10.683 499 HD21 ASN 80 1HD2 ASN 80 16.279 -1.404 11.891 500 HD22 ASN 80 2HD2 ASN 80 17.347 -0.424 12.839 501 H LEU 81 H LEU 81 15.438 -5.424 11.701 502 HA LEU 81 HA LEU 81 14.693 -4.255 14.261 503 HB3 LEU 81 2HB LEU 81 13.258 -5.190 11.825 504 HG LEU 81 HG LEU 81 12.204 -6.207 14.048 505 HD11 LEU 81 1HD1 LEU 81 11.512 -4.727 15.546 506 HD12 LEU 81 2HD1 LEU 81 12.019 -3.379 14.499 507 HD13 LEU 81 3HD1 LEU 81 10.383 -4.063 14.340 508 HD21 LEU 81 3HD2 LEU 81 11.230 -6.489 11.870 509 HD22 LEU 81 1HD2 LEU 81 9.962 -5.953 12.998 510 HD23 LEU 81 2HD2 LEU 81 10.674 -4.798 11.847 511 H GLY 82 H GLY 82 13.714 -7.359 12.674 512 HA2 GLY 82 1HA GLY 82 13.888 -9.494 13.409 513 HA3 GLY 82 2HA GLY 82 14.962 -8.968 14.690 514 H VAL 83 H VAL 83 11.504 -8.262 13.785 515 HA VAL 83 HA VAL 83 10.815 -8.924 16.565 516 HB VAL 83 HB VAL 83 10.188 -6.633 14.835 517 HG11 VAL 83 1HG1 VAL 83 7.984 -7.946 16.463 518 HG12 VAL 83 2HG1 VAL 83 7.911 -6.312 15.762 519 HG13 VAL 83 3HG1 VAL 83 8.020 -7.733 14.696 520 HG21 VAL 83 3HG2 VAL 83 10.170 -5.441 16.861 521 HG22 VAL 83 1HG2 VAL 83 9.778 -6.889 17.818 522 HG23 VAL 83 2HG2 VAL 83 11.400 -6.705 17.108 523 H LEU 84 H LEU 84 10.714 -9.941 13.358 524 HA LEU 84 HA LEU 84 8.317 -11.528 13.935 525 HB3 LEU 84 2HB LEU 84 9.016 -10.411 11.220 526 HG LEU 84 HG LEU 84 6.313 -10.773 11.265 527 HD11 LEU 84 1HD1 LEU 84 8.572 -12.444 10.197 528 HD12 LEU 84 2HD1 LEU 84 6.878 -12.926 9.935 529 HD13 LEU 84 3HD1 LEU 84 7.460 -11.354 9.335 530 HD21 LEU 84 3HD2 LEU 84 6.384 -11.958 13.410 531 HD22 LEU 84 1HD2 LEU 84 5.826 -13.015 12.090 532 HD23 LEU 84 2HD2 LEU 84 7.489 -13.165 12.708 533 H ASN 85 H ASN 85 11.391 -11.812 14.166 534 HA ASN 85 HA ASN 85 12.275 -13.477 12.170 535 HB3 ASN 85 2HB ASN 85 13.724 -12.453 13.944 536 HD21 ASN 85 1HD2 ASN 85 12.866 -11.601 15.765 537 HD22 ASN 85 2HD2 ASN 85 12.538 -12.490 17.214 538 H ASP 86 H ASP 86 9.851 -13.928 14.596 539 HA ASP 86 HA ASP 86 10.203 -16.596 15.224 540 HB3 ASP 86 2HB ASP 86 7.454 -16.241 15.281 541 HD2 ASP 86 HD ASP 86 6.913 -14.906 17.506 542 H PHE 87 H PHE 87 9.111 -14.938 12.331 543 HA PHE 87 HA PHE 87 7.509 -17.068 11.317 544 HB3 PHE 87 2HB PHE 87 8.838 -15.055 9.513 545 HD1 PHE 87 1HD PHE 87 5.499 -15.486 11.144 546 HD2 PHE 87 2HD PHE 87 7.719 -15.366 7.529 547 HE1 PHE 87 1HE PHE 87 3.379 -15.770 9.831 548 HE2 PHE 87 2HE PHE 87 5.599 -15.651 6.217 549 HZ PHE 87 HZ PHE 87 3.453 -15.849 7.384 550 H LEU 88 H LEU 88 10.911 -16.472 11.588 551 HA LEU 88 HA LEU 88 11.578 -17.977 9.214 552 HB3 LEU 88 2HB LEU 88 12.803 -15.941 10.322 553 HG LEU 88 HG LEU 88 13.315 -17.681 12.373 554 HD11 LEU 88 1HD1 LEU 88 15.895 -17.671 10.824 555 HD12 LEU 88 2HD1 LEU 88 15.428 -18.647 12.238 556 HD13 LEU 88 3HD1 LEU 88 14.715 -18.991 10.644 557 HD21 LEU 88 3HD2 LEU 88 13.715 -15.119 11.989 558 HD22 LEU 88 1HD2 LEU 88 14.625 -16.002 13.237 559 HD23 LEU 88 2HD2 LEU 88 15.389 -15.634 11.672 560 H LEU 89 H LEU 89 12.786 -19.999 9.269 561 HA LEU 89 HA LEU 89 11.653 -21.820 11.095 562 HB3 LEU 89 2HB LEU 89 13.408 -23.360 10.023 563 HG LEU 89 HG LEU 89 11.166 -22.015 8.579 564 HD11 LEU 89 1HD1 LEU 89 12.961 -23.981 7.147 565 HD12 LEU 89 2HD1 LEU 89 11.585 -23.059 6.496 566 HD13 LEU 89 3HD1 LEU 89 13.088 -22.217 6.946 567 HD21 LEU 89 3HD2 LEU 89 11.232 -24.139 10.208 568 HD22 LEU 89 1HD2 LEU 89 10.070 -23.977 8.870 569 HD23 LEU 89 2HD2 LEU 89 11.536 -24.964 8.660 570 HA PRO 90 HA PRO 90 14.496 -21.285 14.332 571 HB3 PRO 90 2HB PRO 90 12.863 -21.642 15.916 572 HG3 PRO 90 2HG PRO 90 10.962 -22.680 15.123 573 HD3 PRO 90 2HD PRO 90 11.086 -22.116 12.898 574 H ASP 91 H ASP 91 14.018 -24.678 14.816 575 HA ASP 91 HA ASP 91 16.806 -25.052 14.646 576 HB3 ASP 91 2HB ASP 91 15.138 -27.487 14.490 577 HD2 ASP 91 HD ASP 91 16.865 -28.582 17.333 578 H SER 92 H SER 92 14.068 -25.187 12.452 579 HA SER 92 HA SER 92 14.986 -27.115 10.685 580 HB3 SER 92 2HB SER 92 13.543 -25.169 9.194 581 HG SER 92 HG SER 92 13.193 -27.503 9.200 582 H LYS 93 H LYS 93 15.419 -23.524 10.827 583 HA LYS 93 HA LYS 93 16.917 -23.410 8.426 584 HB3 LYS 93 2HB LYS 93 15.581 -21.582 9.839 585 HG3 LYS 93 2HG LYS 93 17.703 -21.879 11.537 586 HD3 LYS 93 2HD LYS 93 18.468 -19.378 10.029 587 HE3 LYS 93 2HE LYS 93 20.743 -20.111 10.976 588 HZ1 LYS 93 2HZ LYS 93 18.449 -19.156 12.447 589 HZ3 LYS 93 1HZ LYS 93 19.963 -18.558 12.408 590 H ASP 94 H ASP 94 17.588 -24.782 11.440 591 HA ASP 94 HA ASP 94 20.230 -23.942 11.771 592 HB3 ASP 94 2HB ASP 94 19.159 -26.661 12.610 593 HD2 ASP 94 HD ASP 94 20.747 -26.414 15.550 594 H GLU 95 H GLU 95 18.715 -25.801 9.357 595 HA GLU 95 HA GLU 95 21.254 -27.088 8.728 596 HB3 GLU 95 2HB GLU 95 19.792 -28.863 9.472 597 HG3 GLU 95 2HG GLU 95 17.761 -27.406 7.772 598 HE2 GLU 95 HE GLU 95 18.097 -30.855 8.995 599 H ILE 96 H ILE 96 21.218 -24.754 7.658 600 HA ILE 96 HA ILE 96 20.217 -25.162 4.938 601 HB ILE 96 HB ILE 96 19.657 -22.741 4.861 602 HG13 ILE 96 2HG1 ILE 96 20.660 -22.867 7.616 603 HG21 ILE 96 1HG2 ILE 96 17.798 -24.122 4.942 604 HG22 ILE 96 2HG2 ILE 96 18.158 -24.691 6.590 605 HG23 ILE 96 3HG2 ILE 96 17.540 -23.041 6.332 606 HD11 ILE 96 3HD1 ILE 96 21.407 -20.754 7.089 607 HD12 ILE 96 1HD1 ILE 96 21.118 -21.313 5.425 608 HD13 ILE 96 2HD1 ILE 96 19.898 -20.317 6.255 609 H GLU 97 H GLU 97 21.427 -23.854 3.313 610 HA GLU 97 HA GLU 97 24.098 -23.254 4.321 611 HB3 GLU 97 2HB GLU 97 24.770 -23.975 1.865 612 HG3 GLU 97 2HG GLU 97 24.114 -25.722 4.245 613 HE2 GLU 97 HE GLU 97 23.610 -28.400 2.469 614 H ASP 98 H ASP 98 25.282 -21.567 3.110 615 HA ASP 98 HA ASP 98 23.701 -19.386 2.596 616 HB3 ASP 98 2HB ASP 98 25.711 -18.269 2.076 617 HD2 ASP 98 HD ASP 98 28.156 -20.377 2.512 618 H GLU 99 H GLU 99 25.241 -21.839 0.432 619 HA GLU 99 HA GLU 99 24.389 -20.511 -1.925 620 HB3 GLU 99 2HB GLU 99 25.049 -22.975 -2.822 621 HG3 GLU 99 2HG GLU 99 27.051 -20.939 -1.731 622 HE2 GLU 99 HE GLU 99 29.478 -22.025 -3.672 623 H LEU 100 H LEU 100 23.165 -23.082 0.219 624 HA LEU 100 HA LEU 100 21.215 -24.041 -1.601 625 HB3 LEU 100 2HB LEU 100 21.385 -24.266 1.408 626 HG LEU 100 HG LEU 100 19.179 -24.967 0.193 627 HD11 LEU 100 1HD1 LEU 100 20.398 -26.142 -1.654 628 HD12 LEU 100 2HD1 LEU 100 20.880 -27.381 -0.470 629 HD13 LEU 100 3HD1 LEU 100 19.157 -27.121 -0.836 630 HD21 LEU 100 3HD2 LEU 100 20.730 -26.741 2.090 631 HD22 LEU 100 1HD2 LEU 100 19.543 -25.476 2.492 632 HD23 LEU 100 2HD2 LEU 100 19.010 -26.974 1.692 633 H SER 101 H SER 101 21.292 -21.558 1.000 634 HA SER 101 HA SER 101 18.613 -21.080 1.153 635 HB3 SER 101 2HB SER 101 19.253 -18.826 1.984 636 HG SER 101 HG SER 101 20.331 -19.576 3.736 637 H ASP 102 H ASP 102 17.374 -19.123 0.287 638 HA ASP 102 HA ASP 102 16.553 -17.975 -1.356 639 HB3 ASP 102 2HB ASP 102 19.500 -17.765 -1.933 640 HD2 ASP 102 HD ASP 102 18.543 -15.100 -3.590 Start of MODEL 6 1 H1 ILE 1 H ILE 1 30.844 -18.158 10.054 2 HA ILE 1 HA ILE 1 31.688 -20.128 11.220 3 HB ILE 1 HB ILE 1 29.923 -21.512 9.203 4 HG13 ILE 1 2HG1 ILE 1 29.325 -20.583 11.735 5 HG21 ILE 1 1HG2 ILE 1 31.719 -22.913 11.177 6 HG22 ILE 1 2HG2 ILE 1 30.866 -23.577 9.763 7 HG23 ILE 1 3HG2 ILE 1 32.268 -22.504 9.534 8 HD11 ILE 1 3HD1 ILE 1 28.136 -23.058 10.408 9 HD12 ILE 1 1HD1 ILE 1 27.317 -21.928 11.513 10 HD13 ILE 1 2HD1 ILE 1 27.785 -21.395 9.881 11 H SER 2 H SER 2 31.087 -20.326 7.636 12 HA SER 2 HA SER 2 33.549 -19.216 7.010 13 HB3 SER 2 2HB SER 2 34.028 -21.841 5.992 14 HG SER 2 HG SER 2 35.329 -20.596 8.254 15 H GLY 3 H GLY 3 33.557 -18.686 4.796 16 HA2 GLY 3 1HA GLY 3 33.009 -19.118 2.548 17 HA3 GLY 3 2HA GLY 3 31.650 -20.100 3.059 18 H GLY 4 H GLY 4 29.693 -19.067 3.883 19 HA2 GLY 4 1HA GLY 4 29.448 -16.235 4.006 20 HA3 GLY 4 2HA GLY 4 28.860 -16.845 2.472 21 H SER 5 H SER 5 28.720 -17.873 5.966 22 HA SER 5 HA SER 5 26.307 -19.182 5.690 23 HB3 SER 5 2HB SER 5 27.605 -17.896 8.131 24 HG SER 5 HG SER 5 25.187 -18.539 8.202 25 H SER 6 H SER 6 27.123 -15.766 6.028 26 HA SER 6 HA SER 6 24.779 -14.844 7.137 27 HB3 SER 6 2HB SER 6 25.413 -12.660 6.159 28 HG SER 6 HG SER 6 26.723 -13.123 7.911 29 H ILE 7 H ILE 7 25.611 -15.869 3.826 30 HA ILE 7 HA ILE 7 23.366 -14.683 2.579 31 HB ILE 7 HB ILE 7 25.422 -16.727 1.844 32 HG13 ILE 7 2HG1 ILE 7 26.344 -15.075 0.604 33 HG21 ILE 7 1HG2 ILE 7 23.311 -17.602 0.944 34 HG22 ILE 7 2HG2 ILE 7 23.009 -16.043 0.141 35 HG23 ILE 7 3HG2 ILE 7 24.402 -17.038 -0.343 36 HD11 ILE 7 3HD1 ILE 7 24.513 -14.881 -1.017 37 HD12 ILE 7 1HD1 ILE 7 23.530 -13.976 0.161 38 HD13 ILE 7 2HD1 ILE 7 25.015 -13.252 -0.502 39 H SER 8 H SER 8 24.056 -17.879 4.081 40 HA SER 8 HA SER 8 21.981 -19.325 3.255 41 HB3 SER 8 2HB SER 8 22.011 -20.400 5.551 42 HG SER 8 HG SER 8 23.953 -21.294 5.157 43 H MET 9 H MET 9 21.899 -16.471 5.356 44 HA MET 9 HA MET 9 19.174 -16.988 6.111 45 HB3 MET 9 2HB MET 9 20.382 -14.308 6.651 46 HG3 MET 9 2HG MET 9 19.876 -15.252 9.076 47 HE1 MET 9 3HE MET 9 15.813 -15.011 7.165 48 HE2 MET 9 1HE MET 9 17.062 -16.184 6.681 49 HE3 MET 9 2HE MET 9 16.463 -16.160 8.357 50 H MET 10 H MET 10 21.080 -14.703 4.068 51 HA MET 10 HA MET 10 18.812 -13.193 3.351 52 HB3 MET 10 2HB MET 10 20.512 -12.447 1.470 53 HG3 MET 10 2HG MET 10 21.477 -12.218 4.358 54 HE1 MET 10 3HE MET 10 23.743 -12.403 2.948 55 HE2 MET 10 1HE MET 10 24.565 -10.841 2.716 56 HE3 MET 10 2HE MET 10 23.879 -11.259 4.305 57 H TYR 11 H TYR 11 20.943 -15.360 1.338 58 HA TYR 11 HA TYR 11 19.492 -15.481 -0.917 59 HB3 TYR 11 2HB TYR 11 20.275 -18.172 -0.214 60 HD1 TYR 11 2HD TYR 11 21.289 -14.877 -1.541 61 HD2 TYR 11 1HD TYR 11 21.978 -19.098 -1.660 62 HE1 TYR 11 2HE TYR 11 22.682 -14.598 -3.651 63 HE2 TYR 11 1HE TYR 11 23.368 -18.805 -3.769 64 HH TYR 11 HH TYR 11 23.340 -15.947 -5.563 65 H LYS 12 H LYS 12 18.785 -17.195 2.165 66 HA LYS 12 HA LYS 12 16.904 -18.974 1.293 67 HB3 LYS 12 2HB LYS 12 16.211 -17.660 3.827 68 HG3 LYS 12 2HG LYS 12 15.916 -20.153 2.764 69 HD3 LYS 12 2HD LYS 12 18.642 -20.134 3.304 70 HE3 LYS 12 2HE LYS 12 17.350 -21.744 5.538 71 HZ1 LYS 12 2HZ LYS 12 20.034 -20.754 5.794 72 HZ3 LYS 12 1HZ LYS 12 19.868 -21.719 4.492 73 H TYR 13 H TYR 13 16.456 -15.488 2.167 74 HA TYR 13 HA TYR 13 13.739 -15.332 1.880 75 HB3 TYR 13 2HB TYR 13 15.691 -13.279 0.726 76 HD1 TYR 13 1HD TYR 13 13.676 -12.182 -0.226 77 HD2 TYR 13 2HD TYR 13 14.080 -12.870 3.977 78 HE1 TYR 13 1HE TYR 13 11.813 -10.515 0.233 79 HE2 TYR 13 2HE TYR 13 12.214 -11.200 4.422 80 HH TYR 13 HH TYR 13 10.583 -9.558 1.722 81 H CYS 14 H CYS 14 16.289 -15.235 -0.671 82 HA CYS 14 HA CYS 14 14.544 -14.558 -2.747 83 HB3 CYS 14 2HB CYS 14 17.015 -16.200 -3.229 84 HG CYS 14 HG CYS 14 17.524 -14.472 -5.171 85 H SER 15 H SER 15 15.408 -17.577 -1.072 86 HA SER 15 HA SER 15 14.597 -19.376 -2.986 87 HB3 SER 15 2HB SER 15 14.163 -19.817 -0.015 88 HG SER 15 HG SER 15 15.395 -21.538 -1.979 89 H ARG 16 H ARG 16 12.770 -17.069 -1.173 90 HA ARG 16 HA ARG 16 10.397 -18.522 -0.932 91 HB3 ARG 16 2HB ARG 16 9.386 -16.150 -0.691 92 HG3 ARG 16 2HG ARG 16 11.768 -17.080 0.963 93 HD3 ARG 16 2HD ARG 16 10.146 -14.558 1.150 94 HE ARG 16 HE ARG 16 9.488 -15.081 3.321 95 HH11 ARG 16 2HH2 ARG 16 12.588 -16.679 2.701 96 HH12 ARG 16 1HH2 ARG 16 12.727 -17.308 4.309 97 HH22 ARG 16 1HH ARG 16 11.000 -16.843 5.904 98 H LEU 17 H LEU 17 12.019 -17.805 -3.691 99 HA LEU 17 HA LEU 17 10.215 -16.485 -5.331 100 HB3 LEU 17 2HB LEU 17 11.622 -18.423 -6.846 101 HG LEU 17 HG LEU 17 11.253 -15.891 -7.280 102 HD11 LEU 17 1HD1 LEU 17 13.785 -15.809 -5.619 103 HD12 LEU 17 2HD1 LEU 17 13.224 -14.494 -6.679 104 HD13 LEU 17 3HD1 LEU 17 12.241 -14.991 -5.282 105 HD21 LEU 17 3HD2 LEU 17 12.749 -16.011 -8.993 106 HD22 LEU 17 1HD2 LEU 17 14.047 -16.673 -7.971 107 HD23 LEU 17 2HD2 LEU 17 12.721 -17.727 -8.518 108 HA PRO 18 HA PRO 18 7.122 -19.397 -6.081 109 HB3 PRO 18 2HB PRO 18 5.809 -17.852 -7.171 110 HG3 PRO 18 2HG PRO 18 6.966 -16.073 -8.076 111 HD3 PRO 18 2HD PRO 18 8.839 -16.083 -6.743 112 H HIS 19 H HIS 19 6.535 -21.421 -6.923 113 HA HIS 19 HA HIS 19 6.831 -23.244 -8.152 114 HB3 HIS 19 2HB HIS 19 9.257 -22.364 -9.614 115 HD1 HIS 19 1HD HIS 19 8.578 -25.171 -9.768 116 HD2 HIS 19 2HD HIS 19 6.400 -22.362 -11.995 117 HE1 HIS 19 1HE HIS 19 7.459 -26.470 -11.658 118 H ASP 20 H ASP 20 8.996 -21.708 -6.062 119 HA ASP 20 HA ASP 20 10.983 -23.739 -6.072 120 HB3 ASP 20 2HB ASP 20 10.336 -21.464 -4.142 121 HD2 ASP 20 HD ASP 20 13.068 -23.684 -4.856 122 H GLU 21 H GLU 21 10.786 -25.699 -4.972 123 HA GLU 21 HA GLU 21 8.467 -26.142 -3.409 124 HB3 GLU 21 2HB GLU 21 10.816 -28.049 -3.561 125 HG3 GLU 21 2HG GLU 21 7.885 -28.693 -3.954 126 HE2 GLU 21 HE GLU 21 8.824 -31.927 -3.561 127 H PHE 22 H PHE 22 11.789 -25.168 -2.812 128 HA PHE 22 HA PHE 22 11.778 -26.011 -0.070 129 HB3 PHE 22 2HB PHE 22 13.739 -23.969 -0.684 130 HD1 PHE 22 1HD PHE 22 14.273 -25.171 1.504 131 HD2 PHE 22 2HD PHE 22 14.617 -27.035 -2.292 132 HE1 PHE 22 1HE PHE 22 15.791 -26.908 2.495 133 HE2 PHE 22 2HE PHE 22 16.135 -28.772 -1.302 134 HZ PHE 22 HZ PHE 22 16.703 -28.688 1.080 135 H PHE 23 H PHE 23 9.889 -23.807 -1.505 136 HA PHE 23 HA PHE 23 10.319 -21.777 0.569 137 HB3 PHE 23 2HB PHE 23 9.720 -21.810 -2.318 138 HD1 PHE 23 2HD PHE 23 8.575 -18.963 -0.330 139 HD2 PHE 23 1HD PHE 23 7.365 -22.246 -2.732 140 HE1 PHE 23 2HE PHE 23 6.275 -17.977 -0.520 141 HE2 PHE 23 1HE PHE 23 5.065 -21.259 -2.922 142 HZ PHE 23 HZ PHE 23 4.548 -19.137 -1.814 143 H GLN 24 H GLN 24 8.558 -21.081 1.851 144 HA GLN 24 HA GLN 24 6.329 -22.942 1.771 145 HB3 GLN 24 2HB GLN 24 5.907 -22.155 4.119 146 HG3 GLN 24 2HG GLN 24 8.421 -22.866 4.890 147 HE21 GLN 24 1HE2 GLN 24 6.932 -23.757 6.320 148 HE22 GLN 24 2HE2 GLN 24 6.142 -25.271 6.031 149 HA PRO 25 HA PRO 25 3.596 -19.765 0.650 150 HB3 PRO 25 2HB PRO 25 1.879 -21.250 0.269 151 HG3 PRO 25 2HG PRO 25 2.059 -23.244 1.415 152 HD3 PRO 25 2HD PRO 25 4.331 -23.314 1.758 153 H LYS 26 H LYS 26 4.022 -17.751 1.317 154 HA LYS 26 HA LYS 26 2.518 -16.687 3.375 155 HB3 LYS 26 2HB LYS 26 5.013 -16.418 4.683 156 HG3 LYS 26 2HG LYS 26 3.804 -17.570 6.520 157 HD3 LYS 26 2HD LYS 26 2.573 -15.402 4.893 158 HE3 LYS 26 2HE LYS 26 0.898 -16.337 7.200 159 HZ1 LYS 26 2HZ LYS 26 -0.610 -15.608 5.035 160 HZ3 LYS 26 1HZ LYS 26 0.679 -14.620 4.920 161 HA PRO 27 HA PRO 27 5.817 -13.708 1.818 162 HB3 PRO 27 2HB PRO 27 8.011 -14.279 2.224 163 HG3 PRO 27 2HG PRO 27 8.379 -16.537 2.516 164 HD3 PRO 27 2HD PRO 27 6.287 -17.208 3.194 165 H GLU 28 H GLU 28 5.996 -12.412 -0.081 166 HA GLU 28 HA GLU 28 5.228 -13.866 -2.460 167 HB3 GLU 28 2HB GLU 28 3.697 -11.476 -2.537 168 HG3 GLU 28 2HG GLU 28 1.818 -13.340 -2.043 169 HE2 GLU 28 HE GLU 28 2.526 -15.139 -4.251 170 H PHE 29 H PHE 29 6.050 -12.949 -4.380 171 HA PHE 29 HA PHE 29 7.404 -10.375 -4.078 172 HB3 PHE 29 2HB PHE 29 8.602 -12.958 -4.181 173 HD1 PHE 29 1HD PHE 29 7.292 -13.767 -6.394 174 HD2 PHE 29 2HD PHE 29 10.670 -11.200 -6.336 175 HE1 PHE 29 1HE PHE 29 7.821 -14.410 -8.762 176 HE2 PHE 29 2HE PHE 29 11.200 -11.843 -8.703 177 HZ PHE 29 HZ PHE 29 9.770 -13.441 -9.888 178 H GLN 30 H GLN 30 7.486 -9.100 -5.979 179 HA GLN 30 HA GLN 30 6.369 -10.294 -8.358 180 HB3 GLN 30 2HB GLN 30 5.211 -7.643 -7.962 181 HG3 GLN 30 2HG GLN 30 3.152 -9.512 -7.974 182 HE21 GLN 30 1HE2 GLN 30 2.811 -10.182 -10.552 183 HE22 GLN 30 2HE2 GLN 30 2.870 -8.799 -11.594 184 H PHE 31 H PHE 31 7.049 -9.250 -10.309 185 HA PHE 31 HA PHE 31 9.101 -7.200 -9.848 186 HB3 PHE 31 2HB PHE 31 9.761 -9.544 -10.707 187 HD1 PHE 31 2HD PHE 31 7.905 -11.024 -11.337 188 HD2 PHE 31 1HD PHE 31 9.238 -7.944 -13.934 189 HE1 PHE 31 2HE PHE 31 6.688 -12.107 -13.246 190 HE2 PHE 31 1HE PHE 31 8.021 -9.026 -15.843 191 HZ PHE 31 HZ PHE 31 6.759 -11.095 -15.476 192 H LYS 32 H LYS 32 9.039 -5.308 -11.055 193 HA LYS 32 HA LYS 32 6.715 -5.071 -12.833 194 HB3 LYS 32 2HB LYS 32 7.806 -3.377 -10.706 195 HG3 LYS 32 2HG LYS 32 7.149 -2.207 -13.448 196 HD3 LYS 32 2HD LYS 32 7.066 -0.021 -12.405 197 HE3 LYS 32 2HE LYS 32 5.436 -1.549 -10.390 198 HZ1 LYS 32 2HZ LYS 32 5.152 0.852 -10.781 199 HZ3 LYS 32 1HZ LYS 32 3.790 0.051 -11.175 200 HA PRO 33 HA PRO 33 9.807 -4.742 -15.904 201 HB3 PRO 33 2HB PRO 33 8.763 -6.277 -17.266 202 HG3 PRO 33 2HG PRO 33 6.573 -6.731 -16.703 203 HD3 PRO 33 2HD PRO 33 6.599 -6.166 -14.475 204 H VAL 34 H VAL 34 10.894 -2.889 -16.068 205 HA VAL 34 HA VAL 34 9.253 -0.629 -16.986 206 HB VAL 34 HB VAL 34 11.781 -0.332 -15.396 207 HG11 VAL 34 1HG1 VAL 34 11.141 1.747 -16.169 208 HG12 VAL 34 2HG1 VAL 34 9.405 1.361 -16.102 209 HG13 VAL 34 3HG1 VAL 34 10.300 1.698 -14.601 210 HG21 VAL 34 3HG2 VAL 34 9.967 -0.030 -13.444 211 HG22 VAL 34 1HG2 VAL 34 9.130 -1.274 -14.405 212 HG23 VAL 34 2HG2 VAL 34 10.767 -1.584 -13.781 213 H ASP 35 H ASP 35 10.701 1.094 -18.119 214 HA ASP 35 HA ASP 35 11.810 -0.149 -20.327 215 HB3 ASP 35 2HB ASP 35 12.799 2.284 -20.659 216 HD2 ASP 35 HD ASP 35 11.304 3.826 -21.713 217 H GLU 36 H GLU 36 14.171 0.262 -21.099 218 HA GLU 36 HA GLU 36 15.924 -0.767 -19.224 219 HB3 GLU 36 2HB GLU 36 17.684 -0.071 -20.990 220 HG3 GLU 36 2HG GLU 36 15.744 -1.487 -22.637 221 HE2 GLU 36 HE GLU 36 18.175 -3.702 -23.129 222 H PHE 37 H PHE 37 14.712 2.420 -19.617 223 HA PHE 37 HA PHE 37 17.092 3.713 -18.613 224 HB3 PHE 37 2HB PHE 37 14.466 5.134 -18.616 225 HD1 PHE 37 1HD PHE 37 16.670 5.131 -21.533 226 HD2 PHE 37 2HD PHE 37 15.825 6.981 -17.809 227 HE1 PHE 37 1HE PHE 37 18.140 7.066 -22.160 228 HE2 PHE 37 2HE PHE 37 17.295 8.916 -18.437 229 HZ PHE 37 HZ PHE 37 18.436 8.935 -20.605 230 H GLY 38 H GLY 38 15.318 1.610 -17.079 231 HA2 GLY 38 1HA GLY 38 15.550 2.920 -14.531 232 HA3 GLY 38 2HA GLY 38 13.886 2.697 -15.032 233 H GLY 39 H GLY 39 16.535 0.490 -16.002 234 HA2 GLY 39 1HA GLY 39 16.584 -1.779 -15.820 235 HA3 GLY 39 2HA GLY 39 16.717 -1.375 -14.120 236 H THR 40 H THR 40 15.489 -2.917 -13.079 237 HA THR 40 HA THR 40 12.658 -3.036 -13.871 238 HB THR 40 HB THR 40 14.586 -5.330 -13.244 239 HG1 THR 40 1HG THR 40 14.298 -5.603 -15.448 240 HG21 THR 40 3HG2 THR 40 12.778 -6.559 -12.579 241 HG22 THR 40 1HG2 THR 40 11.710 -5.152 -12.801 242 HG23 THR 40 2HG2 THR 40 12.037 -6.247 -14.166 243 H ILE 41 H ILE 41 11.153 -3.222 -12.204 244 HA ILE 41 HA ILE 41 12.318 -2.666 -9.571 245 HB ILE 41 HB ILE 41 9.525 -2.079 -10.552 246 HG13 ILE 41 2HG1 ILE 41 11.273 -0.887 -11.882 247 HG21 ILE 41 1HG2 ILE 41 10.676 -2.086 -7.968 248 HG22 ILE 41 2HG2 ILE 41 10.468 -0.383 -8.439 249 HG23 ILE 41 3HG2 ILE 41 9.074 -1.489 -8.465 250 HD11 ILE 41 3HD1 ILE 41 9.137 0.218 -11.662 251 HD12 ILE 41 1HD1 ILE 41 9.493 0.704 -9.988 252 HD13 ILE 41 2HD1 ILE 41 10.382 1.448 -11.339 253 H CYS 42 H CYS 42 11.771 -3.918 -7.781 254 HA CYS 42 HA CYS 42 10.057 -6.215 -8.389 255 HB3 CYS 42 2HB CYS 42 11.521 -7.541 -6.830 256 HG CYS 42 HG CYS 42 12.111 -6.303 -9.739 257 H ARG 43 H ARG 43 8.316 -6.347 -7.002 258 HA ARG 43 HA ARG 43 8.503 -4.713 -4.605 259 HB3 ARG 43 2HB ARG 43 6.494 -3.887 -5.285 260 HG3 ARG 43 2HG ARG 43 6.421 -6.150 -7.338 261 HD3 ARG 43 2HD ARG 43 4.675 -4.997 -8.420 262 HE ARG 43 HE ARG 43 3.454 -5.646 -6.491 263 HH11 ARG 43 2HH2 ARG 43 5.150 -2.589 -5.918 264 HH12 ARG 43 1HH2 ARG 43 4.278 -2.235 -4.464 265 HH22 ARG 43 1HH ARG 43 2.609 -3.772 -3.693 266 H ILE 44 H ILE 44 8.899 -5.926 -2.779 267 HA ILE 44 HA ILE 44 7.770 -8.636 -2.720 268 HB ILE 44 HB ILE 44 10.376 -7.895 -2.507 269 HG13 ILE 44 2HG1 ILE 44 10.799 -10.138 -1.923 270 HG21 ILE 44 1HG2 ILE 44 9.644 -8.481 0.346 271 HG22 ILE 44 2HG2 ILE 44 11.135 -7.779 -0.325 272 HG23 ILE 44 3HG2 ILE 44 9.645 -6.807 -0.259 273 HD11 ILE 44 3HD1 ILE 44 9.768 -10.778 0.031 274 HD12 ILE 44 1HD1 ILE 44 8.304 -9.826 -0.311 275 HD13 ILE 44 2HD1 ILE 44 8.535 -11.411 -1.085 276 H THR 45 H THR 45 6.454 -9.254 -1.014 277 HA THR 45 HA THR 45 6.069 -7.304 1.136 278 HB THR 45 HB THR 45 3.540 -7.678 0.772 279 HG1 THR 45 1HG THR 45 3.177 -8.414 -1.517 280 HG21 THR 45 3HG2 THR 45 5.105 -6.400 -1.532 281 HG22 THR 45 1HG2 THR 45 3.374 -6.150 -1.204 282 HG23 THR 45 2HG2 THR 45 4.593 -5.564 -0.047 283 H LEU 46 H LEU 46 6.098 -8.229 3.088 284 HA LEU 46 HA LEU 46 5.981 -11.141 3.138 285 HB3 LEU 46 2HB LEU 46 6.706 -10.483 5.624 286 HG LEU 46 HG LEU 46 8.678 -10.281 3.332 287 HD11 LEU 46 1HD1 LEU 46 10.352 -10.371 4.827 288 HD12 LEU 46 2HD1 LEU 46 9.129 -9.755 5.963 289 HD13 LEU 46 3HD1 LEU 46 9.483 -11.497 5.896 290 HD21 LEU 46 3HD2 LEU 46 7.544 -12.313 2.961 291 HD22 LEU 46 1HD2 LEU 46 9.035 -12.751 3.830 292 HD23 LEU 46 2HD2 LEU 46 7.482 -12.695 4.698 293 HA PRO 47 HA PRO 47 2.208 -11.237 5.234 294 HB3 PRO 47 2HB PRO 47 2.224 -13.531 5.425 295 HG3 PRO 47 2HG PRO 47 4.326 -14.482 5.431 296 HD3 PRO 47 2HD PRO 47 5.514 -12.854 4.324 297 H ALA 48 H ALA 48 0.888 -10.949 7.234 298 HA ALA 48 HA ALA 48 1.769 -8.687 8.543 299 HB1 ALA 48 1HB ALA 48 -0.238 -10.818 9.381 300 HB2 ALA 48 2HB ALA 48 -0.093 -9.209 10.130 301 HB3 ALA 48 3HB ALA 48 -0.573 -9.356 8.423 302 H ASN 49 H ASN 49 2.722 -12.008 8.933 303 HA ASN 49 HA ASN 49 3.331 -11.953 11.643 304 HB3 ASN 49 2HB ASN 49 4.945 -13.857 10.978 305 HD21 ASN 49 1HD2 ASN 49 4.110 -15.946 10.805 306 HD22 ASN 49 2HD2 ASN 49 2.412 -16.282 10.865 307 H ALA 50 H ALA 50 4.730 -10.426 8.844 308 HA ALA 50 HA ALA 50 7.181 -9.853 10.368 309 HB1 ALA 50 1HB ALA 50 8.412 -10.448 8.579 310 HB2 ALA 50 2HB ALA 50 6.928 -11.137 7.880 311 HB3 ALA 50 3HB ALA 50 7.407 -9.468 7.485 312 HA PRO 51 HA PRO 51 5.720 -5.772 10.062 313 HB3 PRO 51 2HB PRO 51 6.601 -5.232 12.119 314 HG3 PRO 51 2HG PRO 51 8.235 -6.672 12.876 315 HD3 PRO 51 2HD PRO 51 7.680 -8.570 11.702 316 H ILE 52 H ILE 52 9.200 -5.641 9.469 317 HA ILE 52 HA ILE 52 8.534 -4.188 7.011 318 HB ILE 52 HB ILE 52 11.044 -3.566 7.248 319 HG13 ILE 52 2HG1 ILE 52 10.412 -4.256 10.131 320 HG21 ILE 52 1HG2 ILE 52 8.946 -2.409 9.104 321 HG22 ILE 52 2HG2 ILE 52 10.439 -1.603 8.566 322 HG23 ILE 52 3HG2 ILE 52 9.166 -1.998 7.386 323 HD11 ILE 52 3HD1 ILE 52 12.498 -5.747 9.751 324 HD12 ILE 52 1HD1 ILE 52 10.955 -6.330 9.082 325 HD13 ILE 52 2HD1 ILE 52 12.157 -5.566 8.014 326 H SER 53 H SER 53 10.017 -4.597 5.121 327 HA SER 53 HA SER 53 11.793 -6.422 4.709 328 HB3 SER 53 2HB SER 53 10.122 -8.468 3.985 329 HG SER 53 HG SER 53 10.962 -8.323 6.723 330 H GLU 54 H GLU 54 8.781 -4.936 3.804 331 HA GLU 54 HA GLU 54 8.692 -5.785 1.143 332 HB3 GLU 54 2HB GLU 54 6.686 -4.891 2.060 333 HG3 GLU 54 2HG GLU 54 8.523 -2.763 3.095 334 HE2 GLU 54 HE GLU 54 5.632 -0.861 3.784 335 H ILE 55 H ILE 55 9.615 -4.951 -0.741 336 HA ILE 55 HA ILE 55 11.062 -2.447 -0.563 337 HB ILE 55 HB ILE 55 12.489 -4.948 -1.448 338 HG13 ILE 55 2HG1 ILE 55 13.575 -5.112 0.635 339 HG21 ILE 55 1HG2 ILE 55 13.332 -2.082 -0.990 340 HG22 ILE 55 2HG2 ILE 55 14.489 -3.429 -1.118 341 HG23 ILE 55 3HG2 ILE 55 13.421 -3.040 -2.488 342 HD11 ILE 55 3HD1 ILE 55 14.090 -3.063 1.547 343 HD12 ILE 55 1HD1 ILE 55 12.573 -2.319 0.987 344 HD13 ILE 55 2HD1 ILE 55 12.581 -3.336 2.449 345 H GLU 56 H GLU 56 10.526 -1.284 -2.326 346 HA GLU 56 HA GLU 56 10.159 -2.754 -4.797 347 HB3 GLU 56 2HB GLU 56 7.890 -2.578 -4.233 348 HG3 GLU 56 2HG GLU 56 8.604 -0.901 -2.254 349 HE2 GLU 56 HE GLU 56 6.817 0.320 -4.918 350 H SER 57 H SER 57 11.551 -1.863 -6.252 351 HA SER 57 HA SER 57 11.493 0.676 -7.097 352 HB3 SER 57 2HB SER 57 13.291 0.385 -4.690 353 HG SER 57 HG SER 57 14.672 1.961 -5.395 354 H SER 58 H SER 58 12.970 0.955 -8.860 355 HA SER 58 HA SER 58 14.198 -1.454 -9.675 356 HB3 SER 58 2HB SER 58 13.541 -0.407 -11.589 357 HG SER 58 HG SER 58 12.579 1.477 -11.323 358 H LEU 59 H LEU 59 16.557 -1.476 -10.494 359 HA LEU 59 HA LEU 59 18.413 0.389 -9.587 360 HB3 LEU 59 2HB LEU 59 18.305 -2.050 -7.815 361 HG LEU 59 HG LEU 59 19.670 -0.575 -6.290 362 HD11 LEU 59 1HD1 LEU 59 20.509 -2.088 -8.622 363 HD12 LEU 59 2HD1 LEU 59 21.699 -0.838 -8.184 364 HD13 LEU 59 3HD1 LEU 59 21.190 -2.044 -6.977 365 HD21 LEU 59 3HD2 LEU 59 19.122 1.550 -7.518 366 HD22 LEU 59 1HD2 LEU 59 20.845 1.314 -7.139 367 HD23 LEU 59 2HD2 LEU 59 20.250 1.025 -8.792 368 H LEU 60 H LEU 60 17.580 -3.004 -10.377 369 HA LEU 60 HA LEU 60 20.124 -3.151 -11.838 370 HB3 LEU 60 2HB LEU 60 19.437 -5.712 -11.666 371 HG LEU 60 HG LEU 60 20.991 -6.065 -10.008 372 HD11 LEU 60 1HD1 LEU 60 21.742 -3.223 -10.705 373 HD12 LEU 60 2HD1 LEU 60 22.809 -4.608 -10.373 374 HD13 LEU 60 3HD1 LEU 60 21.848 -4.564 -11.871 375 HD21 LEU 60 3HD2 LEU 60 19.602 -3.871 -8.647 376 HD22 LEU 60 1HD2 LEU 60 20.397 -5.320 -7.987 377 HD23 LEU 60 2HD2 LEU 60 21.363 -3.878 -8.385 378 HA PRO 61 HA PRO 61 17.694 -3.322 -15.409 379 HB3 PRO 61 2HB PRO 61 19.423 -2.516 -16.700 380 HG3 PRO 61 2HG PRO 61 21.519 -2.781 -15.775 381 HD3 PRO 61 2HD PRO 61 20.969 -2.907 -13.547 382 H SER 62 H SER 62 18.565 -5.907 -13.678 383 HA SER 62 HA SER 62 17.218 -7.651 -15.592 384 HB3 SER 62 2HB SER 62 18.791 -9.044 -13.537 385 HG SER 62 HG SER 62 19.321 -10.307 -15.254 386 H THR 63 H THR 63 15.713 -9.235 -14.664 387 HA THR 63 HA THR 63 14.291 -8.178 -12.429 388 HB THR 63 HB THR 63 14.042 -10.702 -14.143 389 HG1 THR 63 1HG THR 63 12.787 -8.063 -13.885 390 HG21 THR 63 3HG2 THR 63 11.922 -11.116 -13.163 391 HG22 THR 63 1HG2 THR 63 12.906 -10.693 -11.740 392 HG23 THR 63 2HG2 THR 63 11.823 -9.481 -12.467 393 H GLU 64 H GLU 64 16.215 -11.201 -12.969 394 HA GLU 64 HA GLU 64 15.858 -12.234 -10.476 395 HB3 GLU 64 2HB GLU 64 16.915 -13.714 -11.911 396 HG3 GLU 64 2HG GLU 64 18.204 -11.239 -12.938 397 HE2 GLU 64 HE GLU 64 20.685 -11.700 -14.132 398 H ALA 65 H ALA 65 18.286 -9.825 -11.631 399 HA ALA 65 HA ALA 65 19.599 -9.698 -9.102 400 HB1 ALA 65 1HB ALA 65 20.556 -9.210 -11.436 401 HB2 ALA 65 2HB ALA 65 19.694 -7.655 -11.344 402 HB3 ALA 65 3HB ALA 65 20.955 -8.046 -10.150 403 H ALA 66 H ALA 66 17.227 -7.642 -10.914 404 HA ALA 66 HA ALA 66 17.039 -5.572 -9.130 405 HB1 ALA 66 1HB ALA 66 15.958 -5.409 -11.241 406 HB2 ALA 66 2HB ALA 66 15.031 -6.904 -10.974 407 HB3 ALA 66 3HB ALA 66 14.639 -5.435 -10.048 408 H LYS 67 H LYS 67 15.298 -8.748 -9.126 409 HA LYS 67 HA LYS 67 13.826 -8.132 -6.789 410 HB3 LYS 67 2HB LYS 67 13.145 -9.773 -8.539 411 HG3 LYS 67 2HG LYS 67 15.651 -11.082 -7.571 412 HD3 LYS 67 2HD LYS 67 13.082 -12.634 -8.138 413 HE3 LYS 67 2HE LYS 67 15.054 -14.474 -7.484 414 HZ1 LYS 67 2HZ LYS 67 15.052 -14.516 -10.166 415 HZ3 LYS 67 1HZ LYS 67 13.695 -13.652 -9.910 416 H LYS 68 H LYS 68 17.004 -9.614 -7.479 417 HA LYS 68 HA LYS 68 17.444 -10.716 -4.962 418 HB3 LYS 68 2HB LYS 68 19.485 -9.593 -6.902 419 HG3 LYS 68 2HG LYS 68 19.604 -11.710 -4.704 420 HD3 LYS 68 2HD LYS 68 21.454 -11.058 -7.014 421 HE3 LYS 68 2HE LYS 68 22.537 -12.675 -4.742 422 HZ1 LYS 68 2HZ LYS 68 23.521 -10.922 -6.867 423 HZ3 LYS 68 1HZ LYS 68 24.095 -12.368 -6.385 424 H ASP 69 H ASP 69 17.766 -7.386 -6.224 425 HA ASP 69 HA ASP 69 19.252 -6.393 -4.115 426 HB3 ASP 69 2HB ASP 69 17.108 -4.792 -5.550 427 HD2 ASP 69 HD ASP 69 18.813 -1.959 -4.920 428 H ALA 70 H ALA 70 15.690 -6.001 -4.833 429 HA ALA 70 HA ALA 70 15.010 -4.950 -2.356 430 HB1 ALA 70 1HB ALA 70 12.695 -6.029 -3.111 431 HB2 ALA 70 2HB ALA 70 13.393 -4.642 -3.983 432 HB3 ALA 70 3HB ALA 70 13.579 -6.289 -4.634 433 H CYS 71 H CYS 71 15.434 -8.315 -3.494 434 HA CYS 71 HA CYS 71 14.184 -9.530 -1.306 435 HB3 CYS 71 2HB CYS 71 15.799 -11.483 -2.046 436 HG CYS 71 HG CYS 71 13.286 -9.960 -3.483 437 H LEU 72 H LEU 72 17.611 -8.620 -2.064 438 HA LEU 72 HA LEU 72 18.653 -9.621 0.355 439 HB3 LEU 72 2HB LEU 72 20.557 -7.989 -0.314 440 HG LEU 72 HG LEU 72 20.063 -9.875 -2.570 441 HD11 LEU 72 1HD1 LEU 72 22.228 -9.450 -2.814 442 HD12 LEU 72 2HD1 LEU 72 22.301 -8.602 -1.250 443 HD13 LEU 72 3HD1 LEU 72 22.521 -10.368 -1.318 444 HD21 LEU 72 3HD2 LEU 72 20.801 -11.780 -1.053 445 HD22 LEU 72 1HD2 LEU 72 20.332 -10.738 0.312 446 HD23 LEU 72 2HD2 LEU 72 19.115 -11.230 -0.892 447 H LYS 73 H LYS 73 17.324 -6.455 -0.689 448 HA LYS 73 HA LYS 73 18.077 -5.134 1.708 449 HB3 LYS 73 2HB LYS 73 15.819 -3.983 0.244 450 HG3 LYS 73 2HG LYS 73 17.659 -2.920 1.802 451 HD3 LYS 73 2HD LYS 73 19.073 -2.807 -0.901 452 HE3 LYS 73 2HE LYS 73 19.894 -1.916 1.906 453 HZ1 LYS 73 2HZ LYS 73 21.344 -1.552 -0.657 454 HZ3 LYS 73 1HZ LYS 73 21.710 -2.740 0.394 455 H ALA 74 H ALA 74 15.307 -7.084 0.616 456 HA ALA 74 HA ALA 74 13.546 -6.293 2.667 457 HB1 ALA 74 1HB ALA 74 12.854 -7.378 0.554 458 HB2 ALA 74 2HB ALA 74 13.695 -8.867 1.045 459 HB3 ALA 74 3HB ALA 74 12.287 -8.294 1.971 460 H VAL 75 H VAL 75 15.811 -9.103 2.288 461 HA VAL 75 HA VAL 75 15.223 -10.200 4.803 462 HB VAL 75 HB VAL 75 16.209 -11.448 2.967 463 HG11 VAL 75 1HG1 VAL 75 18.716 -9.793 3.415 464 HG12 VAL 75 2HG1 VAL 75 18.525 -11.143 2.272 465 HG13 VAL 75 3HG1 VAL 75 17.610 -9.637 2.029 466 HG21 VAL 75 3HG2 VAL 75 17.130 -12.861 4.433 467 HG22 VAL 75 1HG2 VAL 75 18.483 -11.750 4.756 468 HG23 VAL 75 2HG2 VAL 75 16.959 -11.582 5.660 469 H HIS 76 H HIS 76 17.605 -7.767 3.649 470 HA HIS 76 HA HIS 76 19.065 -7.659 6.029 471 HB3 HIS 76 2HB HIS 76 19.265 -5.139 4.884 472 HD1 HIS 76 1HD HIS 76 20.533 -8.620 5.166 473 HD2 HIS 76 2HD HIS 76 21.890 -4.945 3.668 474 HE1 HIS 76 1HE HIS 76 23.052 -8.868 4.838 475 H GLU 77 H GLU 77 16.246 -5.746 4.804 476 HA GLU 77 HA GLU 77 16.122 -3.997 6.914 477 HB3 GLU 77 2HB GLU 77 13.502 -4.183 6.220 478 HG3 GLU 77 2HG GLU 77 14.503 -2.921 3.979 479 HE2 GLU 77 HE GLU 77 12.465 -2.438 5.259 480 H LEU 78 H LEU 78 15.102 -7.386 6.631 481 HA LEU 78 HA LEU 78 13.576 -7.258 9.081 482 HB3 LEU 78 2HB LEU 78 14.308 -9.607 7.329 483 HG LEU 78 HG LEU 78 12.143 -10.545 8.238 484 HD11 LEU 78 1HD1 LEU 78 13.877 -10.493 10.607 485 HD12 LEU 78 2HD1 LEU 78 13.354 -11.856 9.588 486 HD13 LEU 78 3HD1 LEU 78 14.734 -10.848 9.087 487 HD21 LEU 78 3HD2 LEU 78 12.537 -8.747 10.617 488 HD22 LEU 78 1HD2 LEU 78 11.522 -8.239 9.246 489 HD23 LEU 78 2HD2 LEU 78 11.121 -9.719 10.150 490 H HIS 79 H HIS 79 16.808 -8.188 7.913 491 HA HIS 79 HA HIS 79 17.494 -9.587 10.280 492 HB3 HIS 79 2HB HIS 79 19.613 -8.399 8.564 493 HD1 HIS 79 1HD HIS 79 20.358 -9.598 11.147 494 HD2 HIS 79 2HD HIS 79 19.571 -11.998 7.798 495 HE1 HIS 79 1HE HIS 79 21.513 -11.831 11.580 496 H ASN 80 H ASN 80 18.062 -6.251 9.004 497 HA ASN 80 HA ASN 80 19.686 -5.404 11.041 498 HB3 ASN 80 2HB ASN 80 17.674 -3.444 9.972 499 HD21 ASN 80 1HD2 ASN 80 20.998 -4.306 9.105 500 HD22 ASN 80 2HD2 ASN 80 21.776 -2.903 9.758 501 H LEU 81 H LEU 81 16.078 -5.311 10.637 502 HA LEU 81 HA LEU 81 15.734 -4.172 13.263 503 HB3 LEU 81 2HB LEU 81 13.464 -5.238 11.662 504 HG LEU 81 HG LEU 81 13.538 -2.405 12.486 505 HD11 LEU 81 1HD1 LEU 81 11.510 -4.646 12.659 506 HD12 LEU 81 2HD1 LEU 81 11.218 -2.985 13.228 507 HD13 LEU 81 3HD1 LEU 81 11.548 -3.290 11.506 508 HD21 LEU 81 3HD2 LEU 81 14.565 -3.047 14.467 509 HD22 LEU 81 1HD2 LEU 81 12.833 -3.136 14.868 510 HD23 LEU 81 2HD2 LEU 81 13.740 -4.624 14.506 511 H GLY 82 H GLY 82 14.278 -7.106 11.692 512 HA2 GLY 82 1HA GLY 82 13.683 -9.086 12.585 513 HA3 GLY 82 2HA GLY 82 15.272 -9.055 13.322 514 H VAL 83 H VAL 83 12.089 -7.350 13.812 515 HA VAL 83 HA VAL 83 12.516 -7.637 16.689 516 HB VAL 83 HB VAL 83 12.083 -5.404 15.629 517 HG11 VAL 83 1HG1 VAL 83 9.173 -6.066 15.458 518 HG12 VAL 83 2HG1 VAL 83 10.130 -4.860 14.565 519 HG13 VAL 83 3HG1 VAL 83 10.223 -6.580 14.116 520 HG21 VAL 83 3HG2 VAL 83 10.972 -4.627 17.494 521 HG22 VAL 83 1HG2 VAL 83 9.814 -5.979 17.506 522 HG23 VAL 83 2HG2 VAL 83 11.486 -6.232 18.065 523 H LEU 84 H LEU 84 10.927 -9.098 14.023 524 HA LEU 84 HA LEU 84 9.111 -10.443 15.896 525 HB3 LEU 84 2HB LEU 84 7.914 -10.579 13.386 526 HG LEU 84 HG LEU 84 7.316 -8.855 15.791 527 HD11 LEU 84 1HD1 LEU 84 6.589 -7.701 13.692 528 HD12 LEU 84 2HD1 LEU 84 5.546 -9.101 13.348 529 HD13 LEU 84 3HD1 LEU 84 5.267 -8.120 14.807 530 HD21 LEU 84 3HD2 LEU 84 7.015 -11.445 15.669 531 HD22 LEU 84 1HD2 LEU 84 5.731 -10.430 16.365 532 HD23 LEU 84 2HD2 LEU 84 5.576 -11.045 14.702 533 H ASN 85 H ASN 85 11.923 -10.976 14.884 534 HA ASN 85 HA ASN 85 11.932 -12.853 12.912 535 HB3 ASN 85 2HB ASN 85 13.982 -11.885 13.960 536 HD21 ASN 85 1HD2 ASN 85 14.448 -14.697 15.728 537 HD22 ASN 85 2HD2 ASN 85 14.381 -14.064 17.339 538 H ASP 86 H ASP 86 10.593 -12.959 16.131 539 HA ASP 86 HA ASP 86 10.893 -15.710 16.592 540 HB3 ASP 86 2HB ASP 86 8.726 -15.083 18.100 541 HD2 ASP 86 HD ASP 86 9.386 -13.614 20.033 542 H PHE 87 H PHE 87 8.778 -13.700 14.640 543 HA PHE 87 HA PHE 87 6.718 -15.743 14.491 544 HB3 PHE 87 2HB PHE 87 6.243 -13.631 12.650 545 HD1 PHE 87 2HD PHE 87 6.208 -13.377 16.375 546 HD2 PHE 87 1HD PHE 87 3.946 -13.823 12.812 547 HE1 PHE 87 2HE PHE 87 4.085 -13.226 17.705 548 HE2 PHE 87 1HE PHE 87 1.822 -13.673 14.142 549 HZ PHE 87 HZ PHE 87 1.917 -13.377 16.572 550 H LEU 88 H LEU 88 9.630 -14.759 12.878 551 HA LEU 88 HA LEU 88 8.765 -16.145 10.440 552 HB3 LEU 88 2HB LEU 88 10.438 -14.939 9.267 553 HG LEU 88 HG LEU 88 8.704 -13.282 11.037 554 HD11 LEU 88 1HD1 LEU 88 9.948 -11.386 9.432 555 HD12 LEU 88 2HD1 LEU 88 10.138 -11.588 11.190 556 HD13 LEU 88 3HD1 LEU 88 11.291 -12.360 10.076 557 HD21 LEU 88 3HD2 LEU 88 8.285 -14.385 8.642 558 HD22 LEU 88 1HD2 LEU 88 7.540 -12.846 9.137 559 HD23 LEU 88 2HD2 LEU 88 8.991 -12.842 8.107 560 H LEU 89 H LEU 89 10.176 -17.754 9.509 561 HA LEU 89 HA LEU 89 11.547 -19.236 11.563 562 HB3 LEU 89 2HB LEU 89 11.416 -21.040 10.155 563 HG LEU 89 HG LEU 89 9.080 -19.357 10.028 564 HD11 LEU 89 1HD1 LEU 89 9.966 -20.489 7.458 565 HD12 LEU 89 2HD1 LEU 89 8.298 -20.904 7.919 566 HD13 LEU 89 3HD1 LEU 89 8.792 -19.198 7.809 567 HD21 LEU 89 3HD2 LEU 89 7.906 -21.436 10.289 568 HD22 LEU 89 1HD2 LEU 89 9.330 -22.363 9.757 569 HD23 LEU 89 2HD2 LEU 89 9.370 -21.476 11.301 570 HA PRO 90 HA PRO 90 15.384 -17.496 10.473 571 HB3 PRO 90 2HB PRO 90 16.034 -17.350 12.676 572 HG3 PRO 90 2HG PRO 90 14.796 -18.640 14.133 573 HD3 PRO 90 2HD PRO 90 12.841 -18.840 12.941 574 H ASP 91 H ASP 91 17.858 -18.727 10.568 575 HA ASP 91 HA ASP 91 17.401 -20.627 8.417 576 HB3 ASP 91 2HB ASP 91 18.821 -18.865 7.666 577 HD2 ASP 91 HD ASP 91 21.393 -18.367 8.055 578 H SER 92 H SER 92 18.542 -20.175 11.706 579 HA SER 92 HA SER 92 20.407 -22.200 11.869 580 HB3 SER 92 2HB SER 92 20.134 -20.515 13.625 581 HG SER 92 HG SER 92 17.793 -21.824 14.611 582 H LYS 93 H LYS 93 16.832 -22.189 12.493 583 HA LYS 93 HA LYS 93 16.671 -24.876 13.243 584 HB3 LYS 93 2HB LYS 93 14.983 -22.949 13.539 585 HG3 LYS 93 2HG LYS 93 14.876 -23.236 10.696 586 HD3 LYS 93 2HD LYS 93 12.125 -23.462 10.998 587 HE3 LYS 93 2HE LYS 93 14.331 -25.223 9.990 588 HZ1 LYS 93 2HZ LYS 93 12.030 -26.353 11.137 589 HZ3 LYS 93 1HZ LYS 93 13.195 -27.119 10.297 590 H ASP 94 H ASP 94 17.198 -23.324 10.161 591 HA ASP 94 HA ASP 94 16.243 -25.617 8.719 592 HB3 ASP 94 2HB ASP 94 17.702 -23.939 6.969 593 HD2 ASP 94 HD ASP 94 14.165 -22.645 6.629 594 H GLU 95 H GLU 95 19.250 -24.034 9.839 595 HA GLU 95 HA GLU 95 21.376 -24.493 9.577 596 HB3 GLU 95 2HB GLU 95 21.458 -27.328 9.721 597 HG3 GLU 95 2HG GLU 95 21.580 -26.698 12.292 598 HE2 GLU 95 HE GLU 95 23.341 -24.308 10.745 599 H ILE 96 H ILE 96 20.934 -23.808 7.173 600 HA ILE 96 HA ILE 96 21.804 -26.041 5.475 601 HB ILE 96 HB ILE 96 19.907 -23.794 4.793 602 HG13 ILE 96 2HG1 ILE 96 18.251 -25.172 5.330 603 HG21 ILE 96 1HG2 ILE 96 21.250 -24.137 2.870 604 HG22 ILE 96 2HG2 ILE 96 21.197 -25.906 3.057 605 HG23 ILE 96 3HG2 ILE 96 19.727 -25.016 2.591 606 HD11 ILE 96 3HD1 ILE 96 18.204 -27.559 4.375 607 HD12 ILE 96 1HD1 ILE 96 18.263 -26.240 3.179 608 HD13 ILE 96 2HD1 ILE 96 19.738 -27.158 3.566 609 H GLU 97 H GLU 97 22.874 -25.082 3.366 610 HA GLU 97 HA GLU 97 24.790 -23.147 4.361 611 HB3 GLU 97 2HB GLU 97 25.693 -25.282 3.514 612 HG3 GLU 97 2HG GLU 97 25.108 -24.666 0.672 613 HE2 GLU 97 HE GLU 97 24.508 -28.106 0.486 614 H ASP 98 H ASP 98 25.475 -21.330 2.982 615 HA ASP 98 HA ASP 98 23.312 -20.005 1.896 616 HB3 ASP 98 2HB ASP 98 24.999 -18.544 2.534 617 HD2 ASP 98 HD ASP 98 27.490 -20.240 0.363 618 H GLU 99 H GLU 99 25.358 -22.509 0.649 619 HA GLU 99 HA GLU 99 25.251 -21.699 -2.070 620 HB3 GLU 99 2HB GLU 99 25.785 -24.531 -1.750 621 HG3 GLU 99 2HG GLU 99 28.079 -22.676 -2.018 622 HE2 GLU 99 HE GLU 99 29.050 -24.273 -4.658 623 H LEU 100 H LEU 100 23.433 -23.910 0.098 624 HA LEU 100 HA LEU 100 21.881 -25.003 -2.032 625 HB3 LEU 100 2HB LEU 100 21.233 -25.070 0.908 626 HG LEU 100 HG LEU 100 20.135 -27.058 0.558 627 HD11 LEU 100 1HD1 LEU 100 19.044 -25.103 -0.646 628 HD12 LEU 100 2HD1 LEU 100 19.645 -25.828 -2.157 629 HD13 LEU 100 3HD1 LEU 100 18.514 -26.735 -1.124 630 HD21 LEU 100 3HD2 LEU 100 20.540 -28.072 -1.975 631 HD22 LEU 100 1HD2 LEU 100 22.151 -27.461 -1.523 632 HD23 LEU 100 2HD2 LEU 100 21.320 -28.639 -0.478 633 H SER 101 H SER 101 21.521 -22.384 0.406 634 HA SER 101 HA SER 101 18.870 -21.870 0.028 635 HB3 SER 101 2HB SER 101 19.387 -19.583 0.852 636 HG SER 101 HG SER 101 21.305 -21.121 2.263 637 H ASP 102 H ASP 102 17.860 -19.942 -1.151 638 HA ASP 102 HA ASP 102 17.386 -18.877 -2.977 639 HB3 ASP 102 2HB ASP 102 20.403 -18.877 -3.459 640 HD2 ASP 102 HD ASP 102 19.044 -15.767 -5.273 Start of MODEL 7 1 H1 ILE 1 H ILE 1 30.157 -25.994 5.622 2 HA ILE 1 HA ILE 1 32.603 -26.146 7.113 3 HB ILE 1 HB ILE 1 33.627 -26.401 4.904 4 HG13 ILE 1 2HG1 ILE 1 31.604 -24.905 3.911 5 HG21 ILE 1 1HG2 ILE 1 33.068 -28.459 5.741 6 HG22 ILE 1 2HG2 ILE 1 31.325 -28.100 5.781 7 HG23 ILE 1 3HG2 ILE 1 32.126 -28.459 4.232 8 HD11 ILE 1 3HD1 ILE 1 33.900 -25.949 2.933 9 HD12 ILE 1 1HD1 ILE 1 32.736 -26.954 2.038 10 HD13 ILE 1 2HD1 ILE 1 32.684 -25.182 1.885 11 H SER 2 H SER 2 30.724 -23.645 7.003 12 HA SER 2 HA SER 2 32.911 -21.825 6.912 13 HB3 SER 2 2HB SER 2 31.065 -20.405 5.354 14 HG SER 2 HG SER 2 33.166 -20.155 4.767 15 H GLY 3 H GLY 3 29.399 -21.186 6.343 16 HA2 GLY 3 1HA GLY 3 27.941 -20.997 8.324 17 HA3 GLY 3 2HA GLY 3 29.243 -20.117 9.099 18 H GLY 4 H GLY 4 27.404 -20.049 5.956 19 HA2 GLY 4 1HA GLY 4 27.851 -17.369 5.360 20 HA3 GLY 4 2HA GLY 4 26.505 -18.344 4.802 21 H SER 5 H SER 5 27.585 -15.896 7.081 22 HA SER 5 HA SER 5 25.265 -16.020 8.695 23 HB3 SER 5 2HB SER 5 26.161 -13.723 9.482 24 HG SER 5 HG SER 5 27.358 -16.254 9.721 25 H SER 6 H SER 6 26.515 -13.738 6.152 26 HA SER 6 HA SER 6 24.280 -12.113 6.161 27 HB3 SER 6 2HB SER 6 25.206 -11.829 3.606 28 HG SER 6 HG SER 6 25.352 -10.131 5.120 29 H ILE 7 H ILE 7 25.146 -15.038 4.222 30 HA ILE 7 HA ILE 7 22.965 -14.946 2.492 31 HB ILE 7 HB ILE 7 24.429 -17.388 3.493 32 HG13 ILE 7 2HG1 ILE 7 25.335 -15.129 1.824 33 HG21 ILE 7 1HG2 ILE 7 22.853 -16.813 0.974 34 HG22 ILE 7 2HG2 ILE 7 23.912 -18.226 1.189 35 HG23 ILE 7 3HG2 ILE 7 22.492 -18.009 2.242 36 HD11 ILE 7 3HD1 ILE 7 27.186 -17.285 2.670 37 HD12 ILE 7 1HD1 ILE 7 27.282 -15.530 2.948 38 HD13 ILE 7 2HD1 ILE 7 26.275 -16.544 4.008 39 H SER 8 H SER 8 23.418 -16.653 5.660 40 HA SER 8 HA SER 8 21.252 -18.058 5.929 41 HB3 SER 8 2HB SER 8 22.983 -17.389 7.714 42 HG SER 8 HG SER 8 20.953 -15.538 8.568 43 H MET 9 H MET 9 21.325 -14.482 5.803 44 HA MET 9 HA MET 9 18.468 -14.416 6.256 45 HB3 MET 9 2HB MET 9 20.086 -11.943 5.632 46 HG3 MET 9 2HG MET 9 17.605 -12.039 6.409 47 HE1 MET 9 3HE MET 9 16.188 -12.467 9.951 48 HE2 MET 9 1HE MET 9 16.632 -10.993 9.056 49 HE3 MET 9 2HE MET 9 15.828 -12.339 8.212 50 H MET 10 H MET 10 20.963 -13.636 3.775 51 HA MET 10 HA MET 10 19.187 -12.510 1.955 52 HB3 MET 10 2HB MET 10 21.397 -13.889 0.641 53 HG3 MET 10 2HG MET 10 20.366 -11.163 1.032 54 HE1 MET 10 3HE MET 10 23.782 -12.102 -0.513 55 HE2 MET 10 1HE MET 10 24.953 -11.543 0.706 56 HE3 MET 10 2HE MET 10 23.907 -12.942 1.051 57 H TYR 11 H TYR 11 19.687 -15.795 2.969 58 HA TYR 11 HA TYR 11 18.984 -17.075 0.539 59 HB3 TYR 11 2HB TYR 11 19.244 -17.644 3.514 60 HD1 TYR 11 1HD TYR 11 17.586 -19.080 0.525 61 HD2 TYR 11 2HD TYR 11 18.616 -19.670 4.635 62 HE1 TYR 11 1HE TYR 11 16.024 -21.083 0.636 63 HE2 TYR 11 2HE TYR 11 17.053 -21.672 4.732 64 HH TYR 11 HH TYR 11 15.263 -22.704 1.838 65 H LYS 12 H LYS 12 17.151 -16.413 3.611 66 HA LYS 12 HA LYS 12 14.788 -17.502 3.086 67 HB3 LYS 12 2HB LYS 12 14.285 -14.825 4.019 68 HG3 LYS 12 2HG LYS 12 13.218 -17.088 4.667 69 HD3 LYS 12 2HD LYS 12 15.546 -18.129 5.135 70 HE3 LYS 12 2HE LYS 12 15.172 -16.894 7.883 71 HZ1 LYS 12 2HZ LYS 12 17.622 -17.882 6.542 72 HZ3 LYS 12 1HZ LYS 12 16.658 -18.875 7.401 73 H TYR 13 H TYR 13 16.082 -14.516 1.558 74 HA TYR 13 HA TYR 13 13.752 -13.790 0.210 75 HB3 TYR 13 2HB TYR 13 16.701 -13.333 0.225 76 HD1 TYR 13 1HD TYR 13 14.061 -13.080 -2.423 77 HD2 TYR 13 2HD TYR 13 18.229 -12.866 -1.481 78 HE1 TYR 13 1HE TYR 13 14.616 -12.870 -4.896 79 HE2 TYR 13 2HE TYR 13 18.770 -12.656 -3.956 80 HH TYR 13 HH TYR 13 17.046 -13.550 -6.258 81 H CYS 14 H CYS 14 16.620 -15.704 -0.951 82 HA CYS 14 HA CYS 14 15.488 -16.235 -3.450 83 HB3 CYS 14 2HB CYS 14 17.339 -18.304 -2.606 84 HG CYS 14 HG CYS 14 16.676 -17.553 -5.100 85 H SER 15 H SER 15 15.198 -17.674 -0.214 86 HA SER 15 HA SER 15 14.363 -20.181 -0.825 87 HB3 SER 15 2HB SER 15 12.804 -18.890 1.341 88 HG SER 15 HG SER 15 14.060 -21.249 0.833 89 H ARG 16 H ARG 16 12.862 -17.163 -1.606 90 HA ARG 16 HA ARG 16 10.199 -18.003 -1.524 91 HB3 ARG 16 2HB ARG 16 11.429 -15.849 -3.314 92 HG3 ARG 16 2HG ARG 16 9.032 -14.879 -2.425 93 HD3 ARG 16 2HD ARG 16 10.053 -16.083 -4.889 94 HE ARG 16 HE ARG 16 7.733 -17.365 -4.191 95 HH11 ARG 16 2HH2 ARG 16 8.409 -14.873 -6.617 96 HH12 ARG 16 1HH2 ARG 16 7.147 -15.393 -7.683 97 HH22 ARG 16 1HH ARG 16 5.784 -17.264 -7.064 98 H LEU 17 H LEU 17 12.592 -19.405 -3.211 99 HA LEU 17 HA LEU 17 11.918 -19.352 -5.877 100 HB3 LEU 17 2HB LEU 17 12.800 -21.908 -4.619 101 HG LEU 17 HG LEU 17 14.650 -21.655 -6.324 102 HD11 LEU 17 1HD1 LEU 17 11.761 -22.059 -7.046 103 HD12 LEU 17 2HD1 LEU 17 13.031 -22.170 -8.289 104 HD13 LEU 17 3HD1 LEU 17 13.069 -23.254 -6.877 105 HD21 LEU 17 3HD2 LEU 17 13.981 -19.097 -6.552 106 HD22 LEU 17 1HD2 LEU 17 14.700 -20.010 -7.900 107 HD23 LEU 17 2HD2 LEU 17 12.941 -19.741 -7.845 108 HA PRO 18 HA PRO 18 7.957 -21.190 -5.628 109 HB3 PRO 18 2HB PRO 18 6.990 -19.536 -6.904 110 HG3 PRO 18 2HG PRO 18 8.487 -18.204 -8.047 111 HD3 PRO 18 2HD PRO 18 10.358 -18.477 -6.740 112 H HIS 19 H HIS 19 9.078 -23.231 -5.196 113 HA HIS 19 HA HIS 19 8.182 -25.240 -6.662 114 HB3 HIS 19 2HB HIS 19 10.648 -25.578 -7.918 115 HD1 HIS 19 1HD HIS 19 7.118 -24.245 -8.435 116 HD2 HIS 19 2HD HIS 19 10.025 -26.484 -10.466 117 HE1 HIS 19 1HE HIS 19 5.980 -25.168 -10.525 118 H ASP 20 H ASP 20 10.745 -23.752 -4.800 119 HA ASP 20 HA ASP 20 12.037 -26.148 -4.100 120 HB3 ASP 20 2HB ASP 20 11.931 -23.412 -2.748 121 HD2 ASP 20 HD ASP 20 15.068 -25.602 -2.106 122 H GLU 21 H GLU 21 11.225 -27.699 -2.681 123 HA GLU 21 HA GLU 21 8.865 -27.094 -1.217 124 HB3 GLU 21 2HB GLU 21 10.492 -29.638 -0.934 125 HG3 GLU 21 2HG GLU 21 7.495 -29.050 -1.024 126 HE2 GLU 21 HE GLU 21 7.691 -32.425 -2.032 127 H PHE 22 H PHE 22 12.290 -26.940 -0.653 128 HA PHE 22 HA PHE 22 12.368 -27.525 2.073 129 HB3 PHE 22 2HB PHE 22 14.292 -25.531 1.540 130 HD1 PHE 22 1HD PHE 22 15.121 -27.091 3.321 131 HD2 PHE 22 2HD PHE 22 14.795 -28.275 -0.741 132 HE1 PHE 22 1HE PHE 22 16.672 -29.015 3.757 133 HE2 PHE 22 2HE PHE 22 16.345 -30.199 -0.304 134 HZ PHE 22 HZ PHE 22 17.265 -30.548 1.939 135 H PHE 23 H PHE 23 11.180 -24.729 0.285 136 HA PHE 23 HA PHE 23 10.674 -23.426 2.857 137 HB3 PHE 23 2HB PHE 23 11.312 -21.989 0.228 138 HD1 PHE 23 1HD PHE 23 12.633 -21.638 3.681 139 HD2 PHE 23 2HD PHE 23 10.211 -19.960 0.627 140 HE1 PHE 23 1HE PHE 23 12.409 -19.526 5.020 141 HE2 PHE 23 2HE PHE 23 9.988 -17.848 1.966 142 HZ PHE 23 HZ PHE 23 11.088 -17.656 4.146 143 H GLN 24 H GLN 24 8.722 -22.162 2.950 144 HA GLN 24 HA GLN 24 6.790 -23.106 1.044 145 HB3 GLN 24 2HB GLN 24 5.139 -22.053 2.612 146 HG3 GLN 24 2HG GLN 24 7.161 -24.098 3.408 147 HE21 GLN 24 1HE2 GLN 24 4.306 -24.100 5.181 148 HE22 GLN 24 2HE2 GLN 24 4.908 -23.608 6.729 149 HA PRO 25 HA PRO 25 6.536 -19.366 -1.139 150 HB3 PRO 25 2HB PRO 25 5.251 -20.318 -2.797 151 HG3 PRO 25 2HG PRO 25 4.080 -22.196 -2.147 152 HD3 PRO 25 2HD PRO 25 5.371 -22.891 -0.377 153 H LYS 26 H LYS 26 6.718 -18.662 1.366 154 HA LYS 26 HA LYS 26 4.365 -17.240 2.164 155 HB3 LYS 26 2HB LYS 26 6.711 -16.454 3.621 156 HG3 LYS 26 2HG LYS 26 4.537 -18.460 4.365 157 HD3 LYS 26 2HD LYS 26 5.129 -16.677 6.479 158 HE3 LYS 26 2HE LYS 26 4.598 -19.138 6.625 159 HZ1 LYS 26 2HZ LYS 26 7.181 -20.155 6.469 160 HZ3 LYS 26 1HZ LYS 26 6.965 -19.326 5.084 161 HA PRO 27 HA PRO 27 7.066 -13.630 0.748 162 HB3 PRO 27 2HB PRO 27 9.336 -13.819 1.082 163 HG3 PRO 27 2HG PRO 27 10.103 -15.985 1.292 164 HD3 PRO 27 2HD PRO 27 8.181 -17.030 2.000 165 H GLU 28 H GLU 28 7.245 -12.306 -1.228 166 HA GLU 28 HA GLU 28 6.411 -13.848 -3.532 167 HB3 GLU 28 2HB GLU 28 4.885 -11.389 -3.472 168 HG3 GLU 28 2HG GLU 28 4.016 -14.307 -3.206 169 HE2 GLU 28 HE GLU 28 1.836 -14.348 -2.974 170 H PHE 29 H PHE 29 6.511 -12.465 -5.592 171 HA PHE 29 HA PHE 29 8.396 -10.250 -5.269 172 HB3 PHE 29 2HB PHE 29 9.509 -11.258 -7.380 173 HD1 PHE 29 2HD PHE 29 9.912 -10.920 -4.292 174 HD2 PHE 29 1HD PHE 29 10.300 -14.201 -6.954 175 HE1 PHE 29 2HE PHE 29 11.602 -11.964 -2.757 176 HE2 PHE 29 1HE PHE 29 11.989 -15.247 -5.418 177 HZ PHE 29 HZ PHE 29 12.620 -14.116 -3.339 178 H GLN 30 H GLN 30 8.178 -8.565 -6.793 179 HA GLN 30 HA GLN 30 6.194 -8.980 -8.857 180 HB3 GLN 30 2HB GLN 30 5.683 -6.371 -7.867 181 HG3 GLN 30 2HG GLN 30 3.498 -7.525 -7.099 182 HE21 GLN 30 1HE2 GLN 30 3.351 -9.557 -9.531 183 HE22 GLN 30 2HE2 GLN 30 3.051 -8.523 -10.888 184 H PHE 31 H PHE 31 6.732 -7.952 -10.778 185 HA PHE 31 HA PHE 31 9.036 -6.138 -10.616 186 HB3 PHE 31 2HB PHE 31 9.292 -8.459 -11.718 187 HD1 PHE 31 1HD PHE 31 7.097 -9.621 -11.991 188 HD2 PHE 31 2HD PHE 31 8.445 -6.692 -14.750 189 HE1 PHE 31 1HE PHE 31 5.440 -10.453 -13.684 190 HE2 PHE 31 2HE PHE 31 6.789 -7.524 -16.442 191 HZ PHE 31 HZ PHE 31 5.306 -9.394 -15.890 192 H LYS 32 H LYS 32 8.877 -4.135 -11.585 193 HA LYS 32 HA LYS 32 6.354 -3.629 -13.005 194 HB3 LYS 32 2HB LYS 32 7.751 -2.195 -10.843 195 HG3 LYS 32 2HG LYS 32 6.815 -0.806 -13.375 196 HD3 LYS 32 2HD LYS 32 6.752 1.311 -12.004 197 HE3 LYS 32 2HE LYS 32 4.700 -0.333 -10.625 198 HZ1 LYS 32 2HZ LYS 32 4.077 1.593 -12.719 199 HZ3 LYS 32 1HZ LYS 32 4.855 2.199 -11.423 200 HA PRO 33 HA PRO 33 9.088 -2.930 -16.335 201 HB3 PRO 33 2HB PRO 33 7.805 -4.187 -17.775 202 HG3 PRO 33 2HG PRO 33 5.666 -4.623 -17.029 203 HD3 PRO 33 2HD PRO 33 5.974 -4.410 -14.761 204 H VAL 34 H VAL 34 10.260 -1.118 -16.282 205 HA VAL 34 HA VAL 34 8.687 1.315 -16.784 206 HB VAL 34 HB VAL 34 11.183 1.087 -15.095 207 HG11 VAL 34 1HG1 VAL 34 9.307 3.324 -15.824 208 HG12 VAL 34 2HG1 VAL 34 10.175 3.357 -14.270 209 HG13 VAL 34 3HG1 VAL 34 11.087 3.297 -15.799 210 HG21 VAL 34 3HG2 VAL 34 9.772 0.029 -13.655 211 HG22 VAL 34 1HG2 VAL 34 9.284 1.702 -13.292 212 HG23 VAL 34 2HG2 VAL 34 8.310 0.712 -14.405 213 H ASP 35 H ASP 35 10.216 3.132 -17.661 214 HA ASP 35 HA ASP 35 11.220 2.203 -20.059 215 HB3 ASP 35 2HB ASP 35 12.343 4.765 -19.020 216 HD2 ASP 35 HD ASP 35 11.741 6.460 -20.490 217 H GLU 36 H GLU 36 13.574 2.488 -20.821 218 HA GLU 36 HA GLU 36 15.281 1.121 -19.116 219 HB3 GLU 36 2HB GLU 36 17.046 1.835 -20.866 220 HG3 GLU 36 2HG GLU 36 14.938 0.772 -22.577 221 HE2 GLU 36 HE GLU 36 16.952 -2.190 -22.077 222 H PHE 37 H PHE 37 14.296 4.390 -19.094 223 HA PHE 37 HA PHE 37 16.713 5.635 -18.371 224 HB3 PHE 37 2HB PHE 37 14.080 6.575 -17.252 225 HD1 PHE 37 2HD PHE 37 15.794 7.561 -20.386 226 HD2 PHE 37 1HD PHE 37 15.046 8.508 -16.318 227 HE1 PHE 37 2HE PHE 37 16.848 9.814 -20.718 228 HE2 PHE 37 1HE PHE 37 16.100 10.762 -16.649 229 HZ PHE 37 HZ PHE 37 16.988 11.388 -18.845 230 H GLY 38 H GLY 38 14.913 3.255 -16.761 231 HA2 GLY 38 1HA GLY 38 16.363 3.713 -14.305 232 HA3 GLY 38 2HA GLY 38 14.632 3.944 -14.164 233 H GLY 39 H GLY 39 16.615 1.611 -16.126 234 HA2 GLY 39 1HA GLY 39 16.211 -0.607 -16.478 235 HA3 GLY 39 2HA GLY 39 16.558 -0.654 -14.760 236 H THR 40 H THR 40 15.100 -1.905 -13.683 237 HA THR 40 HA THR 40 12.263 -1.495 -14.322 238 HB THR 40 HB THR 40 13.502 -4.229 -13.767 239 HG1 THR 40 1HG THR 40 13.586 -4.354 -16.106 240 HG21 THR 40 3HG2 THR 40 11.478 -4.951 -15.110 241 HG22 THR 40 1HG2 THR 40 11.039 -4.145 -13.585 242 HG23 THR 40 2HG2 THR 40 10.932 -3.257 -15.123 243 H ILE 41 H ILE 41 10.802 -1.796 -12.582 244 HA ILE 41 HA ILE 41 12.148 -1.470 -10.012 245 HB ILE 41 HB ILE 41 9.277 -0.933 -10.776 246 HG13 ILE 41 2HG1 ILE 41 10.897 0.457 -12.057 247 HG21 ILE 41 1HG2 ILE 41 10.387 0.528 -8.513 248 HG22 ILE 41 2HG2 ILE 41 8.881 -0.411 -8.649 249 HG23 ILE 41 3HG2 ILE 41 10.411 -1.235 -8.262 250 HD11 ILE 41 3HD1 ILE 41 8.670 1.369 -11.420 251 HD12 ILE 41 1HD1 ILE 41 9.352 1.941 -9.880 252 HD13 ILE 41 2HD1 ILE 41 9.915 2.640 -11.416 253 H CYS 42 H CYS 42 11.783 -2.842 -8.260 254 HA CYS 42 HA CYS 42 10.159 -5.198 -8.897 255 HB3 CYS 42 2HB CYS 42 11.823 -6.411 -7.329 256 HG CYS 42 HG CYS 42 11.659 -7.307 -9.640 257 H ARG 43 H ARG 43 8.576 -5.642 -7.370 258 HA ARG 43 HA ARG 43 8.742 -4.053 -4.938 259 HB3 ARG 43 2HB ARG 43 6.326 -5.131 -6.472 260 HG3 ARG 43 2HG ARG 43 5.844 -3.258 -4.233 261 HD3 ARG 43 2HD ARG 43 4.264 -5.444 -3.793 262 HE ARG 43 HE ARG 43 3.928 -2.984 -5.307 263 HH11 ARG 43 2HH2 ARG 43 2.332 -6.040 -4.487 264 HH12 ARG 43 1HH2 ARG 43 0.736 -5.418 -4.744 265 HH22 ARG 43 1HH ARG 43 0.459 -3.137 -5.424 266 H ILE 44 H ILE 44 9.415 -5.323 -3.232 267 HA ILE 44 HA ILE 44 8.627 -8.139 -3.261 268 HB ILE 44 HB ILE 44 11.025 -6.738 -2.623 269 HG13 ILE 44 2HG1 ILE 44 10.329 -9.689 -2.523 270 HG21 ILE 44 1HG2 ILE 44 11.583 -7.549 -0.449 271 HG22 ILE 44 2HG2 ILE 44 10.039 -6.671 -0.317 272 HG23 ILE 44 3HG2 ILE 44 10.053 -8.452 -0.326 273 HD11 ILE 44 3HD1 ILE 44 11.348 -7.860 -4.743 274 HD12 ILE 44 1HD1 ILE 44 11.392 -9.638 -4.823 275 HD13 ILE 44 2HD1 ILE 44 9.830 -8.791 -4.730 276 H THR 45 H THR 45 7.338 -9.031 -1.667 277 HA THR 45 HA THR 45 6.638 -7.353 0.612 278 HB THR 45 HB THR 45 5.008 -6.781 -1.204 279 HG1 THR 45 1HG THR 45 4.428 -7.078 1.139 280 HG21 THR 45 3HG2 THR 45 5.165 -9.237 -2.206 281 HG22 THR 45 1HG2 THR 45 3.949 -9.618 -0.963 282 HG23 THR 45 2HG2 THR 45 3.595 -8.398 -2.211 283 H LEU 46 H LEU 46 6.797 -8.515 2.416 284 HA LEU 46 HA LEU 46 6.814 -11.410 2.125 285 HB3 LEU 46 2HB LEU 46 7.461 -10.981 4.697 286 HG LEU 46 HG LEU 46 9.367 -10.648 2.365 287 HD11 LEU 46 1HD1 LEU 46 11.095 -10.410 3.756 288 HD12 LEU 46 2HD1 LEU 46 9.887 -9.975 4.988 289 HD13 LEU 46 3HD1 LEU 46 10.482 -11.649 4.877 290 HD21 LEU 46 3HD2 LEU 46 8.667 -13.080 4.034 291 HD22 LEU 46 1HD2 LEU 46 8.204 -12.786 2.340 292 HD23 LEU 46 2HD2 LEU 46 9.917 -13.006 2.769 293 HA PRO 47 HA PRO 47 3.029 -11.956 4.130 294 HB3 PRO 47 2HB PRO 47 3.165 -14.252 4.039 295 HG3 PRO 47 2HG PRO 47 5.314 -15.087 3.962 296 HD3 PRO 47 2HD PRO 47 6.424 -13.277 3.082 297 H ALA 48 H ALA 48 1.725 -12.148 6.220 298 HA ALA 48 HA ALA 48 2.441 -9.962 7.784 299 HB1 ALA 48 1HB ALA 48 0.172 -11.235 7.399 300 HB2 ALA 48 2HB ALA 48 0.691 -12.198 8.802 301 HB3 ALA 48 3HB ALA 48 0.481 -10.438 8.960 302 H ASN 49 H ASN 49 3.702 -13.173 7.693 303 HA ASN 49 HA ASN 49 4.268 -13.493 10.399 304 HB3 ASN 49 2HB ASN 49 5.911 -15.206 9.596 305 HD21 ASN 49 1HD2 ASN 49 4.139 -16.255 10.544 306 HD22 ASN 49 2HD2 ASN 49 2.866 -16.957 9.603 307 H ALA 50 H ALA 50 5.543 -11.433 7.897 308 HA ALA 50 HA ALA 50 7.922 -10.886 9.539 309 HB1 ALA 50 1HB ALA 50 9.221 -10.770 7.654 310 HB2 ALA 50 2HB ALA 50 7.991 -11.897 7.033 311 HB3 ALA 50 3HB ALA 50 7.887 -10.164 6.642 312 HA PRO 51 HA PRO 51 6.177 -6.932 9.879 313 HB3 PRO 51 2HB PRO 51 7.202 -6.585 11.912 314 HG3 PRO 51 2HG PRO 51 9.018 -7.946 12.320 315 HD3 PRO 51 2HD PRO 51 8.519 -9.717 10.941 316 H ILE 52 H ILE 52 9.561 -6.411 9.004 317 HA ILE 52 HA ILE 52 8.542 -4.700 6.853 318 HB ILE 52 HB ILE 52 11.079 -3.975 6.981 319 HG13 ILE 52 2HG1 ILE 52 10.538 -4.957 9.800 320 HG21 ILE 52 1HG2 ILE 52 8.596 -3.050 8.184 321 HG22 ILE 52 2HG2 ILE 52 10.026 -2.523 9.104 322 HG23 ILE 52 3HG2 ILE 52 9.890 -2.136 7.373 323 HD11 ILE 52 3HD1 ILE 52 11.276 -6.740 8.188 324 HD12 ILE 52 1HD1 ILE 52 12.692 -5.740 7.781 325 HD13 ILE 52 2HD1 ILE 52 12.501 -6.383 9.429 326 H SER 53 H SER 53 10.165 -4.635 4.896 327 HA SER 53 HA SER 53 11.918 -6.297 4.096 328 HB3 SER 53 2HB SER 53 9.423 -7.929 4.501 329 HG SER 53 HG SER 53 11.081 -8.013 2.212 330 H GLU 54 H GLU 54 8.946 -4.660 3.587 331 HA GLU 54 HA GLU 54 8.586 -5.128 0.866 332 HB3 GLU 54 2HB GLU 54 6.742 -4.191 2.005 333 HG3 GLU 54 2HG GLU 54 8.823 -2.369 3.205 334 HE2 GLU 54 HE GLU 54 8.111 -0.607 1.879 335 H ILE 55 H ILE 55 9.478 -4.197 -0.974 336 HA ILE 55 HA ILE 55 11.105 -1.822 -0.672 337 HB ILE 55 HB ILE 55 12.311 -4.332 -1.827 338 HG13 ILE 55 2HG1 ILE 55 13.519 -4.696 0.164 339 HG21 ILE 55 1HG2 ILE 55 14.423 -2.961 -1.524 340 HG22 ILE 55 2HG2 ILE 55 13.307 -2.427 -2.804 341 HG23 ILE 55 3HG2 ILE 55 13.361 -1.558 -1.251 342 HD11 ILE 55 3HD1 ILE 55 14.190 -2.676 1.096 343 HD12 ILE 55 1HD1 ILE 55 12.608 -1.907 0.830 344 HD13 ILE 55 2HD1 ILE 55 12.826 -3.055 2.173 345 H GLU 56 H GLU 56 10.796 -0.498 -2.396 346 HA GLU 56 HA GLU 56 10.048 -1.745 -4.895 347 HB3 GLU 56 2HB GLU 56 8.219 0.061 -5.143 348 HG3 GLU 56 2HG GLU 56 8.132 -2.369 -3.369 349 HE2 GLU 56 HE GLU 56 5.400 -1.376 -1.540 350 H SER 57 H SER 57 11.494 -0.975 -6.368 351 HA SER 57 HA SER 57 11.736 1.572 -7.119 352 HB3 SER 57 2HB SER 57 12.649 2.490 -5.182 353 HG SER 57 HG SER 57 14.640 0.613 -4.609 354 H SER 58 H SER 58 12.976 1.607 -9.019 355 HA SER 58 HA SER 58 14.052 -0.886 -9.805 356 HB3 SER 58 2HB SER 58 13.062 0.231 -11.595 357 HG SER 58 HG SER 58 12.829 2.366 -11.682 358 H LEU 59 H LEU 59 16.332 -0.851 -10.998 359 HA LEU 59 HA LEU 59 18.283 0.960 -10.191 360 HB3 LEU 59 2HB LEU 59 18.332 -1.574 -8.553 361 HG LEU 59 HG LEU 59 19.915 -0.240 -7.128 362 HD11 LEU 59 1HD1 LEU 59 21.375 -1.604 -8.089 363 HD12 LEU 59 2HD1 LEU 59 20.413 -1.647 -9.586 364 HD13 LEU 59 3HD1 LEU 59 21.640 -0.380 -9.354 365 HD21 LEU 59 3HD2 LEU 59 21.025 1.690 -7.981 366 HD22 LEU 59 1HD2 LEU 59 20.208 1.542 -9.555 367 HD23 LEU 59 2HD2 LEU 59 19.273 1.980 -8.104 368 H LEU 60 H LEU 60 17.321 -2.352 -11.125 369 HA LEU 60 HA LEU 60 19.726 -2.448 -12.808 370 HB3 LEU 60 2HB LEU 60 18.961 -4.991 -12.789 371 HG LEU 60 HG LEU 60 20.625 -5.528 -11.299 372 HD11 LEU 60 1HD1 LEU 60 21.522 -2.686 -11.661 373 HD12 LEU 60 2HD1 LEU 60 22.445 -4.201 -11.802 374 HD13 LEU 60 3HD1 LEU 60 21.294 -3.739 -13.077 375 HD21 LEU 60 3HD2 LEU 60 20.234 -4.959 -9.178 376 HD22 LEU 60 1HD2 LEU 60 21.172 -3.487 -9.526 377 HD23 LEU 60 2HD2 LEU 60 19.395 -3.457 -9.639 378 HA PRO 61 HA PRO 61 17.085 -2.355 -16.222 379 HB3 PRO 61 2HB PRO 61 18.819 -1.820 -17.639 380 HG3 PRO 61 2HG PRO 61 20.911 -2.415 -16.870 381 HD3 PRO 61 2HD PRO 61 20.512 -2.470 -14.606 382 H SER 62 H SER 62 17.664 -5.055 -14.545 383 HA SER 62 HA SER 62 15.810 -6.496 -16.271 384 HB3 SER 62 2HB SER 62 17.671 -8.121 -14.594 385 HG SER 62 HG SER 62 16.330 -8.275 -17.090 386 H THR 63 H THR 63 14.213 -7.784 -15.146 387 HA THR 63 HA THR 63 13.533 -6.748 -12.578 388 HB THR 63 HB THR 63 12.412 -8.691 -14.607 389 HG1 THR 63 1HG THR 63 11.561 -6.385 -12.999 390 HG21 THR 63 3HG2 THR 63 12.034 -9.771 -12.335 391 HG22 THR 63 1HG2 THR 63 11.270 -8.256 -11.799 392 HG23 THR 63 2HG2 THR 63 10.531 -9.210 -13.107 393 H GLU 64 H GLU 64 14.941 -9.825 -13.792 394 HA GLU 64 HA GLU 64 14.750 -11.215 -11.437 395 HB3 GLU 64 2HB GLU 64 17.179 -12.025 -12.637 396 HG3 GLU 64 2HG GLU 64 14.301 -12.879 -12.663 397 HE2 GLU 64 HE GLU 64 14.096 -15.186 -14.201 398 H ALA 65 H ALA 65 17.316 -8.963 -12.623 399 HA ALA 65 HA ALA 65 18.899 -9.344 -10.263 400 HB1 ALA 65 1HB ALA 65 19.807 -8.838 -12.552 401 HB2 ALA 65 2HB ALA 65 19.083 -7.217 -12.432 402 HB3 ALA 65 3HB ALA 65 20.361 -7.706 -11.295 403 H ALA 66 H ALA 66 16.747 -6.770 -11.631 404 HA ALA 66 HA ALA 66 17.084 -4.875 -9.683 405 HB1 ALA 66 1HB ALA 66 14.623 -5.682 -11.280 406 HB2 ALA 66 2HB ALA 66 14.748 -4.180 -10.333 407 HB3 ALA 66 3HB ALA 66 15.837 -4.455 -11.713 408 H LYS 67 H LYS 67 15.073 -7.857 -9.666 409 HA LYS 67 HA LYS 67 13.779 -7.234 -7.229 410 HB3 LYS 67 2HB LYS 67 12.917 -8.790 -8.981 411 HG3 LYS 67 2HG LYS 67 15.394 -10.255 -8.175 412 HD3 LYS 67 2HD LYS 67 12.933 -11.856 -8.955 413 HE3 LYS 67 2HE LYS 67 14.539 -13.494 -7.485 414 HZ1 LYS 67 2HZ LYS 67 14.074 -14.251 -9.596 415 HZ3 LYS 67 1HZ LYS 67 15.637 -13.857 -9.840 416 H LYS 68 H LYS 68 16.835 -8.842 -8.146 417 HA LYS 68 HA LYS 68 17.367 -10.055 -5.703 418 HB3 LYS 68 2HB LYS 68 19.263 -8.963 -7.801 419 HG3 LYS 68 2HG LYS 68 19.737 -11.150 -5.730 420 HD3 LYS 68 2HD LYS 68 22.133 -9.922 -6.659 421 HE3 LYS 68 2HE LYS 68 20.774 -12.586 -6.850 422 HZ1 LYS 68 2HZ LYS 68 23.248 -12.172 -8.391 423 HZ3 LYS 68 1HZ LYS 68 21.815 -11.931 -9.125 424 H ASP 69 H ASP 69 17.706 -6.687 -6.831 425 HA ASP 69 HA ASP 69 19.352 -5.852 -4.753 426 HB3 ASP 69 2HB ASP 69 17.254 -4.062 -6.011 427 HD2 ASP 69 HD ASP 69 17.763 -2.559 -4.533 428 H ALA 70 H ALA 70 15.802 -5.200 -5.333 429 HA ALA 70 HA ALA 70 15.265 -4.240 -2.789 430 HB1 ALA 70 1HB ALA 70 12.866 -5.189 -3.544 431 HB2 ALA 70 2HB ALA 70 13.593 -3.744 -4.288 432 HB3 ALA 70 3HB ALA 70 13.709 -5.320 -5.106 433 H CYS 71 H CYS 71 15.603 -7.542 -4.051 434 HA CYS 71 HA CYS 71 14.263 -8.830 -1.953 435 HB3 CYS 71 2HB CYS 71 15.858 -10.780 -2.744 436 HG CYS 71 HG CYS 71 13.255 -10.707 -3.002 437 H LEU 72 H LEU 72 17.737 -8.002 -2.600 438 HA LEU 72 HA LEU 72 18.662 -9.101 -0.166 439 HB3 LEU 72 2HB LEU 72 20.711 -7.732 -0.734 440 HG LEU 72 HG LEU 72 20.321 -9.028 -3.299 441 HD11 LEU 72 1HD1 LEU 72 22.376 -9.893 -2.876 442 HD12 LEU 72 2HD1 LEU 72 22.403 -8.563 -1.693 443 HD13 LEU 72 3HD1 LEU 72 22.016 -10.217 -1.163 444 HD21 LEU 72 3HD2 LEU 72 19.633 -10.684 -0.855 445 HD22 LEU 72 1HD2 LEU 72 18.528 -10.245 -2.179 446 HD23 LEU 72 2HD2 LEU 72 19.920 -11.309 -2.497 447 H LYS 73 H LYS 73 17.702 -5.796 -1.248 448 HA LYS 73 HA LYS 73 18.467 -4.440 1.035 449 HB3 LYS 73 2HB LYS 73 16.214 -3.108 0.159 450 HG3 LYS 73 2HG LYS 73 19.106 -3.108 -0.796 451 HD3 LYS 73 2HD LYS 73 16.739 -1.587 -1.806 452 HE3 LYS 73 2HE LYS 73 18.528 -0.101 -0.317 453 HZ1 LYS 73 2HZ LYS 73 19.438 0.608 -2.962 454 HZ3 LYS 73 1HZ LYS 73 20.034 -0.819 -2.449 455 H ALA 74 H ALA 74 15.647 -6.516 0.366 456 HA ALA 74 HA ALA 74 14.188 -5.716 2.658 457 HB1 ALA 74 1HB ALA 74 12.925 -6.700 0.941 458 HB2 ALA 74 2HB ALA 74 14.100 -8.015 0.697 459 HB3 ALA 74 3HB ALA 74 13.054 -8.011 2.138 460 H VAL 75 H VAL 75 16.609 -8.277 1.924 461 HA VAL 75 HA VAL 75 16.340 -9.734 4.262 462 HB VAL 75 HB VAL 75 18.650 -9.198 2.402 463 HG11 VAL 75 1HG1 VAL 75 19.561 -11.373 3.549 464 HG12 VAL 75 2HG1 VAL 75 19.861 -9.782 4.289 465 HG13 VAL 75 3HG1 VAL 75 18.571 -10.831 4.926 466 HG21 VAL 75 3HG2 VAL 75 17.438 -11.892 2.698 467 HG22 VAL 75 1HG2 VAL 75 16.397 -10.640 1.977 468 HG23 VAL 75 2HG2 VAL 75 17.972 -11.023 1.239 469 H HIS 76 H HIS 76 18.376 -6.836 3.516 470 HA HIS 76 HA HIS 76 19.624 -6.753 6.001 471 HB3 HIS 76 2HB HIS 76 19.368 -4.110 5.001 472 HD1 HIS 76 1HD HIS 76 21.876 -4.173 3.110 473 HD2 HIS 76 2HD HIS 76 21.540 -6.253 6.736 474 HE1 HIS 76 1HE HIS 76 24.261 -4.603 3.910 475 H GLU 77 H GLU 77 16.617 -5.171 4.757 476 HA GLU 77 HA GLU 77 16.104 -3.706 7.032 477 HB3 GLU 77 2HB GLU 77 13.675 -3.812 6.173 478 HG3 GLU 77 2HG GLU 77 14.788 -2.996 3.725 479 HE2 GLU 77 HE GLU 77 13.216 -1.515 3.750 480 H LEU 78 H LEU 78 15.601 -7.138 6.272 481 HA LEU 78 HA LEU 78 13.901 -7.522 8.576 482 HB3 LEU 78 2HB LEU 78 15.085 -9.542 6.668 483 HG LEU 78 HG LEU 78 14.106 -10.494 8.776 484 HD11 LEU 78 1HD1 LEU 78 11.665 -9.032 7.779 485 HD12 LEU 78 2HD1 LEU 78 11.543 -10.464 8.829 486 HD13 LEU 78 3HD1 LEU 78 12.404 -9.013 9.399 487 HD21 LEU 78 3HD2 LEU 78 13.901 -12.212 7.379 488 HD22 LEU 78 1HD2 LEU 78 12.207 -11.717 7.146 489 HD23 LEU 78 2HD2 LEU 78 13.464 -11.149 6.020 490 H HIS 79 H HIS 79 17.305 -7.859 7.596 491 HA HIS 79 HA HIS 79 18.011 -9.445 9.839 492 HB3 HIS 79 2HB HIS 79 20.059 -7.790 8.453 493 HD1 HIS 79 1HD HIS 79 19.863 -9.883 11.022 494 HD2 HIS 79 2HD HIS 79 21.495 -10.544 7.215 495 HE1 HIS 79 1HE HIS 79 21.537 -11.792 11.283 496 H ASN 80 H ASN 80 18.217 -5.933 8.998 497 HA ASN 80 HA ASN 80 19.548 -5.152 11.265 498 HB3 ASN 80 2HB ASN 80 17.398 -3.616 9.712 499 HD21 ASN 80 1HD2 ASN 80 16.794 -1.971 10.892 500 HD22 ASN 80 2HD2 ASN 80 17.800 -0.954 11.869 501 H LEU 81 H LEU 81 16.046 -5.657 10.548 502 HA LEU 81 HA LEU 81 15.337 -4.849 13.249 503 HB3 LEU 81 2HB LEU 81 13.572 -5.725 10.961 504 HG LEU 81 HG LEU 81 12.173 -3.856 12.379 505 HD11 LEU 81 1HD1 LEU 81 12.050 -6.722 11.896 506 HD12 LEU 81 2HD1 LEU 81 11.281 -6.266 13.436 507 HD13 LEU 81 3HD1 LEU 81 10.752 -5.504 11.918 508 HD21 LEU 81 3HD2 LEU 81 13.683 -5.540 14.392 509 HD22 LEU 81 1HD2 LEU 81 13.684 -3.767 14.238 510 HD23 LEU 81 2HD2 LEU 81 12.207 -4.614 14.755 511 H GLY 82 H GLY 82 14.114 -7.576 11.212 512 HA2 GLY 82 1HA GLY 82 13.504 -9.659 11.887 513 HA3 GLY 82 2HA GLY 82 15.202 -9.753 12.308 514 H VAL 83 H VAL 83 12.315 -8.049 13.732 515 HA VAL 83 HA VAL 83 13.174 -9.072 16.338 516 HB VAL 83 HB VAL 83 11.815 -6.625 15.352 517 HG11 VAL 83 1HG1 VAL 83 10.814 -6.169 17.570 518 HG12 VAL 83 2HG1 VAL 83 10.056 -7.558 16.755 519 HG13 VAL 83 3HG1 VAL 83 11.218 -7.827 18.076 520 HG21 VAL 83 3HG2 VAL 83 14.155 -6.560 16.032 521 HG22 VAL 83 1HG2 VAL 83 13.163 -5.590 17.148 522 HG23 VAL 83 2HG2 VAL 83 13.731 -7.206 17.636 523 H LEU 84 H LEU 84 11.253 -9.992 13.816 524 HA LEU 84 HA LEU 84 9.144 -10.976 15.609 525 HB3 LEU 84 2HB LEU 84 8.238 -11.350 13.040 526 HG LEU 84 HG LEU 84 6.858 -10.412 14.834 527 HD11 LEU 84 1HD1 LEU 84 8.470 -7.878 14.420 528 HD12 LEU 84 2HD1 LEU 84 6.992 -8.016 15.404 529 HD13 LEU 84 3HD1 LEU 84 8.458 -8.912 15.869 530 HD21 LEU 84 3HD2 LEU 84 5.536 -9.897 13.126 531 HD22 LEU 84 1HD2 LEU 84 6.214 -8.252 13.175 532 HD23 LEU 84 2HD2 LEU 84 6.925 -9.476 12.095 533 H ASN 85 H ASN 85 11.867 -12.085 15.362 534 HA ASN 85 HA ASN 85 12.061 -14.145 13.612 535 HB3 ASN 85 2HB ASN 85 13.927 -13.530 15.068 536 HD21 ASN 85 1HD2 ASN 85 14.377 -15.237 17.416 537 HD22 ASN 85 2HD2 ASN 85 13.649 -14.440 18.772 538 H ASP 86 H ASP 86 9.878 -13.692 16.299 539 HA ASP 86 HA ASP 86 9.511 -16.303 17.111 540 HB3 ASP 86 2HB ASP 86 8.629 -14.130 18.167 541 HD2 ASP 86 HD ASP 86 6.387 -12.183 16.458 542 H PHE 87 H PHE 87 8.619 -14.563 14.199 543 HA PHE 87 HA PHE 87 6.513 -16.454 13.537 544 HB3 PHE 87 2HB PHE 87 6.631 -14.821 11.415 545 HD1 PHE 87 1HD PHE 87 4.276 -15.300 12.231 546 HD2 PHE 87 2HD PHE 87 6.788 -12.409 14.059 547 HE1 PHE 87 1HE PHE 87 2.268 -14.217 13.279 548 HE2 PHE 87 2HE PHE 87 4.780 -11.327 15.106 549 HZ PHE 87 HZ PHE 87 2.544 -12.244 14.703 550 H LEU 88 H LEU 88 9.921 -15.986 13.115 551 HA LEU 88 HA LEU 88 9.915 -17.590 10.671 552 HB3 LEU 88 2HB LEU 88 11.179 -15.380 10.919 553 HG LEU 88 HG LEU 88 12.315 -16.071 13.122 554 HD11 LEU 88 1HD1 LEU 88 13.247 -18.181 11.435 555 HD12 LEU 88 2HD1 LEU 88 14.642 -17.202 11.949 556 HD13 LEU 88 3HD1 LEU 88 13.554 -17.908 13.167 557 HD21 LEU 88 3HD2 LEU 88 12.900 -14.093 11.736 558 HD22 LEU 88 1HD2 LEU 88 14.283 -14.783 12.617 559 HD23 LEU 88 2HD2 LEU 88 14.094 -15.092 10.874 560 H LEU 89 H LEU 89 11.334 -19.484 10.532 561 HA LEU 89 HA LEU 89 11.013 -21.151 12.764 562 HB3 LEU 89 2HB LEU 89 11.026 -22.325 10.828 563 HG LEU 89 HG LEU 89 12.976 -20.341 9.824 564 HD11 LEU 89 1HD1 LEU 89 14.449 -21.667 8.818 565 HD12 LEU 89 2HD1 LEU 89 13.813 -23.003 9.808 566 HD13 LEU 89 3HD1 LEU 89 13.166 -22.719 8.174 567 HD21 LEU 89 3HD2 LEU 89 11.488 -21.681 7.788 568 HD22 LEU 89 1HD2 LEU 89 10.401 -21.342 9.156 569 HD23 LEU 89 2HD2 LEU 89 11.314 -20.016 8.396 570 HA PRO 90 HA PRO 90 14.523 -19.815 14.974 571 HB3 PRO 90 2HB PRO 90 13.375 -19.828 16.970 572 HG3 PRO 90 2HG PRO 90 11.395 -21.009 16.935 573 HD3 PRO 90 2HD PRO 90 10.910 -20.927 14.689 574 H ASP 91 H ASP 91 14.399 -23.009 16.278 575 HA ASP 91 HA ASP 91 17.058 -23.424 15.512 576 HB3 ASP 91 2HB ASP 91 15.860 -24.433 17.518 577 HD2 ASP 91 HD ASP 91 14.062 -27.402 15.532 578 H SER 92 H SER 92 13.915 -23.961 14.034 579 HA SER 92 HA SER 92 14.489 -26.160 12.463 580 HB3 SER 92 2HB SER 92 12.728 -24.534 10.970 581 HG SER 92 HG SER 92 11.576 -26.292 11.331 582 H LYS 93 H LYS 93 15.195 -22.673 12.101 583 HA LYS 93 HA LYS 93 15.995 -22.908 9.371 584 HB3 LYS 93 2HB LYS 93 15.082 -20.845 10.658 585 HG3 LYS 93 2HG LYS 93 17.488 -21.216 12.084 586 HD3 LYS 93 2HD LYS 93 17.714 -18.652 10.465 587 HE3 LYS 93 2HE LYS 93 18.920 -19.440 12.820 588 HZ1 LYS 93 2HZ LYS 93 20.625 -20.312 10.557 589 HZ3 LYS 93 1HZ LYS 93 20.215 -21.177 11.875 590 H ASP 94 H ASP 94 17.280 -24.153 12.182 591 HA ASP 94 HA ASP 94 19.962 -23.432 11.905 592 HB3 ASP 94 2HB ASP 94 18.811 -26.002 13.087 593 HD2 ASP 94 HD ASP 94 21.205 -24.303 15.217 594 H GLU 95 H GLU 95 17.878 -25.296 9.953 595 HA GLU 95 HA GLU 95 20.077 -26.968 9.025 596 HB3 GLU 95 2HB GLU 95 17.878 -28.040 9.812 597 HG3 GLU 95 2HG GLU 95 16.776 -27.461 7.084 598 HE2 GLU 95 HE GLU 95 14.859 -26.311 9.430 599 H ILE 96 H ILE 96 20.162 -24.251 8.321 600 HA ILE 96 HA ILE 96 19.429 -24.404 5.481 601 HB ILE 96 HB ILE 96 18.864 -22.103 5.466 602 HG13 ILE 96 2HG1 ILE 96 20.313 -22.045 8.020 603 HG21 ILE 96 1HG2 ILE 96 16.843 -22.123 6.671 604 HG22 ILE 96 2HG2 ILE 96 17.191 -23.830 6.307 605 HG23 ILE 96 3HG2 ILE 96 17.507 -23.185 7.936 606 HD11 ILE 96 3HD1 ILE 96 20.476 -20.753 5.613 607 HD12 ILE 96 1HD1 ILE 96 19.520 -19.575 6.545 608 HD13 ILE 96 2HD1 ILE 96 21.121 -20.086 7.133 609 H GLU 97 H GLU 97 21.022 -23.822 4.016 610 HA GLU 97 HA GLU 97 23.528 -22.975 5.246 611 HB3 GLU 97 2HB GLU 97 24.586 -24.291 3.251 612 HG3 GLU 97 2HG GLU 97 23.749 -26.529 4.692 613 HE2 GLU 97 HE GLU 97 25.737 -27.352 5.069 614 H ASP 98 H ASP 98 24.948 -21.653 3.842 615 HA ASP 98 HA ASP 98 23.559 -19.660 2.582 616 HB3 ASP 98 2HB ASP 98 25.677 -18.925 3.093 617 HD2 ASP 98 HD ASP 98 27.699 -21.323 4.446 618 H GLU 99 H GLU 99 24.998 -22.719 1.398 619 HA GLU 99 HA GLU 99 24.719 -22.007 -1.337 620 HB3 GLU 99 2HB GLU 99 24.961 -24.887 -0.652 621 HG3 GLU 99 2HG GLU 99 26.421 -22.839 -2.356 622 HE2 GLU 99 HE GLU 99 28.251 -24.052 -3.672 623 H LEU 100 H LEU 100 22.797 -23.666 1.153 624 HA LEU 100 HA LEU 100 21.005 -24.927 -0.622 625 HB3 LEU 100 2HB LEU 100 20.387 -24.084 2.198 626 HG LEU 100 HG LEU 100 18.570 -25.282 1.151 627 HD11 LEU 100 1HD1 LEU 100 19.264 -26.456 -0.667 628 HD12 LEU 100 2HD1 LEU 100 20.759 -27.018 0.119 629 HD13 LEU 100 3HD1 LEU 100 19.202 -27.790 0.509 630 HD21 LEU 100 3HD2 LEU 100 20.199 -26.839 3.152 631 HD22 LEU 100 1HD2 LEU 100 18.752 -25.838 3.416 632 HD23 LEU 100 2HD2 LEU 100 18.610 -27.407 2.587 633 H SER 101 H SER 101 21.634 -21.656 -0.049 634 HA SER 101 HA SER 101 19.174 -20.520 0.167 635 HB3 SER 101 2HB SER 101 21.314 -19.277 0.265 636 HG SER 101 HG SER 101 22.095 -20.441 -1.818 637 H ASP 102 H ASP 102 17.473 -20.022 -1.261 638 HA ASP 102 HA ASP 102 16.313 -19.933 -3.109 639 HB3 ASP 102 2HB ASP 102 18.647 -21.007 -4.739 640 HD2 ASP 102 HD ASP 102 18.562 -20.296 -6.850 Start of MODEL 8 1 H1 ILE 1 H ILE 1 34.851 -22.732 5.042 2 HA ILE 1 HA ILE 1 35.642 -21.181 7.317 3 HB ILE 1 HB ILE 1 36.844 -21.502 4.565 4 HG13 ILE 1 2HG1 ILE 1 37.022 -23.063 7.091 5 HG21 ILE 1 1HG2 ILE 1 37.729 -19.487 5.324 6 HG22 ILE 1 2HG2 ILE 1 37.773 -20.025 7.019 7 HG23 ILE 1 3HG2 ILE 1 38.933 -20.690 5.844 8 HD11 ILE 1 3HD1 ILE 1 36.310 -24.563 5.542 9 HD12 ILE 1 1HD1 ILE 1 36.698 -23.462 4.198 10 HD13 ILE 1 2HD1 ILE 1 37.962 -24.512 4.881 11 H SER 2 H SER 2 33.558 -19.897 7.302 12 HA SER 2 HA SER 2 32.376 -18.131 6.814 13 HB3 SER 2 2HB SER 2 35.041 -16.858 6.058 14 HG SER 2 HG SER 2 32.761 -15.723 7.433 15 H GLY 3 H GLY 3 31.354 -19.205 4.931 16 HA2 GLY 3 1HA GLY 3 32.411 -18.397 2.312 17 HA3 GLY 3 2HA GLY 3 31.219 -19.641 2.633 18 H GLY 4 H GLY 4 29.088 -18.809 3.722 19 HA2 GLY 4 1HA GLY 4 28.401 -16.060 3.196 20 HA3 GLY 4 2HA GLY 4 27.704 -17.186 2.049 21 H SER 5 H SER 5 28.346 -17.300 5.632 22 HA SER 5 HA SER 5 26.095 -18.804 6.161 23 HB3 SER 5 2HB SER 5 27.877 -18.720 7.774 24 HG SER 5 HG SER 5 27.739 -16.361 8.955 25 H SER 6 H SER 6 26.680 -15.241 6.188 26 HA SER 6 HA SER 6 24.192 -14.582 7.248 27 HB3 SER 6 2HB SER 6 25.231 -12.544 5.434 28 HG SER 6 HG SER 6 25.600 -12.535 8.273 29 H ILE 7 H ILE 7 25.356 -15.351 3.973 30 HA ILE 7 HA ILE 7 23.250 -14.227 2.524 31 HB ILE 7 HB ILE 7 25.058 -16.575 1.945 32 HG13 ILE 7 2HG1 ILE 7 26.548 -14.866 1.987 33 HG21 ILE 7 1HG2 ILE 7 23.303 -15.030 0.018 34 HG22 ILE 7 2HG2 ILE 7 24.428 -16.348 -0.384 35 HG23 ILE 7 3HG2 ILE 7 22.988 -16.679 0.608 36 HD11 ILE 7 3HD1 ILE 7 26.888 -13.887 -0.218 37 HD12 ILE 7 1HD1 ILE 7 26.291 -15.550 -0.436 38 HD13 ILE 7 2HD1 ILE 7 25.186 -14.171 -0.653 39 H SER 8 H SER 8 23.678 -17.451 4.088 40 HA SER 8 HA SER 8 21.640 -18.828 3.135 41 HB3 SER 8 2HB SER 8 21.335 -19.712 5.552 42 HG SER 8 HG SER 8 23.384 -19.964 3.818 43 H MET 9 H MET 9 21.437 -15.923 5.175 44 HA MET 9 HA MET 9 18.655 -16.308 5.695 45 HB3 MET 9 2HB MET 9 19.078 -13.760 6.470 46 HG3 MET 9 2HG MET 9 18.771 -15.776 7.987 47 HE1 MET 9 3HE MET 9 21.915 -17.317 9.997 48 HE2 MET 9 1HE MET 9 22.133 -15.559 9.825 49 HE3 MET 9 2HE MET 9 20.535 -16.220 10.242 50 H MET 10 H MET 10 20.717 -14.149 3.647 51 HA MET 10 HA MET 10 18.595 -12.665 2.642 52 HB3 MET 10 2HB MET 10 20.432 -12.417 0.675 53 HG3 MET 10 2HG MET 10 19.875 -10.774 2.598 54 HE1 MET 10 3HE MET 10 21.676 -9.597 5.273 55 HE2 MET 10 1HE MET 10 23.270 -10.218 4.783 56 HE3 MET 10 2HE MET 10 22.206 -9.448 3.581 57 H TYR 11 H TYR 11 20.611 -15.061 0.785 58 HA TYR 11 HA TYR 11 19.093 -15.354 -1.398 59 HB3 TYR 11 2HB TYR 11 19.847 -17.988 -0.395 60 HD1 TYR 11 1HD TYR 11 19.304 -16.393 -3.032 61 HD2 TYR 11 2HD TYR 11 22.875 -17.716 -1.080 62 HE1 TYR 11 1HE TYR 11 20.513 -16.457 -5.268 63 HE2 TYR 11 2HE TYR 11 24.070 -17.775 -3.324 64 HH TYR 11 HH TYR 11 22.822 -18.033 -6.021 65 H LYS 12 H LYS 12 18.271 -16.450 1.873 66 HA LYS 12 HA LYS 12 16.381 -18.376 1.222 67 HB3 LYS 12 2HB LYS 12 15.736 -16.772 3.587 68 HG3 LYS 12 2HG LYS 12 15.026 -19.118 3.297 69 HD3 LYS 12 2HD LYS 12 17.427 -20.560 3.755 70 HE3 LYS 12 2HE LYS 12 16.274 -20.366 0.979 71 HZ1 LYS 12 2HZ LYS 12 17.032 -22.472 0.958 72 HZ3 LYS 12 1HZ LYS 12 16.266 -22.876 2.338 73 H TYR 13 H TYR 13 16.053 -14.799 1.680 74 HA TYR 13 HA TYR 13 13.344 -14.579 1.406 75 HB3 TYR 13 2HB TYR 13 15.291 -12.742 -0.056 76 HD1 TYR 13 1HD TYR 13 13.244 -12.604 3.089 77 HD2 TYR 13 2HD TYR 13 13.932 -11.022 -0.826 78 HE1 TYR 13 1HE TYR 13 11.461 -10.834 3.483 79 HE2 TYR 13 2HE TYR 13 12.147 -9.258 -0.419 80 HH TYR 13 HH TYR 13 9.888 -9.470 1.844 81 H CYS 14 H CYS 14 15.841 -14.987 -1.155 82 HA CYS 14 HA CYS 14 14.090 -14.484 -3.287 83 HB3 CYS 14 2HB CYS 14 16.169 -16.263 -4.115 84 HG CYS 14 HG CYS 14 15.807 -14.762 -5.935 85 H SER 15 H SER 15 15.010 -17.367 -1.356 86 HA SER 15 HA SER 15 13.651 -19.153 -3.087 87 HB3 SER 15 2HB SER 15 14.073 -20.143 -0.361 88 HG SER 15 HG SER 15 14.645 -21.824 -1.542 89 H ARG 16 H ARG 16 12.731 -16.916 -0.621 90 HA ARG 16 HA ARG 16 10.593 -18.379 0.449 91 HB3 ARG 16 2HB ARG 16 9.903 -15.737 0.876 92 HG3 ARG 16 2HG ARG 16 11.772 -17.653 2.269 93 HD3 ARG 16 2HD ARG 16 11.558 -14.687 2.768 94 HE ARG 16 HE ARG 16 12.148 -16.390 5.113 95 HH11 ARG 16 2HH2 ARG 16 9.794 -14.307 3.479 96 HH12 ARG 16 1HH2 ARG 16 8.864 -14.023 4.911 97 HH22 ARG 16 1HH ARG 16 9.545 -15.038 6.973 98 H LEU 17 H LEU 17 11.036 -17.524 -2.667 99 HA LEU 17 HA LEU 17 8.829 -16.028 -3.413 100 HB3 LEU 17 2HB LEU 17 10.842 -16.629 -4.774 101 HG LEU 17 HG LEU 17 9.528 -19.288 -4.795 102 HD11 LEU 17 1HD1 LEU 17 10.904 -18.522 -7.336 103 HD12 LEU 17 2HD1 LEU 17 9.691 -19.786 -7.022 104 HD13 LEU 17 3HD1 LEU 17 9.194 -18.080 -7.117 105 HD21 LEU 17 3HD2 LEU 17 11.716 -19.015 -3.803 106 HD22 LEU 17 1HD2 LEU 17 11.844 -20.020 -5.268 107 HD23 LEU 17 2HD2 LEU 17 12.351 -18.315 -5.312 108 HA PRO 18 HA PRO 18 5.482 -18.728 -3.071 109 HB3 PRO 18 2HB PRO 18 3.974 -17.099 -3.683 110 HG3 PRO 18 2HG PRO 18 4.858 -15.404 -4.973 111 HD3 PRO 18 2HD PRO 18 7.070 -15.538 -4.363 112 H HIS 19 H HIS 19 7.197 -18.774 -6.061 113 HA HIS 19 HA HIS 19 5.936 -21.162 -6.955 114 HB3 HIS 19 2HB HIS 19 8.457 -20.800 -8.219 115 HD1 HIS 19 1HD HIS 19 6.360 -18.433 -9.866 116 HD2 HIS 19 2HD HIS 19 6.287 -22.606 -9.451 117 HE1 HIS 19 1HE HIS 19 4.890 -19.314 -11.757 118 H ASP 20 H ASP 20 7.922 -20.558 -4.353 119 HA ASP 20 HA ASP 20 9.488 -22.959 -4.711 120 HB3 ASP 20 2HB ASP 20 9.453 -20.964 -2.397 121 HD2 ASP 20 HD ASP 20 12.771 -23.118 -2.741 122 H GLU 21 H GLU 21 8.684 -24.888 -3.868 123 HA GLU 21 HA GLU 21 6.368 -24.782 -2.220 124 HB3 GLU 21 2HB GLU 21 8.018 -27.204 -3.063 125 HG3 GLU 21 2HG GLU 21 5.036 -27.042 -2.478 126 HE2 GLU 21 HE GLU 21 5.537 -30.167 -4.009 127 H PHE 22 H PHE 22 9.856 -25.185 -1.809 128 HA PHE 22 HA PHE 22 9.815 -26.486 0.669 129 HB3 PHE 22 2HB PHE 22 12.086 -24.836 0.597 130 HD1 PHE 22 2HD PHE 22 11.582 -27.082 -2.283 131 HD2 PHE 22 1HD PHE 22 13.055 -26.725 1.682 132 HE1 PHE 22 2HE PHE 22 12.724 -29.306 -2.506 133 HE2 PHE 22 1HE PHE 22 14.196 -28.949 1.458 134 HZ PHE 22 HZ PHE 22 14.017 -30.213 -0.633 135 H PHE 23 H PHE 23 8.643 -23.410 -0.185 136 HA PHE 23 HA PHE 23 8.898 -22.550 2.608 137 HB3 PHE 23 2HB PHE 23 8.567 -20.295 0.850 138 HD1 PHE 23 2HD PHE 23 9.117 -20.369 3.623 139 HD2 PHE 23 1HD PHE 23 11.885 -20.571 0.413 140 HE1 PHE 23 2HE PHE 23 10.916 -19.458 5.116 141 HE2 PHE 23 1HE PHE 23 13.685 -19.660 1.907 142 HZ PHE 23 HZ PHE 23 13.179 -19.114 4.241 143 H GLN 24 H GLN 24 7.035 -21.677 3.549 144 HA GLN 24 HA GLN 24 4.628 -22.437 2.410 145 HB3 GLN 24 2HB GLN 24 4.765 -22.257 4.793 146 HG3 GLN 24 2HG GLN 24 4.920 -19.599 5.526 147 HE21 GLN 24 1HE2 GLN 24 5.795 -19.994 7.399 148 HE22 GLN 24 2HE2 GLN 24 7.193 -20.960 7.731 149 HA PRO 25 HA PRO 25 3.550 -19.011 -0.022 150 HB3 PRO 25 2HB PRO 25 1.752 -20.113 -0.944 151 HG3 PRO 25 2HG PRO 25 0.909 -21.829 0.348 152 HD3 PRO 25 2HD PRO 25 2.765 -22.343 1.604 153 H LYS 26 H LYS 26 4.552 -18.139 2.330 154 HA LYS 26 HA LYS 26 2.573 -16.226 3.289 155 HB3 LYS 26 2HB LYS 26 4.997 -15.935 4.698 156 HG3 LYS 26 2HG LYS 26 2.456 -15.993 5.397 157 HD3 LYS 26 2HD LYS 26 3.020 -18.807 4.929 158 HE3 LYS 26 2HE LYS 26 2.053 -18.120 7.745 159 HZ1 LYS 26 2HZ LYS 26 1.218 -20.199 6.655 160 HZ3 LYS 26 1HZ LYS 26 2.083 -20.494 8.003 161 HA PRO 27 HA PRO 27 6.020 -13.440 1.725 162 HB3 PRO 27 2HB PRO 27 8.152 -13.948 2.431 163 HG3 PRO 27 2HG PRO 27 8.478 -16.159 2.999 164 HD3 PRO 27 2HD PRO 27 6.321 -16.772 3.508 165 H GLU 28 H GLU 28 6.279 -12.321 -0.237 166 HA GLU 28 HA GLU 28 5.883 -14.021 -2.545 167 HB3 GLU 28 2HB GLU 28 4.228 -11.827 -3.092 168 HG3 GLU 28 2HG GLU 28 3.234 -14.450 -1.914 169 HE2 GLU 28 HE GLU 28 1.592 -15.117 -3.695 170 H PHE 29 H PHE 29 6.868 -13.217 -4.439 171 HA PHE 29 HA PHE 29 8.020 -10.537 -4.233 172 HB3 PHE 29 2HB PHE 29 9.473 -12.808 -3.737 173 HD1 PHE 29 1HD PHE 29 8.130 -14.356 -5.560 174 HD2 PHE 29 2HD PHE 29 11.475 -11.868 -6.357 175 HE1 PHE 29 1HE PHE 29 8.694 -15.758 -7.564 176 HE2 PHE 29 2HE PHE 29 12.040 -13.271 -8.360 177 HZ PHE 29 HZ PHE 29 10.643 -15.198 -8.940 178 H GLN 30 H GLN 30 8.116 -9.398 -6.184 179 HA GLN 30 HA GLN 30 7.522 -10.879 -8.587 180 HB3 GLN 30 2HB GLN 30 5.923 -8.440 -8.561 181 HG3 GLN 30 2HG GLN 30 4.501 -11.018 -8.522 182 HE21 GLN 30 1HE2 GLN 30 2.720 -9.824 -8.908 183 HE22 GLN 30 2HE2 GLN 30 2.433 -8.901 -10.345 184 H PHE 31 H PHE 31 8.329 -9.861 -10.494 185 HA PHE 31 HA PHE 31 9.923 -7.459 -9.934 186 HB3 PHE 31 2HB PHE 31 11.050 -9.739 -10.479 187 HD1 PHE 31 2HD PHE 31 9.647 -11.534 -11.347 188 HD2 PHE 31 1HD PHE 31 10.847 -8.312 -13.833 189 HE1 PHE 31 2HE PHE 31 8.975 -12.850 -13.376 190 HE2 PHE 31 1HE PHE 31 10.175 -9.627 -15.863 191 HZ PHE 31 HZ PHE 31 9.247 -11.880 -15.610 192 H LYS 32 H LYS 32 9.677 -5.677 -11.258 193 HA LYS 32 HA LYS 32 7.654 -5.970 -13.360 194 HB3 LYS 32 2HB LYS 32 8.208 -3.946 -11.311 195 HG3 LYS 32 2HG LYS 32 7.858 -3.181 -14.234 196 HD3 LYS 32 2HD LYS 32 7.160 -0.940 -13.486 197 HE3 LYS 32 2HE LYS 32 5.200 -2.507 -11.902 198 HZ1 LYS 32 2HZ LYS 32 5.024 -0.307 -13.309 199 HZ3 LYS 32 1HZ LYS 32 3.749 -1.316 -13.220 200 HA PRO 33 HA PRO 33 11.057 -5.428 -16.052 201 HB3 PRO 33 2HB PRO 33 10.446 -7.227 -17.355 202 HG3 PRO 33 2HG PRO 33 8.291 -7.975 -17.013 203 HD3 PRO 33 2HD PRO 33 7.931 -7.218 -14.873 204 H VAL 34 H VAL 34 11.860 -3.439 -16.257 205 HA VAL 34 HA VAL 34 10.050 -1.568 -17.625 206 HB VAL 34 HB VAL 34 12.197 -0.918 -15.600 207 HG11 VAL 34 1HG1 VAL 34 10.132 0.708 -17.083 208 HG12 VAL 34 2HG1 VAL 34 10.796 1.257 -15.526 209 HG13 VAL 34 3HG1 VAL 34 11.880 0.995 -16.914 210 HG21 VAL 34 3HG2 VAL 34 9.333 -1.664 -15.262 211 HG22 VAL 34 1HG2 VAL 34 10.715 -1.876 -14.159 212 HG23 VAL 34 2HG2 VAL 34 9.926 -0.286 -14.305 213 H ASP 35 H ASP 35 11.354 0.251 -18.760 214 HA ASP 35 HA ASP 35 12.964 -0.982 -20.641 215 HB3 ASP 35 2HB ASP 35 13.618 1.707 -20.832 216 HD2 ASP 35 HD ASP 35 12.117 0.841 -23.822 217 H GLU 36 H GLU 36 15.315 -0.201 -21.147 218 HA GLU 36 HA GLU 36 16.921 -0.753 -18.964 219 HB3 GLU 36 2HB GLU 36 17.603 -1.160 -21.301 220 HG3 GLU 36 2HG GLU 36 16.983 1.697 -21.546 221 HE2 GLU 36 HE GLU 36 20.499 1.322 -23.411 222 H PHE 37 H PHE 37 15.257 2.123 -19.820 223 HA PHE 37 HA PHE 37 17.206 3.921 -18.704 224 HB3 PHE 37 2HB PHE 37 14.322 4.687 -19.081 225 HD1 PHE 37 1HD PHE 37 17.530 5.095 -20.959 226 HD2 PHE 37 2HD PHE 37 14.383 6.969 -18.815 227 HE1 PHE 37 1HE PHE 37 18.547 7.341 -21.430 228 HE2 PHE 37 2HE PHE 37 15.400 9.215 -19.287 229 HZ PHE 37 HZ PHE 37 17.470 9.374 -20.588 230 H GLY 38 H GLY 38 15.679 1.605 -17.164 231 HA2 GLY 38 1HA GLY 38 15.500 3.040 -14.698 232 HA3 GLY 38 2HA GLY 38 13.917 2.611 -15.316 233 H GLY 39 H GLY 39 16.827 0.654 -16.006 234 HA2 GLY 39 1HA GLY 39 17.102 -1.584 -15.696 235 HA3 GLY 39 2HA GLY 39 17.080 -1.092 -14.015 236 H THR 40 H THR 40 15.979 -2.767 -13.017 237 HA THR 40 HA THR 40 13.231 -3.214 -13.973 238 HB THR 40 HB THR 40 15.384 -5.210 -13.128 239 HG1 THR 40 1HG THR 40 13.470 -4.934 -15.338 240 HG21 THR 40 3HG2 THR 40 13.581 -6.295 -12.106 241 HG22 THR 40 1HG2 THR 40 12.376 -5.419 -13.078 242 HG23 THR 40 2HG2 THR 40 13.277 -6.777 -13.791 243 H ILE 41 H ILE 41 11.623 -3.360 -12.433 244 HA ILE 41 HA ILE 41 12.502 -2.538 -9.767 245 HB ILE 41 HB ILE 41 9.725 -2.417 -10.934 246 HG13 ILE 41 2HG1 ILE 41 11.451 -1.150 -12.294 247 HG21 ILE 41 1HG2 ILE 41 9.354 -2.094 -8.723 248 HG22 ILE 41 2HG2 ILE 41 11.015 -1.539 -8.405 249 HG23 ILE 41 3HG2 ILE 41 9.833 -0.431 -9.140 250 HD11 ILE 41 3HD1 ILE 41 9.013 -0.539 -12.210 251 HD12 ILE 41 1HD1 ILE 41 9.364 0.535 -10.834 252 HD13 ILE 41 2HD1 ILE 41 10.072 0.875 -12.431 253 H CYS 42 H CYS 42 11.804 -3.647 -7.890 254 HA CYS 42 HA CYS 42 10.609 -6.261 -8.463 255 HB3 CYS 42 2HB CYS 42 12.968 -5.577 -6.711 256 HG CYS 42 HG CYS 42 12.992 -7.782 -5.445 257 H ARG 43 H ARG 43 8.777 -6.697 -7.242 258 HA ARG 43 HA ARG 43 8.244 -4.788 -5.111 259 HB3 ARG 43 2HB ARG 43 6.212 -6.412 -6.723 260 HG3 ARG 43 2HG ARG 43 5.106 -4.012 -5.688 261 HD3 ARG 43 2HD ARG 43 4.875 -6.889 -4.675 262 HE ARG 43 HE ARG 43 3.605 -5.683 -3.091 263 HH11 ARG 43 2HH2 ARG 43 2.832 -4.561 -6.362 264 HH12 ARG 43 1HH2 ARG 43 1.454 -3.642 -5.855 265 HH22 ARG 43 1HH ARG 43 0.858 -3.603 -3.535 266 H ILE 44 H ILE 44 8.665 -5.761 -3.144 267 HA ILE 44 HA ILE 44 7.810 -8.558 -2.860 268 HB ILE 44 HB ILE 44 10.362 -7.547 -2.639 269 HG13 ILE 44 2HG1 ILE 44 10.963 -9.734 -1.991 270 HG21 ILE 44 1HG2 ILE 44 9.495 -6.473 -0.464 271 HG22 ILE 44 2HG2 ILE 44 9.509 -8.129 0.190 272 HG23 ILE 44 3HG2 ILE 44 11.017 -7.395 -0.407 273 HD11 ILE 44 3HD1 ILE 44 9.799 -10.206 0.009 274 HD12 ILE 44 1HD1 ILE 44 8.222 -9.777 -0.696 275 HD13 ILE 44 2HD1 ILE 44 9.022 -11.296 -1.164 276 H THR 45 H THR 45 6.454 -9.071 -1.165 277 HA THR 45 HA THR 45 5.992 -7.042 0.876 278 HB THR 45 HB THR 45 4.288 -6.317 -0.591 279 HG1 THR 45 1HG THR 45 3.439 -7.211 1.471 280 HG21 THR 45 3HG2 THR 45 4.426 -9.135 -1.586 281 HG22 THR 45 1HG2 THR 45 2.792 -8.431 -1.537 282 HG23 THR 45 2HG2 THR 45 4.076 -7.638 -2.482 283 H LEU 46 H LEU 46 6.176 -8.014 2.784 284 HA LEU 46 HA LEU 46 5.889 -10.884 2.888 285 HB3 LEU 46 2HB LEU 46 6.465 -10.229 5.400 286 HG LEU 46 HG LEU 46 8.613 -9.913 3.294 287 HD11 LEU 46 1HD1 LEU 46 8.992 -9.446 5.823 288 HD12 LEU 46 2HD1 LEU 46 8.937 -11.219 5.980 289 HD13 LEU 46 3HD1 LEU 46 10.155 -10.456 4.932 290 HD21 LEU 46 3HD2 LEU 46 7.577 -11.894 2.614 291 HD22 LEU 46 1HD2 LEU 46 8.904 -12.438 3.667 292 HD23 LEU 46 2HD2 LEU 46 7.236 -12.405 4.284 293 HA PRO 47 HA PRO 47 1.965 -10.930 4.685 294 HB3 PRO 47 2HB PRO 47 1.906 -13.230 4.771 295 HG3 PRO 47 2HG PRO 47 3.976 -14.244 4.864 296 HD3 PRO 47 2HD PRO 47 5.276 -12.606 3.910 297 H ALA 48 H ALA 48 0.557 -10.841 6.709 298 HA ALA 48 HA ALA 48 1.346 -8.601 8.129 299 HB1 ALA 48 1HB ALA 48 -0.981 -9.575 7.814 300 HB2 ALA 48 2HB ALA 48 -0.573 -10.758 9.079 301 HB3 ALA 48 3HB ALA 48 -0.607 -9.021 9.464 302 H ASN 49 H ASN 49 2.378 -11.906 8.387 303 HA ASN 49 HA ASN 49 2.934 -11.900 11.131 304 HB3 ASN 49 2HB ASN 49 4.432 -13.868 10.521 305 HD21 ASN 49 1HD2 ASN 49 3.450 -15.848 9.144 306 HD22 ASN 49 2HD2 ASN 49 1.766 -16.129 9.433 307 H ALA 50 H ALA 50 4.317 -10.312 8.391 308 HA ALA 50 HA ALA 50 6.827 -9.884 9.863 309 HB1 ALA 50 1HB ALA 50 6.396 -10.937 7.249 310 HB2 ALA 50 2HB ALA 50 7.076 -9.303 7.052 311 HB3 ALA 50 3HB ALA 50 7.944 -10.518 8.022 312 HA PRO 51 HA PRO 51 5.470 -5.756 9.838 313 HB3 PRO 51 2HB PRO 51 6.441 -5.355 11.888 314 HG3 PRO 51 2HG PRO 51 8.063 -6.876 12.500 315 HD3 PRO 51 2HD PRO 51 7.415 -8.690 11.244 316 H ILE 52 H ILE 52 8.928 -5.554 9.188 317 HA ILE 52 HA ILE 52 8.194 -4.058 6.774 318 HB ILE 52 HB ILE 52 10.735 -3.413 7.062 319 HG13 ILE 52 2HG1 ILE 52 9.911 -4.070 9.905 320 HG21 ILE 52 1HG2 ILE 52 8.206 -2.269 7.885 321 HG22 ILE 52 2HG2 ILE 52 9.532 -1.723 8.938 322 HG23 ILE 52 3HG2 ILE 52 9.638 -1.486 7.177 323 HD11 ILE 52 3HD1 ILE 52 10.697 -6.065 8.693 324 HD12 ILE 52 1HD1 ILE 52 12.109 -5.164 8.088 325 HD13 ILE 52 2HD1 ILE 52 11.955 -5.515 9.826 326 H SER 53 H SER 53 9.816 -4.320 4.916 327 HA SER 53 HA SER 53 11.616 -6.064 4.441 328 HB3 SER 53 2HB SER 53 10.121 -8.191 3.677 329 HG SER 53 HG SER 53 10.814 -7.928 6.460 330 H GLU 54 H GLU 54 8.614 -4.602 3.576 331 HA GLU 54 HA GLU 54 8.460 -5.431 0.916 332 HB3 GLU 54 2HB GLU 54 7.190 -3.041 0.845 333 HG3 GLU 54 2HG GLU 54 6.322 -5.625 2.205 334 HE2 GLU 54 HE GLU 54 4.224 -5.640 2.937 335 H ILE 55 H ILE 55 9.356 -4.604 -0.988 336 HA ILE 55 HA ILE 55 10.877 -2.143 -0.825 337 HB ILE 55 HB ILE 55 12.195 -4.694 -1.746 338 HG13 ILE 55 2HG1 ILE 55 13.369 -4.842 0.296 339 HG21 ILE 55 1HG2 ILE 55 13.238 -2.946 -2.863 340 HG22 ILE 55 2HG2 ILE 55 13.062 -1.825 -1.492 341 HG23 ILE 55 3HG2 ILE 55 14.247 -3.150 -1.411 342 HD11 ILE 55 3HD1 ILE 55 12.476 -3.023 2.116 343 HD12 ILE 55 1HD1 ILE 55 13.951 -2.783 1.149 344 HD13 ILE 55 2HD1 ILE 55 12.422 -2.027 0.642 345 H GLU 56 H GLU 56 10.040 -0.971 -2.460 346 HA GLU 56 HA GLU 56 9.604 -2.413 -4.956 347 HB3 GLU 56 2HB GLU 56 7.686 -0.670 -5.298 348 HG3 GLU 56 2HG GLU 56 7.637 -3.057 -3.428 349 HE2 GLU 56 HE GLU 56 5.019 -2.590 -1.932 350 H SER 57 H SER 57 11.179 -1.690 -6.330 351 HA SER 57 HA SER 57 11.247 0.712 -7.428 352 HB3 SER 57 2HB SER 57 13.570 1.335 -5.916 353 HG SER 57 HG SER 57 11.284 2.733 -5.161 354 H SER 58 H SER 58 12.899 0.804 -9.048 355 HA SER 58 HA SER 58 14.244 -1.655 -9.407 356 HB3 SER 58 2HB SER 58 13.556 -0.743 -11.437 357 HG SER 58 HG SER 58 14.504 1.813 -10.455 358 H LEU 59 H LEU 59 16.712 -1.479 -10.212 359 HA LEU 59 HA LEU 59 18.346 0.507 -9.145 360 HB3 LEU 59 2HB LEU 59 18.240 -1.970 -7.421 361 HG LEU 59 HG LEU 59 19.896 0.537 -7.321 362 HD11 LEU 59 1HD1 LEU 59 20.036 -0.920 -4.833 363 HD12 LEU 59 2HD1 LEU 59 19.733 0.810 -5.125 364 HD13 LEU 59 3HD1 LEU 59 18.378 -0.343 -5.129 365 HD21 LEU 59 3HD2 LEU 59 20.552 -1.935 -8.107 366 HD22 LEU 59 1HD2 LEU 59 21.695 -0.842 -7.290 367 HD23 LEU 59 2HD2 LEU 59 20.855 -2.108 -6.361 368 H LEU 60 H LEU 60 17.805 -2.880 -10.131 369 HA LEU 60 HA LEU 60 20.491 -2.844 -11.320 370 HB3 LEU 60 2HB LEU 60 19.888 -5.428 -11.395 371 HG LEU 60 HG LEU 60 21.215 -5.853 -9.554 372 HD11 LEU 60 1HD1 LEU 60 23.039 -4.354 -9.630 373 HD12 LEU 60 2HD1 LEU 60 22.274 -4.275 -11.235 374 HD13 LEU 60 3HD1 LEU 60 21.993 -2.976 -10.051 375 HD21 LEU 60 3HD2 LEU 60 21.361 -3.753 -7.803 376 HD22 LEU 60 1HD2 LEU 60 19.650 -3.710 -8.292 377 HD23 LEU 60 2HD2 LEU 60 20.340 -5.197 -7.601 378 HA PRO 61 HA PRO 61 18.513 -2.862 -15.160 379 HB3 PRO 61 2HB PRO 61 20.382 -2.005 -16.199 380 HG3 PRO 61 2HG PRO 61 22.355 -2.327 -15.049 381 HD3 PRO 61 2HD PRO 61 21.547 -2.560 -12.909 382 H SER 62 H SER 62 19.173 -5.534 -13.469 383 HA SER 62 HA SER 62 18.045 -7.170 -15.605 384 HB3 SER 62 2HB SER 62 19.654 -8.722 -15.279 385 HG SER 62 HG SER 62 20.720 -6.474 -14.411 386 H THR 63 H THR 63 16.426 -8.758 -14.942 387 HA THR 63 HA THR 63 14.805 -7.828 -12.788 388 HB THR 63 HB THR 63 13.331 -9.679 -13.574 389 HG1 THR 63 1HG THR 63 15.405 -10.261 -15.508 390 HG21 THR 63 3HG2 THR 63 13.866 -9.203 -16.246 391 HG22 THR 63 1HG2 THR 63 12.890 -8.121 -15.223 392 HG23 THR 63 2HG2 THR 63 14.617 -7.780 -15.485 393 H GLU 64 H GLU 64 16.658 -10.895 -13.360 394 HA GLU 64 HA GLU 64 16.059 -12.037 -10.960 395 HB3 GLU 64 2HB GLU 64 18.711 -12.815 -11.502 396 HG3 GLU 64 2HG GLU 64 15.949 -13.811 -12.135 397 HE2 GLU 64 HE GLU 64 16.772 -15.867 -14.778 398 H ALA 65 H ALA 65 18.466 -9.521 -11.769 399 HA ALA 65 HA ALA 65 19.705 -9.661 -9.181 400 HB1 ALA 65 1HB ALA 65 20.741 -8.996 -11.474 401 HB2 ALA 65 2HB ALA 65 19.977 -7.413 -11.188 402 HB3 ALA 65 3HB ALA 65 21.183 -8.041 -10.038 403 H ALA 66 H ALA 66 17.533 -7.370 -10.974 404 HA ALA 66 HA ALA 66 17.259 -5.458 -9.050 405 HB1 ALA 66 1HB ALA 66 14.994 -5.092 -10.101 406 HB2 ALA 66 2HB ALA 66 16.331 -5.217 -11.269 407 HB3 ALA 66 3HB ALA 66 15.238 -6.599 -11.017 408 H LYS 67 H LYS 67 15.685 -8.682 -9.282 409 HA LYS 67 HA LYS 67 13.923 -8.224 -7.119 410 HB3 LYS 67 2HB LYS 67 13.501 -9.881 -8.882 411 HG3 LYS 67 2HG LYS 67 16.053 -11.054 -7.769 412 HD3 LYS 67 2HD LYS 67 14.024 -12.748 -9.269 413 HE3 LYS 67 2HE LYS 67 16.341 -13.519 -7.435 414 HZ1 LYS 67 2HZ LYS 67 15.084 -15.168 -9.534 415 HZ3 LYS 67 1HZ LYS 67 14.415 -15.109 -8.050 416 H LYS 68 H LYS 68 17.271 -9.433 -7.458 417 HA LYS 68 HA LYS 68 17.464 -10.435 -4.832 418 HB3 LYS 68 2HB LYS 68 19.139 -10.149 -7.167 419 HG3 LYS 68 2HG LYS 68 20.376 -9.488 -4.454 420 HD3 LYS 68 2HD LYS 68 21.563 -10.504 -7.052 421 HE3 LYS 68 2HE LYS 68 23.797 -9.717 -5.831 422 HZ1 LYS 68 2HZ LYS 68 23.536 -7.557 -7.101 423 HZ3 LYS 68 1HZ LYS 68 22.019 -8.012 -7.480 424 H ASP 69 H ASP 69 17.879 -7.215 -6.323 425 HA ASP 69 HA ASP 69 19.236 -6.018 -4.261 426 HB3 ASP 69 2HB ASP 69 17.045 -4.686 -5.909 427 HD2 ASP 69 HD ASP 69 17.764 -2.171 -4.225 428 H ALA 70 H ALA 70 15.675 -5.735 -5.037 429 HA ALA 70 HA ALA 70 14.940 -4.590 -2.627 430 HB1 ALA 70 1HB ALA 70 12.677 -5.857 -3.385 431 HB2 ALA 70 2HB ALA 70 13.282 -4.394 -4.197 432 HB3 ALA 70 3HB ALA 70 13.605 -5.999 -4.896 433 H CYS 71 H CYS 71 15.355 -8.019 -3.605 434 HA CYS 71 HA CYS 71 14.141 -9.133 -1.359 435 HB3 CYS 71 2HB CYS 71 15.770 -11.102 -1.975 436 HG CYS 71 HG CYS 71 14.033 -12.172 -3.233 437 H LEU 72 H LEU 72 17.556 -8.189 -2.128 438 HA LEU 72 HA LEU 72 18.583 -9.048 0.357 439 HB3 LEU 72 2HB LEU 72 20.487 -7.456 -0.385 440 HG LEU 72 HG LEU 72 19.955 -9.503 -2.508 441 HD11 LEU 72 1HD1 LEU 72 22.509 -9.673 -1.209 442 HD12 LEU 72 2HD1 LEU 72 22.122 -9.246 -2.892 443 HD13 LEU 72 3HD1 LEU 72 22.171 -7.980 -1.642 444 HD21 LEU 72 3HD2 LEU 72 19.188 -10.802 -0.739 445 HD22 LEU 72 1HD2 LEU 72 20.921 -11.203 -0.815 446 HD23 LEU 72 2HD2 LEU 72 20.323 -10.074 0.424 447 H LYS 73 H LYS 73 17.466 -5.865 -0.940 448 HA LYS 73 HA LYS 73 18.132 -4.386 1.325 449 HB3 LYS 73 2HB LYS 73 15.927 -3.899 -0.700 450 HG3 LYS 73 2HG LYS 73 16.310 -2.530 1.633 451 HD3 LYS 73 2HD LYS 73 18.085 -1.190 -0.464 452 HE3 LYS 73 2HE LYS 73 18.473 0.255 1.782 453 HZ1 LYS 73 2HZ LYS 73 16.030 0.911 0.304 454 HZ3 LYS 73 1HZ LYS 73 17.413 0.827 -0.551 455 H ALA 74 H ALA 74 15.330 -6.453 0.525 456 HA ALA 74 HA ALA 74 13.732 -5.568 2.683 457 HB1 ALA 74 1HB ALA 74 12.698 -6.624 0.792 458 HB2 ALA 74 2HB ALA 74 13.749 -8.054 0.934 459 HB3 ALA 74 3HB ALA 74 12.506 -7.738 2.167 460 H VAL 75 H VAL 75 16.089 -8.261 2.198 461 HA VAL 75 HA VAL 75 15.646 -9.508 4.649 462 HB VAL 75 HB VAL 75 18.131 -9.337 2.932 463 HG11 VAL 75 1HG1 VAL 75 17.918 -11.817 4.335 464 HG12 VAL 75 2HG1 VAL 75 19.186 -10.573 4.455 465 HG13 VAL 75 3HG1 VAL 75 17.759 -10.496 5.517 466 HG21 VAL 75 3HG2 VAL 75 15.598 -10.522 2.434 467 HG22 VAL 75 1HG2 VAL 75 17.093 -10.671 1.480 468 HG23 VAL 75 2HG2 VAL 75 16.739 -11.845 2.770 469 H HIS 76 H HIS 76 17.951 -6.895 3.665 470 HA HIS 76 HA HIS 76 19.175 -6.703 6.164 471 HB3 HIS 76 2HB HIS 76 19.344 -4.177 5.009 472 HD1 HIS 76 1HD HIS 76 21.506 -5.267 2.722 473 HD2 HIS 76 2HD HIS 76 21.332 -6.148 6.819 474 HE1 HIS 76 1HE HIS 76 23.857 -5.995 3.398 475 H GLU 77 H GLU 77 16.306 -5.072 4.712 476 HA GLU 77 HA GLU 77 15.939 -3.281 6.797 477 HB3 GLU 77 2HB GLU 77 14.586 -4.060 4.373 478 HG3 GLU 77 2HG GLU 77 12.845 -3.807 6.862 479 HE2 GLU 77 HE GLU 77 12.318 -4.424 3.538 480 H LEU 78 H LEU 78 15.188 -6.718 6.429 481 HA LEU 78 HA LEU 78 13.413 -6.680 8.722 482 HB3 LEU 78 2HB LEU 78 14.346 -8.904 6.902 483 HG LEU 78 HG LEU 78 12.317 -10.110 7.750 484 HD11 LEU 78 1HD1 LEU 78 14.137 -9.860 10.093 485 HD12 LEU 78 2HD1 LEU 78 13.550 -11.306 9.238 486 HD13 LEU 78 3HD1 LEU 78 14.857 -10.323 8.533 487 HD21 LEU 78 3HD2 LEU 78 11.156 -8.238 8.786 488 HD22 LEU 78 1HD2 LEU 78 11.445 -9.533 9.972 489 HD23 LEU 78 2HD2 LEU 78 12.459 -8.069 9.987 490 H HIS 79 H HIS 79 16.696 -7.798 7.751 491 HA HIS 79 HA HIS 79 17.271 -9.148 10.106 492 HB3 HIS 79 2HB HIS 79 19.448 -7.706 8.666 493 HD1 HIS 79 1HD HIS 79 18.202 -11.295 9.287 494 HD2 HIS 79 2HD HIS 79 21.637 -8.925 9.722 495 HE1 HIS 79 1HE HIS 79 20.002 -12.817 10.265 496 H ASN 80 H ASN 80 17.740 -5.695 9.145 497 HA ASN 80 HA ASN 80 19.133 -4.904 11.353 498 HB3 ASN 80 2HB ASN 80 17.111 -3.465 9.576 499 HD21 ASN 80 1HD2 ASN 80 19.843 -1.758 10.459 500 HD22 ASN 80 2HD2 ASN 80 19.177 -0.696 11.655 501 H LEU 81 H LEU 81 15.697 -5.672 10.872 502 HA LEU 81 HA LEU 81 15.021 -4.560 13.485 503 HB3 LEU 81 2HB LEU 81 13.020 -5.822 11.672 504 HG LEU 81 HG LEU 81 12.686 -3.109 12.856 505 HD11 LEU 81 1HD1 LEU 81 10.949 -5.438 12.103 506 HD12 LEU 81 2HD1 LEU 81 10.357 -4.220 13.258 507 HD13 LEU 81 3HD1 LEU 81 10.842 -3.730 11.616 508 HD21 LEU 81 3HD2 LEU 81 11.727 -4.375 14.939 509 HD22 LEU 81 1HD2 LEU 81 12.908 -5.623 14.474 510 HD23 LEU 81 2HD2 LEU 81 13.458 -3.971 14.844 511 H GLY 82 H GLY 82 13.885 -7.518 11.732 512 HA2 GLY 82 1HA GLY 82 13.680 -9.649 12.413 513 HA3 GLY 82 2HA GLY 82 15.142 -9.406 13.347 514 H VAL 83 H VAL 83 11.696 -8.230 13.503 515 HA VAL 83 HA VAL 83 11.809 -8.677 16.393 516 HB VAL 83 HB VAL 83 11.207 -6.438 15.385 517 HG11 VAL 83 1HG1 VAL 83 8.598 -7.842 14.720 518 HG12 VAL 83 2HG1 VAL 83 8.967 -6.115 14.509 519 HG13 VAL 83 3HG1 VAL 83 9.817 -7.332 13.528 520 HG21 VAL 83 3HG2 VAL 83 8.896 -6.564 16.885 521 HG22 VAL 83 1HG2 VAL 83 9.838 -7.942 17.504 522 HG23 VAL 83 2HG2 VAL 83 10.536 -6.306 17.524 523 H LEU 84 H LEU 84 11.261 -10.525 13.800 524 HA LEU 84 HA LEU 84 8.973 -11.850 15.077 525 HB3 LEU 84 2HB LEU 84 8.527 -10.617 12.872 526 HG LEU 84 HG LEU 84 9.771 -13.134 11.729 527 HD11 LEU 84 1HD1 LEU 84 7.601 -12.242 10.725 528 HD12 LEU 84 2HD1 LEU 84 8.555 -10.836 10.197 529 HD13 LEU 84 3HD1 LEU 84 8.980 -12.465 9.621 530 HD21 LEU 84 3HD2 LEU 84 11.591 -11.711 12.184 531 HD22 LEU 84 1HD2 LEU 84 11.212 -11.460 10.464 532 HD23 LEU 84 2HD2 LEU 84 10.697 -10.260 11.674 533 H ASN 85 H ASN 85 11.980 -12.073 15.387 534 HA ASN 85 HA ASN 85 12.982 -14.196 14.020 535 HB3 ASN 85 2HB ASN 85 13.900 -14.433 16.730 536 HD21 ASN 85 1HD2 ASN 85 15.483 -15.489 15.598 537 HD22 ASN 85 2HD2 ASN 85 16.688 -14.689 14.645 538 H ASP 86 H ASP 86 10.407 -14.044 16.369 539 HA ASP 86 HA ASP 86 10.723 -16.695 17.328 540 HB3 ASP 86 2HB ASP 86 8.584 -16.294 18.462 541 HD2 ASP 86 HD ASP 86 9.682 -15.794 20.340 542 H PHE 87 H PHE 87 9.287 -15.061 14.574 543 HA PHE 87 HA PHE 87 7.500 -17.286 14.008 544 HB3 PHE 87 2HB PHE 87 7.687 -15.234 11.946 545 HD1 PHE 87 2HD PHE 87 5.823 -17.184 11.809 546 HD2 PHE 87 1HD PHE 87 5.654 -13.784 14.343 547 HE1 PHE 87 2HE PHE 87 3.326 -17.404 11.939 548 HE2 PHE 87 1HE PHE 87 3.158 -14.004 14.472 549 HZ PHE 87 HZ PHE 87 2.023 -15.812 13.268 550 H LEU 88 H LEU 88 10.710 -16.183 13.319 551 HA LEU 88 HA LEU 88 10.806 -17.429 10.715 552 HB3 LEU 88 2HB LEU 88 13.095 -16.661 10.672 553 HG LEU 88 HG LEU 88 11.149 -14.598 11.709 554 HD11 LEU 88 1HD1 LEU 88 12.841 -13.252 12.224 555 HD12 LEU 88 2HD1 LEU 88 14.040 -14.388 11.561 556 HD13 LEU 88 3HD1 LEU 88 13.239 -13.213 10.490 557 HD21 LEU 88 3HD2 LEU 88 12.284 -14.339 9.013 558 HD22 LEU 88 1HD2 LEU 88 11.335 -15.824 9.266 559 HD23 LEU 88 2HD2 LEU 88 10.597 -14.232 9.572 560 H LEU 89 H LEU 89 12.233 -19.234 10.206 561 HA LEU 89 HA LEU 89 11.975 -21.307 12.093 562 HB3 LEU 89 2HB LEU 89 13.428 -22.537 10.425 563 HG LEU 89 HG LEU 89 10.770 -21.379 9.865 564 HD11 LEU 89 1HD1 LEU 89 12.021 -20.833 7.776 565 HD12 LEU 89 2HD1 LEU 89 12.346 -22.571 7.571 566 HD13 LEU 89 3HD1 LEU 89 10.671 -21.970 7.544 567 HD21 LEU 89 3HD2 LEU 89 11.605 -24.160 9.155 568 HD22 LEU 89 1HD2 LEU 89 11.535 -23.698 10.873 569 HD23 LEU 89 2HD2 LEU 89 10.082 -23.560 9.854 570 HA PRO 90 HA PRO 90 15.572 -20.424 14.375 571 HB3 PRO 90 2HB PRO 90 14.529 -20.933 16.365 572 HG3 PRO 90 2HG PRO 90 12.582 -22.149 16.147 573 HD3 PRO 90 2HD PRO 90 11.981 -21.576 14.003 574 H ASP 91 H ASP 91 15.590 -23.839 14.905 575 HA ASP 91 HA ASP 91 18.215 -23.953 13.910 576 HB3 ASP 91 2HB ASP 91 16.910 -26.561 14.108 577 HD2 ASP 91 HD ASP 91 18.810 -27.531 16.528 578 H SER 92 H SER 92 14.969 -24.382 12.609 579 HA SER 92 HA SER 92 15.482 -26.181 10.587 580 HB3 SER 92 2HB SER 92 13.559 -24.347 9.598 581 HG SER 92 HG SER 92 13.365 -26.752 11.186 582 H LYS 93 H LYS 93 15.706 -22.568 10.686 583 HA LYS 93 HA LYS 93 16.651 -22.492 7.966 584 HB3 LYS 93 2HB LYS 93 15.396 -20.690 9.763 585 HG3 LYS 93 2HG LYS 93 18.007 -19.593 8.625 586 HD3 LYS 93 2HD LYS 93 15.552 -18.404 9.674 587 HE3 LYS 93 2HE LYS 93 17.536 -16.778 10.916 588 HZ1 LYS 93 2HZ LYS 93 15.103 -18.113 11.599 589 HZ3 LYS 93 1HZ LYS 93 15.678 -16.698 12.163 590 H ASP 94 H ASP 94 17.960 -23.135 11.064 591 HA ASP 94 HA ASP 94 20.477 -21.915 10.567 592 HB3 ASP 94 2HB ASP 94 19.752 -24.084 12.589 593 HD2 ASP 94 HD ASP 94 22.260 -24.490 12.200 594 H GLU 95 H GLU 95 18.832 -24.667 9.416 595 HA GLU 95 HA GLU 95 21.333 -26.120 9.051 596 HB3 GLU 95 2HB GLU 95 19.701 -27.459 10.250 597 HG3 GLU 95 2HG GLU 95 17.845 -26.580 8.008 598 HE2 GLU 95 HE GLU 95 15.484 -28.683 9.434 599 H ILE 96 H ILE 96 21.044 -23.928 7.417 600 HA ILE 96 HA ILE 96 20.240 -25.157 4.873 601 HB ILE 96 HB ILE 96 19.972 -22.266 5.706 602 HG13 ILE 96 2HG1 ILE 96 17.886 -22.693 6.355 603 HG21 ILE 96 1HG2 ILE 96 20.503 -22.243 3.412 604 HG22 ILE 96 2HG2 ILE 96 19.495 -23.671 3.076 605 HG23 ILE 96 3HG2 ILE 96 18.729 -22.119 3.491 606 HD11 ILE 96 3HD1 ILE 96 16.382 -24.266 4.923 607 HD12 ILE 96 1HD1 ILE 96 16.903 -22.730 4.190 608 HD13 ILE 96 2HD1 ILE 96 17.722 -24.248 3.751 609 H GLU 97 H GLU 97 21.399 -23.922 2.969 610 HA GLU 97 HA GLU 97 24.134 -23.417 3.852 611 HB3 GLU 97 2HB GLU 97 24.753 -24.416 1.523 612 HG3 GLU 97 2HG GLU 97 24.419 -26.817 2.468 613 HE2 GLU 97 HE GLU 97 27.165 -25.442 2.362 614 H ASP 98 H ASP 98 25.384 -21.924 2.464 615 HA ASP 98 HA ASP 98 23.921 -19.701 1.792 616 HB3 ASP 98 2HB ASP 98 26.726 -20.673 1.313 617 HD2 ASP 98 HD ASP 98 25.431 -18.350 -1.430 618 H GLU 99 H GLU 99 25.228 -22.448 -0.156 619 HA GLU 99 HA GLU 99 24.427 -21.279 -2.615 620 HB3 GLU 99 2HB GLU 99 24.871 -24.167 -2.721 621 HG3 GLU 99 2HG GLU 99 26.798 -22.001 -3.611 622 HE2 GLU 99 HE GLU 99 25.889 -23.749 -6.364 623 H LEU 100 H LEU 100 23.192 -23.831 -0.384 624 HA LEU 100 HA LEU 100 21.156 -24.797 -1.976 625 HB3 LEU 100 2HB LEU 100 21.268 -24.492 1.028 626 HG LEU 100 HG LEU 100 19.015 -25.227 -0.132 627 HD11 LEU 100 1HD1 LEU 100 19.021 -27.784 -0.296 628 HD12 LEU 100 2HD1 LEU 100 19.722 -26.865 -1.649 629 HD13 LEU 100 3HD1 LEU 100 20.788 -27.646 -0.455 630 HD21 LEU 100 3HD2 LEU 100 20.077 -25.498 2.361 631 HD22 LEU 100 1HD2 LEU 100 18.429 -25.987 1.896 632 HD23 LEU 100 2HD2 LEU 100 19.736 -27.194 1.941 633 H SER 101 H SER 101 21.091 -22.080 0.430 634 HA SER 101 HA SER 101 18.458 -21.440 0.081 635 HB3 SER 101 2HB SER 101 19.828 -20.500 1.880 636 HG SER 101 HG SER 101 21.230 -18.602 1.202 637 H ASP 102 H ASP 102 17.351 -19.858 -1.245 638 HA ASP 102 HA ASP 102 18.591 -18.236 -3.066 639 HB3 ASP 102 2HB ASP 102 17.386 -20.561 -4.573 640 HD2 ASP 102 HD ASP 102 20.382 -20.299 -5.614 Start of MODEL 9 1 H1 ILE 1 H ILE 1 33.436 -9.372 5.452 2 HA ILE 1 HA ILE 1 34.214 -11.948 4.274 3 HB ILE 1 HB ILE 1 34.399 -12.730 6.615 4 HG13 ILE 1 2HG1 ILE 1 32.945 -10.550 7.315 5 HG21 ILE 1 1HG2 ILE 1 36.583 -11.964 6.903 6 HG22 ILE 1 2HG2 ILE 1 36.300 -11.788 5.154 7 HG23 ILE 1 3HG2 ILE 1 36.219 -10.362 6.218 8 HD11 ILE 1 3HD1 ILE 1 34.674 -12.520 8.712 9 HD12 ILE 1 1HD1 ILE 1 34.330 -11.046 9.648 10 HD13 ILE 1 2HD1 ILE 1 32.989 -12.049 9.041 11 H SER 2 H SER 2 32.019 -11.531 3.135 12 HA SER 2 HA SER 2 30.082 -12.958 4.711 13 HB3 SER 2 2HB SER 2 28.413 -11.110 3.529 14 HG SER 2 HG SER 2 29.410 -11.589 6.092 15 H GLY 3 H GLY 3 30.467 -14.704 3.231 16 HA2 GLY 3 1HA GLY 3 28.965 -14.540 0.789 17 HA3 GLY 3 2HA GLY 3 30.693 -14.622 0.513 18 H GLY 4 H GLY 4 28.561 -16.139 3.037 19 HA2 GLY 4 1HA GLY 4 28.893 -18.764 1.902 20 HA3 GLY 4 2HA GLY 4 29.863 -18.503 3.337 21 H SER 5 H SER 5 28.918 -18.665 5.355 22 HA SER 5 HA SER 5 26.359 -19.724 5.503 23 HB3 SER 5 2HB SER 5 27.683 -18.377 7.866 24 HG SER 5 HG SER 5 26.100 -20.725 7.380 25 H SER 6 H SER 6 27.608 -16.420 5.520 26 HA SER 6 HA SER 6 25.594 -15.157 6.888 27 HB3 SER 6 2HB SER 6 26.238 -13.168 5.349 28 HG SER 6 HG SER 6 27.315 -13.462 7.367 29 H ILE 7 H ILE 7 25.727 -16.495 3.595 30 HA ILE 7 HA ILE 7 23.585 -15.098 2.489 31 HB ILE 7 HB ILE 7 24.923 -17.721 1.939 32 HG13 ILE 7 2HG1 ILE 7 26.231 -16.454 0.672 33 HG21 ILE 7 1HG2 ILE 7 23.526 -17.881 -0.134 34 HG22 ILE 7 2HG2 ILE 7 22.653 -18.214 1.381 35 HG23 ILE 7 3HG2 ILE 7 22.450 -16.646 0.565 36 HD11 ILE 7 3HD1 ILE 7 23.615 -15.557 -0.609 37 HD12 ILE 7 1HD1 ILE 7 25.215 -15.052 -1.201 38 HD13 ILE 7 2HD1 ILE 7 24.761 -16.772 -1.223 39 H SER 8 H SER 8 23.758 -18.027 4.558 40 HA SER 8 HA SER 8 21.375 -19.108 4.322 41 HB3 SER 8 2HB SER 8 22.312 -18.387 7.112 42 HG SER 8 HG SER 8 20.639 -20.225 6.048 43 H MET 9 H MET 9 22.058 -15.861 5.589 44 HA MET 9 HA MET 9 19.417 -15.554 6.631 45 HB3 MET 9 2HB MET 9 20.265 -13.136 6.941 46 HG3 MET 9 2HG MET 9 21.956 -13.724 8.656 47 HE1 MET 9 3HE MET 9 18.551 -13.394 8.423 48 HE2 MET 9 1HE MET 9 18.499 -13.670 10.181 49 HE3 MET 9 2HE MET 9 19.850 -12.762 9.463 50 H MET 10 H MET 10 21.348 -13.865 4.042 51 HA MET 10 HA MET 10 19.198 -12.494 3.008 52 HB3 MET 10 2HB MET 10 21.832 -12.386 2.587 53 HG3 MET 10 2HG MET 10 20.883 -14.076 0.222 54 HE1 MET 10 3HE MET 10 24.999 -12.286 1.235 55 HE2 MET 10 1HE MET 10 23.508 -11.480 1.781 56 HE3 MET 10 2HE MET 10 23.894 -13.122 2.351 57 H TYR 11 H TYR 11 20.330 -15.829 2.475 58 HA TYR 11 HA TYR 11 18.928 -16.309 0.089 59 HB3 TYR 11 2HB TYR 11 19.970 -17.929 2.480 60 HD1 TYR 11 2HD TYR 11 17.732 -18.170 -0.364 61 HD2 TYR 11 1HD TYR 11 20.335 -20.406 2.191 62 HE1 TYR 11 2HE TYR 11 16.623 -20.331 -1.114 63 HE2 TYR 11 1HE TYR 11 19.217 -22.560 1.433 64 HH TYR 11 HH TYR 11 17.979 -23.368 -0.476 65 H LYS 12 H LYS 12 18.114 -17.024 3.558 66 HA LYS 12 HA LYS 12 15.785 -18.314 3.286 67 HB3 LYS 12 2HB LYS 12 15.113 -16.830 5.381 68 HG3 LYS 12 2HG LYS 12 17.292 -18.906 5.056 69 HD3 LYS 12 2HD LYS 12 16.397 -17.722 7.725 70 HE3 LYS 12 2HE LYS 12 17.539 -20.243 7.037 71 HZ1 LYS 12 2HZ LYS 12 19.504 -18.872 8.705 72 HZ3 LYS 12 1HZ LYS 12 19.626 -18.617 7.103 73 H TYR 13 H TYR 13 16.390 -14.846 2.654 74 HA TYR 13 HA TYR 13 13.665 -14.142 2.399 75 HB3 TYR 13 2HB TYR 13 15.902 -12.830 0.824 76 HD1 TYR 13 2HD TYR 13 13.517 -11.897 0.063 77 HD2 TYR 13 1HD TYR 13 15.340 -11.149 3.860 78 HE1 TYR 13 2HE TYR 13 12.081 -9.819 0.351 79 HE2 TYR 13 1HE TYR 13 13.898 -9.073 4.134 80 HH TYR 13 HH TYR 13 12.469 -7.740 3.203 81 H CYS 14 H CYS 14 16.185 -15.321 0.116 82 HA CYS 14 HA CYS 14 14.524 -14.892 -2.153 83 HB3 CYS 14 2HB CYS 14 16.846 -16.784 -2.234 84 HG CYS 14 HG CYS 14 15.567 -14.264 -3.956 85 H SER 15 H SER 15 15.651 -17.740 -0.195 86 HA SER 15 HA SER 15 14.463 -19.723 -1.563 87 HB3 SER 15 2HB SER 15 14.112 -19.975 1.369 88 HG SER 15 HG SER 15 14.791 -21.528 -0.708 89 H ARG 16 H ARG 16 12.932 -17.101 0.154 90 HA ARG 16 HA ARG 16 10.541 -18.407 0.770 91 HB3 ARG 16 2HB ARG 16 9.770 -15.795 0.586 92 HG3 ARG 16 2HG ARG 16 11.503 -17.152 2.689 93 HD3 ARG 16 2HD ARG 16 11.908 -14.757 2.979 94 HE ARG 16 HE ARG 16 9.008 -14.133 3.116 95 HH11 ARG 16 2HH2 ARG 16 12.049 -13.862 1.319 96 HH12 ARG 16 1HH2 ARG 16 11.489 -12.561 0.322 97 HH22 ARG 16 1HH ARG 16 9.262 -11.729 0.622 98 H LEU 17 H LEU 17 11.908 -17.969 -2.197 99 HA LEU 17 HA LEU 17 9.973 -16.742 -3.756 100 HB3 LEU 17 2HB LEU 17 11.127 -18.766 -5.303 101 HG LEU 17 HG LEU 17 11.239 -15.927 -5.174 102 HD11 LEU 17 1HD1 LEU 17 13.892 -16.374 -6.094 103 HD12 LEU 17 2HD1 LEU 17 13.336 -15.359 -4.742 104 HD13 LEU 17 3HD1 LEU 17 13.756 -17.066 -4.460 105 HD21 LEU 17 3HD2 LEU 17 10.849 -17.764 -7.073 106 HD22 LEU 17 1HD2 LEU 17 11.339 -16.092 -7.435 107 HD23 LEU 17 2HD2 LEU 17 12.557 -17.390 -7.405 108 HA PRO 18 HA PRO 18 6.748 -19.608 -3.860 109 HB3 PRO 18 2HB PRO 18 5.303 -18.061 -4.763 110 HG3 PRO 18 2HG PRO 18 6.327 -16.319 -5.876 111 HD3 PRO 18 2HD PRO 18 8.386 -16.337 -4.853 112 H HIS 19 H HIS 19 8.709 -19.465 -6.759 113 HA HIS 19 HA HIS 19 7.860 -21.911 -7.777 114 HB3 HIS 19 2HB HIS 19 10.547 -21.523 -8.539 115 HD1 HIS 19 1HD HIS 19 7.031 -20.251 -9.410 116 HD2 HIS 19 2HD HIS 19 10.408 -21.940 -11.237 117 HE1 HIS 19 1HE HIS 19 6.400 -20.650 -11.849 118 H ASP 20 H ASP 20 9.641 -21.156 -4.939 119 HA ASP 20 HA ASP 20 11.232 -23.507 -4.963 120 HB3 ASP 20 2HB ASP 20 10.488 -21.607 -2.688 121 HD2 ASP 20 HD ASP 20 13.336 -22.883 -0.902 122 H GLU 21 H GLU 21 10.449 -25.545 -4.398 123 HA GLU 21 HA GLU 21 7.805 -25.744 -3.383 124 HB3 GLU 21 2HB GLU 21 9.420 -28.217 -3.401 125 HG3 GLU 21 2HG GLU 21 7.120 -27.484 -5.239 126 HE2 GLU 21 HE GLU 21 6.152 -30.746 -4.979 127 H PHE 22 H PHE 22 11.102 -25.846 -2.101 128 HA PHE 22 HA PHE 22 10.452 -27.197 0.299 129 HB3 PHE 22 2HB PHE 22 12.689 -25.284 0.430 130 HD1 PHE 22 2HD PHE 22 12.648 -26.748 2.530 131 HD2 PHE 22 1HD PHE 22 13.568 -28.261 -1.326 132 HE1 PHE 22 2HE PHE 22 13.764 -28.737 3.578 133 HE2 PHE 22 1HE PHE 22 14.685 -30.250 -0.278 134 HZ PHE 22 HZ PHE 22 14.769 -30.465 2.160 135 H PHE 23 H PHE 23 9.452 -24.201 -0.851 136 HA PHE 23 HA PHE 23 9.102 -23.249 1.897 137 HB3 PHE 23 2HB PHE 23 9.189 -21.015 0.120 138 HD1 PHE 23 1HD PHE 23 12.282 -22.766 1.161 139 HD2 PHE 23 2HD PHE 23 9.475 -19.713 2.066 140 HE1 PHE 23 1HE PHE 23 13.801 -21.903 2.964 141 HE2 PHE 23 2HE PHE 23 10.994 -18.850 3.868 142 HZ PHE 23 HZ PHE 23 13.139 -19.955 4.296 143 H GLN 24 H GLN 24 7.108 -22.207 2.329 144 HA GLN 24 HA GLN 24 5.091 -22.862 0.397 145 HB3 GLN 24 2HB GLN 24 3.950 -21.490 2.624 146 HG3 GLN 24 2HG GLN 24 3.997 -24.189 1.421 147 HE21 GLN 24 1HE2 GLN 24 2.157 -25.520 2.840 148 HE22 GLN 24 2HE2 GLN 24 2.766 -26.035 4.377 149 HA PRO 25 HA PRO 25 4.575 -18.815 -1.078 150 HB3 PRO 25 2HB PRO 25 3.207 -19.519 -2.791 151 HG3 PRO 25 2HG PRO 25 2.136 -21.524 -2.405 152 HD3 PRO 25 2HD PRO 25 3.567 -22.462 -0.870 153 H LYS 26 H LYS 26 4.879 -18.600 1.528 154 HA LYS 26 HA LYS 26 2.547 -17.377 2.661 155 HB3 LYS 26 2HB LYS 26 4.808 -16.825 4.253 156 HG3 LYS 26 2HG LYS 26 2.930 -19.227 4.404 157 HD3 LYS 26 2HD LYS 26 4.710 -17.740 6.341 158 HE3 LYS 26 2HE LYS 26 1.911 -18.416 6.839 159 HZ1 LYS 26 2HZ LYS 26 3.776 -20.292 7.822 160 HZ3 LYS 26 1HZ LYS 26 2.170 -20.248 8.087 161 HA PRO 27 HA PRO 27 5.212 -13.555 1.867 162 HB3 PRO 27 2HB PRO 27 7.492 -13.798 2.072 163 HG3 PRO 27 2HG PRO 27 8.256 -15.962 1.834 164 HD3 PRO 27 2HD PRO 27 6.357 -17.129 2.402 165 H GLU 28 H GLU 28 6.136 -12.210 -0.285 166 HA GLU 28 HA GLU 28 4.530 -13.197 -2.473 167 HB3 GLU 28 2HB GLU 28 3.970 -10.438 -2.455 168 HG3 GLU 28 2HG GLU 28 2.344 -12.866 -1.576 169 HE2 GLU 28 HE GLU 28 1.356 -10.143 -3.378 170 H PHE 29 H PHE 29 5.345 -12.598 -4.519 171 HA PHE 29 HA PHE 29 7.576 -10.711 -4.499 172 HB3 PHE 29 2HB PHE 29 8.011 -13.388 -4.441 173 HD1 PHE 29 2HD PHE 29 5.690 -14.011 -5.799 174 HD2 PHE 29 1HD PHE 29 9.473 -13.151 -7.519 175 HE1 PHE 29 2HE PHE 29 5.055 -15.315 -7.847 176 HE2 PHE 29 1HE PHE 29 8.838 -14.455 -9.567 177 HZ PHE 29 HZ PHE 29 6.636 -15.522 -9.707 178 H GLN 30 H GLN 30 7.625 -9.348 -6.268 179 HA GLN 30 HA GLN 30 6.081 -10.125 -8.578 180 HB3 GLN 30 2HB GLN 30 5.479 -7.355 -8.086 181 HG3 GLN 30 2HG GLN 30 3.242 -9.111 -7.557 182 HE21 GLN 30 1HE2 GLN 30 1.559 -8.699 -9.015 183 HE22 GLN 30 2HE2 GLN 30 1.581 -7.349 -10.100 184 H PHE 31 H PHE 31 6.933 -9.299 -10.515 185 HA PHE 31 HA PHE 31 9.270 -7.557 -10.159 186 HB3 PHE 31 2HB PHE 31 9.536 -10.030 -10.929 187 HD1 PHE 31 1HD PHE 31 9.259 -8.306 -14.152 188 HD2 PHE 31 2HD PHE 31 7.602 -11.296 -11.638 189 HE1 PHE 31 1HE PHE 31 7.932 -9.196 -16.087 190 HE2 PHE 31 2HE PHE 31 6.275 -12.187 -13.573 191 HZ PHE 31 HZ PHE 31 6.457 -11.127 -15.774 192 H LYS 32 H LYS 32 9.322 -5.651 -11.293 193 HA LYS 32 HA LYS 32 7.190 -5.295 -13.285 194 HB3 LYS 32 2HB LYS 32 8.066 -3.640 -10.995 195 HG3 LYS 32 2HG LYS 32 7.548 -2.512 -13.774 196 HD3 LYS 32 2HD LYS 32 7.261 -0.292 -12.626 197 HE3 LYS 32 2HE LYS 32 4.929 -0.596 -11.992 198 HZ1 LYS 32 2HZ LYS 32 5.936 -1.576 -14.333 199 HZ3 LYS 32 1HZ LYS 32 4.356 -1.307 -14.041 200 HA PRO 33 HA PRO 33 10.738 -4.864 -15.827 201 HB3 PRO 33 2HB PRO 33 10.038 -6.492 -17.298 202 HG3 PRO 33 2HG PRO 33 7.826 -7.105 -17.074 203 HD3 PRO 33 2HD PRO 33 7.458 -6.511 -14.883 204 H VAL 34 H VAL 34 11.772 -2.998 -16.087 205 HA VAL 34 HA VAL 34 10.062 -0.814 -17.059 206 HB VAL 34 HB VAL 34 12.566 -0.601 -15.382 207 HG11 VAL 34 1HG1 VAL 34 11.370 1.679 -14.887 208 HG12 VAL 34 2HG1 VAL 34 12.295 1.469 -16.393 209 HG13 VAL 34 3HG1 VAL 34 10.519 1.347 -16.415 210 HG21 VAL 34 3HG2 VAL 34 11.101 -1.692 -13.920 211 HG22 VAL 34 1HG2 VAL 34 10.840 0.031 -13.556 212 HG23 VAL 34 2HG2 VAL 34 9.671 -0.852 -14.568 213 H ASP 35 H ASP 35 11.471 0.948 -18.210 214 HA ASP 35 HA ASP 35 12.541 -0.266 -20.446 215 HB3 ASP 35 2HB ASP 35 13.576 2.444 -19.987 216 HD2 ASP 35 HD ASP 35 13.936 1.320 -22.297 217 H GLU 36 H GLU 36 14.859 -0.047 -21.252 218 HA GLU 36 HA GLU 36 16.645 -0.957 -19.334 219 HB3 GLU 36 2HB GLU 36 18.359 -0.512 -21.221 220 HG3 GLU 36 2HG GLU 36 16.313 -2.012 -22.651 221 HE2 GLU 36 HE GLU 36 17.878 -4.375 -23.045 222 H PHE 37 H PHE 37 15.480 2.193 -19.934 223 HA PHE 37 HA PHE 37 17.792 3.719 -19.575 224 HB3 PHE 37 2HB PHE 37 15.245 4.726 -18.391 225 HD1 PHE 37 2HD PHE 37 16.691 4.856 -21.830 226 HD2 PHE 37 1HD PHE 37 15.844 6.954 -18.239 227 HE1 PHE 37 2HE PHE 37 17.478 6.991 -22.891 228 HE2 PHE 37 1HE PHE 37 16.631 9.088 -19.300 229 HZ PHE 37 HZ PHE 37 17.440 9.080 -21.613 230 H GLY 38 H GLY 38 16.292 1.542 -17.435 231 HA2 GLY 38 1HA GLY 38 17.714 2.755 -15.171 232 HA3 GLY 38 2HA GLY 38 16.005 2.405 -15.000 233 H GLY 39 H GLY 39 15.292 0.088 -15.552 234 HA2 GLY 39 1HA GLY 39 16.907 -2.080 -15.859 235 HA3 GLY 39 2HA GLY 39 17.013 -1.737 -14.144 236 H THR 40 H THR 40 15.696 -3.133 -13.052 237 HA THR 40 HA THR 40 12.914 -3.312 -13.977 238 HB THR 40 HB THR 40 14.972 -5.475 -13.655 239 HG1 THR 40 1HG THR 40 13.722 -4.640 -15.620 240 HG21 THR 40 3HG2 THR 40 12.137 -5.614 -12.570 241 HG22 THR 40 1HG2 THR 40 12.843 -7.036 -13.375 242 HG23 THR 40 2HG2 THR 40 13.616 -6.362 -11.920 243 H ILE 41 H ILE 41 11.346 -3.461 -12.369 244 HA ILE 41 HA ILE 41 12.391 -2.790 -9.720 245 HB ILE 41 HB ILE 41 9.619 -2.420 -10.857 246 HG13 ILE 41 2HG1 ILE 41 11.415 -1.110 -12.032 247 HG21 ILE 41 1HG2 ILE 41 10.814 -1.119 -8.406 248 HG22 ILE 41 2HG2 ILE 41 9.114 -1.150 -8.934 249 HG23 ILE 41 3HG2 ILE 41 9.889 -2.638 -8.341 250 HD11 ILE 41 3HD1 ILE 41 9.315 0.346 -10.368 251 HD12 ILE 41 1HD1 ILE 41 10.260 1.130 -11.655 252 HD13 ILE 41 2HD1 ILE 41 9.164 -0.215 -12.050 253 H CYS 42 H CYS 42 11.821 -3.975 -7.878 254 HA CYS 42 HA CYS 42 10.365 -6.451 -8.459 255 HB3 CYS 42 2HB CYS 42 12.923 -6.037 -6.924 256 HG CYS 42 HG CYS 42 11.394 -7.000 -5.084 257 H ARG 43 H ARG 43 8.591 -6.778 -7.129 258 HA ARG 43 HA ARG 43 8.373 -4.927 -4.897 259 HB3 ARG 43 2HB ARG 43 6.165 -6.407 -6.415 260 HG3 ARG 43 2HG ARG 43 6.205 -4.576 -4.028 261 HD3 ARG 43 2HD ARG 43 4.841 -3.750 -6.337 262 HE ARG 43 HE ARG 43 3.118 -5.594 -4.830 263 HH11 ARG 43 2HH2 ARG 43 3.198 -2.774 -6.974 264 HH12 ARG 43 1HH2 ARG 43 1.571 -2.992 -7.524 265 HH22 ARG 43 1HH ARG 43 0.280 -4.826 -6.678 266 H ILE 44 H ILE 44 8.912 -5.947 -2.984 267 HA ILE 44 HA ILE 44 7.928 -8.695 -2.648 268 HB ILE 44 HB ILE 44 10.586 -7.669 -2.524 269 HG13 ILE 44 2HG1 ILE 44 9.355 -10.394 -2.035 270 HG21 ILE 44 1HG2 ILE 44 9.857 -7.208 -0.113 271 HG22 ILE 44 2HG2 ILE 44 9.813 -8.977 0.081 272 HG23 ILE 44 3HG2 ILE 44 11.335 -8.169 -0.361 273 HD11 ILE 44 3HD1 ILE 44 9.534 -8.937 -4.369 274 HD12 ILE 44 1HD1 ILE 44 11.079 -9.819 -4.385 275 HD13 ILE 44 2HD1 ILE 44 9.544 -10.715 -4.291 276 H THR 45 H THR 45 6.736 -9.136 -0.819 277 HA THR 45 HA THR 45 6.722 -7.208 1.343 278 HB THR 45 HB THR 45 5.050 -6.122 0.044 279 HG1 THR 45 1HG THR 45 3.944 -6.545 1.951 280 HG21 THR 45 3HG2 THR 45 3.175 -8.198 -0.600 281 HG22 THR 45 1HG2 THR 45 4.089 -7.179 -1.737 282 HG23 THR 45 2HG2 THR 45 4.763 -8.735 -1.197 283 H LEU 46 H LEU 46 7.045 -8.425 3.090 284 HA LEU 46 HA LEU 46 6.378 -11.195 3.048 285 HB3 LEU 46 2HB LEU 46 7.005 -10.645 5.631 286 HG LEU 46 HG LEU 46 8.677 -11.306 3.257 287 HD11 LEU 46 1HD1 LEU 46 10.443 -10.134 3.962 288 HD12 LEU 46 2HD1 LEU 46 9.710 -9.803 5.550 289 HD13 LEU 46 3HD1 LEU 46 10.558 -11.341 5.265 290 HD21 LEU 46 3HD2 LEU 46 9.362 -13.171 4.833 291 HD22 LEU 46 1HD2 LEU 46 8.124 -12.553 5.952 292 HD23 LEU 46 2HD2 LEU 46 7.651 -13.137 4.340 293 HA PRO 47 HA PRO 47 2.508 -11.073 4.957 294 HB3 PRO 47 2HB PRO 47 2.310 -13.366 4.993 295 HG3 PRO 47 2HG PRO 47 4.315 -14.506 5.028 296 HD3 PRO 47 2HD PRO 47 5.697 -12.927 4.088 297 H ALA 48 H ALA 48 1.194 -11.159 7.139 298 HA ALA 48 HA ALA 48 2.100 -8.927 8.556 299 HB1 ALA 48 1HB ALA 48 0.278 -10.457 10.142 300 HB2 ALA 48 2HB ALA 48 -0.065 -9.023 9.144 301 HB3 ALA 48 3HB ALA 48 -0.196 -10.651 8.437 302 H ASN 49 H ASN 49 3.126 -12.206 8.605 303 HA ASN 49 HA ASN 49 3.712 -12.366 11.351 304 HB3 ASN 49 2HB ASN 49 5.272 -14.278 10.495 305 HD21 ASN 49 1HD2 ASN 49 3.949 -16.127 8.985 306 HD22 ASN 49 2HD2 ASN 49 2.404 -16.501 9.672 307 H ALA 50 H ALA 50 5.046 -10.648 8.675 308 HA ALA 50 HA ALA 50 7.617 -10.370 10.078 309 HB1 ALA 50 1HB ALA 50 8.706 -10.714 8.133 310 HB2 ALA 50 2HB ALA 50 7.164 -11.343 7.505 311 HB3 ALA 50 3HB ALA 50 7.605 -9.639 7.237 312 HA PRO 51 HA PRO 51 6.438 -6.208 10.391 313 HB3 PRO 51 2HB PRO 51 7.677 -5.935 12.312 314 HG3 PRO 51 2HG PRO 51 9.330 -7.513 12.625 315 HD3 PRO 51 2HD PRO 51 8.482 -9.245 11.372 316 H ILE 52 H ILE 52 9.787 -5.906 9.371 317 HA ILE 52 HA ILE 52 8.762 -4.363 7.099 318 HB ILE 52 HB ILE 52 11.297 -3.633 7.153 319 HG13 ILE 52 2HG1 ILE 52 10.786 -4.410 10.040 320 HG21 ILE 52 1HG2 ILE 52 9.972 -1.829 7.351 321 HG22 ILE 52 2HG2 ILE 52 8.856 -2.636 8.477 322 HG23 ILE 52 3HG2 ILE 52 10.383 -1.948 9.080 323 HD11 ILE 52 3HD1 ILE 52 12.825 -5.799 9.722 324 HD12 ILE 52 1HD1 ILE 52 11.512 -6.324 8.643 325 HD13 ILE 52 2HD1 ILE 52 12.856 -5.350 8.001 326 H SER 53 H SER 53 10.253 -4.489 5.096 327 HA SER 53 HA SER 53 12.038 -6.246 4.459 328 HB3 SER 53 2HB SER 53 10.320 -8.204 3.565 329 HG SER 53 HG SER 53 12.054 -7.915 5.780 330 H GLU 54 H GLU 54 8.971 -4.733 3.779 331 HA GLU 54 HA GLU 54 8.533 -5.280 1.177 332 HB3 GLU 54 2HB GLU 54 7.964 -2.578 1.282 333 HG3 GLU 54 2HG GLU 54 6.436 -4.929 2.490 334 HE2 GLU 54 HE GLU 54 3.660 -3.713 2.062 335 H ILE 55 H ILE 55 9.385 -4.680 -0.829 336 HA ILE 55 HA ILE 55 11.431 -2.637 -0.901 337 HB ILE 55 HB ILE 55 12.837 -4.413 -2.251 338 HG13 ILE 55 2HG1 ILE 55 10.845 -6.087 -1.394 339 HG21 ILE 55 1HG2 ILE 55 13.130 -4.704 0.697 340 HG22 ILE 55 2HG2 ILE 55 14.337 -4.306 -0.550 341 HG23 ILE 55 3HG2 ILE 55 13.202 -3.059 0.022 342 HD11 ILE 55 3HD1 ILE 55 13.780 -6.707 -1.958 343 HD12 ILE 55 1HD1 ILE 55 12.477 -7.919 -1.940 344 HD13 ILE 55 2HD1 ILE 55 12.466 -6.619 -3.155 345 H GLU 56 H GLU 56 10.824 -1.355 -2.552 346 HA GLU 56 HA GLU 56 10.005 -2.672 -4.991 347 HB3 GLU 56 2HB GLU 56 8.120 -0.923 -5.204 348 HG3 GLU 56 2HG GLU 56 8.147 -3.280 -3.316 349 HE2 GLU 56 HE GLU 56 6.589 -1.945 -1.349 350 H SER 57 H SER 57 11.693 -1.983 -6.271 351 HA SER 57 HA SER 57 11.767 0.461 -7.339 352 HB3 SER 57 2HB SER 57 14.141 0.951 -5.847 353 HG SER 57 HG SER 57 13.205 2.904 -5.572 354 H SER 58 H SER 58 13.112 0.304 -9.136 355 HA SER 58 HA SER 58 14.598 -2.094 -9.374 356 HB3 SER 58 2HB SER 58 13.361 -1.198 -11.289 357 HG SER 58 HG SER 58 14.967 0.812 -12.102 358 H LEU 59 H LEU 59 16.906 -1.662 -10.691 359 HA LEU 59 HA LEU 59 18.474 0.488 -10.026 360 HB3 LEU 59 2HB LEU 59 18.448 -1.643 -7.905 361 HG LEU 59 HG LEU 59 20.786 -0.217 -8.846 362 HD11 LEU 59 1HD1 LEU 59 20.208 1.572 -7.371 363 HD12 LEU 59 2HD1 LEU 59 19.838 0.441 -6.047 364 HD13 LEU 59 3HD1 LEU 59 21.516 0.636 -6.608 365 HD21 LEU 59 3HD2 LEU 59 20.208 -2.651 -7.744 366 HD22 LEU 59 1HD2 LEU 59 21.841 -1.969 -7.932 367 HD23 LEU 59 2HD2 LEU 59 20.984 -1.808 -6.381 368 H LEU 60 H LEU 60 18.066 -2.987 -10.607 369 HA LEU 60 HA LEU 60 20.637 -2.964 -12.025 370 HB3 LEU 60 2HB LEU 60 20.069 -5.570 -11.848 371 HG LEU 60 HG LEU 60 22.091 -5.251 -10.897 372 HD11 LEU 60 1HD1 LEU 60 22.214 -2.918 -10.856 373 HD12 LEU 60 2HD1 LEU 60 20.919 -2.772 -9.646 374 HD13 LEU 60 3HD1 LEU 60 22.516 -3.398 -9.170 375 HD21 LEU 60 3HD2 LEU 60 21.528 -6.649 -9.222 376 HD22 LEU 60 1HD2 LEU 60 21.729 -5.194 -8.215 377 HD23 LEU 60 2HD2 LEU 60 20.105 -5.690 -8.750 378 HA PRO 61 HA PRO 61 18.429 -3.433 -15.703 379 HB3 PRO 61 2HB PRO 61 20.269 -2.866 -16.966 380 HG3 PRO 61 2HG PRO 61 22.296 -3.192 -15.915 381 HD3 PRO 61 2HD PRO 61 21.636 -3.081 -13.715 382 H SER 62 H SER 62 19.176 -5.969 -13.772 383 HA SER 62 HA SER 62 17.669 -7.726 -15.548 384 HB3 SER 62 2HB SER 62 19.130 -9.431 -15.169 385 HG SER 62 HG SER 62 20.714 -7.846 -15.594 386 H THR 63 H THR 63 16.118 -9.185 -14.477 387 HA THR 63 HA THR 63 14.822 -7.912 -12.274 388 HB THR 63 HB THR 63 14.316 -10.617 -13.622 389 HG1 THR 63 1HG THR 63 12.999 -9.234 -15.005 390 HG21 THR 63 3HG2 THR 63 13.039 -9.554 -11.405 391 HG22 THR 63 1HG2 THR 63 12.098 -8.831 -12.733 392 HG23 THR 63 2HG2 THR 63 12.243 -10.601 -12.605 393 H GLU 64 H GLU 64 16.540 -11.075 -12.695 394 HA GLU 64 HA GLU 64 16.203 -11.928 -10.125 395 HB3 GLU 64 2HB GLU 64 18.716 -12.900 -10.806 396 HG3 GLU 64 2HG GLU 64 15.892 -13.774 -11.504 397 HE2 GLU 64 HE GLU 64 15.813 -15.989 -12.091 398 H ALA 65 H ALA 65 18.581 -9.629 -11.501 399 HA ALA 65 HA ALA 65 20.089 -9.497 -9.063 400 HB1 ALA 65 1HB ALA 65 20.483 -8.858 -11.772 401 HB2 ALA 65 2HB ALA 65 20.467 -7.290 -10.931 402 HB3 ALA 65 3HB ALA 65 21.611 -8.557 -10.429 403 H ALA 66 H ALA 66 17.770 -7.368 -10.868 404 HA ALA 66 HA ALA 66 17.774 -5.265 -9.080 405 HB1 ALA 66 1HB ALA 66 15.681 -6.399 -10.963 406 HB2 ALA 66 2HB ALA 66 15.423 -4.897 -10.042 407 HB3 ALA 66 3HB ALA 66 16.755 -5.002 -11.218 408 H LYS 67 H LYS 67 15.731 -8.256 -9.152 409 HA LYS 67 HA LYS 67 14.297 -7.533 -6.823 410 HB3 LYS 67 2HB LYS 67 13.549 -9.100 -8.662 411 HG3 LYS 67 2HG LYS 67 15.849 -10.603 -7.598 412 HD3 LYS 67 2HD LYS 67 13.423 -12.307 -8.166 413 HE3 LYS 67 2HE LYS 67 15.891 -12.660 -6.396 414 HZ1 LYS 67 2HZ LYS 67 14.195 -14.862 -7.319 415 HZ3 LYS 67 1HZ LYS 67 13.643 -13.979 -6.067 416 H LYS 68 H LYS 68 17.322 -9.311 -7.498 417 HA LYS 68 HA LYS 68 17.577 -10.395 -4.907 418 HB3 LYS 68 2HB LYS 68 19.442 -9.967 -7.234 419 HG3 LYS 68 2HG LYS 68 20.080 -10.928 -4.418 420 HD3 LYS 68 2HD LYS 68 21.751 -11.424 -6.923 421 HE3 LYS 68 2HE LYS 68 22.738 -13.122 -5.102 422 HZ1 LYS 68 2HZ LYS 68 23.985 -11.292 -6.130 423 HZ3 LYS 68 1HZ LYS 68 24.345 -11.382 -4.544 424 H ASP 69 H ASP 69 18.638 -7.335 -6.474 425 HA ASP 69 HA ASP 69 20.293 -6.468 -4.478 426 HB3 ASP 69 2HB ASP 69 18.392 -4.698 -6.080 427 HD2 ASP 69 HD ASP 69 21.727 -4.128 -6.541 428 H ALA 70 H ALA 70 16.822 -5.500 -5.101 429 HA ALA 70 HA ALA 70 16.436 -4.117 -2.746 430 HB1 ALA 70 1HB ALA 70 14.002 -5.414 -3.496 431 HB2 ALA 70 2HB ALA 70 14.518 -3.749 -3.854 432 HB3 ALA 70 3HB ALA 70 14.906 -5.064 -4.988 433 H CYS 71 H CYS 71 15.872 -7.613 -3.509 434 HA CYS 71 HA CYS 71 14.786 -8.319 -1.084 435 HB3 CYS 71 2HB CYS 71 16.443 -9.901 -3.065 436 HG CYS 71 HG CYS 71 15.638 -10.423 -0.056 437 H LEU 72 H LEU 72 18.233 -8.170 -2.201 438 HA LEU 72 HA LEU 72 19.372 -9.151 0.141 439 HB3 LEU 72 2HB LEU 72 21.388 -7.816 -0.719 440 HG LEU 72 HG LEU 72 20.740 -9.315 -3.099 441 HD11 LEU 72 1HD1 LEU 72 22.929 -8.836 -1.511 442 HD12 LEU 72 2HD1 LEU 72 22.557 -10.538 -1.149 443 HD13 LEU 72 3HD1 LEU 72 22.841 -10.028 -2.831 444 HD21 LEU 72 3HD2 LEU 72 20.306 -10.843 -0.520 445 HD22 LEU 72 1HD2 LEU 72 19.009 -10.332 -1.627 446 HD23 LEU 72 2HD2 LEU 72 20.250 -11.480 -2.181 447 H LYS 73 H LYS 73 18.592 -5.773 -0.903 448 HA LYS 73 HA LYS 73 19.607 -4.596 1.442 449 HB3 LYS 73 2HB LYS 73 17.438 -3.182 0.026 450 HG3 LYS 73 2HG LYS 73 20.399 -2.608 0.515 451 HD3 LYS 73 2HD LYS 73 18.077 -0.852 -0.405 452 HE3 LYS 73 2HE LYS 73 19.524 0.290 1.317 453 HZ1 LYS 73 2HZ LYS 73 21.835 0.780 0.491 454 HZ3 LYS 73 1HZ LYS 73 21.655 -0.384 -0.633 455 H ALA 74 H ALA 74 16.509 -6.107 0.556 456 HA ALA 74 HA ALA 74 15.024 -5.047 2.702 457 HB1 ALA 74 1HB ALA 74 13.339 -6.465 1.940 458 HB2 ALA 74 2HB ALA 74 14.332 -6.278 0.474 459 HB3 ALA 74 3HB ALA 74 14.482 -7.745 1.471 460 H VAL 75 H VAL 75 17.067 -7.982 2.263 461 HA VAL 75 HA VAL 75 16.399 -9.265 4.618 462 HB VAL 75 HB VAL 75 19.089 -9.173 3.239 463 HG11 VAL 75 1HG1 VAL 75 18.487 -10.380 5.605 464 HG12 VAL 75 2HG1 VAL 75 18.093 -11.681 4.456 465 HG13 VAL 75 3HG1 VAL 75 19.722 -10.964 4.465 466 HG21 VAL 75 3HG2 VAL 75 16.572 -9.992 2.198 467 HG22 VAL 75 1HG2 VAL 75 18.186 -10.190 1.473 468 HG23 VAL 75 2HG2 VAL 75 17.517 -11.466 2.519 469 H HIS 76 H HIS 76 18.712 -6.591 3.955 470 HA HIS 76 HA HIS 76 19.925 -6.606 6.458 471 HB3 HIS 76 2HB HIS 76 19.860 -3.944 5.507 472 HD1 HIS 76 1HD HIS 76 21.808 -4.751 7.404 473 HD2 HIS 76 2HD HIS 76 22.415 -5.683 3.360 474 HE1 HIS 76 1HE HIS 76 24.304 -5.213 7.145 475 H GLU 77 H GLU 77 17.024 -4.853 5.196 476 HA GLU 77 HA GLU 77 16.570 -3.374 7.476 477 HB3 GLU 77 2HB GLU 77 14.194 -3.240 6.598 478 HG3 GLU 77 2HG GLU 77 15.676 -2.897 4.092 479 HE2 GLU 77 HE GLU 77 13.973 -0.835 3.474 480 H LEU 78 H LEU 78 15.898 -6.769 6.690 481 HA LEU 78 HA LEU 78 14.163 -7.068 8.987 482 HB3 LEU 78 2HB LEU 78 15.197 -9.117 7.022 483 HG LEU 78 HG LEU 78 12.942 -10.206 7.614 484 HD11 LEU 78 1HD1 LEU 78 14.434 -10.769 9.992 485 HD12 LEU 78 2HD1 LEU 78 14.275 -11.735 8.505 486 HD13 LEU 78 3HD1 LEU 78 15.565 -10.516 8.643 487 HD21 LEU 78 3HD2 LEU 78 12.169 -9.848 9.925 488 HD22 LEU 78 1HD2 LEU 78 13.323 -8.505 10.094 489 HD23 LEU 78 2HD2 LEU 78 11.992 -8.393 8.918 490 H HIS 79 H HIS 79 17.539 -7.557 8.009 491 HA HIS 79 HA HIS 79 18.163 -9.262 10.185 492 HB3 HIS 79 2HB HIS 79 20.283 -7.627 8.884 493 HD1 HIS 79 1HD HIS 79 20.489 -9.435 11.419 494 HD2 HIS 79 2HD HIS 79 21.131 -10.760 7.491 495 HE1 HIS 79 1HE HIS 79 21.955 -11.514 11.597 496 H ASN 80 H ASN 80 18.523 -5.726 9.506 497 HA ASN 80 HA ASN 80 19.849 -5.124 11.842 498 HB3 ASN 80 2HB ASN 80 17.871 -3.418 10.238 499 HD21 ASN 80 1HD2 ASN 80 21.077 -2.510 11.124 500 HD22 ASN 80 2HD2 ASN 80 20.697 -1.329 12.333 501 H LEU 81 H LEU 81 16.441 -5.779 11.082 502 HA LEU 81 HA LEU 81 15.605 -4.816 13.708 503 HB3 LEU 81 2HB LEU 81 13.508 -5.925 12.064 504 HG LEU 81 HG LEU 81 13.872 -2.982 12.513 505 HD11 LEU 81 1HD1 LEU 81 11.896 -3.196 11.437 506 HD12 LEU 81 2HD1 LEU 81 11.652 -4.874 11.977 507 HD13 LEU 81 3HD1 LEU 81 11.299 -3.524 13.081 508 HD21 LEU 81 3HD2 LEU 81 14.381 -3.542 14.681 509 HD22 LEU 81 1HD2 LEU 81 12.603 -3.483 14.756 510 HD23 LEU 81 2HD2 LEU 81 13.437 -5.051 14.634 511 H GLY 82 H GLY 82 14.442 -7.626 11.760 512 HA2 GLY 82 1HA GLY 82 13.928 -9.719 12.438 513 HA3 GLY 82 2HA GLY 82 15.580 -9.728 13.022 514 H VAL 83 H VAL 83 12.374 -8.319 14.026 515 HA VAL 83 HA VAL 83 13.034 -9.183 16.757 516 HB VAL 83 HB VAL 83 11.611 -7.352 17.515 517 HG11 VAL 83 1HG1 VAL 83 13.914 -6.680 15.675 518 HG12 VAL 83 2HG1 VAL 83 13.078 -5.434 16.634 519 HG13 VAL 83 3HG1 VAL 83 13.897 -6.786 17.452 520 HG21 VAL 83 3HG2 VAL 83 10.062 -6.526 16.133 521 HG22 VAL 83 1HG2 VAL 83 11.372 -5.669 15.285 522 HG23 VAL 83 2HG2 VAL 83 10.841 -7.269 14.716 523 H LEU 84 H LEU 84 11.190 -9.840 13.999 524 HA LEU 84 HA LEU 84 9.089 -11.054 15.657 525 HB3 LEU 84 2HB LEU 84 8.142 -10.876 13.041 526 HG LEU 84 HG LEU 84 7.578 -8.941 15.304 527 HD11 LEU 84 1HD1 LEU 84 6.458 -9.292 12.593 528 HD12 LEU 84 2HD1 LEU 84 5.264 -9.136 13.904 529 HD13 LEU 84 3HD1 LEU 84 6.486 -7.865 13.657 530 HD21 LEU 84 3HD2 LEU 84 7.095 -11.726 15.176 531 HD22 LEU 84 1HD2 LEU 84 6.509 -10.555 16.381 532 HD23 LEU 84 2HD2 LEU 84 5.529 -10.912 14.939 533 H ASN 85 H ASN 85 11.892 -11.955 14.748 534 HA ASN 85 HA ASN 85 11.563 -13.832 12.741 535 HB3 ASN 85 2HB ASN 85 13.774 -12.997 13.633 536 HD21 ASN 85 1HD2 ASN 85 14.246 -12.062 15.491 537 HD22 ASN 85 2HD2 ASN 85 14.343 -12.832 17.039 538 H ASP 86 H ASP 86 10.408 -13.683 16.001 539 HA ASP 86 HA ASP 86 10.560 -16.388 16.672 540 HB3 ASP 86 2HB ASP 86 8.648 -15.723 18.283 541 HD2 ASP 86 HD ASP 86 11.144 -16.354 19.024 542 H PHE 87 H PHE 87 8.534 -14.483 14.537 543 HA PHE 87 HA PHE 87 6.381 -16.430 14.577 544 HB3 PHE 87 2HB PHE 87 6.238 -14.375 12.505 545 HD1 PHE 87 2HD PHE 87 4.000 -15.364 12.408 546 HD2 PHE 87 1HD PHE 87 5.377 -13.404 15.910 547 HE1 PHE 87 2HE PHE 87 1.644 -15.241 13.263 548 HE2 PHE 87 1HE PHE 87 3.020 -13.280 16.767 549 HZ PHE 87 HZ PHE 87 1.182 -14.200 15.433 550 H LEU 88 H LEU 88 9.347 -15.782 12.907 551 HA LEU 88 HA LEU 88 8.415 -17.294 10.577 552 HB3 LEU 88 2HB LEU 88 10.389 -16.421 9.450 553 HG LEU 88 HG LEU 88 8.672 -14.326 10.788 554 HD11 LEU 88 1HD1 LEU 88 10.593 -13.071 10.424 555 HD12 LEU 88 2HD1 LEU 88 11.015 -13.954 8.937 556 HD13 LEU 88 3HD1 LEU 88 9.652 -12.810 8.935 557 HD21 LEU 88 3HD2 LEU 88 8.569 -15.895 8.286 558 HD22 LEU 88 1HD2 LEU 88 7.260 -15.183 9.260 559 HD23 LEU 88 2HD2 LEU 88 8.181 -14.165 8.127 560 H LEU 89 H LEU 89 9.718 -19.084 9.792 561 HA LEU 89 HA LEU 89 10.588 -20.736 11.898 562 HB3 LEU 89 2HB LEU 89 10.893 -22.369 10.275 563 HG LEU 89 HG LEU 89 8.984 -22.459 9.002 564 HD11 LEU 89 1HD1 LEU 89 7.880 -22.212 10.950 565 HD12 LEU 89 2HD1 LEU 89 8.686 -20.674 11.342 566 HD13 LEU 89 3HD1 LEU 89 7.320 -20.697 10.201 567 HD21 LEU 89 3HD2 LEU 89 8.228 -19.700 8.581 568 HD22 LEU 89 1HD2 LEU 89 9.867 -20.011 7.962 569 HD23 LEU 89 2HD2 LEU 89 8.499 -21.002 7.399 570 HA PRO 90 HA PRO 90 14.735 -19.564 12.182 571 HB3 PRO 90 2HB PRO 90 14.940 -20.548 14.253 572 HG3 PRO 90 2HG PRO 90 13.384 -22.191 14.698 573 HD3 PRO 90 2HD PRO 90 11.697 -21.550 13.274 574 H ASP 91 H ASP 91 17.074 -21.071 12.068 575 HA ASP 91 HA ASP 91 16.987 -21.619 9.216 576 HB3 ASP 91 2HB ASP 91 18.601 -19.885 10.149 577 HD2 ASP 91 HD ASP 91 20.313 -23.007 11.745 578 H SER 92 H SER 92 17.407 -22.978 12.427 579 HA SER 92 HA SER 92 18.970 -25.191 11.655 580 HB3 SER 92 2HB SER 92 19.085 -24.611 13.950 581 HG SER 92 HG SER 92 17.429 -23.737 14.975 582 H LYS 93 H LYS 93 15.448 -24.657 12.346 583 HA LYS 93 HA LYS 93 14.771 -27.340 11.666 584 HB3 LYS 93 2HB LYS 93 12.409 -26.026 11.620 585 HG3 LYS 93 2HG LYS 93 12.824 -26.215 14.330 586 HD3 LYS 93 2HD LYS 93 12.563 -28.628 12.479 587 HE3 LYS 93 2HE LYS 93 10.913 -28.425 14.928 588 HZ1 LYS 93 2HZ LYS 93 11.213 -30.446 13.554 589 HZ3 LYS 93 1HZ LYS 93 11.661 -30.716 15.096 590 H ASP 94 H ASP 94 15.703 -24.602 9.863 591 HA ASP 94 HA ASP 94 13.981 -25.198 7.652 592 HB3 ASP 94 2HB ASP 94 16.336 -23.443 7.200 593 HD2 ASP 94 HD ASP 94 12.548 -23.291 6.791 594 H GLU 95 H GLU 95 17.187 -25.954 8.915 595 HA GLU 95 HA GLU 95 19.012 -26.801 7.976 596 HB3 GLU 95 2HB GLU 95 17.990 -29.075 6.674 597 HG3 GLU 95 2HG GLU 95 18.134 -30.023 9.122 598 HE2 GLU 95 HE GLU 95 20.856 -27.956 7.529 599 H ILE 96 H ILE 96 19.326 -24.987 6.409 600 HA ILE 96 HA ILE 96 19.020 -25.990 3.669 601 HB ILE 96 HB ILE 96 18.663 -23.636 2.963 602 HG13 ILE 96 2HG1 ILE 96 18.925 -23.186 5.874 603 HG21 ILE 96 1HG2 ILE 96 16.396 -23.837 3.092 604 HG22 ILE 96 2HG2 ILE 96 16.860 -25.483 3.584 605 HG23 ILE 96 3HG2 ILE 96 16.415 -24.279 4.816 606 HD11 ILE 96 3HD1 ILE 96 19.144 -20.778 4.566 607 HD12 ILE 96 1HD1 ILE 96 20.498 -21.909 4.807 608 HD13 ILE 96 2HD1 ILE 96 19.598 -21.912 3.271 609 H GLU 97 H GLU 97 20.599 -24.766 2.146 610 HA GLU 97 HA GLU 97 23.057 -24.290 3.645 611 HB3 GLU 97 2HB GLU 97 24.277 -25.309 1.683 612 HG3 GLU 97 2HG GLU 97 22.617 -27.602 2.290 613 HE2 GLU 97 HE GLU 97 24.726 -29.086 3.787 614 H ASP 98 H ASP 98 24.592 -22.771 2.620 615 HA ASP 98 HA ASP 98 23.321 -20.529 1.675 616 HB3 ASP 98 2HB ASP 98 25.477 -19.578 1.533 617 HD2 ASP 98 HD ASP 98 25.427 -21.369 4.850 618 H GLU 99 H GLU 99 25.389 -23.006 -0.019 619 HA GLU 99 HA GLU 99 25.248 -21.900 -2.523 620 HB3 GLU 99 2HB GLU 99 25.238 -24.845 -2.543 621 HG3 GLU 99 2HG GLU 99 27.684 -23.134 -2.948 622 HE2 GLU 99 HE GLU 99 28.663 -25.107 -2.888 623 H LEU 100 H LEU 100 22.901 -23.861 -0.708 624 HA LEU 100 HA LEU 100 21.301 -24.451 -3.000 625 HB3 LEU 100 2HB LEU 100 20.354 -24.572 -0.158 626 HG LEU 100 HG LEU 100 18.926 -25.350 -2.157 627 HD11 LEU 100 1HD1 LEU 100 19.878 -26.743 -3.602 628 HD12 LEU 100 2HD1 LEU 100 21.289 -26.978 -2.543 629 HD13 LEU 100 3HD1 LEU 100 19.840 -27.990 -2.333 630 HD21 LEU 100 3HD2 LEU 100 18.926 -27.727 -0.570 631 HD22 LEU 100 1HD2 LEU 100 19.261 -26.334 0.487 632 HD23 LEU 100 2HD2 LEU 100 17.800 -26.349 -0.532 633 H SER 101 H SER 101 22.045 -21.574 -1.559 634 HA SER 101 HA SER 101 19.670 -20.382 -0.984 635 HB3 SER 101 2HB SER 101 21.766 -19.261 -0.541 636 HG SER 101 HG SER 101 23.223 -18.689 -2.112 637 H ASP 102 H ASP 102 18.118 -19.156 -2.212 638 HA ASP 102 HA ASP 102 18.350 -18.614 -4.887 639 HB3 ASP 102 2HB ASP 102 16.482 -20.974 -4.498 640 HD2 ASP 102 HD ASP 102 15.501 -21.385 -6.289 Start of MODEL 10 1 H1 ILE 1 H ILE 1 34.751 -22.868 12.594 2 HA ILE 1 HA ILE 1 33.035 -24.455 10.850 3 HB ILE 1 HB ILE 1 31.058 -23.203 11.599 4 HG13 ILE 1 2HG1 ILE 1 32.740 -21.420 12.727 5 HG21 ILE 1 1HG2 ILE 1 32.532 -24.985 13.532 6 HG22 ILE 1 2HG2 ILE 1 30.899 -24.369 13.885 7 HG23 ILE 1 3HG2 ILE 1 31.178 -25.376 12.444 8 HD11 ILE 1 3HD1 ILE 1 30.289 -21.143 12.284 9 HD12 ILE 1 1HD1 ILE 1 29.943 -22.076 13.760 10 HD13 ILE 1 2HD1 ILE 1 30.767 -20.503 13.875 11 H SER 2 H SER 2 32.710 -23.503 8.873 12 HA SER 2 HA SER 2 33.203 -20.675 8.664 13 HB3 SER 2 2HB SER 2 34.777 -21.011 6.731 14 HG SER 2 HG SER 2 36.134 -20.680 8.365 15 H GLY 3 H GLY 3 32.134 -19.733 6.826 16 HA2 GLY 3 1HA GLY 3 31.155 -21.009 4.605 17 HA3 GLY 3 2HA GLY 3 29.928 -21.258 5.831 18 H GLY 4 H GLY 4 29.315 -19.757 3.555 19 HA2 GLY 4 1HA GLY 4 29.765 -16.991 3.789 20 HA3 GLY 4 2HA GLY 4 28.493 -17.779 2.877 21 H SER 5 H SER 5 29.389 -16.272 5.961 22 HA SER 5 HA SER 5 26.956 -16.882 7.242 23 HB3 SER 5 2HB SER 5 27.919 -14.665 8.568 24 HG SER 5 HG SER 5 28.763 -17.426 8.717 25 H SER 6 H SER 6 28.143 -14.337 5.068 26 HA SER 6 HA SER 6 26.258 -12.403 5.668 27 HB3 SER 6 2HB SER 6 26.750 -11.814 3.105 28 HG SER 6 HG SER 6 27.678 -10.619 4.853 29 H ILE 7 H ILE 7 26.146 -15.366 3.703 30 HA ILE 7 HA ILE 7 23.822 -14.696 2.246 31 HB ILE 7 HB ILE 7 25.314 -17.228 2.845 32 HG13 ILE 7 2HG1 ILE 7 26.357 -16.831 0.915 33 HG21 ILE 7 1HG2 ILE 7 23.748 -18.314 1.160 34 HG22 ILE 7 2HG2 ILE 7 23.109 -18.053 2.800 35 HG23 ILE 7 3HG2 ILE 7 22.636 -16.960 1.476 36 HD11 ILE 7 3HD1 ILE 7 25.046 -16.028 -1.156 37 HD12 ILE 7 1HD1 ILE 7 24.601 -17.626 -0.510 38 HD13 ILE 7 2HD1 ILE 7 23.580 -16.209 -0.165 39 H SER 8 H SER 8 24.464 -16.012 5.485 40 HA SER 8 HA SER 8 22.297 -17.303 6.174 41 HB3 SER 8 2HB SER 8 22.482 -16.292 8.440 42 HG SER 8 HG SER 8 24.267 -17.452 8.572 43 H MET 9 H MET 9 22.436 -13.856 5.305 44 HA MET 9 HA MET 9 19.648 -13.566 6.052 45 HB3 MET 9 2HB MET 9 20.061 -11.198 5.963 46 HG3 MET 9 2HG MET 9 21.883 -12.838 7.384 47 HE1 MET 9 3HE MET 9 23.936 -11.019 8.713 48 HE2 MET 9 1HE MET 9 25.096 -10.155 7.675 49 HE3 MET 9 2HE MET 9 23.439 -9.534 7.866 50 H MET 10 H MET 10 21.853 -12.839 3.247 51 HA MET 10 HA MET 10 19.894 -12.197 1.464 52 HB3 MET 10 2HB MET 10 22.609 -13.574 1.122 53 HG3 MET 10 2HG MET 10 22.322 -12.439 -1.271 54 HE1 MET 10 3HE MET 10 20.870 -15.578 -3.218 55 HE2 MET 10 1HE MET 10 20.569 -13.833 -3.039 56 HE3 MET 10 2HE MET 10 22.198 -14.417 -3.452 57 H TYR 11 H TYR 11 20.610 -15.289 2.884 58 HA TYR 11 HA TYR 11 19.715 -16.923 0.746 59 HB3 TYR 11 2HB TYR 11 20.288 -17.051 3.731 60 HD1 TYR 11 2HD TYR 11 19.096 -19.457 1.093 61 HD2 TYR 11 1HD TYR 11 19.167 -18.398 5.239 62 HE1 TYR 11 2HE TYR 11 17.634 -21.465 1.639 63 HE2 TYR 11 1HE TYR 11 17.705 -20.409 5.769 64 HH TYR 11 HH TYR 11 15.892 -21.906 3.729 65 H LYS 12 H LYS 12 18.180 -16.092 3.943 66 HA LYS 12 HA LYS 12 15.801 -17.243 3.682 67 HB3 LYS 12 2HB LYS 12 15.442 -14.493 4.579 68 HG3 LYS 12 2HG LYS 12 14.149 -16.538 5.318 69 HD3 LYS 12 2HD LYS 12 16.018 -17.410 7.346 70 HE3 LYS 12 2HE LYS 12 15.655 -19.634 6.167 71 HZ1 LYS 12 2HZ LYS 12 13.096 -18.183 6.473 72 HZ3 LYS 12 1HZ LYS 12 14.004 -18.553 7.774 73 H TYR 13 H TYR 13 16.831 -14.217 2.015 74 HA TYR 13 HA TYR 13 14.437 -13.485 0.904 75 HB3 TYR 13 2HB TYR 13 17.379 -13.279 0.419 76 HD1 TYR 13 2HD TYR 13 14.359 -12.830 -1.762 77 HD2 TYR 13 1HD TYR 13 18.623 -13.114 -1.543 78 HE1 TYR 13 2HE TYR 13 14.500 -12.781 -4.300 79 HE2 TYR 13 1HE TYR 13 18.749 -13.064 -4.082 80 HH TYR 13 HH TYR 13 15.877 -13.303 -6.035 81 H CYS 14 H CYS 14 16.935 -15.715 -0.517 82 HA CYS 14 HA CYS 14 15.420 -16.288 -2.789 83 HB3 CYS 14 2HB CYS 14 17.004 -18.086 -3.180 84 HG CYS 14 HG CYS 14 18.610 -15.738 -1.509 85 H SER 15 H SER 15 15.819 -17.896 0.432 86 HA SER 15 HA SER 15 14.407 -20.154 -0.025 87 HB3 SER 15 2HB SER 15 13.857 -18.825 2.589 88 HG SER 15 HG SER 15 14.082 -20.851 3.254 89 H ARG 16 H ARG 16 13.274 -16.856 0.001 90 HA ARG 16 HA ARG 16 10.609 -17.490 0.704 91 HB3 ARG 16 2HB ARG 16 10.143 -15.133 0.121 92 HG3 ARG 16 2HG ARG 16 12.872 -14.716 1.197 93 HD3 ARG 16 2HD ARG 16 10.552 -14.435 3.000 94 HE ARG 16 HE ARG 16 12.354 -12.990 3.530 95 HH11 ARG 16 2HH2 ARG 16 11.245 -12.412 0.215 96 HH12 ARG 16 1HH2 ARG 16 12.133 -10.936 0.042 97 HH22 ARG 16 1HH ARG 16 13.470 -10.149 1.870 98 H LEU 17 H LEU 17 12.351 -18.448 -1.891 99 HA LEU 17 HA LEU 17 10.932 -17.609 -4.128 100 HB3 LEU 17 2HB LEU 17 12.372 -20.221 -3.643 101 HG LEU 17 HG LEU 17 10.963 -19.933 -5.819 102 HD11 LEU 17 1HD1 LEU 17 12.196 -17.543 -6.007 103 HD12 LEU 17 2HD1 LEU 17 13.304 -18.539 -6.981 104 HD13 LEU 17 3HD1 LEU 17 11.578 -18.452 -7.406 105 HD21 LEU 17 3HD2 LEU 17 13.607 -21.059 -5.303 106 HD22 LEU 17 1HD2 LEU 17 12.202 -21.758 -6.141 107 HD23 LEU 17 2HD2 LEU 17 13.330 -20.703 -7.024 108 HA PRO 18 HA PRO 18 7.179 -19.676 -3.232 109 HB3 PRO 18 2HB PRO 18 5.922 -17.782 -3.600 110 HG3 PRO 18 2HG PRO 18 7.035 -16.084 -4.694 111 HD3 PRO 18 2HD PRO 18 9.209 -16.613 -4.163 112 H HIS 19 H HIS 19 8.602 -19.444 -6.412 113 HA HIS 19 HA HIS 19 7.081 -21.458 -7.571 114 HB3 HIS 19 2HB HIS 19 9.656 -21.525 -8.725 115 HD1 HIS 19 1HD HIS 19 9.443 -20.940 -11.239 116 HD2 HIS 19 2HD HIS 19 6.057 -19.950 -8.968 117 HE1 HIS 19 1HE HIS 19 7.596 -20.388 -12.911 118 H ASP 20 H ASP 20 9.390 -21.577 -5.021 119 HA ASP 20 HA ASP 20 10.307 -24.202 -5.629 120 HB3 ASP 20 2HB ASP 20 10.503 -22.507 -3.095 121 HD2 ASP 20 HD ASP 20 11.909 -25.943 -4.016 122 H GLU 21 H GLU 21 9.180 -26.077 -5.076 123 HA GLU 21 HA GLU 21 6.750 -25.814 -3.647 124 HB3 GLU 21 2HB GLU 21 7.075 -28.511 -3.892 125 HG3 GLU 21 2HG GLU 21 6.462 -26.712 -6.278 126 HE2 GLU 21 HE GLU 21 4.828 -30.365 -5.811 127 H PHE 22 H PHE 22 10.087 -26.729 -2.910 128 HA PHE 22 HA PHE 22 9.580 -28.208 -0.587 129 HB3 PHE 22 2HB PHE 22 12.044 -26.779 -0.343 130 HD1 PHE 22 2HD PHE 22 11.823 -29.009 0.994 131 HD2 PHE 22 1HD PHE 22 12.438 -28.815 -3.201 132 HE1 PHE 22 2HE PHE 22 12.717 -31.355 1.017 133 HE2 PHE 22 1HE PHE 22 13.331 -31.160 -3.178 134 HZ PHE 22 HZ PHE 22 13.459 -32.403 -1.069 135 H PHE 23 H PHE 23 9.754 -24.713 -1.270 136 HA PHE 23 HA PHE 23 9.709 -24.137 1.582 137 HB3 PHE 23 2HB PHE 23 9.917 -22.527 -1.027 138 HD1 PHE 23 2HD PHE 23 10.889 -21.858 2.507 139 HD2 PHE 23 1HD PHE 23 8.712 -20.547 -0.892 140 HE1 PHE 23 2HE PHE 23 10.368 -19.698 3.674 141 HE2 PHE 23 1HE PHE 23 8.191 -18.387 0.275 142 HZ PHE 23 HZ PHE 23 9.026 -17.988 2.545 143 H GLN 24 H GLN 24 7.956 -23.194 2.650 144 HA GLN 24 HA GLN 24 5.454 -23.603 1.395 145 HB3 GLN 24 2HB GLN 24 5.072 -22.121 3.787 146 HG3 GLN 24 2HG GLN 24 3.833 -24.176 2.978 147 HE21 GLN 24 1HE2 GLN 24 3.921 -26.156 2.227 148 HE22 GLN 24 2HE2 GLN 24 5.235 -27.272 2.380 149 HA PRO 25 HA PRO 25 4.764 -19.571 -0.052 150 HB3 PRO 25 2HB PRO 25 2.957 -20.243 -1.312 151 HG3 PRO 25 2HG PRO 25 1.945 -22.183 -0.585 152 HD3 PRO 25 2HD PRO 25 3.694 -23.157 0.545 153 H LYS 26 H LYS 26 4.227 -17.370 0.401 154 HA LYS 26 HA LYS 26 2.797 -16.520 2.529 155 HB3 LYS 26 2HB LYS 26 5.292 -16.213 3.870 156 HG3 LYS 26 2HG LYS 26 2.576 -17.384 4.345 157 HD3 LYS 26 2HD LYS 26 4.889 -17.923 6.260 158 HE3 LYS 26 2HE LYS 26 2.702 -17.712 7.366 159 HZ1 LYS 26 2HZ LYS 26 0.873 -18.307 6.235 160 HZ3 LYS 26 1HZ LYS 26 1.329 -19.872 6.233 161 HA PRO 27 HA PRO 27 5.982 -13.327 1.134 162 HB3 PRO 27 2HB PRO 27 8.203 -13.879 1.389 163 HG3 PRO 27 2HG PRO 27 8.628 -16.144 1.483 164 HD3 PRO 27 2HD PRO 27 6.585 -16.913 2.205 165 H GLU 28 H GLU 28 6.373 -11.976 -0.814 166 HA GLU 28 HA GLU 28 5.201 -13.255 -3.133 167 HB3 GLU 28 2HB GLU 28 4.163 -10.566 -2.971 168 HG3 GLU 28 2HG GLU 28 2.953 -13.363 -2.888 169 HE2 GLU 28 HE GLU 28 -0.118 -11.933 -3.659 170 H PHE 29 H PHE 29 5.890 -12.342 -5.150 171 HA PHE 29 HA PHE 29 7.835 -10.169 -4.900 172 HB3 PHE 29 2HB PHE 29 8.687 -12.689 -5.088 173 HD1 PHE 29 1HD PHE 29 6.899 -14.163 -6.080 174 HD2 PHE 29 2HD PHE 29 9.310 -11.606 -8.459 175 HE1 PHE 29 1HE PHE 29 6.296 -15.494 -8.122 176 HE2 PHE 29 2HE PHE 29 8.708 -12.936 -10.500 177 HZ PHE 29 HZ PHE 29 7.208 -14.864 -10.307 178 H GLN 30 H GLN 30 7.639 -8.591 -6.453 179 HA GLN 30 HA GLN 30 6.190 -9.298 -8.857 180 HB3 GLN 30 2HB GLN 30 5.298 -6.683 -8.134 181 HG3 GLN 30 2HG GLN 30 3.218 -8.527 -7.612 182 HE21 GLN 30 1HE2 GLN 30 1.764 -7.138 -8.272 183 HE22 GLN 30 2HE2 GLN 30 1.703 -6.334 -9.804 184 H PHE 31 H PHE 31 6.956 -8.233 -10.702 185 HA PHE 31 HA PHE 31 9.116 -6.312 -10.184 186 HB3 PHE 31 2HB PHE 31 9.527 -8.675 -11.254 187 HD1 PHE 31 1HD PHE 31 9.123 -6.485 -14.179 188 HD2 PHE 31 2HD PHE 31 7.748 -9.978 -12.200 189 HE1 PHE 31 1HE PHE 31 7.875 -7.166 -16.248 190 HE2 PHE 31 2HE PHE 31 6.500 -10.660 -14.270 191 HZ PHE 31 HZ PHE 31 6.579 -9.245 -16.268 192 H LYS 32 H LYS 32 9.029 -4.310 -11.159 193 HA LYS 32 HA LYS 32 6.679 -3.852 -12.852 194 HB3 LYS 32 2HB LYS 32 7.948 -2.367 -10.667 195 HG3 LYS 32 2HG LYS 32 8.669 -1.050 -12.758 196 HD3 LYS 32 2HD LYS 32 6.624 -1.458 -14.115 197 HE3 LYS 32 2HE LYS 32 5.310 -0.639 -11.665 198 HZ1 LYS 32 2HZ LYS 32 3.816 0.986 -12.556 199 HZ3 LYS 32 1HZ LYS 32 4.446 0.895 -14.054 200 HA PRO 33 HA PRO 33 9.624 -3.429 -16.047 201 HB3 PRO 33 2HB PRO 33 8.402 -4.753 -17.480 202 HG3 PRO 33 2HG PRO 33 6.213 -5.099 -16.841 203 HD3 PRO 33 2HD PRO 33 6.390 -4.747 -14.575 204 H VAL 34 H VAL 34 10.856 -1.689 -16.310 205 HA VAL 34 HA VAL 34 9.351 0.763 -16.900 206 HB VAL 34 HB VAL 34 11.877 0.615 -15.254 207 HG11 VAL 34 1HG1 VAL 34 9.939 2.785 -16.021 208 HG12 VAL 34 2HG1 VAL 34 10.859 2.905 -14.502 209 HG13 VAL 34 3HG1 VAL 34 11.718 2.788 -16.057 210 HG21 VAL 34 3HG2 VAL 34 9.019 0.282 -14.442 211 HG22 VAL 34 1HG2 VAL 34 10.500 -0.428 -13.753 212 HG23 VAL 34 2HG2 VAL 34 10.074 1.262 -13.396 213 H ASP 35 H ASP 35 10.980 2.480 -17.862 214 HA ASP 35 HA ASP 35 11.873 1.414 -20.238 215 HB3 ASP 35 2HB ASP 35 13.348 3.791 -19.819 216 HD2 ASP 35 HD ASP 35 11.179 5.579 -20.211 217 H GLU 36 H GLU 36 14.009 0.844 -20.977 218 HA GLU 36 HA GLU 36 15.718 -0.174 -19.046 219 HB3 GLU 36 2HB GLU 36 17.326 -0.373 -21.056 220 HG3 GLU 36 2HG GLU 36 14.870 -1.518 -22.150 221 HE2 GLU 36 HE GLU 36 16.118 -3.608 -23.065 222 H PHE 37 H PHE 37 15.190 3.049 -20.022 223 HA PHE 37 HA PHE 37 17.791 4.068 -20.010 224 HB3 PHE 37 2HB PHE 37 16.253 6.145 -19.152 225 HD1 PHE 37 2HD PHE 37 17.964 6.599 -21.043 226 HD2 PHE 37 1HD PHE 37 14.141 4.881 -21.704 227 HE1 PHE 37 2HE PHE 37 18.078 7.278 -23.457 228 HE2 PHE 37 1HE PHE 37 14.254 5.560 -24.119 229 HZ PHE 37 HZ PHE 37 16.221 6.749 -24.966 230 H GLY 38 H GLY 38 16.048 2.565 -17.505 231 HA2 GLY 38 1HA GLY 38 17.817 3.808 -15.503 232 HA3 GLY 38 2HA GLY 38 16.095 3.684 -15.200 233 H GLY 39 H GLY 39 15.478 1.162 -16.339 234 HA2 GLY 39 1HA GLY 39 16.760 -1.057 -16.145 235 HA3 GLY 39 2HA GLY 39 16.897 -0.605 -14.458 236 H THR 40 H THR 40 15.531 -2.000 -13.385 237 HA THR 40 HA THR 40 12.707 -1.879 -14.179 238 HB THR 40 HB THR 40 14.474 -4.325 -13.737 239 HG1 THR 40 1HG THR 40 12.482 -3.316 -15.642 240 HG21 THR 40 3HG2 THR 40 11.497 -3.975 -13.324 241 HG22 THR 40 1HG2 THR 40 12.064 -5.437 -14.165 242 HG23 THR 40 2HG2 THR 40 12.619 -5.091 -12.510 243 H ILE 41 H ILE 41 11.192 -2.275 -12.453 244 HA ILE 41 HA ILE 41 12.370 -1.494 -9.898 245 HB ILE 41 HB ILE 41 9.551 -1.358 -10.967 246 HG13 ILE 41 2HG1 ILE 41 11.040 0.285 -11.967 247 HG21 ILE 41 1HG2 ILE 41 9.908 -1.830 -8.427 248 HG22 ILE 41 2HG2 ILE 41 10.410 -0.123 -8.370 249 HG23 ILE 41 3HG2 ILE 41 8.782 -0.553 -8.945 250 HD11 ILE 41 3HD1 ILE 41 9.012 1.376 -11.727 251 HD12 ILE 41 1HD1 ILE 41 8.957 1.108 -9.969 252 HD13 ILE 41 2HD1 ILE 41 9.991 2.390 -10.642 253 H CYS 42 H CYS 42 11.893 -2.633 -7.950 254 HA CYS 42 HA CYS 42 10.925 -5.352 -8.465 255 HB3 CYS 42 2HB CYS 42 13.049 -5.868 -7.847 256 HG CYS 42 HG CYS 42 14.020 -3.508 -8.057 257 H ARG 43 H ARG 43 9.115 -5.949 -7.291 258 HA ARG 43 HA ARG 43 8.434 -4.190 -5.073 259 HB3 ARG 43 2HB ARG 43 6.592 -5.560 -7.094 260 HG3 ARG 43 2HG ARG 43 5.868 -3.842 -4.673 261 HD3 ARG 43 2HD ARG 43 4.451 -4.523 -7.139 262 HE ARG 43 HE ARG 43 3.225 -6.273 -6.124 263 HH11 ARG 43 2HH2 ARG 43 3.351 -3.465 -3.968 264 HH12 ARG 43 1HH2 ARG 43 2.144 -4.082 -2.890 265 HH22 ARG 43 1HH ARG 43 1.147 -6.215 -3.342 266 H ILE 44 H ILE 44 8.794 -5.350 -3.198 267 HA ILE 44 HA ILE 44 7.901 -8.150 -3.206 268 HB ILE 44 HB ILE 44 10.494 -7.137 -2.806 269 HG13 ILE 44 2HG1 ILE 44 9.187 -9.836 -2.451 270 HG21 ILE 44 1HG2 ILE 44 9.527 -8.379 -0.232 271 HG22 ILE 44 2HG2 ILE 44 11.087 -7.596 -0.580 272 HG23 ILE 44 3HG2 ILE 44 9.605 -6.617 -0.469 273 HD11 ILE 44 3HD1 ILE 44 11.341 -9.302 -4.434 274 HD12 ILE 44 1HD1 ILE 44 9.815 -10.196 -4.626 275 HD13 ILE 44 2HD1 ILE 44 9.822 -8.418 -4.716 276 H THR 45 H THR 45 6.637 -8.831 -1.472 277 HA THR 45 HA THR 45 6.214 -6.942 0.708 278 HB THR 45 HB THR 45 4.553 -6.299 -1.026 279 HG1 THR 45 1HG THR 45 2.999 -6.352 0.589 280 HG21 THR 45 3HG2 THR 45 3.087 -7.804 -2.056 281 HG22 THR 45 1HG2 THR 45 4.503 -8.868 -1.884 282 HG23 THR 45 2HG2 THR 45 3.171 -8.961 -0.707 283 H LEU 46 H LEU 46 6.613 -8.070 2.497 284 HA LEU 46 HA LEU 46 6.312 -10.931 2.441 285 HB3 LEU 46 2HB LEU 46 7.008 -10.432 4.960 286 HG LEU 46 HG LEU 46 9.056 -9.951 2.789 287 HD11 LEU 46 1HD1 LEU 46 9.564 -9.673 5.308 288 HD12 LEU 46 2HD1 LEU 46 9.469 -11.450 5.366 289 HD13 LEU 46 3HD1 LEU 46 10.664 -10.656 4.313 290 HD21 LEU 46 3HD2 LEU 46 7.991 -11.875 1.994 291 HD22 LEU 46 1HD2 LEU 46 9.365 -12.495 2.939 292 HD23 LEU 46 2HD2 LEU 46 7.726 -12.522 3.631 293 HA PRO 47 HA PRO 47 2.492 -11.148 4.438 294 HB3 PRO 47 2HB PRO 47 2.471 -13.450 4.402 295 HG3 PRO 47 2HG PRO 47 4.557 -14.431 4.338 296 HD3 PRO 47 2HD PRO 47 5.783 -12.722 3.410 297 H ALA 48 H ALA 48 1.233 -11.336 6.614 298 HA ALA 48 HA ALA 48 2.131 -9.130 8.115 299 HB1 ALA 48 1HB ALA 48 -0.233 -9.690 7.865 300 HB2 ALA 48 2HB ALA 48 0.025 -11.259 8.663 301 HB3 ALA 48 3HB ALA 48 0.212 -9.750 9.587 302 H ASN 49 H ASN 49 2.779 -12.584 8.216 303 HA ASN 49 HA ASN 49 3.449 -12.722 10.921 304 HB3 ASN 49 2HB ASN 49 2.993 -14.701 9.402 305 HD21 ASN 49 1HD2 ASN 49 3.598 -16.030 7.764 306 HD22 ASN 49 2HD2 ASN 49 4.838 -15.664 6.610 307 H ALA 50 H ALA 50 4.846 -11.035 8.319 308 HA ALA 50 HA ALA 50 7.508 -11.130 9.568 309 HB1 ALA 50 1HB ALA 50 8.284 -11.653 7.527 310 HB2 ALA 50 2HB ALA 50 6.648 -11.535 6.837 311 HB3 ALA 50 3HB ALA 50 7.680 -10.088 6.931 312 HA PRO 51 HA PRO 51 6.916 -6.908 10.311 313 HB3 PRO 51 2HB PRO 51 8.550 -6.893 11.932 314 HG3 PRO 51 2HG PRO 51 10.082 -8.610 11.772 315 HD3 PRO 51 2HD PRO 51 8.835 -10.161 10.618 316 H ILE 52 H ILE 52 10.018 -6.361 8.881 317 HA ILE 52 HA ILE 52 8.613 -4.890 6.768 318 HB ILE 52 HB ILE 52 11.080 -3.898 6.646 319 HG13 ILE 52 2HG1 ILE 52 10.790 -4.705 9.555 320 HG21 ILE 52 1HG2 ILE 52 9.881 -2.086 7.080 321 HG22 ILE 52 2HG2 ILE 52 8.562 -3.102 7.709 322 HG23 ILE 52 3HG2 ILE 52 9.835 -2.515 8.807 323 HD11 ILE 52 3HD1 ILE 52 12.771 -6.024 9.215 324 HD12 ILE 52 1HD1 ILE 52 11.661 -6.463 7.895 325 HD13 ILE 52 2HD1 ILE 52 13.019 -5.355 7.585 326 H SER 53 H SER 53 10.214 -4.687 4.722 327 HA SER 53 HA SER 53 12.033 -6.322 3.926 328 HB3 SER 53 2HB SER 53 10.476 -8.298 2.892 329 HG SER 53 HG SER 53 12.403 -8.270 4.553 330 H GLU 54 H GLU 54 8.926 -4.851 3.399 331 HA GLU 54 HA GLU 54 8.541 -5.224 0.727 332 HB3 GLU 54 2HB GLU 54 6.807 -4.138 1.902 333 HG3 GLU 54 2HG GLU 54 8.015 -1.609 2.663 334 HE2 GLU 54 HE GLU 54 6.881 -3.247 5.875 335 H ILE 55 H ILE 55 9.282 -4.234 -1.190 336 HA ILE 55 HA ILE 55 11.207 -2.083 -0.943 337 HB ILE 55 HB ILE 55 12.791 -3.372 -2.449 338 HG13 ILE 55 2HG1 ILE 55 10.924 -5.576 -1.635 339 HG21 ILE 55 1HG2 ILE 55 13.908 -4.452 -0.532 340 HG22 ILE 55 2HG2 ILE 55 13.340 -2.807 -0.158 341 HG23 ILE 55 3HG2 ILE 55 12.434 -4.219 0.438 342 HD11 ILE 55 3HD1 ILE 55 12.219 -6.148 -4.043 343 HD12 ILE 55 1HD1 ILE 55 10.605 -5.415 -3.881 344 HD13 ILE 55 2HD1 ILE 55 12.037 -4.378 -4.087 345 H GLU 56 H GLU 56 10.784 -0.597 -2.491 346 HA GLU 56 HA GLU 56 9.722 -1.572 -4.998 347 HB3 GLU 56 2HB GLU 56 7.877 0.026 -5.011 348 HG3 GLU 56 2HG GLU 56 7.561 -1.033 -2.230 349 HE2 GLU 56 HE GLU 56 4.382 -1.554 -2.969 350 H SER 57 H SER 57 11.841 -1.032 -5.831 351 HA SER 57 HA SER 57 11.982 1.603 -6.748 352 HB3 SER 57 2HB SER 57 14.509 1.497 -5.467 353 HG SER 57 HG SER 57 13.911 3.490 -4.928 354 H SER 58 H SER 58 13.161 1.581 -8.667 355 HA SER 58 HA SER 58 14.202 -0.932 -9.455 356 HB3 SER 58 2HB SER 58 13.316 0.052 -11.322 357 HG SER 58 HG SER 58 12.779 2.145 -11.415 358 H LEU 59 H LEU 59 16.458 -1.003 -10.609 359 HA LEU 59 HA LEU 59 18.445 0.825 -9.966 360 HB3 LEU 59 2HB LEU 59 18.486 -1.556 -8.113 361 HG LEU 59 HG LEU 59 20.077 -0.130 -6.813 362 HD11 LEU 59 1HD1 LEU 59 20.572 -1.645 -9.220 363 HD12 LEU 59 2HD1 LEU 59 21.805 -0.378 -9.010 364 HD13 LEU 59 3HD1 LEU 59 21.514 -1.562 -7.712 365 HD21 LEU 59 3HD2 LEU 59 20.915 1.863 -7.533 366 HD22 LEU 59 1HD2 LEU 59 20.679 1.474 -9.254 367 HD23 LEU 59 2HD2 LEU 59 19.289 1.956 -8.253 368 H LEU 60 H LEU 60 17.419 -2.538 -10.597 369 HA LEU 60 HA LEU 60 19.811 -2.827 -12.278 370 HB3 LEU 60 2HB LEU 60 19.002 -5.344 -12.029 371 HG LEU 60 HG LEU 60 20.623 -5.776 -10.420 372 HD11 LEU 60 1HD1 LEU 60 22.530 -4.498 -11.024 373 HD12 LEU 60 2HD1 LEU 60 21.470 -4.548 -12.453 374 HD13 LEU 60 3HD1 LEU 60 21.539 -3.082 -11.446 375 HD21 LEU 60 3HD2 LEU 60 19.538 -3.403 -9.113 376 HD22 LEU 60 1HD2 LEU 60 20.344 -4.832 -8.422 377 HD23 LEU 60 2HD2 LEU 60 21.315 -3.476 -9.042 378 HA PRO 61 HA PRO 61 17.110 -2.918 -15.648 379 HB3 PRO 61 2HB PRO 61 18.800 -2.346 -17.102 380 HG3 PRO 61 2HG PRO 61 20.927 -2.799 -16.333 381 HD3 PRO 61 2HD PRO 61 20.551 -2.791 -14.065 382 H SER 62 H SER 62 17.852 -5.522 -13.884 383 HA SER 62 HA SER 62 16.211 -7.192 -15.625 384 HB3 SER 62 2HB SER 62 17.650 -8.727 -13.623 385 HG SER 62 HG SER 62 18.386 -8.756 -16.371 386 H THR 63 H THR 63 14.508 -8.429 -14.611 387 HA THR 63 HA THR 63 13.418 -7.169 -12.293 388 HB THR 63 HB THR 63 12.667 -9.293 -14.295 389 HG1 THR 63 1HG THR 63 11.204 -7.636 -14.640 390 HG21 THR 63 3HG2 THR 63 11.479 -8.984 -11.500 391 HG22 THR 63 1HG2 THR 63 10.488 -9.523 -12.877 392 HG23 THR 63 2HG2 THR 63 11.890 -10.490 -12.357 393 H GLU 64 H GLU 64 14.793 -10.451 -12.970 394 HA GLU 64 HA GLU 64 14.412 -11.379 -10.399 395 HB3 GLU 64 2HB GLU 64 16.709 -12.684 -11.348 396 HG3 GLU 64 2HG GLU 64 14.568 -14.030 -12.531 397 HE2 GLU 64 HE GLU 64 14.103 -15.285 -9.259 398 H ALA 65 H ALA 65 16.996 -9.397 -11.869 399 HA ALA 65 HA ALA 65 18.734 -9.654 -9.608 400 HB1 ALA 65 1HB ALA 65 19.266 -9.165 -12.127 401 HB2 ALA 65 2HB ALA 65 18.886 -7.480 -11.699 402 HB3 ALA 65 3HB ALA 65 20.206 -8.335 -10.864 403 H ALA 66 H ALA 66 16.597 -7.060 -10.985 404 HA ALA 66 HA ALA 66 17.056 -5.141 -9.084 405 HB1 ALA 66 1HB ALA 66 14.752 -4.346 -9.715 406 HB2 ALA 66 2HB ALA 66 15.795 -4.715 -11.110 407 HB3 ALA 66 3HB ALA 66 14.528 -5.864 -10.616 408 H LYS 67 H LYS 67 14.792 -7.952 -9.007 409 HA LYS 67 HA LYS 67 13.673 -7.226 -6.511 410 HB3 LYS 67 2HB LYS 67 12.566 -8.650 -8.230 411 HG3 LYS 67 2HG LYS 67 14.682 -10.635 -7.292 412 HD3 LYS 67 2HD LYS 67 12.844 -11.725 -9.242 413 HE3 LYS 67 2HE LYS 67 14.388 -12.684 -7.197 414 HZ1 LYS 67 2HZ LYS 67 12.565 -11.822 -5.638 415 HZ3 LYS 67 1HZ LYS 67 13.023 -13.370 -5.423 416 H LYS 68 H LYS 68 16.365 -9.378 -7.568 417 HA LYS 68 HA LYS 68 16.873 -10.479 -5.058 418 HB3 LYS 68 2HB LYS 68 18.577 -10.057 -7.519 419 HG3 LYS 68 2HG LYS 68 19.277 -11.144 -4.798 420 HD3 LYS 68 2HD LYS 68 19.453 -12.751 -7.173 421 HE3 LYS 68 2HE LYS 68 21.911 -13.149 -7.234 422 HZ1 LYS 68 2HZ LYS 68 21.081 -10.348 -7.771 423 HZ3 LYS 68 1HZ LYS 68 21.075 -11.576 -8.840 424 H ASP 69 H ASP 69 18.024 -7.463 -6.656 425 HA ASP 69 HA ASP 69 19.916 -6.800 -4.788 426 HB3 ASP 69 2HB ASP 69 18.128 -4.720 -6.085 427 HD2 ASP 69 HD ASP 69 19.028 -2.878 -6.072 428 H ALA 70 H ALA 70 16.522 -5.487 -5.135 429 HA ALA 70 HA ALA 70 16.464 -4.149 -2.712 430 HB1 ALA 70 1HB ALA 70 13.852 -4.770 -3.134 431 HB2 ALA 70 2HB ALA 70 14.718 -3.505 -4.036 432 HB3 ALA 70 3HB ALA 70 14.518 -5.125 -4.745 433 H CYS 71 H CYS 71 15.658 -7.553 -3.569 434 HA CYS 71 HA CYS 71 14.487 -8.292 -1.200 435 HB3 CYS 71 2HB CYS 71 15.642 -10.603 -1.847 436 HG CYS 71 HG CYS 71 13.329 -11.021 -2.176 437 H LEU 72 H LEU 72 17.954 -8.045 -2.175 438 HA LEU 72 HA LEU 72 19.041 -9.213 0.106 439 HB3 LEU 72 2HB LEU 72 21.072 -7.856 -0.553 440 HG LEU 72 HG LEU 72 20.410 -8.943 -3.157 441 HD11 LEU 72 1HD1 LEU 72 22.671 -8.635 -2.045 442 HD12 LEU 72 2HD1 LEU 72 22.285 -10.077 -1.075 443 HD13 LEU 72 3HD1 LEU 72 22.388 -10.198 -2.848 444 HD21 LEU 72 3HD2 LEU 72 19.883 -10.768 -0.794 445 HD22 LEU 72 1HD2 LEU 72 18.678 -10.188 -1.970 446 HD23 LEU 72 2HD2 LEU 72 19.993 -11.264 -2.500 447 H LYS 73 H LYS 73 18.069 -5.820 -0.634 448 HA LYS 73 HA LYS 73 19.043 -4.790 1.807 449 HB3 LYS 73 2HB LYS 73 16.799 -3.411 0.441 450 HG3 LYS 73 2HG LYS 73 19.664 -2.539 1.014 451 HD3 LYS 73 2HD LYS 73 17.616 -1.270 -0.373 452 HE3 LYS 73 2HE LYS 73 17.090 -0.967 2.480 453 HZ1 LYS 73 2HZ LYS 73 16.908 1.664 1.578 454 HZ3 LYS 73 1HZ LYS 73 18.447 1.209 1.305 455 H ALA 74 H ALA 74 15.927 -6.197 0.719 456 HA ALA 74 HA ALA 74 14.520 -5.492 3.069 457 HB1 ALA 74 1HB ALA 74 13.272 -5.941 1.089 458 HB2 ALA 74 2HB ALA 74 14.095 -7.499 0.832 459 HB3 ALA 74 3HB ALA 74 12.945 -7.310 2.178 460 H VAL 75 H VAL 75 16.410 -8.365 1.991 461 HA VAL 75 HA VAL 75 15.740 -10.042 4.093 462 HB VAL 75 HB VAL 75 17.488 -9.988 1.873 463 HG11 VAL 75 1HG1 VAL 75 18.894 -10.594 4.484 464 HG12 VAL 75 2HG1 VAL 75 19.436 -11.264 2.926 465 HG13 VAL 75 3HG1 VAL 75 19.404 -9.502 3.174 466 HG21 VAL 75 3HG2 VAL 75 16.764 -12.205 3.819 467 HG22 VAL 75 1HG2 VAL 75 15.880 -11.750 2.342 468 HG23 VAL 75 2HG2 VAL 75 17.514 -12.445 2.223 469 H HIS 76 H HIS 76 18.310 -7.524 3.787 470 HA HIS 76 HA HIS 76 19.453 -8.084 6.289 471 HB3 HIS 76 2HB HIS 76 19.980 -5.403 5.702 472 HD1 HIS 76 1HD HIS 76 22.077 -6.042 7.072 473 HD2 HIS 76 2HD HIS 76 21.697 -8.160 3.471 474 HE1 HIS 76 1HE HIS 76 24.304 -7.233 6.705 475 H GLU 77 H GLU 77 16.999 -5.675 5.161 476 HA GLU 77 HA GLU 77 16.719 -4.376 7.562 477 HB3 GLU 77 2HB GLU 77 14.321 -3.913 6.627 478 HG3 GLU 77 2HG GLU 77 16.188 -3.178 4.454 479 HE2 GLU 77 HE GLU 77 15.813 -0.492 6.745 480 H LEU 78 H LEU 78 15.480 -7.511 6.447 481 HA LEU 78 HA LEU 78 13.616 -7.712 8.636 482 HB3 LEU 78 2HB LEU 78 14.479 -9.733 6.563 483 HG LEU 78 HG LEU 78 12.033 -10.519 7.016 484 HD11 LEU 78 1HD1 LEU 78 13.262 -12.302 7.504 485 HD12 LEU 78 2HD1 LEU 78 14.608 -11.297 8.094 486 HD13 LEU 78 3HD1 LEU 78 13.282 -11.744 9.194 487 HD21 LEU 78 3HD2 LEU 78 11.407 -10.376 9.418 488 HD22 LEU 78 1HD2 LEU 78 12.720 -9.197 9.654 489 HD23 LEU 78 2HD2 LEU 78 11.361 -8.810 8.571 490 H HIS 79 H HIS 79 16.918 -8.753 7.767 491 HA HIS 79 HA HIS 79 17.122 -10.582 9.924 492 HB3 HIS 79 2HB HIS 79 19.565 -9.371 8.738 493 HD1 HIS 79 1HD HIS 79 20.783 -10.804 10.564 494 HD2 HIS 79 2HD HIS 79 18.363 -13.012 7.943 495 HE1 HIS 79 1HE HIS 79 21.406 -13.254 10.909 496 H ASN 80 H ASN 80 18.187 -7.174 9.331 497 HA ASN 80 HA ASN 80 19.495 -6.886 11.745 498 HB3 ASN 80 2HB ASN 80 18.259 -4.379 10.989 499 HD21 ASN 80 1HD2 ASN 80 20.825 -5.747 9.072 500 HD22 ASN 80 2HD2 ASN 80 22.166 -4.997 9.872 501 H LEU 81 H LEU 81 16.070 -6.500 10.716 502 HA LEU 81 HA LEU 81 15.298 -5.451 13.295 503 HB3 LEU 81 2HB LEU 81 13.402 -6.282 11.130 504 HG LEU 81 HG LEU 81 13.076 -3.617 12.215 505 HD11 LEU 81 1HD1 LEU 81 11.515 -5.659 11.141 506 HD12 LEU 81 2HD1 LEU 81 10.971 -5.521 12.831 507 HD13 LEU 81 3HD1 LEU 81 10.951 -4.092 11.768 508 HD21 LEU 81 3HD2 LEU 81 13.241 -5.891 14.191 509 HD22 LEU 81 1HD2 LEU 81 13.995 -4.280 14.270 510 HD23 LEU 81 2HD2 LEU 81 12.235 -4.451 14.481 511 H GLY 82 H GLY 82 13.925 -8.163 11.315 512 HA2 GLY 82 1HA GLY 82 12.947 -10.080 12.028 513 HA3 GLY 82 2HA GLY 82 14.510 -10.331 12.781 514 H VAL 83 H VAL 83 11.646 -8.178 13.446 515 HA VAL 83 HA VAL 83 11.966 -8.758 16.272 516 HB VAL 83 HB VAL 83 11.524 -6.465 15.042 517 HG11 VAL 83 1HG1 VAL 83 8.687 -7.366 15.622 518 HG12 VAL 83 2HG1 VAL 83 9.217 -5.814 14.931 519 HG13 VAL 83 3HG1 VAL 83 9.403 -7.315 13.994 520 HG21 VAL 83 3HG2 VAL 83 11.263 -5.627 17.121 521 HG22 VAL 83 1HG2 VAL 83 9.844 -6.644 17.466 522 HG23 VAL 83 2HG2 VAL 83 11.483 -7.317 17.635 523 H LEU 84 H LEU 84 10.334 -10.010 13.543 524 HA LEU 84 HA LEU 84 8.428 -11.337 15.334 525 HB3 LEU 84 2HB LEU 84 6.863 -11.346 13.340 526 HG LEU 84 HG LEU 84 7.516 -8.734 14.716 527 HD11 LEU 84 1HD1 LEU 84 5.151 -9.294 12.905 528 HD12 LEU 84 2HD1 LEU 84 5.443 -7.812 13.849 529 HD13 LEU 84 3HD1 LEU 84 6.536 -8.247 12.513 530 HD21 LEU 84 3HD2 LEU 84 4.952 -10.166 15.140 531 HD22 LEU 84 1HD2 LEU 84 6.418 -10.947 15.779 532 HD23 LEU 84 2HD2 LEU 84 5.995 -9.295 16.291 533 H ASN 85 H ASN 85 11.215 -11.705 13.736 534 HA ASN 85 HA ASN 85 10.708 -13.814 11.998 535 HB3 ASN 85 2HB ASN 85 13.262 -13.316 13.613 536 HD21 ASN 85 1HD2 ASN 85 15.076 -13.445 11.797 537 HD22 ASN 85 2HD2 ASN 85 15.083 -14.924 10.894 538 H ASP 86 H ASP 86 10.608 -13.525 15.443 539 HA ASP 86 HA ASP 86 11.609 -15.989 16.209 540 HB3 ASP 86 2HB ASP 86 11.128 -14.112 17.769 541 HD2 ASP 86 HD ASP 86 8.324 -12.718 18.689 542 H PHE 87 H PHE 87 8.664 -14.981 14.592 543 HA PHE 87 HA PHE 87 7.242 -17.401 15.341 544 HB3 PHE 87 2HB PHE 87 5.925 -15.808 13.318 545 HD1 PHE 87 2HD PHE 87 4.899 -17.912 14.910 546 HD2 PHE 87 1HD PHE 87 5.189 -13.796 15.901 547 HE1 PHE 87 2HE PHE 87 2.998 -18.167 16.529 548 HE2 PHE 87 1HE PHE 87 3.287 -14.051 17.519 549 HZ PHE 87 HZ PHE 87 2.214 -16.234 17.814 550 H LEU 88 H LEU 88 9.366 -16.206 12.875 551 HA LEU 88 HA LEU 88 8.378 -18.245 11.010 552 HB3 LEU 88 2HB LEU 88 9.565 -16.994 9.285 553 HG LEU 88 HG LEU 88 7.705 -15.272 10.941 554 HD11 LEU 88 1HD1 LEU 88 8.379 -14.709 8.065 555 HD12 LEU 88 2HD1 LEU 88 7.647 -13.645 9.290 556 HD13 LEU 88 3HD1 LEU 88 9.377 -14.050 9.383 557 HD21 LEU 88 3HD2 LEU 88 6.082 -16.501 10.068 558 HD22 LEU 88 1HD2 LEU 88 6.607 -16.036 8.432 559 HD23 LEU 88 2HD2 LEU 88 7.276 -17.495 9.201 560 H LEU 89 H LEU 89 9.949 -19.648 9.969 561 HA LEU 89 HA LEU 89 11.900 -20.551 11.808 562 HB3 LEU 89 2HB LEU 89 12.255 -22.307 10.313 563 HG LEU 89 HG LEU 89 9.487 -21.442 10.577 564 HD11 LEU 89 1HD1 LEU 89 10.010 -21.739 7.967 565 HD12 LEU 89 2HD1 LEU 89 9.724 -23.444 8.392 566 HD13 LEU 89 3HD1 LEU 89 8.467 -22.223 8.710 567 HD21 LEU 89 3HD2 LEU 89 11.164 -23.795 11.033 568 HD22 LEU 89 1HD2 LEU 89 9.732 -23.211 11.915 569 HD23 LEU 89 2HD2 LEU 89 9.531 -24.198 10.447 570 HA PRO 90 HA PRO 90 15.071 -17.886 10.481 571 HB3 PRO 90 2HB PRO 90 15.810 -17.563 12.638 572 HG3 PRO 90 2HG PRO 90 15.054 -19.124 14.158 573 HD3 PRO 90 2HD PRO 90 13.140 -19.832 13.098 574 H ASP 91 H ASP 91 17.800 -18.485 10.456 575 HA ASP 91 HA ASP 91 17.702 -20.371 8.251 576 HB3 ASP 91 2HB ASP 91 18.669 -17.969 8.045 577 HD2 ASP 91 HD ASP 91 21.721 -18.622 7.761 578 H SER 92 H SER 92 18.832 -19.807 11.528 579 HA SER 92 HA SER 92 21.016 -21.590 11.429 580 HB3 SER 92 2HB SER 92 20.283 -21.420 14.105 581 HG SER 92 HG SER 92 21.827 -19.612 12.458 582 H LYS 93 H LYS 93 17.613 -21.746 12.680 583 HA LYS 93 HA LYS 93 17.819 -24.412 13.562 584 HB3 LYS 93 2HB LYS 93 15.152 -24.034 13.159 585 HG3 LYS 93 2HG LYS 93 17.023 -23.099 15.367 586 HD3 LYS 93 2HD LYS 93 14.098 -22.596 15.022 587 HE3 LYS 93 2HE LYS 93 14.317 -22.727 17.788 588 HZ1 LYS 93 2HZ LYS 93 13.020 -24.303 15.724 589 HZ3 LYS 93 1HZ LYS 93 12.370 -23.610 17.045 590 H ASP 94 H ASP 94 17.732 -22.999 10.424 591 HA ASP 94 HA ASP 94 16.436 -25.269 9.245 592 HB3 ASP 94 2HB ASP 94 17.894 -23.421 7.451 593 HD2 ASP 94 HD ASP 94 14.338 -22.740 6.998 594 H GLU 95 H GLU 95 19.599 -24.202 10.222 595 HA GLU 95 HA GLU 95 21.658 -24.743 9.627 596 HB3 GLU 95 2HB GLU 95 21.679 -27.503 9.548 597 HG3 GLU 95 2HG GLU 95 21.203 -26.713 12.275 598 HE2 GLU 95 HE GLU 95 23.999 -25.935 10.499 599 H ILE 96 H ILE 96 21.532 -23.788 7.427 600 HA ILE 96 HA ILE 96 21.731 -25.901 5.401 601 HB ILE 96 HB ILE 96 20.721 -24.320 3.789 602 HG13 ILE 96 2HG1 ILE 96 20.769 -22.552 6.130 603 HG21 ILE 96 1HG2 ILE 96 19.415 -25.838 5.866 604 HG22 ILE 96 2HG2 ILE 96 18.406 -24.455 5.379 605 HG23 ILE 96 3HG2 ILE 96 18.964 -25.623 4.158 606 HD11 ILE 96 3HD1 ILE 96 20.389 -20.880 4.213 607 HD12 ILE 96 1HD1 ILE 96 21.875 -21.856 4.115 608 HD13 ILE 96 2HD1 ILE 96 20.466 -22.277 3.113 609 H GLU 97 H GLU 97 22.894 -24.900 3.348 610 HA GLU 97 HA GLU 97 25.222 -23.550 4.445 611 HB3 GLU 97 2HB GLU 97 26.350 -24.396 2.330 612 HG3 GLU 97 2HG GLU 97 25.408 -26.951 3.284 613 HE2 GLU 97 HE GLU 97 27.586 -27.825 2.752 614 H ASP 98 H ASP 98 26.267 -21.824 3.147 615 HA ASP 98 HA ASP 98 24.466 -19.919 2.363 616 HB3 ASP 98 2HB ASP 98 27.009 -19.767 2.971 617 HD2 ASP 98 HD ASP 98 26.721 -19.096 -0.388 618 H GLU 99 H GLU 99 26.242 -22.457 0.544 619 HA GLU 99 HA GLU 99 25.504 -21.417 -1.988 620 HB3 GLU 99 2HB GLU 99 26.223 -24.151 -2.261 621 HG3 GLU 99 2HG GLU 99 27.398 -21.462 -2.749 622 HE2 GLU 99 HE GLU 99 29.159 -21.348 -1.426 623 H LEU 100 H LEU 100 24.187 -23.736 0.365 624 HA LEU 100 HA LEU 100 22.374 -24.941 -1.466 625 HB3 LEU 100 2HB LEU 100 22.101 -24.898 1.527 626 HG LEU 100 HG LEU 100 20.710 -26.318 -0.417 627 HD11 LEU 100 1HD1 LEU 100 22.067 -27.987 -1.062 628 HD12 LEU 100 2HD1 LEU 100 23.148 -27.795 0.340 629 HD13 LEU 100 3HD1 LEU 100 21.629 -28.710 0.504 630 HD21 LEU 100 3HD2 LEU 100 21.056 -26.457 2.537 631 HD22 LEU 100 1HD2 LEU 100 19.600 -26.158 1.557 632 HD23 LEU 100 2HD2 LEU 100 20.224 -27.815 1.741 633 H SER 101 H SER 101 22.603 -21.811 -0.344 634 HA SER 101 HA SER 101 20.114 -21.188 0.564 635 HB3 SER 101 2HB SER 101 22.106 -19.656 0.445 636 HG SER 101 HG SER 101 21.433 -18.623 -2.041 637 H ASP 102 H ASP 102 18.337 -19.944 -0.651 638 HA ASP 102 HA ASP 102 16.822 -19.814 -2.195 639 HB3 ASP 102 2HB ASP 102 19.022 -20.701 -4.121 640 HD2 ASP 102 HD ASP 102 17.628 -18.076 -5.202
Contact the webmaster for help, if required. Monday, April 29, 2024 6:30:30 AM GMT (wattos1)