NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
15867 | 1z2d | 6075 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 H1 MET 1 0.601 -1.237 -0.224 2 2H MET 1 H2 MET 1 -0.231 0.182 -0.278 3 3H MET 1 H3 MET 1 0.334 -0.479 -1.666 4 HA MET 1 HA MET 1 2.042 0.469 0.528 5 1HB MET 1 HB2 MET 1 2.736 -0.283 -2.355 6 2HB MET 1 HB3 MET 1 3.857 0.384 -1.169 7 1HG MET 1 HG2 MET 1 3.504 -1.583 0.293 8 2HG MET 1 HG3 MET 1 2.464 -2.302 -0.945 9 1HE MET 1 HE1 MET 1 4.949 -3.788 0.362 10 2HE MET 1 HE2 MET 1 3.901 -4.510 -0.882 11 3HE MET 1 HE3 MET 1 5.668 -4.547 -1.076 12 H GLU 2 H GLU 2 3.530 2.339 -0.979 13 HA GLU 2 HA GLU 2 1.649 4.202 -2.242 14 1HB GLU 2 HB2 GLU 2 1.574 4.772 0.167 15 2HB GLU 2 HB3 GLU 2 3.339 4.857 0.215 16 1HG GLU 2 HG2 GLU 2 3.266 6.777 -1.383 17 2HG GLU 2 HG3 GLU 2 1.504 6.699 -1.380 18 H ASN 3 H ASN 3 2.829 5.621 -3.619 19 HA ASN 3 HA ASN 3 5.717 5.493 -3.823 20 1HB ASN 3 HB2 ASN 3 5.457 3.438 -4.925 21 2HB ASN 3 HB3 ASN 3 4.005 3.946 -5.760 22 1HD2 ASN 3 HD21 ASN 3 4.175 4.940 -7.755 23 2HD2 ASN 3 HD22 ASN 3 5.720 5.235 -8.559 24 H LYS 4 H LYS 4 2.639 6.397 -5.357 25 HA LYS 4 HA LYS 4 3.666 9.166 -5.661 26 1HB LYS 4 HB2 LYS 4 2.138 7.532 -7.734 27 2HB LYS 4 HB3 LYS 4 2.142 9.296 -7.748 28 1HG LYS 4 HG2 LYS 4 4.570 9.377 -7.968 29 2HG LYS 4 HG3 LYS 4 4.673 7.620 -7.899 30 1HD LYS 4 HD2 LYS 4 3.317 9.247 -10.091 31 2HD LYS 4 HD3 LYS 4 4.878 8.407 -10.185 32 1HE LYS 4 HE2 LYS 4 3.585 6.262 -9.589 33 2HE LYS 4 HE3 LYS 4 2.108 7.179 -9.891 34 1HZ LYS 4 HZ1 LYS 4 2.753 7.437 -12.164 35 2HZ LYS 4 HZ2 LYS 4 4.262 6.846 -11.907 36 3HZ LYS 4 HZ3 LYS 4 2.984 5.842 -11.800 37 H ILE 5 H ILE 5 1.723 10.652 -5.878 38 HA ILE 5 HA ILE 5 -0.713 9.710 -4.488 39 HB ILE 5 HB ILE 5 1.173 11.944 -3.656 40 1HG1 ILE 5 HG12 ILE 5 -0.099 9.749 -1.987 41 2HG1 ILE 5 HG13 ILE 5 1.535 9.703 -2.649 42 1HG2 ILE 5 HG21 ILE 5 -0.561 12.798 -2.083 43 2HG2 ILE 5 HG22 ILE 5 -1.107 12.937 -3.742 44 3HG2 ILE 5 HG23 ILE 5 -1.718 11.609 -2.753 45 1HD1 ILE 5 HD11 ILE 5 1.730 10.356 -0.373 46 2HD1 ILE 5 HD12 ILE 5 2.088 11.786 -1.360 47 3HD1 ILE 5 HD13 ILE 5 0.516 11.629 -0.536 48 H ILE 6 H ILE 6 -2.462 10.556 -5.581 49 HA ILE 6 HA ILE 6 -2.014 12.849 -7.410 50 HB ILE 6 HB ILE 6 -2.095 11.064 -8.888 51 1HG1 ILE 6 HG12 ILE 6 -4.922 12.193 -8.735 52 2HG1 ILE 6 HG13 ILE 6 -3.516 12.982 -9.456 53 1HG2 ILE 6 HG21 ILE 6 -4.509 9.900 -7.460 54 2HG2 ILE 6 HG22 ILE 6 -3.756 9.247 -8.930 55 3HG2 ILE 6 HG23 ILE 6 -2.861 9.237 -7.427 56 1HD1 ILE 6 HD11 ILE 6 -4.935 10.473 -10.434 57 2HD1 ILE 6 HD12 ILE 6 -4.794 12.036 -11.244 58 3HD1 ILE 6 HD13 ILE 6 -3.359 11.006 -11.066 59 H TYR 7 H TYR 7 -3.397 14.503 -6.923 60 HA TYR 7 HA TYR 7 -5.560 13.943 -4.960 61 1HB TYR 7 HB2 TYR 7 -3.358 14.904 -4.106 62 2HB TYR 7 HB3 TYR 7 -3.749 16.378 -4.976 63 HD1 TYR 7 HD1 TYR 7 -6.059 14.150 -2.937 64 HD2 TYR 7 HD2 TYR 7 -3.947 17.903 -3.201 65 HE1 TYR 7 HE1 TYR 7 -7.007 14.835 -0.763 66 HE2 TYR 7 HE2 TYR 7 -4.841 18.566 -0.995 67 HH TYR 7 HH TYR 7 -6.022 17.842 0.903 68 H PHE 8 H PHE 8 -7.431 14.177 -6.037 69 HA PHE 8 HA PHE 8 -7.710 16.031 -8.284 70 1HB PHE 8 HB2 PHE 8 -9.698 14.301 -6.738 71 2HB PHE 8 HB3 PHE 8 -10.140 15.326 -8.100 72 HD1 PHE 8 HD1 PHE 8 -8.726 12.115 -7.135 73 HD2 PHE 8 HD2 PHE 8 -8.997 14.985 -10.341 74 HE1 PHE 8 HE1 PHE 8 -7.880 10.421 -8.746 75 HE2 PHE 8 HE2 PHE 8 -8.140 13.288 -11.938 76 HZ PHE 8 HZ PHE 8 -7.561 11.016 -11.127 77 H LEU 9 H LEU 9 -8.905 17.938 -8.345 78 HA LEU 9 HA LEU 9 -9.777 19.154 -5.794 79 1HB LEU 9 HB2 LEU 9 -7.306 19.526 -6.229 80 2HB LEU 9 HB3 LEU 9 -7.710 20.301 -7.744 81 HG LEU 9 HG LEU 9 -7.096 21.853 -5.938 82 1HD1 LEU 9 HD11 LEU 9 -8.735 22.542 -7.763 83 2HD1 LEU 9 HD12 LEU 9 -10.020 22.355 -6.539 84 3HD1 LEU 9 HD13 LEU 9 -8.714 23.517 -6.290 85 1HD2 LEU 9 HD21 LEU 9 -7.971 20.594 -4.027 86 2HD2 LEU 9 HD22 LEU 9 -8.535 22.282 -4.039 87 3HD2 LEU 9 HD23 LEU 9 -9.630 20.978 -4.519 88 H CYS 10 H CYS 10 -11.735 20.206 -6.204 89 HA CYS 10 HA CYS 10 -12.136 21.488 -8.805 90 1HB CYS 10 HB2 CYS 10 -13.032 18.988 -8.776 91 2HB CYS 10 HB3 CYS 10 -14.381 19.689 -7.866 92 HG CYS 10 HG CYS 10 -14.942 19.492 -10.479 93 H THR 11 H THR 11 -14.548 22.682 -8.624 94 HA THR 11 HA THR 11 -14.247 24.348 -6.317 95 HB THR 11 HB THR 11 -16.363 25.391 -7.193 96 HG1 THR 11 HG1 THR 11 -17.149 24.727 -9.071 97 1HG2 THR 11 HG21 THR 11 -13.957 26.053 -7.766 98 2HG2 THR 11 HG22 THR 11 -14.152 25.109 -9.261 99 3HG2 THR 11 HG23 THR 11 -15.195 26.503 -8.955 100 H GLY 12 H GLY 12 -15.754 21.333 -6.623 101 1HA GLY 12 HA1 GLY 12 -16.603 21.479 -3.869 102 2HA GLY 12 HA2 GLY 12 -17.914 21.098 -5.012 103 H ASN 13 H ASN 13 -15.642 19.694 -3.092 104 HA ASN 13 HA ASN 13 -14.360 17.687 -4.644 105 1HB ASN 13 HB2 ASN 13 -13.883 18.284 -2.258 106 2HB ASN 13 HB3 ASN 13 -15.399 17.556 -1.764 107 1HD2 ASN 13 HD22 ASN 13 -12.743 16.862 -0.862 108 2HD2 ASN 13 HD21 ASN 13 -12.422 15.204 -1.319 109 H SER 14 H SER 14 -17.466 17.769 -2.997 110 HA SER 14 HA SER 14 -18.410 15.360 -2.744 111 1HB SER 14 HB2 SER 14 -20.020 17.674 -3.875 112 2HB SER 14 HB3 SER 14 -20.590 16.430 -2.750 113 HG SER 14 HG SER 14 -19.882 18.651 -1.985 114 H CYS 15 H CYS 15 -18.296 16.908 -5.962 115 HA CYS 15 HA CYS 15 -19.823 14.598 -7.084 116 1HB CYS 15 HB2 CYS 15 -19.510 17.408 -8.223 117 2HB CYS 15 HB3 CYS 15 -20.520 16.100 -8.857 118 HG CYS 15 HG CYS 15 -21.822 18.117 -7.697 119 H ARG 16 H ARG 16 -17.441 17.010 -8.408 120 HA ARG 16 HA ARG 16 -16.770 15.097 -10.457 121 1HB ARG 16 HB2 ARG 16 -15.307 17.701 -9.780 122 2HB ARG 16 HB3 ARG 16 -15.065 16.703 -11.201 123 1HG ARG 16 HG2 ARG 16 -16.448 18.231 -12.099 124 2HG ARG 16 HG3 ARG 16 -17.637 17.029 -11.629 125 1HD ARG 16 HD2 ARG 16 -18.687 18.532 -10.295 126 2HD ARG 16 HD3 ARG 16 -17.204 18.855 -9.398 127 HE ARG 16 HE ARG 16 -17.334 20.136 -12.028 128 1HH1 ARG 16 HH11 ARG 16 -18.445 20.724 -8.701 129 2HH1 ARG 16 HH12 ARG 16 -17.684 22.302 -8.629 130 1HH2 ARG 16 HH21 ARG 16 -16.703 22.226 -12.023 131 2HH2 ARG 16 HH22 ARG 16 -16.774 23.212 -10.566 132 H SER 17 H SER 17 -14.897 16.238 -7.560 133 HA SER 17 HA SER 17 -12.589 14.770 -8.256 134 1HB SER 17 HB2 SER 17 -13.477 15.513 -5.459 135 2HB SER 17 HB3 SER 17 -11.825 15.264 -6.059 136 HG SER 17 HG SER 17 -12.303 17.461 -5.902 137 H GLN 18 H GLN 18 -15.359 13.895 -6.120 138 HA GLN 18 HA GLN 18 -14.429 11.373 -5.330 139 1HB GLN 18 HB2 GLN 18 -17.270 12.376 -5.877 140 2HB GLN 18 HB3 GLN 18 -16.921 10.834 -5.103 141 1HG GLN 18 HG2 GLN 18 -16.103 13.561 -4.033 142 2HG GLN 18 HG3 GLN 18 -17.444 12.591 -3.451 143 1HE2 GLN 18 HE22 GLN 18 -14.494 13.492 -2.504 144 2HE2 GLN 18 HE21 GLN 18 -14.070 12.068 -1.543 145 H MET 19 H MET 19 -16.291 12.148 -8.354 146 HA MET 19 HA MET 19 -16.347 9.362 -9.153 147 1HB MET 19 HB2 MET 19 -16.749 11.908 -10.774 148 2HB MET 19 HB3 MET 19 -16.953 10.260 -11.393 149 1HG MET 19 HG2 MET 19 -18.611 9.849 -9.524 150 2HG MET 19 HG3 MET 19 -18.569 11.579 -9.193 151 1HE MET 19 HE1 MET 19 -18.378 12.831 -12.198 152 2HE MET 19 HE2 MET 19 -20.110 13.087 -12.489 153 3HE MET 19 HE3 MET 19 -19.418 13.439 -10.886 154 H ALA 20 H ALA 20 -14.175 12.157 -10.006 155 HA ALA 20 HA ALA 20 -12.621 10.781 -11.902 156 1HB ALA 20 HB1 ALA 20 -11.668 12.893 -9.929 157 2HB ALA 20 HB2 ALA 20 -10.931 12.470 -11.488 158 3HB ALA 20 HB3 ALA 20 -12.527 13.240 -11.448 159 H GLU 21 H GLU 21 -12.318 10.883 -8.346 160 HA GLU 21 HA GLU 21 -9.946 9.376 -8.088 161 1HB GLU 21 HB2 GLU 21 -10.784 10.685 -6.297 162 2HB GLU 21 HB3 GLU 21 -12.333 9.831 -6.256 163 1HG GLU 21 HG2 GLU 21 -11.175 7.781 -5.543 164 2HG GLU 21 HG3 GLU 21 -9.633 8.631 -5.546 165 H GLY 22 H GLY 22 -13.424 8.236 -8.159 166 1HA GLY 22 HA1 GLY 22 -12.826 5.493 -7.799 167 2HA GLY 22 HA2 GLY 22 -14.262 6.155 -8.573 168 H TRP 23 H TRP 23 -13.159 7.424 -10.916 169 HA TRP 23 HA TRP 23 -12.617 5.079 -12.516 170 1HB TRP 23 HB2 TRP 23 -12.255 8.024 -13.142 171 2HB TRP 23 HB3 TRP 23 -11.999 6.727 -14.295 172 HD1 TRP 23 HD1 TRP 23 -14.706 8.740 -12.683 173 HE1 TRP 23 HE1 TRP 23 -16.892 8.399 -13.898 174 HE3 TRP 23 HE3 TRP 23 -13.466 4.584 -15.418 175 HZ2 TRP 23 HZ2 TRP 23 -17.924 6.707 -15.979 176 HZ3 TRP 23 HZ3 TRP 23 -15.069 3.687 -17.081 177 HH2 TRP 23 HH2 TRP 23 -17.305 4.781 -17.388 178 H ALA 24 H ALA 24 -10.442 7.564 -11.042 179 HA ALA 24 HA ALA 24 -8.164 6.683 -12.436 180 1HB ALA 24 HB1 ALA 24 -8.310 8.845 -11.162 181 2HB ALA 24 HB2 ALA 24 -8.263 7.932 -9.655 182 3HB ALA 24 HB3 ALA 24 -6.857 7.918 -10.746 183 H LYS 25 H LYS 25 -9.553 5.461 -9.382 184 HA LYS 25 HA LYS 25 -7.383 3.737 -8.736 185 1HB LYS 25 HB2 LYS 25 -10.371 3.556 -8.202 186 2HB LYS 25 HB3 LYS 25 -9.220 2.392 -7.532 187 1HG LYS 25 HG2 LYS 25 -8.089 4.042 -6.239 188 2HG LYS 25 HG3 LYS 25 -8.850 5.381 -7.106 189 1HD LYS 25 HD2 LYS 25 -11.066 4.717 -6.228 190 2HD LYS 25 HD3 LYS 25 -10.300 3.410 -5.287 191 1HE LYS 25 HE2 LYS 25 -8.960 5.062 -4.038 192 2HE LYS 25 HE3 LYS 25 -9.561 6.359 -5.079 193 1HZ LYS 25 HZ1 LYS 25 -10.839 6.490 -3.175 194 2HZ LYS 25 HZ2 LYS 25 -11.827 5.779 -4.243 195 3HZ LYS 25 HZ3 LYS 25 -11.107 4.852 -3.072 196 H GLN 26 H GLN 26 -9.804 3.411 -11.259 197 HA GLN 26 HA GLN 26 -9.293 0.534 -11.663 198 1HB GLN 26 HB2 GLN 26 -11.128 2.634 -12.817 199 2HB GLN 26 HB3 GLN 26 -10.686 1.293 -13.853 200 1HG GLN 26 HG2 GLN 26 -12.843 1.086 -12.534 201 2HG GLN 26 HG3 GLN 26 -11.749 -0.296 -12.544 202 1HE2 GLN 26 HE22 GLN 26 -12.029 2.743 -10.463 203 2HE2 GLN 26 HE21 GLN 26 -12.021 1.834 -8.984 204 H TYR 27 H TYR 27 -8.631 3.642 -13.294 205 HA TYR 27 HA TYR 27 -7.160 2.353 -15.425 206 1HB TYR 27 HB2 TYR 27 -7.705 5.219 -14.623 207 2HB TYR 27 HB3 TYR 27 -6.686 4.820 -16.010 208 HD1 TYR 27 HD1 TYR 27 -9.927 5.759 -15.209 209 HD2 TYR 27 HD2 TYR 27 -7.813 2.843 -17.584 210 HE1 TYR 27 HE1 TYR 27 -11.886 5.550 -16.698 211 HE2 TYR 27 HE2 TYR 27 -9.804 2.555 -19.014 212 HH TYR 27 HH TYR 27 -11.997 3.245 -19.446 213 H LEU 28 H LEU 28 -6.165 3.804 -12.349 214 HA LEU 28 HA LEU 28 -3.300 3.593 -13.112 215 1HB LEU 28 HB2 LEU 28 -4.560 4.820 -10.632 216 2HB LEU 28 HB3 LEU 28 -2.876 4.905 -11.127 217 HG LEU 28 HG LEU 28 -5.218 6.207 -12.578 218 1HD1 LEU 28 HD11 LEU 28 -4.562 7.258 -10.416 219 2HD1 LEU 28 HD12 LEU 28 -2.919 7.475 -11.048 220 3HD1 LEU 28 HD13 LEU 28 -4.286 8.304 -11.819 221 1HD2 LEU 28 HD21 LEU 28 -2.241 6.332 -13.223 222 2HD2 LEU 28 HD22 LEU 28 -3.499 5.568 -14.219 223 3HD2 LEU 28 HD23 LEU 28 -3.511 7.312 -13.980 224 H GLY 29 H GLY 29 -3.044 3.201 -9.946 225 1HA GLY 29 HA1 GLY 29 -3.946 0.614 -9.322 226 2HA GLY 29 HA2 GLY 29 -2.364 0.459 -10.110 227 H ASP 30 H ASP 30 -2.063 -0.407 -7.749 228 HA ASP 30 HA ASP 30 -2.055 1.346 -5.554 229 1HB ASP 30 HB2 ASP 30 -2.082 -1.158 -5.487 230 2HB ASP 30 HB3 ASP 30 -0.359 -1.150 -5.897 231 H GLU 31 H GLU 31 0.173 1.185 -8.109 232 HA GLU 31 HA GLU 31 2.589 2.241 -7.078 233 1HB GLU 31 HB2 GLU 31 2.151 1.296 -9.356 234 2HB GLU 31 HB3 GLU 31 1.115 2.668 -9.723 235 1HG GLU 31 HG2 GLU 31 3.149 4.165 -9.448 236 2HG GLU 31 HG3 GLU 31 4.125 2.703 -9.291 237 H TRP 32 H TRP 32 -0.566 3.613 -7.092 238 HA TRP 32 HA TRP 32 0.492 6.301 -6.425 239 1HB TRP 32 HB2 TRP 32 -2.129 5.770 -7.861 240 2HB TRP 32 HB3 TRP 32 -1.370 7.314 -7.557 241 HD1 TRP 32 HD1 TRP 32 -0.632 4.139 -9.650 242 HE1 TRP 32 HE1 TRP 32 0.107 4.854 -11.998 243 HE3 TRP 32 HE3 TRP 32 -0.576 9.219 -8.990 244 HZ2 TRP 32 HZ2 TRP 32 0.400 7.264 -13.470 245 HZ3 TRP 32 HZ3 TRP 32 -0.158 10.707 -10.922 246 HH2 TRP 32 HH2 TRP 32 0.296 9.718 -13.189 247 H LYS 33 H LYS 33 -0.968 7.422 -4.971 248 HA LYS 33 HA LYS 33 -3.179 5.827 -3.760 249 1HB LYS 33 HB2 LYS 33 -1.309 7.861 -2.489 250 2HB LYS 33 HB3 LYS 33 -2.852 7.410 -1.768 251 1HG LYS 33 HG2 LYS 33 -0.642 5.415 -2.386 252 2HG LYS 33 HG3 LYS 33 -0.839 6.261 -0.853 253 1HD LYS 33 HD2 LYS 33 -1.801 4.229 -0.391 254 2HD LYS 33 HD3 LYS 33 -3.184 5.254 -0.706 255 1HE LYS 33 HE2 LYS 33 -3.482 3.030 -1.647 256 2HE LYS 33 HE3 LYS 33 -3.455 4.206 -2.961 257 1HZ LYS 33 HZ1 LYS 33 -2.034 2.012 -3.054 258 2HZ LYS 33 HZ2 LYS 33 -1.456 3.410 -3.697 259 3HZ LYS 33 HZ3 LYS 33 -0.955 2.862 -2.212 260 H VAL 34 H VAL 34 -5.134 6.860 -3.674 261 HA VAL 34 HA VAL 34 -5.276 9.273 -5.416 262 HB VAL 34 HB VAL 34 -7.252 6.971 -5.415 263 1HG1 VAL 34 HG11 VAL 34 -7.708 9.269 -6.514 264 2HG1 VAL 34 HG12 VAL 34 -6.507 8.782 -7.725 265 3HG1 VAL 34 HG13 VAL 34 -7.970 7.806 -7.475 266 1HG2 VAL 34 HG21 VAL 34 -4.745 7.078 -7.140 267 2HG2 VAL 34 HG22 VAL 34 -5.196 5.802 -5.981 268 3HG2 VAL 34 HG23 VAL 34 -6.146 6.037 -7.453 269 H TYR 35 H TYR 35 -6.160 10.924 -4.314 270 HA TYR 35 HA TYR 35 -8.565 10.375 -2.698 271 1HB TYR 35 HB2 TYR 35 -7.056 12.514 -1.438 272 2HB TYR 35 HB3 TYR 35 -7.881 11.154 -0.739 273 HD1 TYR 35 HD1 TYR 35 -4.716 12.671 -1.498 274 HD2 TYR 35 HD2 TYR 35 -6.599 8.908 -0.547 275 HE1 TYR 35 HE1 TYR 35 -2.566 11.825 -0.680 276 HE2 TYR 35 HE2 TYR 35 -4.423 8.023 0.250 277 HH TYR 35 HH TYR 35 -1.427 10.006 0.281 278 H SER 36 H SER 36 -9.609 12.536 -2.090 279 HA SER 36 HA SER 36 -9.536 14.418 -4.400 280 1HB SER 36 HB2 SER 36 -11.880 13.113 -2.935 281 2HB SER 36 HB3 SER 36 -12.031 14.420 -4.113 282 HG SER 36 HG SER 36 -11.220 11.759 -4.412 283 H ALA 37 H ALA 37 -9.826 16.521 -3.933 284 HA ALA 37 HA ALA 37 -10.866 17.416 -1.323 285 1HB ALA 37 HB1 ALA 37 -8.232 18.090 -2.628 286 2HB ALA 37 HB2 ALA 37 -9.109 19.314 -1.714 287 3HB ALA 37 HB3 ALA 37 -8.651 17.794 -0.910 288 H GLY 38 H GLY 38 -11.219 19.950 -1.702 289 1HA GLY 38 HA1 GLY 38 -11.786 20.808 -4.358 290 2HA GLY 38 HA2 GLY 38 -13.273 20.456 -3.465 291 H ILE 39 H ILE 39 -12.852 23.015 -4.244 292 HA ILE 39 HA ILE 39 -11.701 24.801 -2.325 293 HB ILE 39 HB ILE 39 -13.979 24.937 -4.307 294 1HG1 ILE 39 HG12 ILE 39 -12.651 26.737 -5.319 295 2HG1 ILE 39 HG13 ILE 39 -11.476 26.641 -4.008 296 1HG2 ILE 39 HG21 ILE 39 -13.363 27.183 -2.368 297 2HG2 ILE 39 HG22 ILE 39 -14.341 27.332 -3.846 298 3HG2 ILE 39 HG23 ILE 39 -14.900 26.294 -2.544 299 1HD1 ILE 39 HD11 ILE 39 -10.713 25.589 -6.114 300 2HD1 ILE 39 HD12 ILE 39 -10.752 24.424 -4.788 301 3HD1 ILE 39 HD13 ILE 39 -12.036 24.428 -6.024 302 H GLU 40 H GLU 40 -14.832 23.095 -2.498 303 HA GLU 40 HA GLU 40 -14.889 23.110 0.441 304 1HB GLU 40 HB2 GLU 40 -17.211 23.757 0.596 305 2HB GLU 40 HB3 GLU 40 -16.274 25.040 -0.154 306 1HG GLU 40 HG2 GLU 40 -17.101 24.385 -2.388 307 2HG GLU 40 HG3 GLU 40 -18.004 23.033 -1.693 308 H ALA 41 H ALA 41 -16.939 21.699 1.050 309 HA ALA 41 HA ALA 41 -17.440 19.414 -0.731 310 1HB ALA 41 HB1 ALA 41 -15.466 18.689 0.551 311 2HB ALA 41 HB2 ALA 41 -16.230 19.214 2.073 312 3HB ALA 41 HB3 ALA 41 -16.919 17.865 1.165 313 H HIS 42 H HIS 42 -19.268 18.221 0.111 314 HA HIS 42 HA HIS 42 -20.905 19.531 2.229 315 1HB HIS 42 HB2 HIS 42 -21.686 20.331 0.010 316 2HB HIS 42 HB3 HIS 42 -21.890 18.661 -0.523 317 HD1 HIS 42 HD1 HIS 42 -23.410 21.088 2.113 318 HD2 HIS 42 HD2 HIS 42 -24.187 17.508 0.032 319 HE1 HIS 42 HE1 HIS 42 -25.814 20.453 2.655 320 H GLY 43 H GLY 43 -20.193 16.651 0.175 321 1HA GLY 43 HA1 GLY 43 -19.858 14.882 2.223 322 2HA GLY 43 HA2 GLY 43 -21.589 14.765 1.835 323 H LEU 44 H LEU 44 -20.368 12.531 1.348 324 HA LEU 44 HA LEU 44 -19.309 12.238 -1.342 325 1HB LEU 44 HB2 LEU 44 -18.935 10.563 0.484 326 2HB LEU 44 HB3 LEU 44 -20.676 10.294 0.588 327 HG LEU 44 HG LEU 44 -20.614 9.541 -1.835 328 1HD1 LEU 44 HD11 LEU 44 -18.492 10.480 -2.571 329 2HD1 LEU 44 HD12 LEU 44 -17.619 9.556 -1.327 330 3HD1 LEU 44 HD13 LEU 44 -18.413 8.720 -2.675 331 1HD2 LEU 44 HD21 LEU 44 -19.113 8.014 0.320 332 2HD2 LEU 44 HD22 LEU 44 -20.837 7.921 -0.074 333 3HD2 LEU 44 HD23 LEU 44 -19.627 7.299 -1.214 334 H ASN 45 H ASN 45 -20.675 13.153 -2.916 335 HA ASN 45 HA ASN 45 -23.428 13.527 -2.511 336 1HB ASN 45 HB2 ASN 45 -21.968 14.827 -4.047 337 2HB ASN 45 HB3 ASN 45 -21.974 13.479 -5.185 338 1HD2 ASN 45 HD22 ASN 45 -23.143 16.386 -5.200 339 2HD2 ASN 45 HD21 ASN 45 -24.810 16.141 -5.663 340 HA PRO 46 HA PRO 46 -24.980 9.355 -3.368 341 1HB PRO 46 HB2 PRO 46 -27.427 10.932 -4.190 342 2HB PRO 46 HB3 PRO 46 -27.329 9.435 -3.209 343 1HG PRO 46 HG2 PRO 46 -27.663 11.835 -1.997 344 2HG PRO 46 HG3 PRO 46 -26.506 10.644 -1.317 345 1HD PRO 46 HD2 PRO 46 -25.917 13.061 -3.039 346 2HD PRO 46 HD3 PRO 46 -25.058 12.465 -1.584 347 H ASN 47 H ASN 47 -25.362 12.034 -5.755 348 HA ASN 47 HA ASN 47 -25.779 10.378 -8.069 349 1HB ASN 47 HB2 ASN 47 -26.133 12.771 -8.294 350 2HB ASN 47 HB3 ASN 47 -24.492 13.118 -7.735 351 1HD2 ASN 47 HD22 ASN 47 -24.081 14.354 -9.694 352 2HD2 ASN 47 HD21 ASN 47 -23.843 13.510 -11.211 353 H ALA 48 H ALA 48 -22.747 11.587 -6.466 354 HA ALA 48 HA ALA 48 -21.033 10.591 -8.524 355 1HB ALA 48 HB1 ALA 48 -20.320 12.315 -6.888 356 2HB ALA 48 HB2 ALA 48 -20.411 11.116 -5.578 357 3HB ALA 48 HB3 ALA 48 -19.231 10.916 -6.886 358 H VAL 49 H VAL 49 -22.356 9.177 -5.508 359 HA VAL 49 HA VAL 49 -20.909 6.716 -5.686 360 HB VAL 49 HB VAL 49 -23.611 7.173 -4.371 361 1HG1 VAL 49 HG11 VAL 49 -22.897 5.225 -2.984 362 2HG1 VAL 49 HG12 VAL 49 -23.085 4.788 -4.683 363 3HG1 VAL 49 HG13 VAL 49 -21.459 5.033 -4.011 364 1HG2 VAL 49 HG21 VAL 49 -20.777 7.456 -3.296 365 2HG2 VAL 49 HG22 VAL 49 -22.000 8.733 -3.428 366 3HG2 VAL 49 HG23 VAL 49 -22.244 7.417 -2.287 367 H LYS 50 H LYS 50 -24.334 7.476 -6.679 368 HA LYS 50 HA LYS 50 -24.655 4.852 -7.680 369 1HB LYS 50 HB2 LYS 50 -26.479 6.517 -7.034 370 2HB LYS 50 HB3 LYS 50 -26.251 7.268 -8.625 371 1HG LYS 50 HG2 LYS 50 -26.742 5.037 -9.688 372 2HG LYS 50 HG3 LYS 50 -26.981 4.344 -8.078 373 1HD LYS 50 HD2 LYS 50 -28.865 5.909 -7.684 374 2HD LYS 50 HD3 LYS 50 -28.619 6.605 -9.300 375 1HE LYS 50 HE2 LYS 50 -29.049 4.384 -10.327 376 2HE LYS 50 HE3 LYS 50 -29.292 3.685 -8.720 377 1HZ LYS 50 HZ1 LYS 50 -31.204 5.155 -8.442 378 2HZ LYS 50 HZ2 LYS 50 -30.983 5.800 -9.930 379 3HZ LYS 50 HZ3 LYS 50 -31.392 4.232 -9.769 380 H ALA 51 H ALA 51 -23.643 7.849 -9.385 381 HA ALA 51 HA ALA 51 -23.723 6.868 -12.012 382 1HB ALA 51 HB1 ALA 51 -22.035 8.654 -12.469 383 2HB ALA 51 HB2 ALA 51 -23.349 9.245 -11.437 384 3HB ALA 51 HB3 ALA 51 -21.769 8.839 -10.726 385 H MET 52 H MET 52 -21.043 6.658 -9.575 386 HA MET 52 HA MET 52 -19.300 5.211 -11.382 387 1HB MET 52 HB2 MET 52 -19.362 5.634 -8.378 388 2HB MET 52 HB3 MET 52 -18.059 4.800 -9.231 389 1HG MET 52 HG2 MET 52 -18.667 7.427 -10.421 390 2HG MET 52 HG3 MET 52 -18.206 7.519 -8.729 391 1HE MET 52 HE1 MET 52 -16.867 4.741 -11.252 392 2HE MET 52 HE2 MET 52 -17.076 6.156 -12.282 393 3HE MET 52 HE3 MET 52 -15.437 5.559 -11.893 394 H LYS 53 H LYS 53 -21.595 4.296 -8.778 395 HA LYS 53 HA LYS 53 -20.844 1.583 -8.670 396 1HB LYS 53 HB2 LYS 53 -22.086 3.108 -7.019 397 2HB LYS 53 HB3 LYS 53 -23.569 2.671 -7.875 398 1HG LYS 53 HG2 LYS 53 -23.279 0.338 -7.189 399 2HG LYS 53 HG3 LYS 53 -21.627 0.674 -6.616 400 1HD LYS 53 HD2 LYS 53 -22.565 2.323 -4.970 401 2HD LYS 53 HD3 LYS 53 -24.201 1.843 -5.459 402 1HE LYS 53 HE2 LYS 53 -23.766 -0.456 -4.667 403 2HE LYS 53 HE3 LYS 53 -22.077 -0.038 -4.330 404 1HZ LYS 53 HZ1 LYS 53 -22.855 1.545 -2.666 405 2HZ LYS 53 HZ2 LYS 53 -24.418 1.123 -2.941 406 3HZ LYS 53 HZ3 LYS 53 -23.376 0.034 -2.319 407 H GLU 54 H GLU 54 -23.237 3.236 -10.710 408 HA GLU 54 HA GLU 54 -24.360 0.898 -11.883 409 1HB GLU 54 HB2 GLU 54 -24.146 3.813 -12.731 410 2HB GLU 54 HB3 GLU 54 -24.879 2.623 -13.796 411 1HG GLU 54 HG2 GLU 54 -25.794 3.071 -10.929 412 2HG GLU 54 HG3 GLU 54 -26.472 3.908 -12.321 413 H VAL 55 H VAL 55 -21.221 2.387 -12.327 414 HA VAL 55 HA VAL 55 -20.666 0.810 -14.768 415 HB VAL 55 HB VAL 55 -18.870 2.718 -13.195 416 1HG1 VAL 55 HG11 VAL 55 -17.487 1.263 -14.571 417 2HG1 VAL 55 HG12 VAL 55 -18.536 1.537 -15.982 418 3HG1 VAL 55 HG13 VAL 55 -17.557 2.854 -15.298 419 1HG2 VAL 55 HG21 VAL 55 -20.836 3.921 -14.177 420 2HG2 VAL 55 HG22 VAL 55 -19.337 4.338 -14.996 421 3HG2 VAL 55 HG23 VAL 55 -20.477 3.200 -15.752 422 H GLY 56 H GLY 56 -20.830 0.199 -11.449 423 1HA GLY 56 HA1 GLY 56 -20.239 -1.729 -10.339 424 2HA GLY 56 HA2 GLY 56 -19.140 -2.192 -11.646 425 H ILE 57 H ILE 57 -18.892 1.076 -10.350 426 HA ILE 57 HA ILE 57 -16.346 0.381 -8.940 427 HB ILE 57 HB ILE 57 -17.185 2.867 -10.435 428 1HG1 ILE 57 HG12 ILE 57 -14.953 0.875 -11.047 429 2HG1 ILE 57 HG13 ILE 57 -16.518 0.880 -11.855 430 1HG2 ILE 57 HG21 ILE 57 -14.906 3.729 -9.902 431 2HG2 ILE 57 HG22 ILE 57 -15.807 3.422 -8.430 432 3HG2 ILE 57 HG23 ILE 57 -14.576 2.263 -8.955 433 1HD1 ILE 57 HD11 ILE 57 -16.115 3.147 -12.716 434 2HD1 ILE 57 HD12 ILE 57 -14.478 3.115 -12.003 435 3HD1 ILE 57 HD13 ILE 57 -14.927 1.964 -13.273 436 H ASP 58 H ASP 58 -17.179 0.001 -6.964 437 HA ASP 58 HA ASP 58 -19.399 1.570 -5.902 438 1HB ASP 58 HB2 ASP 58 -19.310 -0.807 -5.447 439 2HB ASP 58 HB3 ASP 58 -17.725 -0.643 -4.669 440 H ILE 59 H ILE 59 -18.452 3.707 -5.904 441 HA ILE 59 HA ILE 59 -16.230 4.209 -4.120 442 HB ILE 59 HB ILE 59 -16.340 6.451 -4.687 443 1HG1 ILE 59 HG12 ILE 59 -18.893 6.250 -6.265 444 2HG1 ILE 59 HG13 ILE 59 -18.936 6.627 -4.545 445 1HG2 ILE 59 HG21 ILE 59 -15.456 4.945 -6.410 446 2HG2 ILE 59 HG22 ILE 59 -17.043 4.966 -7.215 447 3HG2 ILE 59 HG23 ILE 59 -16.097 6.456 -7.071 448 1HD1 ILE 59 HD11 ILE 59 -17.367 8.535 -4.927 449 2HD1 ILE 59 HD12 ILE 59 -17.543 8.279 -6.676 450 3HD1 ILE 59 HD13 ILE 59 -18.952 8.712 -5.677 451 H SER 60 H SER 60 -19.193 3.206 -3.144 452 HA SER 60 HA SER 60 -20.176 5.212 -1.470 453 1HB SER 60 HB2 SER 60 -20.179 2.261 -0.760 454 2HB SER 60 HB3 SER 60 -21.340 3.501 -0.267 455 HG SER 60 HG SER 60 -20.926 2.242 -2.753 456 H ASN 61 H ASN 61 -17.322 3.213 -1.054 457 HA ASN 61 HA ASN 61 -16.981 3.575 1.773 458 1HB ASN 61 HB2 ASN 61 -16.036 1.667 0.515 459 2HB ASN 61 HB3 ASN 61 -15.023 2.771 -0.422 460 1HD2 ASN 61 HD22 ASN 61 -15.684 1.756 3.003 461 2HD2 ASN 61 HD21 ASN 61 -14.043 1.989 3.539 462 H GLN 62 H GLN 62 -16.354 5.719 -0.932 463 HA GLN 62 HA GLN 62 -14.021 6.998 0.149 464 1HB GLN 62 HB2 GLN 62 -15.962 7.927 -2.005 465 2HB GLN 62 HB3 GLN 62 -14.401 8.670 -1.601 466 1HG GLN 62 HG2 GLN 62 -13.257 6.544 -2.156 467 2HG GLN 62 HG3 GLN 62 -14.800 5.865 -2.684 468 1HE2 GLN 62 HE22 GLN 62 -14.893 9.138 -3.689 469 2HE2 GLN 62 HE21 GLN 62 -14.356 8.831 -5.335 470 H THR 63 H THR 63 -14.142 9.474 0.492 471 HA THR 63 HA THR 63 -16.599 10.518 1.607 472 HB THR 63 HB THR 63 -15.180 11.372 3.644 473 HG1 THR 63 HG1 THR 63 -13.189 10.473 3.033 474 1HG2 THR 63 HG21 THR 63 -17.136 9.810 3.792 475 2HG2 THR 63 HG22 THR 63 -16.008 8.443 3.668 476 3HG2 THR 63 HG23 THR 63 -15.907 9.561 5.044 477 H SER 64 H SER 64 -16.508 12.893 1.792 478 HA SER 64 HA SER 64 -14.622 14.106 -0.090 479 1HB SER 64 HB2 SER 64 -16.247 16.028 0.242 480 2HB SER 64 HB3 SER 64 -16.951 14.557 -0.430 481 HG SER 64 HG SER 64 -17.140 15.450 2.261 482 H ASP 65 H ASP 65 -13.674 16.192 0.528 483 HA ASP 65 HA ASP 65 -13.505 17.067 3.265 484 1HB ASP 65 HB2 ASP 65 -11.628 15.267 3.013 485 2HB ASP 65 HB3 ASP 65 -10.870 16.390 1.869 486 H ILE 66 H ILE 66 -12.357 19.274 3.245 487 HA ILE 66 HA ILE 66 -12.420 20.489 0.534 488 HB ILE 66 HB ILE 66 -12.556 22.564 1.529 489 1HG1 ILE 66 HG12 ILE 66 -11.868 21.308 4.210 490 2HG1 ILE 66 HG13 ILE 66 -10.901 22.468 3.274 491 1HG2 ILE 66 HG21 ILE 66 -14.572 20.984 1.658 492 2HG2 ILE 66 HG22 ILE 66 -14.285 20.893 3.396 493 3HG2 ILE 66 HG23 ILE 66 -14.664 22.455 2.644 494 1HD1 ILE 66 HD11 ILE 66 -12.844 24.100 3.506 495 2HD1 ILE 66 HD12 ILE 66 -13.531 22.963 4.691 496 3HD1 ILE 66 HD13 ILE 66 -11.957 23.716 5.011 497 H ILE 67 H ILE 67 -10.474 21.863 0.027 498 HA ILE 67 HA ILE 67 -8.303 20.154 -0.026 499 HB ILE 67 HB ILE 67 -8.810 21.795 -1.719 500 1HG1 ILE 67 HG12 ILE 67 -6.474 20.805 -1.355 501 2HG1 ILE 67 HG13 ILE 67 -6.711 22.092 -2.510 502 1HG2 ILE 67 HG21 ILE 67 -9.537 23.712 -0.466 503 2HG2 ILE 67 HG22 ILE 67 -7.909 23.951 0.215 504 3HG2 ILE 67 HG23 ILE 67 -8.195 24.152 -1.523 505 1HD1 ILE 67 HD11 ILE 67 -4.641 22.275 -1.058 506 2HD1 ILE 67 HD12 ILE 67 -5.653 23.727 -1.187 507 3HD1 ILE 67 HD13 ILE 67 -5.698 22.741 0.278 508 H ASP 68 H ASP 68 -6.364 19.993 0.806 509 HA ASP 68 HA ASP 68 -5.677 21.531 3.241 510 1HB ASP 68 HB2 ASP 68 -6.628 19.339 3.938 511 2HB ASP 68 HB3 ASP 68 -5.386 18.514 2.981 512 H SER 69 H SER 69 -3.920 22.607 2.618 513 HA SER 69 HA SER 69 -2.324 22.134 0.432 514 1HB SER 69 HB2 SER 69 -1.305 23.499 2.919 515 2HB SER 69 HB3 SER 69 -1.052 23.932 1.215 516 HG SER 69 HG SER 69 -2.576 25.283 2.347 517 H ASP 70 H ASP 70 -2.192 20.610 3.605 518 HA ASP 70 HA ASP 70 0.533 19.840 3.659 519 1HB ASP 70 HB2 ASP 70 -0.948 19.905 5.634 520 2HB ASP 70 HB3 ASP 70 -1.855 18.530 4.982 521 H ILE 71 H ILE 71 -2.196 18.473 1.889 522 HA ILE 71 HA ILE 71 -0.542 16.046 1.260 523 HB ILE 71 HB ILE 71 -3.498 16.609 0.876 524 1HG1 ILE 71 HG12 ILE 71 -1.936 14.532 2.483 525 2HG1 ILE 71 HG13 ILE 71 -2.645 16.001 3.170 526 1HG2 ILE 71 HG21 ILE 71 -1.834 14.199 -0.008 527 2HG2 ILE 71 HG22 ILE 71 -3.615 14.297 -0.063 528 3HG2 ILE 71 HG23 ILE 71 -2.656 15.344 -1.089 529 1HD1 ILE 71 HD11 ILE 71 -4.099 14.194 3.686 530 2HD1 ILE 71 HD12 ILE 71 -4.909 15.203 2.468 531 3HD1 ILE 71 HD13 ILE 71 -4.161 13.649 2.003 532 H LEU 72 H LEU 72 -2.283 18.793 -0.179 533 HA LEU 72 HA LEU 72 -1.809 18.465 -2.881 534 1HB LEU 72 HB2 LEU 72 -3.146 20.218 -1.751 535 2HB LEU 72 HB3 LEU 72 -1.658 20.910 -1.114 536 HG LEU 72 HG LEU 72 -1.057 21.115 -3.725 537 1HD1 LEU 72 HD11 LEU 72 -3.045 21.751 -5.012 538 2HD1 LEU 72 HD12 LEU 72 -3.231 20.080 -4.434 539 3HD1 LEU 72 HD13 LEU 72 -4.101 21.396 -3.630 540 1HD2 LEU 72 HD21 LEU 72 -2.889 23.016 -2.226 541 2HD2 LEU 72 HD22 LEU 72 -1.136 22.920 -2.017 542 3HD2 LEU 72 HD23 LEU 72 -1.810 23.432 -3.583 543 H ASN 73 H ASN 73 0.427 20.107 -0.564 544 HA ASN 73 HA ASN 73 2.444 20.572 -2.484 545 1HB ASN 73 HB2 ASN 73 3.713 21.457 -0.751 546 2HB ASN 73 HB3 ASN 73 2.076 21.614 -0.103 547 1HD2 ASN 73 HD22 ASN 73 1.355 20.055 1.471 548 2HD2 ASN 73 HD21 ASN 73 2.496 19.096 2.407 549 H ASN 74 H ASN 74 1.637 17.534 -1.106 550 HA ASN 74 HA ASN 74 4.423 16.470 -1.401 551 1HB ASN 74 HB2 ASN 74 2.004 15.485 0.175 552 2HB ASN 74 HB3 ASN 74 3.392 14.470 -0.164 553 1HD2 ASN 74 HD22 ASN 74 2.121 16.585 2.118 554 2HD2 ASN 74 HD21 ASN 74 3.610 16.894 2.982 555 H ALA 75 H ALA 75 1.296 16.602 -2.890 556 HA ALA 75 HA ALA 75 1.129 13.956 -3.834 557 1HB ALA 75 HB1 ALA 75 -0.012 16.508 -5.037 558 2HB ALA 75 HB2 ALA 75 -0.573 14.847 -5.344 559 3HB ALA 75 HB3 ALA 75 -0.759 15.557 -3.728 560 H ASP 76 H ASP 76 1.652 13.098 -6.014 561 HA ASP 76 HA ASP 76 4.074 14.249 -7.239 562 1HB ASP 76 HB2 ASP 76 3.587 11.795 -7.401 563 2HB ASP 76 HB3 ASP 76 2.120 12.169 -8.324 564 H LEU 77 H LEU 77 0.571 14.364 -7.538 565 HA LEU 77 HA LEU 77 0.662 16.430 -9.634 566 1HB LEU 77 HB2 LEU 77 0.693 14.398 -10.865 567 2HB LEU 77 HB3 LEU 77 -0.474 13.633 -9.781 568 HG LEU 77 HG LEU 77 -2.238 15.175 -10.610 569 1HD1 LEU 77 HD11 LEU 77 -0.731 16.994 -11.548 570 2HD1 LEU 77 HD12 LEU 77 -0.294 15.871 -12.854 571 3HD1 LEU 77 HD13 LEU 77 -1.966 16.414 -12.659 572 1HD2 LEU 77 HD21 LEU 77 -0.798 13.485 -12.679 573 2HD2 LEU 77 HD22 LEU 77 -1.915 12.868 -11.453 574 3HD2 LEU 77 HD23 LEU 77 -2.519 13.932 -12.734 575 H VAL 78 H VAL 78 -1.066 17.707 -9.623 576 HA VAL 78 HA VAL 78 -3.387 17.097 -7.865 577 HB VAL 78 HB VAL 78 -2.233 19.833 -8.557 578 1HG1 VAL 78 HG11 VAL 78 -4.704 19.836 -8.212 579 2HG1 VAL 78 HG12 VAL 78 -4.478 19.053 -6.633 580 3HG1 VAL 78 HG13 VAL 78 -3.865 20.699 -6.930 581 1HG2 VAL 78 HG21 VAL 78 -1.582 20.014 -6.197 582 2HG2 VAL 78 HG22 VAL 78 -2.129 18.338 -5.900 583 3HG2 VAL 78 HG23 VAL 78 -0.754 18.682 -6.966 584 H VAL 79 H VAL 79 -5.361 17.180 -9.008 585 HA VAL 79 HA VAL 79 -5.159 17.988 -11.890 586 HB VAL 79 HB VAL 79 -6.933 15.793 -10.793 587 1HG1 VAL 79 HG11 VAL 79 -7.266 15.280 -13.184 588 2HG1 VAL 79 HG12 VAL 79 -7.764 16.937 -12.815 589 3HG1 VAL 79 HG13 VAL 79 -6.209 16.645 -13.626 590 1HG2 VAL 79 HG21 VAL 79 -4.285 15.568 -12.275 591 2HG2 VAL 79 HG22 VAL 79 -4.645 14.977 -10.634 592 3HG2 VAL 79 HG23 VAL 79 -5.426 14.229 -12.027 593 H THR 80 H THR 80 -6.078 19.881 -12.053 594 HA THR 80 HA THR 80 -8.218 20.705 -10.215 595 HB THR 80 HB THR 80 -7.892 22.924 -11.208 596 HG1 THR 80 HG1 THR 80 -5.878 21.630 -12.744 597 1HG2 THR 80 HG21 THR 80 -5.367 21.555 -10.154 598 2HG2 THR 80 HG22 THR 80 -5.613 23.301 -10.238 599 3HG2 THR 80 HG23 THR 80 -6.653 22.314 -9.194 600 H LEU 81 H LEU 81 -9.979 19.583 -10.774 601 HA LEU 81 HA LEU 81 -10.522 18.737 -13.456 602 1HB LEU 81 HB2 LEU 81 -12.210 18.750 -10.938 603 2HB LEU 81 HB3 LEU 81 -12.728 17.986 -12.438 604 HG LEU 81 HG LEU 81 -10.192 17.219 -10.919 605 1HD1 LEU 81 HD11 LEU 81 -12.231 16.759 -9.604 606 2HD1 LEU 81 HD12 LEU 81 -12.896 15.832 -10.976 607 3HD1 LEU 81 HD13 LEU 81 -11.434 15.276 -10.146 608 1HD2 LEU 81 HD21 LEU 81 -10.328 15.142 -12.319 609 2HD2 LEU 81 HD22 LEU 81 -11.667 15.864 -13.224 610 3HD2 LEU 81 HD23 LEU 81 -10.055 16.584 -13.293 611 H CYS 82 H CYS 82 -11.133 21.828 -12.040 612 HA CYS 82 HA CYS 82 -12.543 22.494 -14.481 613 1HB CYS 82 HB2 CYS 82 -14.381 21.943 -12.895 614 2HB CYS 82 HB3 CYS 82 -13.783 23.203 -11.790 615 HG CYS 82 HG CYS 82 -15.880 24.152 -13.046 616 H GLY 83 H GLY 83 -12.100 24.649 -15.085 617 1HA GLY 83 HA1 GLY 83 -9.569 25.500 -14.274 618 2HA GLY 83 HA2 GLY 83 -10.683 26.417 -15.310 619 H ASP 84 H ASP 84 -12.783 26.747 -13.270 620 HA ASP 84 HA ASP 84 -11.775 29.051 -11.909 621 1HB ASP 84 HB2 ASP 84 -14.163 28.689 -12.520 622 2HB ASP 84 HB3 ASP 84 -14.271 27.431 -11.282 623 H ALA 85 H ALA 85 -11.768 25.639 -11.061 624 HA ALA 85 HA ALA 85 -11.372 26.045 -8.210 625 1HB ALA 85 HB1 ALA 85 -11.079 23.696 -8.101 626 2HB ALA 85 HB2 ALA 85 -12.305 23.912 -9.361 627 3HB ALA 85 HB3 ALA 85 -10.623 23.558 -9.799 628 H ALA 86 H ALA 86 -9.335 26.025 -11.096 629 HA ALA 86 HA ALA 86 -6.991 24.993 -9.926 630 1HB ALA 86 HB1 ALA 86 -7.190 26.897 -12.293 631 2HB ALA 86 HB2 ALA 86 -5.862 25.779 -11.929 632 3HB ALA 86 HB3 ALA 86 -7.454 25.135 -12.377 633 H ASP 87 H ASP 87 -8.351 28.185 -9.607 634 HA ASP 87 HA ASP 87 -6.038 29.662 -8.890 635 1HB ASP 87 HB2 ASP 87 -8.243 30.688 -9.250 636 2HB ASP 87 HB3 ASP 87 -8.891 29.820 -7.852 637 H LYS 88 H LYS 88 -7.928 27.237 -7.128 638 HA LYS 88 HA LYS 88 -6.737 27.956 -4.550 639 1HB LYS 88 HB2 LYS 88 -9.182 27.286 -4.968 640 2HB LYS 88 HB3 LYS 88 -8.585 25.642 -5.194 641 1HG LYS 88 HG2 LYS 88 -9.336 25.755 -2.985 642 2HG LYS 88 HG3 LYS 88 -7.572 25.825 -2.858 643 1HD LYS 88 HD2 LYS 88 -7.649 28.244 -2.470 644 2HD LYS 88 HD3 LYS 88 -9.407 28.261 -2.768 645 1HE LYS 88 HE2 LYS 88 -9.746 26.709 -0.877 646 2HE LYS 88 HE3 LYS 88 -8.007 26.679 -0.568 647 1HZ LYS 88 HZ1 LYS 88 -8.123 29.060 -0.061 648 2HZ LYS 88 HZ2 LYS 88 -9.733 29.086 -0.345 649 3HZ LYS 88 HZ3 LYS 88 -9.137 28.232 0.906 650 H CYS 89 H CYS 89 -4.589 27.479 -5.815 651 HA CYS 89 HA CYS 89 -3.715 24.735 -4.990 652 1HB CYS 89 HB2 CYS 89 -2.663 26.341 -7.349 653 2HB CYS 89 HB3 CYS 89 -1.996 24.820 -6.733 654 HG CYS 89 HG CYS 89 -4.840 25.537 -8.192 655 HA PRO 90 HA PRO 90 -2.003 28.243 -2.511 656 1HB PRO 90 HB2 PRO 90 -1.767 26.845 -0.085 657 2HB PRO 90 HB3 PRO 90 -3.136 27.861 -0.623 658 1HG PRO 90 HG2 PRO 90 -2.822 24.868 -0.818 659 2HG PRO 90 HG3 PRO 90 -4.280 25.804 -0.362 660 1HD PRO 90 HD2 PRO 90 -4.035 24.805 -2.848 661 2HD PRO 90 HD3 PRO 90 -4.682 26.448 -2.603 662 H MET 91 H MET 91 -0.637 24.978 -2.839 663 HA MET 91 HA MET 91 1.964 26.094 -3.250 664 1HB MET 91 HB2 MET 91 3.063 24.660 -1.417 665 2HB MET 91 HB3 MET 91 2.325 26.182 -0.942 666 1HG MET 91 HG2 MET 91 0.351 25.034 -0.085 667 2HG MET 91 HG3 MET 91 0.955 23.488 -0.663 668 1HE MET 91 HE1 MET 91 1.143 26.290 2.020 669 2HE MET 91 HE2 MET 91 2.562 25.843 2.991 670 3HE MET 91 HE3 MET 91 2.781 26.468 1.345 671 H THR 92 H THR 92 2.540 24.963 -5.014 672 HA THR 92 HA THR 92 2.523 22.001 -4.833 673 HB THR 92 HB THR 92 1.910 21.872 -7.250 674 HG1 THR 92 HG1 THR 92 2.312 24.106 -7.718 675 1HG2 THR 92 HG21 THR 92 0.267 21.467 -5.450 676 2HG2 THR 92 HG22 THR 92 -0.256 23.164 -5.566 677 3HG2 THR 92 HG23 THR 92 -0.451 22.067 -6.950 678 HA PRO 93 HA PRO 93 6.777 23.785 -5.482 679 1HB PRO 93 HB2 PRO 93 7.315 21.200 -4.016 680 2HB PRO 93 HB3 PRO 93 8.113 22.790 -3.814 681 1HG PRO 93 HG2 PRO 93 6.281 21.943 -2.015 682 2HG PRO 93 HG3 PRO 93 6.264 23.647 -2.581 683 1HD PRO 93 HD2 PRO 93 4.540 21.342 -3.507 684 2HD PRO 93 HD3 PRO 93 4.070 23.013 -3.092 685 HA PRO 94 HA PRO 94 8.032 21.171 -8.922 686 1HB PRO 94 HB2 PRO 94 10.661 20.655 -7.517 687 2HB PRO 94 HB3 PRO 94 10.371 21.131 -9.220 688 1HG PRO 94 HG2 PRO 94 11.159 22.985 -7.414 689 2HG PRO 94 HG3 PRO 94 9.850 23.377 -8.576 690 1HD PRO 94 HD2 PRO 94 9.604 22.536 -5.681 691 2HD PRO 94 HD3 PRO 94 8.740 23.836 -6.558 692 H HIS 95 H HIS 95 8.182 19.741 -5.715 693 HA HIS 95 HA HIS 95 8.481 16.991 -6.453 694 1HB HIS 95 HB2 HIS 95 6.860 18.170 -4.160 695 2HB HIS 95 HB3 HIS 95 7.518 16.541 -4.262 696 HD1 HIS 95 HD1 HIS 95 10.548 17.033 -4.861 697 HD2 HIS 95 HD2 HIS 95 8.175 19.383 -2.293 698 HE1 HIS 95 HE1 HIS 95 12.155 18.212 -3.281 699 H VAL 96 H VAL 96 6.019 19.221 -7.184 700 HA VAL 96 HA VAL 96 3.842 17.235 -7.559 701 HB VAL 96 HB VAL 96 3.533 20.192 -6.893 702 1HG1 VAL 96 HG11 VAL 96 1.519 19.229 -7.722 703 2HG1 VAL 96 HG12 VAL 96 1.668 17.816 -6.659 704 3HG1 VAL 96 HG13 VAL 96 1.328 19.413 -5.985 705 1HG2 VAL 96 HG21 VAL 96 3.078 19.654 -4.533 706 2HG2 VAL 96 HG22 VAL 96 3.758 18.043 -4.775 707 3HG2 VAL 96 HG23 VAL 96 4.772 19.477 -4.976 708 H LYS 97 H LYS 97 2.427 17.850 -9.330 709 HA LYS 97 HA LYS 97 3.271 20.014 -11.128 710 1HB LYS 97 HB2 LYS 97 3.310 18.690 -13.090 711 2HB LYS 97 HB3 LYS 97 4.295 17.824 -11.920 712 1HG LYS 97 HG2 LYS 97 1.909 16.583 -11.485 713 2HG LYS 97 HG3 LYS 97 1.678 17.094 -13.166 714 1HD LYS 97 HD2 LYS 97 3.914 15.976 -13.688 715 2HD LYS 97 HD3 LYS 97 3.926 15.401 -12.009 716 1HE LYS 97 HE2 LYS 97 1.545 14.433 -12.587 717 2HE LYS 97 HE3 LYS 97 2.011 14.656 -14.271 718 1HZ LYS 97 HZ1 LYS 97 4.005 13.242 -13.693 719 2HZ LYS 97 HZ2 LYS 97 3.330 12.965 -12.208 720 3HZ LYS 97 HZ3 LYS 97 2.583 12.450 -13.569 721 H ARG 98 H ARG 98 1.312 20.369 -12.746 722 HA ARG 98 HA ARG 98 -1.210 19.653 -11.342 723 1HB ARG 98 HB2 ARG 98 -0.592 22.424 -12.423 724 2HB ARG 98 HB3 ARG 98 -2.114 21.861 -11.721 725 1HG ARG 98 HG2 ARG 98 -0.661 21.289 -9.606 726 2HG ARG 98 HG3 ARG 98 0.529 22.381 -10.321 727 1HD ARG 98 HD2 ARG 98 -2.356 23.033 -9.596 728 2HD ARG 98 HD3 ARG 98 -0.938 23.515 -8.679 729 HE ARG 98 HE ARG 98 -1.771 24.519 -11.360 730 1HH1 ARG 98 HH21 ARG 98 0.346 24.973 -8.509 731 2HH1 ARG 98 HH22 ARG 98 0.631 26.639 -8.852 732 1HH2 ARG 98 HH11 ARG 98 -1.286 26.698 -11.831 733 2HH2 ARG 98 HH12 ARG 98 -0.266 27.617 -10.794 734 H GLU 99 H GLU 99 -3.035 19.542 -12.648 735 HA GLU 99 HA GLU 99 -2.683 19.729 -15.565 736 1HB GLU 99 HB2 GLU 99 -2.310 17.364 -14.852 737 2HB GLU 99 HB3 GLU 99 -3.895 17.350 -14.075 738 1HG GLU 99 HG2 GLU 99 -3.817 16.217 -16.275 739 2HG GLU 99 HG3 GLU 99 -5.007 17.522 -16.198 740 H HIS 100 H HIS 100 -4.867 19.994 -16.611 741 HA HIS 100 HA HIS 100 -6.836 21.298 -14.781 742 1HB HIS 100 HB2 HIS 100 -5.217 22.981 -15.350 743 2HB HIS 100 HB3 HIS 100 -5.200 22.497 -17.041 744 HD1 HIS 100 HD1 HIS 100 -7.516 23.144 -18.474 745 HD2 HIS 100 HD2 HIS 100 -6.781 24.977 -14.757 746 HE1 HIS 100 HE1 HIS 100 -8.931 25.260 -18.429 747 H TRP 101 H TRP 101 -8.886 21.041 -15.380 748 HA TRP 101 HA TRP 101 -9.648 20.551 -18.196 749 1HB TRP 101 HB2 TRP 101 -10.812 18.977 -15.903 750 2HB TRP 101 HB3 TRP 101 -11.046 18.750 -17.636 751 HD1 TRP 101 HD1 TRP 101 -8.851 17.792 -14.774 752 HE1 TRP 101 HE1 TRP 101 -7.004 16.183 -15.476 753 HE3 TRP 101 HE3 TRP 101 -9.334 18.192 -19.857 754 HZ2 TRP 101 HZ2 TRP 101 -5.839 15.206 -17.932 755 HZ3 TRP 101 HZ3 TRP 101 -7.811 16.930 -21.352 756 HH2 TRP 101 HH2 TRP 101 -6.070 15.423 -20.397 757 H GLY 102 H GLY 102 -12.435 20.472 -17.780 758 1HA GLY 102 HA1 GLY 102 -13.035 23.101 -16.480 759 2HA GLY 102 HA2 GLY 102 -13.333 22.826 -18.190 760 H PHE 103 H PHE 103 -13.897 20.547 -15.428 761 HA PHE 103 HA PHE 103 -16.462 19.897 -16.594 762 1HB PHE 103 HB2 PHE 103 -14.963 18.840 -14.179 763 2HB PHE 103 HB3 PHE 103 -16.556 18.266 -14.670 764 HD1 PHE 103 HD1 PHE 103 -12.981 18.020 -15.373 765 HD2 PHE 103 HD2 PHE 103 -16.918 17.372 -17.008 766 HE1 PHE 103 HE1 PHE 103 -11.984 16.736 -17.222 767 HE2 PHE 103 HE2 PHE 103 -15.937 16.054 -18.836 768 HZ PHE 103 HZ PHE 103 -13.473 15.711 -18.968 769 H ASP 104 H ASP 104 -18.187 21.073 -16.327 770 HA ASP 104 HA ASP 104 -18.821 22.764 -14.092 771 1HB ASP 104 HB2 ASP 104 -19.815 22.979 -16.370 772 2HB ASP 104 HB3 ASP 104 -20.610 21.413 -16.149 773 H ASP 105 H ASP 105 -20.707 22.298 -12.585 774 HA ASP 105 HA ASP 105 -20.101 19.734 -11.343 775 1HB ASP 105 HB2 ASP 105 -20.351 21.911 -10.079 776 2HB ASP 105 HB3 ASP 105 -22.094 21.746 -10.312 777 HA PRO 106 HA PRO 106 -23.494 17.969 -13.564 778 1HB PRO 106 HB2 PRO 106 -23.459 15.375 -12.619 779 2HB PRO 106 HB3 PRO 106 -22.248 16.033 -13.754 780 1HG PRO 106 HG2 PRO 106 -22.036 15.757 -10.746 781 2HG PRO 106 HG3 PRO 106 -20.826 15.311 -11.992 782 1HD PRO 106 HD2 PRO 106 -20.701 17.667 -10.628 783 2HD PRO 106 HD3 PRO 106 -20.223 17.556 -12.351 784 H ALA 107 H ALA 107 -23.464 17.877 -9.976 785 HA ALA 107 HA ALA 107 -26.094 16.796 -9.723 786 1HB ALA 107 HB1 ALA 107 -25.937 17.543 -7.392 787 2HB ALA 107 HB2 ALA 107 -24.439 16.741 -7.912 788 3HB ALA 107 HB3 ALA 107 -24.503 18.513 -7.780 789 H ARG 108 H ARG 108 -25.020 19.926 -10.696 790 HA ARG 108 HA ARG 108 -27.594 21.233 -10.000 791 1HB ARG 108 HB2 ARG 108 -24.868 22.319 -10.873 792 2HB ARG 108 HB3 ARG 108 -26.327 23.299 -10.762 793 1HG ARG 108 HG2 ARG 108 -25.355 23.715 -8.739 794 2HG ARG 108 HG3 ARG 108 -26.558 22.481 -8.351 795 1HD ARG 108 HD2 ARG 108 -24.705 20.767 -8.357 796 2HD ARG 108 HD3 ARG 108 -23.552 22.077 -8.659 797 HE ARG 108 HE ARG 108 -25.003 22.836 -6.409 798 1HH1 ARG 108 HH21 ARG 108 -22.813 20.143 -7.267 799 2HH1 ARG 108 HH22 ARG 108 -22.318 19.874 -5.634 800 1HH2 ARG 108 HH11 ARG 108 -24.333 22.449 -4.252 801 2HH2 ARG 108 HH12 ARG 108 -23.202 21.204 -3.890 802 H ALA 109 H ALA 109 -26.459 19.380 -12.541 803 HA ALA 109 HA ALA 109 -27.289 20.884 -14.792 804 1HB ALA 109 HB1 ALA 109 -27.450 18.671 -15.877 805 2HB ALA 109 HB2 ALA 109 -25.961 18.768 -14.901 806 3HB ALA 109 HB3 ALA 109 -27.371 17.867 -14.297 807 H GLN 110 H GLN 110 -29.342 20.843 -15.836 808 HA GLN 110 HA GLN 110 -31.673 19.807 -14.408 809 1HB GLN 110 HB2 GLN 110 -32.629 22.031 -13.928 810 2HB GLN 110 HB3 GLN 110 -31.151 21.718 -13.037 811 1HG GLN 110 HG2 GLN 110 -29.932 23.078 -14.897 812 2HG GLN 110 HG3 GLN 110 -31.548 23.583 -15.402 813 1HE2 GLN 110 HE22 GLN 110 -29.308 23.439 -12.577 814 2HE2 GLN 110 HE21 GLN 110 -29.934 24.874 -11.786 815 H GLY 111 H GLY 111 -33.701 20.477 -15.476 816 1HA GLY 111 HA1 GLY 111 -34.411 21.697 -17.692 817 2HA GLY 111 HA2 GLY 111 -33.456 20.380 -18.417 818 H THR 112 H THR 112 -33.895 18.263 -16.809 819 HA THR 112 HA THR 112 -36.447 17.871 -15.738 820 HB THR 112 HB THR 112 -37.317 17.702 -17.964 821 HG1 THR 112 HG1 THR 112 -38.182 15.733 -17.847 822 1HG2 THR 112 HG21 THR 112 -36.501 16.031 -19.624 823 2HG2 THR 112 HG22 THR 112 -35.360 17.347 -19.338 824 3HG2 THR 112 HG23 THR 112 -35.076 15.756 -18.602 825 H GLU 113 H GLU 113 -36.492 15.439 -15.015 826 HA GLU 113 HA GLU 113 -34.090 14.991 -13.561 827 1HB GLU 113 HB2 GLU 113 -36.256 14.227 -12.769 828 2HB GLU 113 HB3 GLU 113 -36.454 13.169 -14.175 829 1HG GLU 113 HG2 GLU 113 -34.580 11.776 -13.466 830 2HG GLU 113 HG3 GLU 113 -34.207 12.881 -12.136 831 H GLU 114 H GLU 114 -35.321 13.561 -16.580 832 HA GLU 114 HA GLU 114 -33.167 11.691 -16.794 833 1HB GLU 114 HB2 GLU 114 -33.967 11.232 -19.039 834 2HB GLU 114 HB3 GLU 114 -35.289 11.252 -17.874 835 1HG GLU 114 HG2 GLU 114 -35.940 13.517 -18.629 836 2HG GLU 114 HG3 GLU 114 -34.600 13.528 -19.784 837 H GLU 115 H GLU 115 -33.453 15.088 -17.683 838 HA GLU 115 HA GLU 115 -31.187 15.070 -19.473 839 1HB GLU 115 HB2 GLU 115 -33.026 16.765 -19.590 840 2HB GLU 115 HB3 GLU 115 -32.510 17.397 -18.027 841 1HG GLU 115 HG2 GLU 115 -31.627 18.833 -19.696 842 2HG GLU 115 HG3 GLU 115 -30.269 17.936 -19.036 843 H LYS 116 H LYS 116 -31.841 15.950 -16.055 844 HA LYS 116 HA LYS 116 -29.205 16.617 -15.292 845 1HB LYS 116 HB2 LYS 116 -31.039 17.190 -13.876 846 2HB LYS 116 HB3 LYS 116 -31.612 15.521 -13.802 847 1HG LYS 116 HG2 LYS 116 -29.716 14.833 -12.508 848 2HG LYS 116 HG3 LYS 116 -28.956 16.431 -12.629 849 1HD LYS 116 HD2 LYS 116 -31.721 16.185 -11.424 850 2HD LYS 116 HD3 LYS 116 -30.322 15.631 -10.487 851 1HE LYS 116 HE2 LYS 116 -29.263 17.920 -10.906 852 2HE LYS 116 HE3 LYS 116 -30.831 18.427 -11.544 853 1HZ LYS 116 HZ1 LYS 116 -31.806 17.919 -9.379 854 2HZ LYS 116 HZ2 LYS 116 -30.350 17.445 -8.792 855 3HZ LYS 116 HZ3 LYS 116 -30.587 18.993 -9.221 856 H TRP 117 H TRP 117 -30.863 13.425 -15.199 857 HA TRP 117 HA TRP 117 -28.575 12.004 -14.271 858 1HB TRP 117 HB2 TRP 117 -30.841 11.045 -14.218 859 2HB TRP 117 HB3 TRP 117 -30.877 10.986 -15.981 860 HD1 TRP 117 HD1 TRP 117 -29.453 9.097 -17.177 861 HE1 TRP 117 HE1 TRP 117 -28.321 6.927 -16.376 862 HE3 TRP 117 HE3 TRP 117 -29.484 9.969 -12.137 863 HZ2 TRP 117 HZ2 TRP 117 -27.273 5.875 -13.929 864 HZ3 TRP 117 HZ3 TRP 117 -28.263 8.454 -10.610 865 HH2 TRP 117 HH2 TRP 117 -27.145 6.405 -11.492 866 H ALA 118 H ALA 118 -29.705 12.675 -17.662 867 HA ALA 118 HA ALA 118 -27.674 11.200 -18.941 868 1HB ALA 118 HB1 ALA 118 -28.096 12.668 -20.887 869 2HB ALA 118 HB2 ALA 118 -29.610 12.122 -20.140 870 3HB ALA 118 HB3 ALA 118 -29.026 13.777 -19.858 871 H PHE 119 H PHE 119 -27.623 14.557 -17.672 872 HA PHE 119 HA PHE 119 -25.016 15.190 -18.592 873 1HB PHE 119 HB2 PHE 119 -26.866 16.709 -17.627 874 2HB PHE 119 HB3 PHE 119 -26.251 16.259 -16.046 875 HD1 PHE 119 HD1 PHE 119 -23.809 16.824 -15.479 876 HD2 PHE 119 HD2 PHE 119 -25.827 18.380 -18.954 877 HE1 PHE 119 HE1 PHE 119 -22.201 18.727 -15.563 878 HE2 PHE 119 HE2 PHE 119 -24.196 20.244 -19.066 879 HZ PHE 119 HZ PHE 119 -22.386 20.422 -17.372 880 H PHE 120 H PHE 120 -26.134 13.603 -15.519 881 HA PHE 120 HA PHE 120 -23.611 13.314 -14.275 882 1HB PHE 120 HB2 PHE 120 -25.733 11.144 -14.314 883 2HB PHE 120 HB3 PHE 120 -24.460 11.379 -13.167 884 HD1 PHE 120 HD1 PHE 120 -25.506 14.672 -13.243 885 HD2 PHE 120 HD2 PHE 120 -26.986 10.753 -12.226 886 HE1 PHE 120 HE1 PHE 120 -26.970 15.653 -11.517 887 HE2 PHE 120 HE2 PHE 120 -28.476 11.755 -10.517 888 HZ PHE 120 HZ PHE 120 -28.426 14.209 -10.121 889 H GLN 121 H GLN 121 -25.266 11.201 -16.701 890 HA GLN 121 HA GLN 121 -23.207 9.263 -16.840 891 1HB GLN 121 HB2 GLN 121 -25.234 9.971 -18.982 892 2HB GLN 121 HB3 GLN 121 -24.228 8.527 -18.939 893 1HG GLN 121 HG2 GLN 121 -26.427 9.255 -16.969 894 2HG GLN 121 HG3 GLN 121 -26.457 7.980 -18.168 895 1HE2 GLN 121 HE22 GLN 121 -25.540 8.797 -14.908 896 2HE2 GLN 121 HE21 GLN 121 -24.825 7.259 -14.509 897 H ARG 122 H ARG 122 -23.722 12.185 -18.836 898 HA ARG 122 HA ARG 122 -21.492 11.760 -20.563 899 1HB ARG 122 HB2 ARG 122 -23.087 14.210 -19.758 900 2HB ARG 122 HB3 ARG 122 -21.539 14.428 -20.560 901 1HG ARG 122 HG2 ARG 122 -23.158 14.491 -22.264 902 2HG ARG 122 HG3 ARG 122 -22.278 12.971 -22.437 903 1HD ARG 122 HD2 ARG 122 -24.174 11.792 -21.288 904 2HD ARG 122 HD3 ARG 122 -25.039 13.330 -21.198 905 HE ARG 122 HE ARG 122 -24.550 11.649 -23.564 906 1HH1 ARG 122 HH21 ARG 122 -25.789 14.768 -22.388 907 2HH1 ARG 122 HH22 ARG 122 -26.732 15.081 -23.796 908 1HH2 ARG 122 HH11 ARG 122 -25.795 12.078 -25.441 909 2HH2 ARG 122 HH12 ARG 122 -26.726 13.520 -25.571 910 H VAL 123 H VAL 123 -21.684 13.640 -17.465 911 HA VAL 123 HA VAL 123 -18.943 14.353 -17.604 912 HB VAL 123 HB VAL 123 -20.845 14.254 -15.237 913 1HG1 VAL 123 HG11 VAL 123 -19.220 15.777 -14.103 914 2HG1 VAL 123 HG12 VAL 123 -18.540 14.164 -14.350 915 3HG1 VAL 123 HG13 VAL 123 -18.055 15.496 -15.416 916 1HG2 VAL 123 HG21 VAL 123 -21.415 15.896 -17.038 917 2HG2 VAL 123 HG22 VAL 123 -20.845 16.730 -15.587 918 3HG2 VAL 123 HG23 VAL 123 -19.767 16.539 -16.977 919 H ARG 124 H ARG 124 -20.454 11.433 -15.940 920 HA ARG 124 HA ARG 124 -17.903 10.623 -14.987 921 1HB ARG 124 HB2 ARG 124 -18.755 8.368 -14.698 922 2HB ARG 124 HB3 ARG 124 -19.901 9.548 -14.065 923 1HG ARG 124 HG2 ARG 124 -21.401 9.178 -15.867 924 2HG ARG 124 HG3 ARG 124 -20.212 8.291 -16.821 925 1HD ARG 124 HD2 ARG 124 -20.206 6.512 -15.008 926 2HD ARG 124 HD3 ARG 124 -21.593 7.344 -14.309 927 HE ARG 124 HE ARG 124 -22.951 6.535 -15.974 928 1HH1 ARG 124 HH21 ARG 124 -19.607 5.927 -17.058 929 2HH1 ARG 124 HH22 ARG 124 -20.108 5.010 -18.430 930 1HH2 ARG 124 HH11 ARG 124 -23.569 5.401 -17.744 931 2HH2 ARG 124 HH12 ARG 124 -22.422 4.653 -18.818 932 H ASP 125 H ASP 125 -19.480 9.960 -18.121 933 HA ASP 125 HA ASP 125 -17.559 8.106 -19.047 934 1HB ASP 125 HB2 ASP 125 -19.697 8.415 -20.172 935 2HB ASP 125 HB3 ASP 125 -19.273 10.072 -20.610 936 H GLU 126 H GLU 126 -17.639 11.700 -19.304 937 HA GLU 126 HA GLU 126 -15.240 11.859 -20.828 938 1HB GLU 126 HB2 GLU 126 -16.799 13.892 -19.207 939 2HB GLU 126 HB3 GLU 126 -15.330 14.276 -20.128 940 1HG GLU 126 HG2 GLU 126 -16.384 13.456 -22.203 941 2HG GLU 126 HG3 GLU 126 -17.878 13.123 -21.335 942 H ILE 127 H ILE 127 -15.891 12.017 -17.268 943 HA ILE 127 HA ILE 127 -13.193 12.695 -16.602 944 HB ILE 127 HB ILE 127 -15.595 12.475 -15.194 945 1HG1 ILE 127 HG12 ILE 127 -14.173 13.036 -13.140 946 2HG1 ILE 127 HG13 ILE 127 -12.770 12.951 -14.211 947 1HG2 ILE 127 HG21 ILE 127 -15.289 11.080 -13.292 948 2HG2 ILE 127 HG22 ILE 127 -15.344 10.144 -14.786 949 3HG2 ILE 127 HG23 ILE 127 -13.778 10.428 -13.969 950 1HD1 ILE 127 HD11 ILE 127 -13.711 15.272 -13.961 951 2HD1 ILE 127 HD12 ILE 127 -13.802 14.704 -15.647 952 3HD1 ILE 127 HD13 ILE 127 -15.253 14.703 -14.622 953 H GLY 128 H GLY 128 -14.887 9.568 -17.031 954 1HA GLY 128 HA1 GLY 128 -12.740 7.869 -16.278 955 2HA GLY 128 HA2 GLY 128 -14.100 7.453 -17.348 956 H ASN 129 H ASN 129 -13.808 9.063 -19.509 957 HA ASN 129 HA ASN 129 -11.670 8.119 -21.072 958 1HB ASN 129 HB2 ASN 129 -13.391 9.049 -22.318 959 2HB ASN 129 HB3 ASN 129 -13.577 10.431 -21.245 960 1HD2 ASN 129 HD22 ASN 129 -12.355 12.287 -21.519 961 2HD2 ASN 129 HD21 ASN 129 -10.999 12.384 -22.634 962 H ARG 130 H ARG 130 -11.824 11.102 -19.083 963 HA ARG 130 HA ARG 130 -9.315 12.136 -19.876 964 1HB ARG 130 HB2 ARG 130 -11.319 12.775 -17.871 965 2HB ARG 130 HB3 ARG 130 -9.776 12.697 -17.062 966 1HG ARG 130 HG2 ARG 130 -10.034 14.910 -17.663 967 2HG ARG 130 HG3 ARG 130 -8.851 14.289 -18.807 968 1HD ARG 130 HD2 ARG 130 -11.785 14.303 -19.576 969 2HD ARG 130 HD3 ARG 130 -10.905 15.832 -19.516 970 HE ARG 130 HE ARG 130 -9.722 13.641 -21.145 971 1HH1 ARG 130 HH21 ARG 130 -11.542 16.714 -21.159 972 2HH1 ARG 130 HH22 ARG 130 -11.192 17.042 -22.813 973 1HH2 ARG 130 HH11 ARG 130 -9.296 14.054 -23.262 974 2HH2 ARG 130 HH12 ARG 130 -9.874 15.498 -24.058 975 H LEU 131 H LEU 131 -10.132 9.937 -17.146 976 HA LEU 131 HA LEU 131 -7.379 9.752 -16.350 977 1HB LEU 131 HB2 LEU 131 -9.898 8.364 -15.548 978 2HB LEU 131 HB3 LEU 131 -8.388 7.510 -15.248 979 HG LEU 131 HG LEU 131 -9.065 8.788 -13.336 980 1HD1 LEU 131 HD11 LEU 131 -6.634 8.336 -13.828 981 2HD1 LEU 131 HD12 LEU 131 -6.503 9.989 -14.470 982 3HD1 LEU 131 HD13 LEU 131 -6.906 9.733 -12.785 983 1HD2 LEU 131 HD21 LEU 131 -8.590 11.341 -14.913 984 2HD2 LEU 131 HD22 LEU 131 -10.179 10.696 -14.441 985 3HD2 LEU 131 HD23 LEU 131 -9.027 11.196 -13.199 986 H LYS 132 H LYS 132 -9.355 7.805 -18.597 987 HA LYS 132 HA LYS 132 -7.390 5.829 -19.105 988 1HB LYS 132 HB2 LYS 132 -9.504 5.344 -19.872 989 2HB LYS 132 HB3 LYS 132 -9.801 6.918 -20.544 990 1HG LYS 132 HG2 LYS 132 -7.796 5.047 -21.845 991 2HG LYS 132 HG3 LYS 132 -9.540 4.859 -22.075 992 1HD LYS 132 HD2 LYS 132 -9.427 7.454 -22.698 993 2HD LYS 132 HD3 LYS 132 -7.743 7.064 -23.060 994 1HE LYS 132 HE2 LYS 132 -10.244 5.819 -24.277 995 2HE LYS 132 HE3 LYS 132 -9.108 6.918 -25.060 996 1HZ LYS 132 HZ1 LYS 132 -8.573 4.127 -24.254 997 2HZ LYS 132 HZ2 LYS 132 -8.603 4.735 -25.768 998 3HZ LYS 132 HZ3 LYS 132 -7.390 5.145 -24.734 999 H GLU 133 H GLU 133 -7.900 8.978 -20.756 1000 HA GLU 133 HA GLU 133 -5.627 8.726 -22.487 1001 1HB GLU 133 HB2 GLU 133 -6.862 11.210 -21.216 1002 2HB GLU 133 HB3 GLU 133 -5.636 11.229 -22.490 1003 1HG GLU 133 HG2 GLU 133 -7.122 10.320 -24.108 1004 2HG GLU 133 HG3 GLU 133 -8.330 9.881 -22.904 1005 H PHE 134 H PHE 134 -5.928 10.271 -19.231 1006 HA PHE 134 HA PHE 134 -3.256 11.074 -19.066 1007 1HB PHE 134 HB2 PHE 134 -4.912 11.906 -17.585 1008 2HB PHE 134 HB3 PHE 134 -5.341 10.288 -17.024 1009 HD1 PHE 134 HD1 PHE 134 -4.276 9.276 -15.176 1010 HD2 PHE 134 HD2 PHE 134 -2.613 12.836 -16.967 1011 HE1 PHE 134 HE1 PHE 134 -2.675 9.487 -13.283 1012 HE2 PHE 134 HE2 PHE 134 -1.003 13.022 -15.093 1013 HZ PHE 134 HZ PHE 134 -1.058 11.360 -13.248 1014 H ALA 135 H ALA 135 -4.691 7.924 -18.246 1015 HA ALA 135 HA ALA 135 -2.307 6.827 -17.117 1016 1HB ALA 135 HB1 ALA 135 -4.531 5.952 -16.568 1017 2HB ALA 135 HB2 ALA 135 -4.767 5.438 -18.255 1018 3HB ALA 135 HB3 ALA 135 -3.513 4.674 -17.257 1019 H GLU 136 H GLU 136 -3.778 6.658 -20.366 1020 HA GLU 136 HA GLU 136 -1.889 4.733 -21.380 1021 1HB GLU 136 HB2 GLU 136 -3.996 6.479 -22.687 1022 2HB GLU 136 HB3 GLU 136 -2.949 5.387 -23.605 1023 1HG GLU 136 HG2 GLU 136 -3.723 3.463 -22.280 1024 2HG GLU 136 HG3 GLU 136 -4.824 4.497 -21.372 1025 H THR 137 H THR 137 -2.317 8.230 -21.720 1026 HA THR 137 HA THR 137 -0.160 8.469 -23.573 1027 HB THR 137 HB THR 137 -0.744 10.781 -23.683 1028 HG1 THR 137 HG1 THR 137 -2.638 10.259 -21.655 1029 1HG2 THR 137 HG21 THR 137 -2.109 9.201 -24.966 1030 2HG2 THR 137 HG22 THR 137 -3.206 8.960 -23.603 1031 3HG2 THR 137 HG23 THR 137 -3.112 10.551 -24.392 1032 H GLY 138 H GLY 138 -0.571 8.694 -20.103 1033 1HA GLY 138 HA1 GLY 138 0.849 9.104 -18.376 1034 2HA GLY 138 HA2 GLY 138 2.228 8.989 -19.493 1035 H LYS 139 H LYS 139 -0.603 11.165 -19.657 1036 HA LYS 139 HA LYS 139 0.802 13.297 -20.668 1037 1HB LYS 139 HB2 LYS 139 -1.732 12.847 -20.532 1038 2HB LYS 139 HB3 LYS 139 -1.693 13.694 -18.985 1039 1HG LYS 139 HG2 LYS 139 -1.009 15.735 -19.987 1040 2HG LYS 139 HG3 LYS 139 -0.489 14.955 -21.481 1041 1HD LYS 139 HD2 LYS 139 -3.400 15.091 -20.595 1042 2HD LYS 139 HD3 LYS 139 -2.619 16.255 -21.681 1043 1HE LYS 139 HE2 LYS 139 -1.995 14.355 -23.210 1044 2HE LYS 139 HE3 LYS 139 -2.924 13.254 -22.192 1045 1HZ LYS 139 HZ1 LYS 139 -4.910 14.561 -22.722 1046 2HZ LYS 139 HZ2 LYS 139 -4.035 15.585 -23.653 1047 3HZ LYS 139 HZ3 LYS 139 -4.202 14.028 -24.091 Start of MODEL 2 1 1H MET 1 H1 MET 1 2.083 -2.254 -2.463 2 2H MET 1 H2 MET 1 1.255 -1.202 -3.425 3 3H MET 1 H3 MET 1 2.735 -1.722 -3.877 4 HA MET 1 HA MET 1 2.190 -0.090 -1.502 5 1HB MET 1 HB2 MET 1 4.176 -1.530 -1.250 6 2HB MET 1 HB3 MET 1 4.836 -0.927 -2.775 7 1HG MET 1 HG2 MET 1 5.897 0.140 -0.850 8 2HG MET 1 HG3 MET 1 5.052 1.315 -1.845 9 1HE MET 1 HE1 MET 1 5.049 3.221 -0.132 10 2HE MET 1 HE2 MET 1 4.669 3.017 1.593 11 3HE MET 1 HE3 MET 1 6.084 2.199 0.894 12 H GLU 2 H GLU 2 1.786 2.028 -1.903 13 HA GLU 2 HA GLU 2 1.716 3.093 -4.532 14 1HB GLU 2 HB2 GLU 2 1.296 5.227 -3.457 15 2HB GLU 2 HB3 GLU 2 0.255 3.971 -2.828 16 1HG GLU 2 HG2 GLU 2 2.806 4.708 -1.339 17 2HG GLU 2 HG3 GLU 2 1.404 5.756 -1.264 18 H ASN 3 H ASN 3 2.882 4.850 -5.417 19 HA ASN 3 HA ASN 3 5.781 4.955 -4.707 20 1HB ASN 3 HB2 ASN 3 5.761 3.295 -6.349 21 2HB ASN 3 HB3 ASN 3 4.355 3.958 -7.164 22 1HD2 ASN 3 HD22 ASN 3 4.582 5.422 -8.831 23 2HD2 ASN 3 HD21 ASN 3 6.143 5.941 -9.437 24 H LYS 4 H LYS 4 2.944 6.470 -6.194 25 HA LYS 4 HA LYS 4 4.178 9.094 -5.779 26 1HB LYS 4 HB2 LYS 4 3.676 9.911 -8.013 27 2HB LYS 4 HB3 LYS 4 4.782 8.553 -8.086 28 1HG LYS 4 HG2 LYS 4 2.645 7.109 -8.587 29 2HG LYS 4 HG3 LYS 4 1.859 8.668 -8.897 30 1HD LYS 4 HD2 LYS 4 3.733 9.185 -10.543 31 2HD LYS 4 HD3 LYS 4 4.358 7.549 -10.253 32 1HE LYS 4 HE2 LYS 4 1.905 6.798 -10.870 33 2HE LYS 4 HE3 LYS 4 1.782 8.413 -11.581 34 1HZ LYS 4 HZ1 LYS 4 3.865 7.740 -12.866 35 2HZ LYS 4 HZ2 LYS 4 3.564 6.190 -12.349 36 3HZ LYS 4 HZ3 LYS 4 2.482 6.971 -13.277 37 H ILE 5 H ILE 5 2.274 10.804 -6.301 38 HA ILE 5 HA ILE 5 -0.226 9.685 -5.129 39 HB ILE 5 HB ILE 5 1.486 11.974 -4.085 40 1HG1 ILE 5 HG12 ILE 5 0.422 9.418 -2.843 41 2HG1 ILE 5 HG13 ILE 5 2.095 9.804 -3.235 42 1HG2 ILE 5 HG21 ILE 5 -1.408 11.345 -3.332 43 2HG2 ILE 5 HG22 ILE 5 -0.370 12.559 -2.532 44 3HG2 ILE 5 HG23 ILE 5 -0.868 12.801 -4.181 45 1HD1 ILE 5 HD11 ILE 5 0.392 11.017 -1.041 46 2HD1 ILE 5 HD12 ILE 5 1.898 10.102 -0.897 47 3HD1 ILE 5 HD13 ILE 5 1.923 11.739 -1.601 48 H ILE 6 H ILE 6 -2.087 10.662 -5.797 49 HA ILE 6 HA ILE 6 -1.891 13.037 -7.543 50 HB ILE 6 HB ILE 6 -2.092 11.262 -9.072 51 1HG1 ILE 6 HG12 ILE 6 -4.823 12.552 -8.690 52 2HG1 ILE 6 HG13 ILE 6 -3.413 13.287 -9.469 53 1HG2 ILE 6 HG21 ILE 6 -3.795 9.521 -9.058 54 2HG2 ILE 6 HG22 ILE 6 -2.935 9.455 -7.536 55 3HG2 ILE 6 HG23 ILE 6 -4.539 10.210 -7.602 56 1HD1 ILE 6 HD11 ILE 6 -3.473 11.398 -11.156 57 2HD1 ILE 6 HD12 ILE 6 -5.005 10.881 -10.415 58 3HD1 ILE 6 HD13 ILE 6 -4.890 12.473 -11.164 59 H TYR 7 H TYR 7 -3.494 14.524 -7.159 60 HA TYR 7 HA TYR 7 -5.420 13.930 -4.973 61 1HB TYR 7 HB2 TYR 7 -3.328 14.921 -4.181 62 2HB TYR 7 HB3 TYR 7 -3.555 16.299 -5.262 63 HD1 TYR 7 HD1 TYR 7 -6.499 14.917 -3.374 64 HD2 TYR 7 HD2 TYR 7 -3.294 17.797 -3.410 65 HE1 TYR 7 HE1 TYR 7 -7.273 15.794 -1.212 66 HE2 TYR 7 HE2 TYR 7 -4.145 18.748 -1.274 67 HH TYR 7 HH TYR 7 -5.404 18.359 0.501 68 H PHE 8 H PHE 8 -7.405 14.115 -5.995 69 HA PHE 8 HA PHE 8 -7.800 15.933 -8.259 70 1HB PHE 8 HB2 PHE 8 -9.713 14.162 -6.670 71 2HB PHE 8 HB3 PHE 8 -10.180 15.135 -8.058 72 HD1 PHE 8 HD1 PHE 8 -9.041 11.912 -7.067 73 HD2 PHE 8 HD2 PHE 8 -8.727 14.824 -10.230 74 HE1 PHE 8 HE1 PHE 8 -8.120 10.184 -8.594 75 HE2 PHE 8 HE2 PHE 8 -7.725 13.105 -11.719 76 HZ PHE 8 HZ PHE 8 -7.373 10.793 -10.863 77 H LEU 9 H LEU 9 -8.890 17.858 -8.260 78 HA LEU 9 HA LEU 9 -9.888 18.985 -5.694 79 1HB LEU 9 HB2 LEU 9 -7.509 19.726 -7.297 80 2HB LEU 9 HB3 LEU 9 -8.653 21.038 -7.262 81 HG LEU 9 HG LEU 9 -7.014 21.300 -5.523 82 1HD1 LEU 9 HD11 LEU 9 -9.581 20.567 -4.098 83 2HD1 LEU 9 HD12 LEU 9 -8.468 21.902 -3.771 84 3HD1 LEU 9 HD13 LEU 9 -9.484 21.965 -5.201 85 1HD2 LEU 9 HD21 LEU 9 -7.975 18.723 -4.261 86 2HD2 LEU 9 HD22 LEU 9 -6.460 18.917 -5.154 87 3HD2 LEU 9 HD23 LEU 9 -6.721 19.817 -3.656 88 H CYS 10 H CYS 10 -11.848 20.070 -5.983 89 HA CYS 10 HA CYS 10 -12.367 21.424 -8.497 90 1HB CYS 10 HB2 CYS 10 -14.485 20.372 -9.035 91 2HB CYS 10 HB3 CYS 10 -13.221 19.140 -9.001 92 HG CYS 10 HG CYS 10 -13.687 18.148 -6.754 93 H THR 11 H THR 11 -14.816 22.473 -8.220 94 HA THR 11 HA THR 11 -14.562 24.061 -5.869 95 HB THR 11 HB THR 11 -16.822 24.968 -6.797 96 HG1 THR 11 HG1 THR 11 -17.188 24.449 -8.899 97 1HG2 THR 11 HG21 THR 11 -15.582 26.280 -8.418 98 2HG2 THR 11 HG22 THR 11 -14.546 25.991 -7.009 99 3HG2 THR 11 HG23 THR 11 -14.291 25.059 -8.494 100 H GLY 12 H GLY 12 -15.829 20.952 -6.013 101 1HA GLY 12 HA1 GLY 12 -16.636 21.201 -3.302 102 2HA GLY 12 HA2 GLY 12 -18.070 20.974 -4.322 103 H ASN 13 H ASN 13 -15.478 19.435 -2.771 104 HA ASN 13 HA ASN 13 -14.410 17.471 -4.339 105 1HB ASN 13 HB2 ASN 13 -13.882 17.916 -1.948 106 2HB ASN 13 HB3 ASN 13 -15.394 17.192 -1.457 107 1HD2 ASN 13 HD22 ASN 13 -12.907 16.375 -0.486 108 2HD2 ASN 13 HD21 ASN 13 -12.531 14.765 -1.066 109 H SER 14 H SER 14 -17.437 17.267 -2.574 110 HA SER 14 HA SER 14 -18.204 14.754 -2.566 111 1HB SER 14 HB2 SER 14 -19.968 17.175 -3.123 112 2HB SER 14 HB3 SER 14 -20.447 15.683 -2.279 113 HG SER 14 HG SER 14 -18.963 16.110 -0.702 114 H CYS 15 H CYS 15 -18.349 16.700 -5.570 115 HA CYS 15 HA CYS 15 -19.731 14.398 -6.874 116 1HB CYS 15 HB2 CYS 15 -20.256 16.063 -8.685 117 2HB CYS 15 HB3 CYS 15 -21.084 16.283 -7.142 118 HG CYS 15 HG CYS 15 -20.625 18.654 -7.943 119 H ARG 16 H ARG 16 -17.596 16.884 -8.345 120 HA ARG 16 HA ARG 16 -16.709 14.904 -10.168 121 1HB ARG 16 HB2 ARG 16 -15.329 17.585 -9.674 122 2HB ARG 16 HB3 ARG 16 -15.058 16.488 -11.011 123 1HG ARG 16 HG2 ARG 16 -16.471 17.935 -12.016 124 2HG ARG 16 HG3 ARG 16 -17.620 16.717 -11.486 125 1HD ARG 16 HD2 ARG 16 -18.763 18.302 -10.359 126 2HD ARG 16 HD3 ARG 16 -17.349 18.595 -9.334 127 HE ARG 16 HE ARG 16 -17.429 19.897 -11.990 128 1HH1 ARG 16 HH11 ARG 16 -17.891 20.360 -8.467 129 2HH1 ARG 16 HH12 ARG 16 -17.535 22.065 -8.568 130 1HH2 ARG 16 HH21 ARG 16 -17.106 22.060 -12.073 131 2HH2 ARG 16 HH22 ARG 16 -17.277 23.077 -10.659 132 H SER 17 H SER 17 -14.929 16.103 -7.221 133 HA SER 17 HA SER 17 -12.601 14.602 -7.950 134 1HB SER 17 HB2 SER 17 -13.437 15.541 -5.192 135 2HB SER 17 HB3 SER 17 -11.815 15.049 -5.714 136 HG SER 17 HG SER 17 -12.066 17.292 -5.670 137 H GLN 18 H GLN 18 -15.466 13.803 -5.894 138 HA GLN 18 HA GLN 18 -14.503 11.260 -5.016 139 1HB GLN 18 HB2 GLN 18 -17.332 12.316 -5.538 140 2HB GLN 18 HB3 GLN 18 -17.009 10.745 -4.822 141 1HG GLN 18 HG2 GLN 18 -16.166 13.409 -3.634 142 2HG GLN 18 HG3 GLN 18 -17.535 12.441 -3.117 143 1HE2 GLN 18 HE22 GLN 18 -14.470 13.199 -2.234 144 2HE2 GLN 18 HE21 GLN 18 -14.124 11.762 -1.271 145 H MET 19 H MET 19 -16.438 12.144 -7.928 146 HA MET 19 HA MET 19 -16.707 9.448 -8.878 147 1HB MET 19 HB2 MET 19 -16.844 12.137 -10.320 148 2HB MET 19 HB3 MET 19 -17.278 10.586 -11.058 149 1HG MET 19 HG2 MET 19 -19.099 10.250 -9.533 150 2HG MET 19 HG3 MET 19 -18.568 11.564 -8.497 151 1HE MET 19 HE1 MET 19 -20.712 12.137 -12.563 152 2HE MET 19 HE2 MET 19 -19.072 11.461 -12.480 153 3HE MET 19 HE3 MET 19 -20.440 10.571 -11.767 154 H ALA 20 H ALA 20 -14.350 12.074 -9.698 155 HA ALA 20 HA ALA 20 -12.828 10.651 -11.577 156 1HB ALA 20 HB1 ALA 20 -12.567 13.086 -11.117 157 2HB ALA 20 HB2 ALA 20 -11.858 12.703 -9.535 158 3HB ALA 20 HB3 ALA 20 -11.020 12.225 -11.022 159 H GLU 21 H GLU 21 -12.492 10.781 -7.994 160 HA GLU 21 HA GLU 21 -10.156 9.258 -7.828 161 1HB GLU 21 HB2 GLU 21 -10.906 10.496 -5.937 162 2HB GLU 21 HB3 GLU 21 -12.455 9.638 -5.865 163 1HG GLU 21 HG2 GLU 21 -11.383 7.584 -5.250 164 2HG GLU 21 HG3 GLU 21 -9.777 8.259 -5.479 165 H GLY 22 H GLY 22 -13.594 8.105 -7.794 166 1HA GLY 22 HA1 GLY 22 -13.025 5.381 -7.422 167 2HA GLY 22 HA2 GLY 22 -14.460 6.030 -8.211 168 H TRP 23 H TRP 23 -13.293 7.201 -10.589 169 HA TRP 23 HA TRP 23 -12.779 4.808 -12.168 170 1HB TRP 23 HB2 TRP 23 -12.466 7.768 -12.762 171 2HB TRP 23 HB3 TRP 23 -12.106 6.542 -13.953 172 HD1 TRP 23 HD1 TRP 23 -14.835 8.520 -12.426 173 HE1 TRP 23 HE1 TRP 23 -17.016 8.185 -13.636 174 HE3 TRP 23 HE3 TRP 23 -13.553 4.460 -15.283 175 HZ2 TRP 23 HZ2 TRP 23 -18.099 6.437 -15.654 176 HZ3 TRP 23 HZ3 TRP 23 -15.184 3.532 -16.906 177 HH2 TRP 23 HH2 TRP 23 -17.462 4.538 -17.107 178 H ALA 24 H ALA 24 -10.699 7.351 -10.718 179 HA ALA 24 HA ALA 24 -8.415 6.711 -12.216 180 1HB ALA 24 HB1 ALA 24 -7.198 8.031 -10.511 181 2HB ALA 24 HB2 ALA 24 -8.743 8.813 -10.889 182 3HB ALA 24 HB3 ALA 24 -8.564 7.882 -9.392 183 H LYS 25 H LYS 25 -9.580 5.417 -9.105 184 HA LYS 25 HA LYS 25 -7.322 3.841 -8.459 185 1HB LYS 25 HB2 LYS 25 -10.290 3.420 -7.957 186 2HB LYS 25 HB3 LYS 25 -9.054 2.349 -7.286 187 1HG LYS 25 HG2 LYS 25 -8.070 4.087 -5.959 188 2HG LYS 25 HG3 LYS 25 -8.960 5.354 -6.806 189 1HD LYS 25 HD2 LYS 25 -11.106 4.430 -5.963 190 2HD LYS 25 HD3 LYS 25 -10.211 3.204 -5.033 191 1HE LYS 25 HE2 LYS 25 -9.133 4.917 -3.687 192 2HE LYS 25 HE3 LYS 25 -9.706 6.188 -4.771 193 1HZ LYS 25 HZ1 LYS 25 -11.101 6.259 -2.938 194 2HZ LYS 25 HZ2 LYS 25 -12.007 5.561 -4.087 195 3HZ LYS 25 HZ3 LYS 25 -11.351 4.617 -2.894 196 H GLN 26 H GLN 26 -9.829 3.289 -10.923 197 HA GLN 26 HA GLN 26 -9.050 0.526 -11.410 198 1HB GLN 26 HB2 GLN 26 -10.444 2.379 -13.344 199 2HB GLN 26 HB3 GLN 26 -10.349 0.630 -13.391 200 1HG GLN 26 HG2 GLN 26 -11.726 0.554 -11.273 201 2HG GLN 26 HG3 GLN 26 -11.933 2.318 -11.410 202 1HE2 GLN 26 HE22 GLN 26 -12.279 2.857 -13.987 203 2HE2 GLN 26 HE21 GLN 26 -13.668 2.022 -14.662 204 H TYR 27 H TYR 27 -8.685 3.565 -13.255 205 HA TYR 27 HA TYR 27 -7.046 2.373 -15.251 206 1HB TYR 27 HB2 TYR 27 -7.525 5.299 -14.559 207 2HB TYR 27 HB3 TYR 27 -6.653 4.761 -15.983 208 HD1 TYR 27 HD1 TYR 27 -9.810 5.808 -14.890 209 HD2 TYR 27 HD2 TYR 27 -7.924 2.893 -17.453 210 HE1 TYR 27 HE1 TYR 27 -11.867 5.672 -16.249 211 HE2 TYR 27 HE2 TYR 27 -10.003 2.709 -18.783 212 HH TYR 27 HH TYR 27 -12.940 4.653 -18.063 213 H LEU 28 H LEU 28 -6.110 4.384 -12.422 214 HA LEU 28 HA LEU 28 -3.408 4.698 -13.473 215 1HB LEU 28 HB2 LEU 28 -4.545 5.501 -10.767 216 2HB LEU 28 HB3 LEU 28 -3.054 6.051 -11.498 217 HG LEU 28 HG LEU 28 -5.868 6.719 -12.390 218 1HD1 LEU 28 HD11 LEU 28 -4.871 7.979 -10.490 219 2HD1 LEU 28 HD12 LEU 28 -3.536 8.480 -11.546 220 3HD1 LEU 28 HD13 LEU 28 -5.200 8.994 -11.907 221 1HD2 LEU 28 HD21 LEU 28 -4.911 8.071 -14.200 222 2HD2 LEU 28 HD22 LEU 28 -3.293 7.406 -13.855 223 3HD2 LEU 28 HD23 LEU 28 -4.605 6.364 -14.451 224 H GLY 29 H GLY 29 -4.960 2.846 -10.886 225 1HA GLY 29 HA1 GLY 29 -4.333 0.774 -10.058 226 2HA GLY 29 HA2 GLY 29 -2.822 0.848 -10.968 227 H ASP 30 H ASP 30 -2.520 -0.137 -8.595 228 HA ASP 30 HA ASP 30 -2.534 1.526 -6.333 229 1HB ASP 30 HB2 ASP 30 -2.618 -0.964 -6.390 230 2HB ASP 30 HB3 ASP 30 -0.906 -0.976 -6.842 231 H GLU 31 H GLU 31 -0.155 1.376 -8.835 232 HA GLU 31 HA GLU 31 2.204 2.227 -7.534 233 1HB GLU 31 HB2 GLU 31 2.009 1.567 -9.919 234 2HB GLU 31 HB3 GLU 31 1.068 3.024 -10.255 235 1HG GLU 31 HG2 GLU 31 3.018 4.424 -9.590 236 2HG GLU 31 HG3 GLU 31 3.955 2.955 -9.283 237 H TRP 32 H TRP 32 -0.852 3.866 -8.012 238 HA TRP 32 HA TRP 32 0.375 6.452 -7.165 239 1HB TRP 32 HB2 TRP 32 -2.329 6.046 -8.492 240 2HB TRP 32 HB3 TRP 32 -1.532 7.560 -8.140 241 HD1 TRP 32 HD1 TRP 32 -0.772 4.461 -10.353 242 HE1 TRP 32 HE1 TRP 32 -0.348 5.250 -12.735 243 HE3 TRP 32 HE3 TRP 32 -0.885 9.505 -9.560 244 HZ2 TRP 32 HZ2 TRP 32 -0.343 7.728 -14.177 245 HZ3 TRP 32 HZ3 TRP 32 -0.764 11.073 -11.475 246 HH2 TRP 32 HH2 TRP 32 -0.545 10.194 -13.806 247 H LYS 33 H LYS 33 -0.361 7.256 -5.200 248 HA LYS 33 HA LYS 33 -2.605 5.862 -3.825 249 1HB LYS 33 HB2 LYS 33 -0.225 7.052 -2.860 250 2HB LYS 33 HB3 LYS 33 -1.471 8.237 -2.492 251 1HG LYS 33 HG2 LYS 33 -1.514 5.297 -1.697 252 2HG LYS 33 HG3 LYS 33 -1.051 6.631 -0.646 253 1HD LYS 33 HD2 LYS 33 -3.828 6.210 -1.840 254 2HD LYS 33 HD3 LYS 33 -3.333 5.831 -0.193 255 1HE LYS 33 HE2 LYS 33 -2.838 8.191 0.268 256 2HE LYS 33 HE3 LYS 33 -3.231 8.641 -1.391 257 1HZ LYS 33 HZ1 LYS 33 -5.191 7.427 0.476 258 2HZ LYS 33 HZ2 LYS 33 -5.058 9.031 0.168 259 3HZ LYS 33 HZ3 LYS 33 -5.503 8.033 -1.031 260 H VAL 34 H VAL 34 -4.640 6.854 -3.865 261 HA VAL 34 HA VAL 34 -4.825 9.374 -5.441 262 HB VAL 34 HB VAL 34 -6.911 7.182 -5.080 263 1HG1 VAL 34 HG11 VAL 34 -6.640 9.416 -7.131 264 2HG1 VAL 34 HG12 VAL 34 -7.936 8.197 -7.078 265 3HG1 VAL 34 HG13 VAL 34 -7.796 9.398 -5.788 266 1HG2 VAL 34 HG21 VAL 34 -5.025 6.144 -6.274 267 2HG2 VAL 34 HG22 VAL 34 -6.346 6.436 -7.397 268 3HG2 VAL 34 HG23 VAL 34 -4.940 7.521 -7.391 269 H TYR 35 H TYR 35 -6.058 11.071 -4.643 270 HA TYR 35 HA TYR 35 -7.752 10.672 -2.253 271 1HB TYR 35 HB2 TYR 35 -5.847 13.009 -2.604 272 2HB TYR 35 HB3 TYR 35 -6.990 12.811 -1.296 273 HD1 TYR 35 HD1 TYR 35 -3.722 12.059 -2.620 274 HD2 TYR 35 HD2 TYR 35 -6.483 11.272 0.598 275 HE1 TYR 35 HE1 TYR 35 -1.849 11.565 -1.157 276 HE2 TYR 35 HE2 TYR 35 -4.582 10.674 2.084 277 HH TYR 35 HH TYR 35 -1.157 10.857 1.002 278 H SER 36 H SER 36 -9.244 12.539 -2.037 279 HA SER 36 HA SER 36 -9.578 14.273 -4.403 280 1HB SER 36 HB2 SER 36 -12.098 13.785 -4.031 281 2HB SER 36 HB3 SER 36 -11.131 12.577 -4.890 282 HG SER 36 HG SER 36 -11.083 11.305 -3.119 283 H ALA 37 H ALA 37 -9.960 16.341 -3.815 284 HA ALA 37 HA ALA 37 -11.217 16.990 -1.232 285 1HB ALA 37 HB1 ALA 37 -9.657 18.784 -0.846 286 2HB ALA 37 HB2 ALA 37 -8.910 17.205 -0.689 287 3HB ALA 37 HB3 ALA 37 -8.606 18.194 -2.152 288 H GLY 38 H GLY 38 -11.388 19.650 -1.451 289 1HA GLY 38 HA1 GLY 38 -11.770 20.685 -4.060 290 2HA GLY 38 HA2 GLY 38 -13.326 20.253 -3.334 291 H ILE 39 H ILE 39 -13.115 22.772 -3.833 292 HA ILE 39 HA ILE 39 -12.023 24.583 -1.938 293 HB ILE 39 HB ILE 39 -14.436 24.533 -3.758 294 1HG1 ILE 39 HG12 ILE 39 -13.376 26.270 -4.992 295 2HG1 ILE 39 HG13 ILE 39 -12.235 26.602 -3.714 296 1HG2 ILE 39 HG21 ILE 39 -13.861 26.849 -1.890 297 2HG2 ILE 39 HG22 ILE 39 -14.951 26.897 -3.295 298 3HG2 ILE 39 HG23 ILE 39 -15.330 25.843 -1.940 299 1HD1 ILE 39 HD11 ILE 39 -12.251 24.168 -5.534 300 2HD1 ILE 39 HD12 ILE 39 -11.112 25.511 -5.551 301 3HD1 ILE 39 HD13 ILE 39 -11.091 24.410 -4.192 302 H GLU 40 H GLU 40 -15.017 22.656 -1.925 303 HA GLU 40 HA GLU 40 -14.976 22.622 0.994 304 1HB GLU 40 HB2 GLU 40 -17.312 23.205 1.249 305 2HB GLU 40 HB3 GLU 40 -16.433 24.531 0.503 306 1HG GLU 40 HG2 GLU 40 -17.320 23.864 -1.735 307 2HG GLU 40 HG3 GLU 40 -18.208 22.536 -0.986 308 H ALA 41 H ALA 41 -16.962 21.060 1.627 309 HA ALA 41 HA ALA 41 -17.515 18.951 -0.360 310 1HB ALA 41 HB1 ALA 41 -16.926 17.217 1.331 311 2HB ALA 41 HB2 ALA 41 -15.498 18.128 0.781 312 3HB ALA 41 HB3 ALA 41 -16.220 18.467 2.369 313 H HIS 42 H HIS 42 -19.675 18.567 -0.204 314 HA HIS 42 HA HIS 42 -21.248 19.686 2.024 315 1HB HIS 42 HB2 HIS 42 -21.921 19.761 -0.415 316 2HB HIS 42 HB3 HIS 42 -22.138 18.014 -0.367 317 HD1 HIS 42 HD1 HIS 42 -23.657 18.282 2.674 318 HD2 HIS 42 HD2 HIS 42 -24.503 20.135 -1.013 319 HE1 HIS 42 HE1 HIS 42 -26.118 18.949 2.753 320 H GLY 43 H GLY 43 -20.137 16.560 0.776 321 1HA GLY 43 HA1 GLY 43 -20.050 14.949 2.991 322 2HA GLY 43 HA2 GLY 43 -21.749 14.885 2.459 323 H LEU 44 H LEU 44 -21.238 12.570 1.872 324 HA LEU 44 HA LEU 44 -19.693 12.270 -0.647 325 1HB LEU 44 HB2 LEU 44 -19.525 10.490 1.088 326 2HB LEU 44 HB3 LEU 44 -21.273 10.237 0.984 327 HG LEU 44 HG LEU 44 -21.010 9.643 -1.434 328 1HD1 LEU 44 HD11 LEU 44 -18.028 9.774 -0.831 329 2HD1 LEU 44 HD12 LEU 44 -18.745 9.015 -2.266 330 3HD1 LEU 44 HD13 LEU 44 -18.913 10.749 -2.025 331 1HD2 LEU 44 HD21 LEU 44 -19.892 7.429 -0.969 332 2HD2 LEU 44 HD22 LEU 44 -19.454 8.039 0.631 333 3HD2 LEU 44 HD23 LEU 44 -21.164 7.865 0.191 334 H ASN 45 H ASN 45 -20.822 13.051 -2.419 335 HA ASN 45 HA ASN 45 -23.582 13.722 -2.260 336 1HB ASN 45 HB2 ASN 45 -21.964 14.889 -3.733 337 2HB ASN 45 HB3 ASN 45 -21.801 13.417 -4.703 338 1HD2 ASN 45 HD22 ASN 45 -23.790 16.249 -4.135 339 2HD2 ASN 45 HD21 ASN 45 -24.971 15.862 -5.360 340 HA PRO 46 HA PRO 46 -25.159 9.648 -3.059 341 1HB PRO 46 HB2 PRO 46 -27.797 10.150 -3.686 342 2HB PRO 46 HB3 PRO 46 -27.116 10.245 -2.034 343 1HG PRO 46 HG2 PRO 46 -27.565 12.508 -3.998 344 2HG PRO 46 HG3 PRO 46 -28.002 12.445 -2.259 345 1HD PRO 46 HD2 PRO 46 -25.741 13.678 -3.110 346 2HD PRO 46 HD3 PRO 46 -25.747 12.728 -1.593 347 H ASN 47 H ASN 47 -25.565 12.148 -5.629 348 HA ASN 47 HA ASN 47 -26.111 10.151 -7.682 349 1HB ASN 47 HB2 ASN 47 -26.739 12.475 -8.174 350 2HB ASN 47 HB3 ASN 47 -25.054 12.994 -7.980 351 1HD2 ASN 47 HD22 ASN 47 -24.231 13.439 -10.008 352 2HD2 ASN 47 HD21 ASN 47 -24.468 12.398 -11.393 353 H ALA 48 H ALA 48 -23.138 11.673 -6.270 354 HA ALA 48 HA ALA 48 -21.364 10.617 -8.229 355 1HB ALA 48 HB1 ALA 48 -19.609 10.954 -6.550 356 2HB ALA 48 HB2 ALA 48 -20.699 12.351 -6.592 357 3HB ALA 48 HB3 ALA 48 -20.813 11.163 -5.274 358 H VAL 49 H VAL 49 -22.701 9.234 -5.172 359 HA VAL 49 HA VAL 49 -21.309 6.748 -5.395 360 HB VAL 49 HB VAL 49 -23.980 7.281 -4.046 361 1HG1 VAL 49 HG11 VAL 49 -21.948 5.009 -3.762 362 2HG1 VAL 49 HG12 VAL 49 -23.366 5.261 -2.710 363 3HG1 VAL 49 HG13 VAL 49 -23.592 4.867 -4.416 364 1HG2 VAL 49 HG21 VAL 49 -22.607 7.428 -1.979 365 2HG2 VAL 49 HG22 VAL 49 -21.129 7.327 -2.966 366 3HG2 VAL 49 HG23 VAL 49 -22.217 8.715 -3.117 367 H LYS 50 H LYS 50 -24.696 7.605 -6.387 368 HA LYS 50 HA LYS 50 -25.130 5.019 -7.407 369 1HB LYS 50 HB2 LYS 50 -26.883 6.744 -6.786 370 2HB LYS 50 HB3 LYS 50 -26.561 7.552 -8.330 371 1HG LYS 50 HG2 LYS 50 -27.142 5.396 -9.518 372 2HG LYS 50 HG3 LYS 50 -27.507 4.666 -7.944 373 1HD LYS 50 HD2 LYS 50 -29.271 6.402 -7.590 374 2HD LYS 50 HD3 LYS 50 -28.902 7.066 -9.198 375 1HE LYS 50 HE2 LYS 50 -29.486 4.879 -10.230 376 2HE LYS 50 HE3 LYS 50 -29.837 4.214 -8.631 377 1HZ LYS 50 HZ1 LYS 50 -31.317 6.443 -9.910 378 2HZ LYS 50 HZ2 LYS 50 -31.850 4.913 -9.746 379 3HZ LYS 50 HZ3 LYS 50 -31.632 5.835 -8.423 380 H ALA 51 H ALA 51 -24.170 7.988 -9.254 381 HA ALA 51 HA ALA 51 -24.265 6.858 -11.812 382 1HB ALA 51 HB1 ALA 51 -22.294 8.942 -10.750 383 2HB ALA 51 HB2 ALA 51 -22.706 8.652 -12.457 384 3HB ALA 51 HB3 ALA 51 -23.937 9.281 -11.346 385 H MET 52 H MET 52 -21.504 6.843 -9.425 386 HA MET 52 HA MET 52 -19.739 5.434 -11.204 387 1HB MET 52 HB2 MET 52 -19.849 5.847 -8.192 388 2HB MET 52 HB3 MET 52 -18.499 5.103 -9.038 389 1HG MET 52 HG2 MET 52 -19.527 7.933 -9.493 390 2HG MET 52 HG3 MET 52 -18.093 7.499 -8.575 391 1HE MET 52 HE1 MET 52 -16.807 5.240 -10.308 392 2HE MET 52 HE2 MET 52 -15.676 6.148 -11.296 393 3HE MET 52 HE3 MET 52 -15.913 6.600 -9.595 394 H LYS 53 H LYS 53 -21.990 4.430 -8.590 395 HA LYS 53 HA LYS 53 -21.239 1.712 -8.593 396 1HB LYS 53 HB2 LYS 53 -22.375 3.053 -6.818 397 2HB LYS 53 HB3 LYS 53 -23.892 2.932 -7.725 398 1HG LYS 53 HG2 LYS 53 -23.963 0.531 -7.366 399 2HG LYS 53 HG3 LYS 53 -22.279 0.520 -6.784 400 1HD LYS 53 HD2 LYS 53 -22.942 2.019 -4.901 401 2HD LYS 53 HD3 LYS 53 -24.634 1.903 -5.409 402 1HE LYS 53 HE2 LYS 53 -24.778 -0.385 -4.796 403 2HE LYS 53 HE3 LYS 53 -23.028 -0.622 -4.924 404 1HZ LYS 53 HZ1 LYS 53 -24.334 0.938 -2.780 405 2HZ LYS 53 HZ2 LYS 53 -23.713 -0.565 -2.623 406 3HZ LYS 53 HZ3 LYS 53 -22.711 0.691 -2.961 407 H GLU 54 H GLU 54 -23.577 3.458 -10.599 408 HA GLU 54 HA GLU 54 -24.757 1.169 -11.808 409 1HB GLU 54 HB2 GLU 54 -24.502 4.099 -12.573 410 2HB GLU 54 HB3 GLU 54 -25.239 2.954 -13.686 411 1HG GLU 54 HG2 GLU 54 -26.149 3.292 -10.808 412 2HG GLU 54 HG3 GLU 54 -26.812 4.211 -12.154 413 H VAL 55 H VAL 55 -21.554 2.524 -12.189 414 HA VAL 55 HA VAL 55 -21.060 0.945 -14.653 415 HB VAL 55 HB VAL 55 -19.140 2.631 -12.984 416 1HG1 VAL 55 HG11 VAL 55 -17.900 1.066 -14.399 417 2HG1 VAL 55 HG12 VAL 55 -18.866 1.542 -15.816 418 3HG1 VAL 55 HG13 VAL 55 -17.757 2.693 -15.034 419 1HG2 VAL 55 HG21 VAL 55 -20.694 3.352 -15.505 420 2HG2 VAL 55 HG22 VAL 55 -20.901 4.082 -13.899 421 3HG2 VAL 55 HG23 VAL 55 -19.395 4.328 -14.775 422 H GLY 56 H GLY 56 -21.215 0.442 -11.280 423 1HA GLY 56 HA1 GLY 56 -20.808 -1.599 -10.206 424 2HA GLY 56 HA2 GLY 56 -19.551 -2.011 -11.381 425 H ILE 57 H ILE 57 -19.274 1.285 -10.365 426 HA ILE 57 HA ILE 57 -16.944 0.556 -8.678 427 HB ILE 57 HB ILE 57 -17.602 3.195 -10.019 428 1HG1 ILE 57 HG12 ILE 57 -15.741 0.961 -10.936 429 2HG1 ILE 57 HG13 ILE 57 -17.203 1.524 -11.750 430 1HG2 ILE 57 HG21 ILE 57 -15.262 3.766 -9.405 431 2HG2 ILE 57 HG22 ILE 57 -16.125 3.268 -7.957 432 3HG2 ILE 57 HG23 ILE 57 -15.013 2.139 -8.749 433 1HD1 ILE 57 HD11 ILE 57 -15.420 2.480 -12.942 434 2HD1 ILE 57 HD12 ILE 57 -16.096 3.799 -11.987 435 3HD1 ILE 57 HD13 ILE 57 -14.574 3.010 -11.476 436 H ASP 58 H ASP 58 -18.022 0.094 -6.826 437 HA ASP 58 HA ASP 58 -20.156 1.739 -5.732 438 1HB ASP 58 HB2 ASP 58 -20.168 -0.657 -5.415 439 2HB ASP 58 HB3 ASP 58 -18.591 -0.608 -4.616 440 H ILE 59 H ILE 59 -18.937 3.811 -5.762 441 HA ILE 59 HA ILE 59 -16.735 4.147 -3.957 442 HB ILE 59 HB ILE 59 -16.768 6.446 -4.436 443 1HG1 ILE 59 HG12 ILE 59 -19.328 6.347 -6.017 444 2HG1 ILE 59 HG13 ILE 59 -19.362 6.671 -4.285 445 1HG2 ILE 59 HG21 ILE 59 -15.949 4.966 -6.228 446 2HG2 ILE 59 HG22 ILE 59 -17.553 5.047 -7.003 447 3HG2 ILE 59 HG23 ILE 59 -16.568 6.507 -6.844 448 1HD1 ILE 59 HD11 ILE 59 -19.353 8.788 -5.356 449 2HD1 ILE 59 HD12 ILE 59 -17.769 8.564 -4.611 450 3HD1 ILE 59 HD13 ILE 59 -17.953 8.364 -6.370 451 H SER 60 H SER 60 -19.724 3.319 -2.911 452 HA SER 60 HA SER 60 -20.489 5.381 -1.161 453 1HB SER 60 HB2 SER 60 -21.733 3.651 0.057 454 2HB SER 60 HB3 SER 60 -21.969 3.543 -1.693 455 HG SER 60 HG SER 60 -20.865 1.727 -1.793 456 H ASN 61 H ASN 61 -17.872 3.066 -0.888 457 HA ASN 61 HA ASN 61 -17.402 3.328 1.927 458 1HB ASN 61 HB2 ASN 61 -16.660 1.392 0.553 459 2HB ASN 61 HB3 ASN 61 -15.554 2.449 -0.331 460 1HD2 ASN 61 HD22 ASN 61 -13.443 2.231 0.403 461 2HD2 ASN 61 HD21 ASN 61 -12.992 1.900 2.053 462 H GLN 62 H GLN 62 -16.713 5.503 -0.729 463 HA GLN 62 HA GLN 62 -14.299 6.641 0.362 464 1HB GLN 62 HB2 GLN 62 -16.206 7.742 -1.742 465 2HB GLN 62 HB3 GLN 62 -14.603 8.377 -1.327 466 1HG GLN 62 HG2 GLN 62 -13.592 6.198 -1.978 467 2HG GLN 62 HG3 GLN 62 -15.175 5.657 -2.543 468 1HE2 GLN 62 HE22 GLN 62 -15.158 8.931 -3.422 469 2HE2 GLN 62 HE21 GLN 62 -14.567 8.685 -5.061 470 H THR 63 H THR 63 -14.350 9.094 0.807 471 HA THR 63 HA THR 63 -16.771 10.180 1.953 472 HB THR 63 HB THR 63 -15.350 10.924 4.003 473 HG1 THR 63 HG1 THR 63 -13.690 9.588 4.583 474 1HG2 THR 63 HG21 THR 63 -16.032 9.042 5.345 475 2HG2 THR 63 HG22 THR 63 -17.278 9.330 4.119 476 3HG2 THR 63 HG23 THR 63 -16.135 7.982 3.923 477 H SER 64 H SER 64 -16.455 12.546 2.364 478 HA SER 64 HA SER 64 -14.540 13.665 0.387 479 1HB SER 64 HB2 SER 64 -17.182 14.772 1.387 480 2HB SER 64 HB3 SER 64 -16.191 15.405 0.060 481 HG SER 64 HG SER 64 -18.108 13.912 -0.316 482 H ASP 65 H ASP 65 -13.641 15.715 0.857 483 HA ASP 65 HA ASP 65 -13.557 16.806 3.572 484 1HB ASP 65 HB2 ASP 65 -11.862 14.876 3.456 485 2HB ASP 65 HB3 ASP 65 -11.041 15.792 2.179 486 H ILE 66 H ILE 66 -12.230 18.873 3.515 487 HA ILE 66 HA ILE 66 -12.368 20.135 0.837 488 HB ILE 66 HB ILE 66 -12.565 22.179 1.903 489 1HG1 ILE 66 HG12 ILE 66 -11.725 20.866 4.516 490 2HG1 ILE 66 HG13 ILE 66 -10.827 22.078 3.580 491 1HG2 ILE 66 HG21 ILE 66 -14.526 20.512 2.086 492 2HG2 ILE 66 HG22 ILE 66 -14.142 20.393 3.803 493 3HG2 ILE 66 HG23 ILE 66 -14.614 21.955 3.117 494 1HD1 ILE 66 HD11 ILE 66 -11.841 23.234 5.403 495 2HD1 ILE 66 HD12 ILE 66 -12.785 23.658 3.948 496 3HD1 ILE 66 HD13 ILE 66 -13.412 22.465 5.111 497 H ILE 67 H ILE 67 -10.477 21.616 0.346 498 HA ILE 67 HA ILE 67 -8.282 19.954 0.141 499 HB ILE 67 HB ILE 67 -8.890 21.648 -1.437 500 1HG1 ILE 67 HG12 ILE 67 -6.611 20.557 -1.338 501 2HG1 ILE 67 HG13 ILE 67 -6.805 21.988 -2.335 502 1HG2 ILE 67 HG21 ILE 67 -9.444 23.563 -0.089 503 2HG2 ILE 67 HG22 ILE 67 -7.734 23.770 0.385 504 3HG2 ILE 67 HG23 ILE 67 -8.224 23.972 -1.305 505 1HD1 ILE 67 HD11 ILE 67 -5.674 23.390 -0.716 506 2HD1 ILE 67 HD12 ILE 67 -5.508 22.039 0.402 507 3HD1 ILE 67 HD13 ILE 67 -4.665 21.997 -1.150 508 H ASP 68 H ASP 68 -6.836 19.227 1.373 509 HA ASP 68 HA ASP 68 -5.718 20.797 3.648 510 1HB ASP 68 HB2 ASP 68 -6.468 18.494 4.159 511 2HB ASP 68 HB3 ASP 68 -5.416 17.861 2.883 512 H SER 69 H SER 69 -4.057 22.060 2.915 513 HA SER 69 HA SER 69 -2.808 21.690 0.443 514 1HB SER 69 HB2 SER 69 -1.573 23.342 2.639 515 2HB SER 69 HB3 SER 69 -1.721 23.702 0.905 516 HG SER 69 HG SER 69 -3.163 24.915 2.258 517 H ASP 70 H ASP 70 -2.076 20.074 3.460 518 HA ASP 70 HA ASP 70 0.752 19.813 3.064 519 1HB ASP 70 HB2 ASP 70 -0.285 19.482 5.258 520 2HB ASP 70 HB3 ASP 70 -1.190 18.093 4.639 521 H ILE 71 H ILE 71 -2.057 17.851 2.101 522 HA ILE 71 HA ILE 71 -0.520 15.683 0.925 523 HB ILE 71 HB ILE 71 -3.363 16.649 0.427 524 1HG1 ILE 71 HG12 ILE 71 -2.283 14.196 1.889 525 2HG1 ILE 71 HG13 ILE 71 -2.871 15.664 2.681 526 1HG2 ILE 71 HG21 ILE 71 -3.719 14.558 -0.852 527 2HG2 ILE 71 HG22 ILE 71 -2.473 15.503 -1.619 528 3HG2 ILE 71 HG23 ILE 71 -2.010 14.113 -0.623 529 1HD1 ILE 71 HD11 ILE 71 -4.611 13.997 2.752 530 2HD1 ILE 71 HD12 ILE 71 -5.120 15.294 1.647 531 3HD1 ILE 71 HD13 ILE 71 -4.524 13.746 1.005 532 H LEU 72 H LEU 72 -2.006 18.722 -0.328 533 HA LEU 72 HA LEU 72 -1.235 18.397 -3.007 534 1HB LEU 72 HB2 LEU 72 -2.832 20.030 -2.322 535 2HB LEU 72 HB3 LEU 72 -1.694 20.857 -1.283 536 HG LEU 72 HG LEU 72 -0.971 20.660 -4.182 537 1HD1 LEU 72 HD11 LEU 72 -3.245 22.370 -3.129 538 2HD1 LEU 72 HD12 LEU 72 -2.470 22.614 -4.710 539 3HD1 LEU 72 HD13 LEU 72 -3.356 21.115 -4.370 540 1HD2 LEU 72 HD21 LEU 72 -0.844 22.842 -2.043 541 2HD2 LEU 72 HD22 LEU 72 0.513 21.904 -2.684 542 3HD2 LEU 72 HD23 LEU 72 -0.322 23.064 -3.715 543 H ASN 73 H ASN 73 0.637 19.901 -0.324 544 HA ASN 73 HA ASN 73 2.821 20.620 -1.986 545 1HB ASN 73 HB2 ASN 73 2.381 20.418 0.996 546 2HB ASN 73 HB3 ASN 73 4.026 20.566 0.409 547 1HD2 ASN 73 HD22 ASN 73 0.870 22.217 0.446 548 2HD2 ASN 73 HD21 ASN 73 1.507 23.785 -0.028 549 H ASN 74 H ASN 74 1.950 17.426 -1.247 550 HA ASN 74 HA ASN 74 4.696 16.589 -1.969 551 1HB ASN 74 HB2 ASN 74 4.929 14.965 -0.392 552 2HB ASN 74 HB3 ASN 74 4.248 16.294 0.549 553 1HD2 ASN 74 HD22 ASN 74 1.851 16.115 1.120 554 2HD2 ASN 74 HD21 ASN 74 1.248 14.487 1.330 555 H ALA 75 H ALA 75 1.595 16.650 -3.028 556 HA ALA 75 HA ALA 75 1.310 14.003 -4.052 557 1HB ALA 75 HB1 ALA 75 0.185 16.646 -5.059 558 2HB ALA 75 HB2 ALA 75 -0.358 15.025 -5.543 559 3HB ALA 75 HB3 ALA 75 -0.588 15.569 -3.872 560 H ASP 76 H ASP 76 1.858 13.262 -6.268 561 HA ASP 76 HA ASP 76 4.201 14.600 -7.479 562 1HB ASP 76 HB2 ASP 76 3.931 12.136 -7.687 563 2HB ASP 76 HB3 ASP 76 2.423 12.380 -8.586 564 H LEU 77 H LEU 77 0.697 14.378 -7.850 565 HA LEU 77 HA LEU 77 0.672 16.547 -9.855 566 1HB LEU 77 HB2 LEU 77 0.710 14.532 -11.130 567 2HB LEU 77 HB3 LEU 77 -0.460 13.747 -10.064 568 HG LEU 77 HG LEU 77 -2.213 15.320 -10.840 569 1HD1 LEU 77 HD11 LEU 77 -0.327 16.103 -13.089 570 2HD1 LEU 77 HD12 LEU 77 -1.967 16.686 -12.774 571 3HD1 LEU 77 HD13 LEU 77 -0.661 17.154 -11.693 572 1HD2 LEU 77 HD21 LEU 77 -0.839 13.666 -13.001 573 2HD2 LEU 77 HD22 LEU 77 -2.014 13.088 -11.806 574 3HD2 LEU 77 HD23 LEU 77 -2.520 14.229 -13.054 575 H VAL 78 H VAL 78 -1.049 17.804 -9.746 576 HA VAL 78 HA VAL 78 -3.325 17.132 -7.933 577 HB VAL 78 HB VAL 78 -2.141 19.865 -8.604 578 1HG1 VAL 78 HG11 VAL 78 -3.747 20.738 -6.923 579 2HG1 VAL 78 HG12 VAL 78 -4.581 19.998 -8.287 580 3HG1 VAL 78 HG13 VAL 78 -4.450 19.106 -6.752 581 1HG2 VAL 78 HG21 VAL 78 -2.146 18.408 -5.924 582 2HG2 VAL 78 HG22 VAL 78 -0.733 18.609 -6.981 583 3HG2 VAL 78 HG23 VAL 78 -1.477 20.031 -6.283 584 H VAL 79 H VAL 79 -5.289 17.105 -9.071 585 HA VAL 79 HA VAL 79 -5.178 18.082 -11.904 586 HB VAL 79 HB VAL 79 -6.873 15.783 -10.896 587 1HG1 VAL 79 HG11 VAL 79 -6.307 16.850 -13.692 588 2HG1 VAL 79 HG12 VAL 79 -7.328 15.445 -13.287 589 3HG1 VAL 79 HG13 VAL 79 -7.817 17.069 -12.786 590 1HG2 VAL 79 HG21 VAL 79 -4.279 15.769 -12.484 591 2HG2 VAL 79 HG22 VAL 79 -4.580 15.004 -10.908 592 3HG2 VAL 79 HG23 VAL 79 -5.377 14.382 -12.358 593 H THR 80 H THR 80 -6.217 19.881 -12.057 594 HA THR 80 HA THR 80 -8.272 20.615 -10.056 595 HB THR 80 HB THR 80 -7.945 22.891 -10.942 596 HG1 THR 80 HG1 THR 80 -5.855 21.688 -12.483 597 1HG2 THR 80 HG21 THR 80 -5.287 21.597 -10.163 598 2HG2 THR 80 HG22 THR 80 -5.802 23.271 -9.880 599 3HG2 THR 80 HG23 THR 80 -6.597 21.937 -9.020 600 H LEU 81 H LEU 81 -10.029 19.518 -10.638 601 HA LEU 81 HA LEU 81 -10.598 18.772 -13.341 602 1HB LEU 81 HB2 LEU 81 -12.304 18.664 -10.834 603 2HB LEU 81 HB3 LEU 81 -12.734 17.883 -12.346 604 HG LEU 81 HG LEU 81 -10.207 17.208 -10.771 605 1HD1 LEU 81 HD11 LEU 81 -12.872 15.740 -10.828 606 2HD1 LEU 81 HD12 LEU 81 -11.393 15.191 -10.030 607 3HD1 LEU 81 HD13 LEU 81 -12.208 16.651 -9.447 608 1HD2 LEU 81 HD21 LEU 81 -10.065 16.593 -13.159 609 2HD2 LEU 81 HD22 LEU 81 -10.218 15.145 -12.160 610 3HD2 LEU 81 HD23 LEU 81 -11.619 15.758 -13.058 611 H CYS 82 H CYS 82 -11.179 21.872 -11.898 612 HA CYS 82 HA CYS 82 -12.914 22.460 -14.138 613 1HB CYS 82 HB2 CYS 82 -14.729 23.455 -12.797 614 2HB CYS 82 HB3 CYS 82 -14.589 21.708 -12.558 615 HG CYS 82 HG CYS 82 -15.222 23.100 -10.321 616 H GLY 83 H GLY 83 -13.334 24.799 -14.327 617 1HA GLY 83 HA1 GLY 83 -10.912 26.082 -14.598 618 2HA GLY 83 HA2 GLY 83 -12.485 26.862 -14.682 619 H ASP 84 H ASP 84 -13.506 26.957 -12.256 620 HA ASP 84 HA ASP 84 -12.034 29.113 -11.147 621 1HB ASP 84 HB2 ASP 84 -14.483 28.957 -11.101 622 2HB ASP 84 HB3 ASP 84 -14.393 27.574 -10.010 623 H ALA 85 H ALA 85 -12.177 25.682 -10.207 624 HA ALA 85 HA ALA 85 -11.400 26.003 -7.534 625 1HB ALA 85 HB1 ALA 85 -12.266 23.875 -8.360 626 2HB ALA 85 HB2 ALA 85 -10.849 23.658 -9.416 627 3HB ALA 85 HB3 ALA 85 -10.663 23.608 -7.650 628 H ALA 86 H ALA 86 -9.416 25.839 -10.453 629 HA ALA 86 HA ALA 86 -6.921 25.263 -9.309 630 1HB ALA 86 HB1 ALA 86 -7.444 25.193 -11.713 631 2HB ALA 86 HB2 ALA 86 -7.588 26.973 -11.730 632 3HB ALA 86 HB3 ALA 86 -6.018 26.209 -11.397 633 H ASP 87 H ASP 87 -8.698 28.307 -9.307 634 HA ASP 87 HA ASP 87 -6.494 30.060 -8.765 635 1HB ASP 87 HB2 ASP 87 -8.719 30.823 -9.586 636 2HB ASP 87 HB3 ASP 87 -9.436 30.314 -8.045 637 H LYS 88 H LYS 88 -8.668 28.111 -6.781 638 HA LYS 88 HA LYS 88 -7.726 29.261 -4.208 639 1HB LYS 88 HB2 LYS 88 -10.064 28.628 -4.293 640 2HB LYS 88 HB3 LYS 88 -9.669 27.071 -5.020 641 1HG LYS 88 HG2 LYS 88 -10.346 26.732 -2.766 642 2HG LYS 88 HG3 LYS 88 -8.662 26.300 -2.923 643 1HD LYS 88 HD2 LYS 88 -8.032 28.484 -1.857 644 2HD LYS 88 HD3 LYS 88 -9.759 28.908 -1.760 645 1HE LYS 88 HE2 LYS 88 -10.193 26.883 -0.424 646 2HE LYS 88 HE3 LYS 88 -8.497 26.409 -0.540 647 1HZ LYS 88 HZ1 LYS 88 -8.968 27.507 1.573 648 2HZ LYS 88 HZ2 LYS 88 -7.923 28.420 0.721 649 3HZ LYS 88 HZ3 LYS 88 -9.495 28.853 0.826 650 H CYS 89 H CYS 89 -7.162 26.423 -6.238 651 HA CYS 89 HA CYS 89 -5.912 24.727 -4.454 652 1HB CYS 89 HB2 CYS 89 -5.193 25.277 -7.349 653 2HB CYS 89 HB3 CYS 89 -4.580 23.905 -6.406 654 HG CYS 89 HG CYS 89 -7.787 24.712 -6.829 655 HA PRO 90 HA PRO 90 -2.742 27.644 -3.201 656 1HB PRO 90 HB2 PRO 90 -1.597 26.255 -1.141 657 2HB PRO 90 HB3 PRO 90 -3.179 27.108 -1.094 658 1HG PRO 90 HG2 PRO 90 -2.690 24.153 -1.522 659 2HG PRO 90 HG3 PRO 90 -3.899 24.948 -0.456 660 1HD PRO 90 HD2 PRO 90 -4.555 24.031 -2.926 661 2HD PRO 90 HD3 PRO 90 -5.280 25.495 -2.222 662 H MET 91 H MET 91 -0.249 27.561 -2.757 663 HA MET 91 HA MET 91 0.883 27.208 -5.239 664 1HB MET 91 HB2 MET 91 1.736 28.692 -3.449 665 2HB MET 91 HB3 MET 91 2.317 27.280 -2.552 666 1HG MET 91 HG2 MET 91 3.816 26.716 -4.477 667 2HG MET 91 HG3 MET 91 3.208 28.132 -5.336 668 1HE MET 91 HE1 MET 91 5.517 26.705 -2.563 669 2HE MET 91 HE2 MET 91 6.061 28.148 -1.680 670 3HE MET 91 HE3 MET 91 4.384 27.590 -1.514 671 H THR 92 H THR 92 1.569 25.511 -6.386 672 HA THR 92 HA THR 92 2.198 22.923 -5.079 673 HB THR 92 HB THR 92 1.791 22.102 -7.484 674 HG1 THR 92 HG1 THR 92 1.859 24.172 -8.494 675 1HG2 THR 92 HG21 THR 92 -0.595 22.074 -7.304 676 2HG2 THR 92 HG22 THR 92 0.144 21.800 -5.726 677 3HG2 THR 92 HG23 THR 92 -0.569 23.379 -6.100 678 HA PRO 93 HA PRO 93 6.471 24.362 -6.057 679 1HB PRO 93 HB2 PRO 93 6.953 21.602 -4.913 680 2HB PRO 93 HB3 PRO 93 7.871 23.111 -4.620 681 1HG PRO 93 HG2 PRO 93 6.097 22.212 -2.783 682 2HG PRO 93 HG3 PRO 93 6.164 23.960 -3.188 683 1HD PRO 93 HD2 PRO 93 4.198 21.881 -4.160 684 2HD PRO 93 HD3 PRO 93 3.912 23.561 -3.627 685 HA PRO 94 HA PRO 94 7.338 22.166 -9.890 686 1HB PRO 94 HB2 PRO 94 10.101 21.563 -8.816 687 2HB PRO 94 HB3 PRO 94 9.635 22.207 -10.422 688 1HG PRO 94 HG2 PRO 94 10.592 23.876 -8.516 689 2HG PRO 94 HG3 PRO 94 9.176 24.366 -9.501 690 1HD PRO 94 HD2 PRO 94 9.212 23.251 -6.691 691 2HD PRO 94 HD3 PRO 94 8.254 24.605 -7.361 692 H HIS 95 H HIS 95 8.189 20.459 -6.885 693 HA HIS 95 HA HIS 95 8.290 17.813 -7.978 694 1HB HIS 95 HB2 HIS 95 7.554 18.710 -5.160 695 2HB HIS 95 HB3 HIS 95 8.111 17.110 -5.640 696 HD1 HIS 95 HD1 HIS 95 10.773 17.363 -6.957 697 HD2 HIS 95 HD2 HIS 95 9.431 20.135 -4.081 698 HE1 HIS 95 HE1 HIS 95 12.848 18.543 -6.078 699 H VAL 96 H VAL 96 5.661 19.916 -7.801 700 HA VAL 96 HA VAL 96 3.575 17.808 -7.617 701 HB VAL 96 HB VAL 96 3.458 20.651 -6.489 702 1HG1 VAL 96 HG11 VAL 96 1.326 19.592 -7.187 703 2HG1 VAL 96 HG12 VAL 96 1.640 18.272 -6.039 704 3HG1 VAL 96 HG13 VAL 96 1.419 19.936 -5.462 705 1HG2 VAL 96 HG21 VAL 96 4.098 18.147 -4.922 706 2HG2 VAL 96 HG22 VAL 96 5.070 19.618 -5.078 707 3HG2 VAL 96 HG23 VAL 96 3.528 19.667 -4.224 708 H LYS 97 H LYS 97 3.454 17.710 -9.917 709 HA LYS 97 HA LYS 97 3.284 20.191 -11.459 710 1HB LYS 97 HB2 LYS 97 3.228 18.855 -13.369 711 2HB LYS 97 HB3 LYS 97 4.290 18.000 -12.260 712 1HG LYS 97 HG2 LYS 97 1.960 16.731 -11.680 713 2HG LYS 97 HG3 LYS 97 1.606 17.263 -13.337 714 1HD LYS 97 HD2 LYS 97 3.819 16.197 -14.030 715 2HD LYS 97 HD3 LYS 97 3.954 15.592 -12.367 716 1HE LYS 97 HE2 LYS 97 1.536 14.620 -12.824 717 2HE LYS 97 HE3 LYS 97 1.936 14.838 -14.527 718 1HZ LYS 97 HZ1 LYS 97 3.940 13.425 -14.043 719 2HZ LYS 97 HZ2 LYS 97 3.379 13.191 -12.507 720 3HZ LYS 97 HZ3 LYS 97 2.536 12.628 -13.794 721 H ARG 98 H ARG 98 1.285 20.446 -12.898 722 HA ARG 98 HA ARG 98 -1.201 19.716 -11.433 723 1HB ARG 98 HB2 ARG 98 -0.617 22.412 -12.724 724 2HB ARG 98 HB3 ARG 98 -2.207 21.847 -12.226 725 1HG ARG 98 HG2 ARG 98 -1.171 21.575 -9.850 726 2HG ARG 98 HG3 ARG 98 0.126 22.620 -10.472 727 1HD ARG 98 HD2 ARG 98 -1.697 24.238 -11.237 728 2HD ARG 98 HD3 ARG 98 -2.875 23.196 -10.396 729 HE ARG 98 HE ARG 98 -0.715 24.030 -8.670 730 1HH1 ARG 98 HH21 ARG 98 -3.604 25.383 -10.233 731 2HH1 ARG 98 HH22 ARG 98 -3.986 26.475 -8.948 732 1HH2 ARG 98 HH11 ARG 98 -1.308 25.347 -6.869 733 2HH2 ARG 98 HH12 ARG 98 -2.635 26.430 -6.977 734 H GLU 99 H GLU 99 -3.065 19.617 -12.759 735 HA GLU 99 HA GLU 99 -2.765 19.782 -15.651 736 1HB GLU 99 HB2 GLU 99 -2.348 17.383 -15.053 737 2HB GLU 99 HB3 GLU 99 -3.914 17.325 -14.237 738 1HG GLU 99 HG2 GLU 99 -3.907 16.309 -16.495 739 2HG GLU 99 HG3 GLU 99 -5.079 17.619 -16.312 740 H HIS 100 H HIS 100 -5.003 20.089 -16.599 741 HA HIS 100 HA HIS 100 -6.909 21.195 -14.597 742 1HB HIS 100 HB2 HIS 100 -5.159 22.905 -15.196 743 2HB HIS 100 HB3 HIS 100 -5.671 22.789 -16.880 744 HD1 HIS 100 HD1 HIS 100 -7.432 23.447 -13.489 745 HD2 HIS 100 HD2 HIS 100 -7.318 24.742 -17.489 746 HE1 HIS 100 HE1 HIS 100 -9.071 25.397 -13.655 747 H TRP 101 H TRP 101 -8.989 21.113 -15.207 748 HA TRP 101 HA TRP 101 -9.767 20.671 -18.029 749 1HB TRP 101 HB2 TRP 101 -10.782 18.951 -15.771 750 2HB TRP 101 HB3 TRP 101 -11.100 18.795 -17.499 751 HD1 TRP 101 HD1 TRP 101 -8.924 17.555 -14.822 752 HE1 TRP 101 HE1 TRP 101 -6.997 16.127 -15.680 753 HE3 TRP 101 HE3 TRP 101 -9.199 18.741 -19.799 754 HZ2 TRP 101 HZ2 TRP 101 -5.781 15.477 -18.220 755 HZ3 TRP 101 HZ3 TRP 101 -7.647 17.677 -21.417 756 HH2 TRP 101 HH2 TRP 101 -5.950 16.022 -20.637 757 H GLY 102 H GLY 102 -12.500 20.441 -17.679 758 1HA GLY 102 HA1 GLY 102 -13.279 22.946 -16.240 759 2HA GLY 102 HA2 GLY 102 -13.515 22.772 -17.975 760 H PHE 103 H PHE 103 -14.024 20.398 -15.279 761 HA PHE 103 HA PHE 103 -16.516 19.558 -16.502 762 1HB PHE 103 HB2 PHE 103 -15.052 18.719 -13.980 763 2HB PHE 103 HB3 PHE 103 -16.604 18.058 -14.468 764 HD1 PHE 103 HD1 PHE 103 -16.821 16.429 -16.203 765 HD2 PHE 103 HD2 PHE 103 -13.022 18.339 -15.522 766 HE1 PHE 103 HE1 PHE 103 -15.718 14.789 -17.669 767 HE2 PHE 103 HE2 PHE 103 -11.927 16.753 -17.056 768 HZ PHE 103 HZ PHE 103 -13.273 14.958 -18.143 769 H ASP 104 H ASP 104 -18.347 20.655 -16.284 770 HA ASP 104 HA ASP 104 -18.972 22.434 -14.089 771 1HB ASP 104 HB2 ASP 104 -19.924 22.635 -16.385 772 2HB ASP 104 HB3 ASP 104 -20.781 21.109 -16.144 773 H ASP 105 H ASP 105 -20.952 21.992 -12.687 774 HA ASP 105 HA ASP 105 -20.521 19.550 -11.195 775 1HB ASP 105 HB2 ASP 105 -21.172 21.652 -10.103 776 2HB ASP 105 HB3 ASP 105 -22.731 21.624 -10.949 777 HA PRO 106 HA PRO 106 -23.558 17.296 -13.663 778 1HB PRO 106 HB2 PRO 106 -23.501 14.858 -12.409 779 2HB PRO 106 HB3 PRO 106 -22.116 15.452 -13.368 780 1HG PRO 106 HG2 PRO 106 -22.503 15.635 -10.351 781 2HG PRO 106 HG3 PRO 106 -21.067 15.034 -11.248 782 1HD PRO 106 HD2 PRO 106 -21.241 17.588 -10.307 783 2HD PRO 106 HD3 PRO 106 -20.433 17.220 -11.863 784 H ALA 107 H ALA 107 -23.854 17.249 -10.079 785 HA ALA 107 HA ALA 107 -26.412 16.004 -10.043 786 1HB ALA 107 HB1 ALA 107 -24.922 15.944 -8.115 787 2HB ALA 107 HB2 ALA 107 -24.988 17.715 -7.964 788 3HB ALA 107 HB3 ALA 107 -26.446 16.738 -7.671 789 H ARG 108 H ARG 108 -25.374 19.350 -10.325 790 HA ARG 108 HA ARG 108 -28.122 20.386 -10.121 791 1HB ARG 108 HB2 ARG 108 -25.323 21.594 -10.068 792 2HB ARG 108 HB3 ARG 108 -26.745 22.598 -10.314 793 1HG ARG 108 HG2 ARG 108 -26.296 22.671 -8.007 794 2HG ARG 108 HG3 ARG 108 -27.765 21.733 -8.265 795 1HD ARG 108 HD2 ARG 108 -26.638 20.592 -6.542 796 2HD ARG 108 HD3 ARG 108 -26.327 19.629 -7.972 797 HE ARG 108 HE ARG 108 -24.120 20.191 -7.992 798 1HH1 ARG 108 HH21 ARG 108 -25.721 22.026 -5.385 799 2HH1 ARG 108 HH22 ARG 108 -24.251 22.415 -4.573 800 1HH2 ARG 108 HH11 ARG 108 -22.218 20.683 -6.946 801 2HH2 ARG 108 HH12 ARG 108 -22.180 21.637 -5.482 802 H ALA 109 H ALA 109 -26.563 18.951 -12.623 803 HA ALA 109 HA ALA 109 -26.978 20.738 -14.781 804 1HB ALA 109 HB1 ALA 109 -27.195 18.663 -16.134 805 2HB ALA 109 HB2 ALA 109 -25.829 18.522 -14.996 806 3HB ALA 109 HB3 ALA 109 -27.377 17.705 -14.657 807 H GLN 110 H GLN 110 -28.875 21.178 -15.958 808 HA GLN 110 HA GLN 110 -31.470 20.147 -14.919 809 1HB GLN 110 HB2 GLN 110 -30.455 23.015 -14.873 810 2HB GLN 110 HB3 GLN 110 -32.181 22.680 -14.965 811 1HG GLN 110 HG2 GLN 110 -32.255 21.634 -12.847 812 2HG GLN 110 HG3 GLN 110 -30.512 21.436 -12.763 813 1HE2 GLN 110 HE22 GLN 110 -29.167 23.149 -12.152 814 2HE2 GLN 110 HE21 GLN 110 -29.796 24.655 -11.496 815 H GLY 111 H GLY 111 -33.255 20.672 -16.283 816 1HA GLY 111 HA1 GLY 111 -33.618 22.074 -18.510 817 2HA GLY 111 HA2 GLY 111 -32.672 20.715 -19.160 818 H THR 112 H THR 112 -33.435 18.548 -17.840 819 HA THR 112 HA THR 112 -36.148 18.341 -17.062 820 HB THR 112 HB THR 112 -36.669 18.299 -19.410 821 HG1 THR 112 HG1 THR 112 -37.755 16.434 -19.430 822 1HG2 THR 112 HG21 THR 112 -34.630 16.069 -19.734 823 2HG2 THR 112 HG22 THR 112 -35.813 16.568 -20.958 824 3HG2 THR 112 HG23 THR 112 -34.553 17.696 -20.450 825 H GLU 113 H GLU 113 -36.473 15.994 -16.286 826 HA GLU 113 HA GLU 113 -34.278 15.412 -14.587 827 1HB GLU 113 HB2 GLU 113 -36.571 14.879 -13.983 828 2HB GLU 113 HB3 GLU 113 -36.730 13.769 -15.354 829 1HG GLU 113 HG2 GLU 113 -35.071 12.253 -14.394 830 2HG GLU 113 HG3 GLU 113 -34.732 13.391 -13.083 831 H GLU 114 H GLU 114 -35.326 13.919 -17.640 832 HA GLU 114 HA GLU 114 -33.352 11.850 -17.561 833 1HB GLU 114 HB2 GLU 114 -33.954 11.409 -19.884 834 2HB GLU 114 HB3 GLU 114 -35.378 11.568 -18.858 835 1HG GLU 114 HG2 GLU 114 -35.745 13.872 -19.702 836 2HG GLU 114 HG3 GLU 114 -34.308 13.734 -20.721 837 H GLU 115 H GLU 115 -33.238 15.218 -18.577 838 HA GLU 115 HA GLU 115 -30.794 14.891 -20.090 839 1HB GLU 115 HB2 GLU 115 -32.326 16.568 -20.793 840 2HB GLU 115 HB3 GLU 115 -32.330 17.348 -19.203 841 1HG GLU 115 HG2 GLU 115 -30.202 18.247 -19.473 842 2HG GLU 115 HG3 GLU 115 -29.723 17.048 -20.684 843 H LYS 116 H LYS 116 -31.753 16.100 -16.844 844 HA LYS 116 HA LYS 116 -29.187 16.633 -15.807 845 1HB LYS 116 HB2 LYS 116 -31.145 17.314 -14.605 846 2HB LYS 116 HB3 LYS 116 -31.791 15.675 -14.574 847 1HG LYS 116 HG2 LYS 116 -30.060 14.924 -13.087 848 2HG LYS 116 HG3 LYS 116 -29.245 16.496 -13.119 849 1HD LYS 116 HD2 LYS 116 -32.132 16.302 -12.226 850 2HD LYS 116 HD3 LYS 116 -30.839 15.743 -11.144 851 1HE LYS 116 HE2 LYS 116 -29.741 18.023 -11.460 852 2HE LYS 116 HE3 LYS 116 -31.233 18.535 -12.251 853 1HZ LYS 116 HZ1 LYS 116 -31.276 19.103 -9.920 854 2HZ LYS 116 HZ2 LYS 116 -32.418 17.967 -10.174 855 3HZ LYS 116 HZ3 LYS 116 -30.995 17.569 -9.460 856 H TRP 117 H TRP 117 -31.042 13.547 -15.806 857 HA TRP 117 HA TRP 117 -28.974 12.018 -14.606 858 1HB TRP 117 HB2 TRP 117 -31.280 11.185 -14.803 859 2HB TRP 117 HB3 TRP 117 -31.106 11.067 -16.556 860 HD1 TRP 117 HD1 TRP 117 -29.662 9.059 -17.516 861 HE1 TRP 117 HE1 TRP 117 -28.644 6.930 -16.514 862 HE3 TRP 117 HE3 TRP 117 -30.320 10.082 -12.547 863 HZ2 TRP 117 HZ2 TRP 117 -27.803 6.004 -13.918 864 HZ3 TRP 117 HZ3 TRP 117 -29.303 8.621 -10.830 865 HH2 TRP 117 HH2 TRP 117 -28.019 6.587 -11.503 866 H ALA 118 H ALA 118 -29.697 12.601 -18.104 867 HA ALA 118 HA ALA 118 -27.632 10.999 -19.135 868 1HB ALA 118 HB1 ALA 118 -27.828 12.421 -21.163 869 2HB ALA 118 HB2 ALA 118 -29.419 11.965 -20.521 870 3HB ALA 118 HB3 ALA 118 -28.780 13.600 -20.245 871 H PHE 119 H PHE 119 -27.522 14.383 -17.965 872 HA PHE 119 HA PHE 119 -24.855 14.914 -18.733 873 1HB PHE 119 HB2 PHE 119 -26.760 16.485 -17.891 874 2HB PHE 119 HB3 PHE 119 -26.160 16.108 -16.285 875 HD1 PHE 119 HD1 PHE 119 -23.682 16.669 -15.765 876 HD2 PHE 119 HD2 PHE 119 -25.742 18.103 -19.270 877 HE1 PHE 119 HE1 PHE 119 -22.037 18.520 -15.978 878 HE2 PHE 119 HE2 PHE 119 -24.082 19.931 -19.496 879 HZ PHE 119 HZ PHE 119 -22.228 20.144 -17.853 880 H PHE 120 H PHE 120 -26.195 13.358 -15.752 881 HA PHE 120 HA PHE 120 -23.791 13.153 -14.261 882 1HB PHE 120 HB2 PHE 120 -25.829 10.918 -14.488 883 2HB PHE 120 HB3 PHE 120 -24.703 11.219 -13.205 884 HD1 PHE 120 HD1 PHE 120 -25.715 14.460 -13.357 885 HD2 PHE 120 HD2 PHE 120 -27.414 10.553 -12.678 886 HE1 PHE 120 HE1 PHE 120 -27.455 15.445 -11.910 887 HE2 PHE 120 HE2 PHE 120 -29.108 11.551 -11.176 888 HZ PHE 120 HZ PHE 120 -29.123 14.004 -10.774 889 H GLN 121 H GLN 121 -25.220 10.884 -16.688 890 HA GLN 121 HA GLN 121 -23.072 9.110 -16.751 891 1HB GLN 121 HB2 GLN 121 -24.908 9.667 -19.084 892 2HB GLN 121 HB3 GLN 121 -24.012 8.190 -18.746 893 1HG GLN 121 HG2 GLN 121 -26.387 9.283 -17.180 894 2HG GLN 121 HG3 GLN 121 -26.365 7.901 -18.240 895 1HE2 GLN 121 HE22 GLN 121 -26.463 6.003 -17.092 896 2HE2 GLN 121 HE21 GLN 121 -25.827 5.797 -15.473 897 H ARG 122 H ARG 122 -23.568 12.004 -18.787 898 HA ARG 122 HA ARG 122 -21.257 11.610 -20.419 899 1HB ARG 122 HB2 ARG 122 -22.897 14.053 -19.681 900 2HB ARG 122 HB3 ARG 122 -21.319 14.278 -20.416 901 1HG ARG 122 HG2 ARG 122 -22.875 14.334 -22.184 902 2HG ARG 122 HG3 ARG 122 -21.967 12.820 -22.320 903 1HD ARG 122 HD2 ARG 122 -23.887 11.647 -21.192 904 2HD ARG 122 HD3 ARG 122 -24.779 13.188 -21.216 905 HE ARG 122 HE ARG 122 -24.085 12.835 -23.835 906 1HH1 ARG 122 HH21 ARG 122 -25.752 10.789 -21.473 907 2HH1 ARG 122 HH22 ARG 122 -26.720 9.962 -22.643 908 1HH2 ARG 122 HH11 ARG 122 -25.378 11.748 -25.408 909 2HH2 ARG 122 HH12 ARG 122 -26.505 10.537 -24.934 910 H VAL 123 H VAL 123 -21.627 13.413 -17.315 911 HA VAL 123 HA VAL 123 -18.904 14.223 -17.275 912 HB VAL 123 HB VAL 123 -21.017 13.944 -15.097 913 1HG1 VAL 123 HG11 VAL 123 -18.222 15.131 -14.794 914 2HG1 VAL 123 HG12 VAL 123 -19.557 15.359 -13.645 915 3HG1 VAL 123 HG13 VAL 123 -18.888 13.747 -13.905 916 1HG2 VAL 123 HG21 VAL 123 -21.028 16.413 -15.251 917 2HG2 VAL 123 HG22 VAL 123 -19.736 16.363 -16.464 918 3HG2 VAL 123 HG23 VAL 123 -21.337 15.708 -16.845 919 H ARG 124 H ARG 124 -20.421 11.252 -15.723 920 HA ARG 124 HA ARG 124 -17.868 10.492 -14.707 921 1HB ARG 124 HB2 ARG 124 -18.749 8.203 -14.444 922 2HB ARG 124 HB3 ARG 124 -19.832 9.410 -13.769 923 1HG ARG 124 HG2 ARG 124 -21.363 9.169 -15.579 924 2HG ARG 124 HG3 ARG 124 -20.242 8.173 -16.520 925 1HD ARG 124 HD2 ARG 124 -20.357 6.419 -14.748 926 2HD ARG 124 HD3 ARG 124 -21.543 7.400 -13.897 927 HE ARG 124 HE ARG 124 -23.170 6.825 -15.375 928 1HH1 ARG 124 HH21 ARG 124 -20.070 5.919 -16.901 929 2HH1 ARG 124 HH22 ARG 124 -20.803 4.972 -18.138 930 1HH2 ARG 124 HH11 ARG 124 -24.112 5.474 -16.995 931 2HH2 ARG 124 HH12 ARG 124 -23.129 4.728 -18.200 932 H ASP 125 H ASP 125 -19.400 9.774 -17.854 933 HA ASP 125 HA ASP 125 -17.443 7.929 -18.733 934 1HB ASP 125 HB2 ASP 125 -19.562 8.225 -19.906 935 2HB ASP 125 HB3 ASP 125 -19.131 9.883 -20.340 936 H GLU 126 H GLU 126 -17.560 11.523 -19.001 937 HA GLU 126 HA GLU 126 -15.093 11.621 -20.415 938 1HB GLU 126 HB2 GLU 126 -16.941 13.685 -19.241 939 2HB GLU 126 HB3 GLU 126 -15.354 14.144 -19.854 940 1HG GLU 126 HG2 GLU 126 -17.482 12.682 -21.454 941 2HG GLU 126 HG3 GLU 126 -17.125 14.406 -21.548 942 H ILE 127 H ILE 127 -15.888 11.906 -16.928 943 HA ILE 127 HA ILE 127 -13.260 12.762 -16.185 944 HB ILE 127 HB ILE 127 -15.628 12.350 -14.796 945 1HG1 ILE 127 HG12 ILE 127 -14.291 12.802 -12.691 946 2HG1 ILE 127 HG13 ILE 127 -12.830 12.761 -13.688 947 1HG2 ILE 127 HG21 ILE 127 -15.332 9.992 -14.543 948 2HG2 ILE 127 HG22 ILE 127 -13.779 10.247 -13.703 949 3HG2 ILE 127 HG23 ILE 127 -15.303 10.824 -12.993 950 1HD1 ILE 127 HD11 ILE 127 -15.240 14.567 -14.201 951 2HD1 ILE 127 HD12 ILE 127 -13.833 15.056 -13.236 952 3HD1 ILE 127 HD13 ILE 127 -13.628 14.675 -14.957 953 H GLY 128 H GLY 128 -14.741 9.510 -16.622 954 1HA GLY 128 HA1 GLY 128 -12.472 7.965 -15.973 955 2HA GLY 128 HA2 GLY 128 -13.820 7.473 -17.021 956 H ASN 129 H ASN 129 -13.662 9.134 -19.158 957 HA ASN 129 HA ASN 129 -11.584 8.200 -20.802 958 1HB ASN 129 HB2 ASN 129 -13.724 9.123 -21.610 959 2HB ASN 129 HB3 ASN 129 -13.282 10.704 -20.957 960 1HD2 ASN 129 HD22 ASN 129 -13.202 11.959 -22.762 961 2HD2 ASN 129 HD21 ASN 129 -12.112 11.636 -24.103 962 H ARG 130 H ARG 130 -11.693 11.197 -18.837 963 HA ARG 130 HA ARG 130 -9.230 12.191 -19.886 964 1HB ARG 130 HB2 ARG 130 -11.219 13.131 -18.071 965 2HB ARG 130 HB3 ARG 130 -9.783 12.995 -17.089 966 1HG ARG 130 HG2 ARG 130 -10.011 15.224 -18.049 967 2HG ARG 130 HG3 ARG 130 -8.550 14.418 -18.614 968 1HD ARG 130 HD2 ARG 130 -9.611 15.654 -20.447 969 2HD ARG 130 HD3 ARG 130 -9.579 13.955 -20.802 970 HE ARG 130 HE ARG 130 -11.914 13.768 -20.458 971 1HH1 ARG 130 HH21 ARG 130 -10.854 17.121 -20.067 972 2HH1 ARG 130 HH22 ARG 130 -12.331 17.809 -20.648 973 1HH2 ARG 130 HH11 ARG 130 -13.776 14.650 -21.438 974 2HH2 ARG 130 HH12 ARG 130 -14.069 16.362 -21.362 975 H LEU 131 H LEU 131 -9.935 10.142 -17.033 976 HA LEU 131 HA LEU 131 -7.207 10.079 -16.127 977 1HB LEU 131 HB2 LEU 131 -9.568 8.173 -15.750 978 2HB LEU 131 HB3 LEU 131 -8.090 8.087 -14.797 979 HG LEU 131 HG LEU 131 -9.694 10.689 -14.904 980 1HD1 LEU 131 HD11 LEU 131 -10.871 9.995 -12.887 981 2HD1 LEU 131 HD12 LEU 131 -11.293 8.998 -14.282 982 3HD1 LEU 131 HD13 LEU 131 -10.177 8.367 -13.048 983 1HD2 LEU 131 HD21 LEU 131 -7.502 10.836 -13.960 984 2HD2 LEU 131 HD22 LEU 131 -8.721 11.007 -12.704 985 3HD2 LEU 131 HD23 LEU 131 -7.805 9.477 -12.869 986 H LYS 132 H LYS 132 -9.164 7.972 -18.251 987 HA LYS 132 HA LYS 132 -7.195 6.080 -18.937 988 1HB LYS 132 HB2 LYS 132 -9.403 5.625 -19.526 989 2HB LYS 132 HB3 LYS 132 -9.689 7.206 -20.198 990 1HG LYS 132 HG2 LYS 132 -7.909 5.181 -21.592 991 2HG LYS 132 HG3 LYS 132 -9.663 5.231 -21.777 992 1HD LYS 132 HD2 LYS 132 -9.171 7.835 -22.329 993 2HD LYS 132 HD3 LYS 132 -7.601 7.158 -22.784 994 1HE LYS 132 HE2 LYS 132 -8.745 7.131 -24.779 995 2HE LYS 132 HE3 LYS 132 -8.948 5.470 -24.217 996 1HZ LYS 132 HZ1 LYS 132 -10.949 7.658 -23.913 997 2HZ LYS 132 HZ2 LYS 132 -11.016 6.470 -25.036 998 3HZ LYS 132 HZ3 LYS 132 -11.181 6.091 -23.462 999 H GLU 133 H GLU 133 -7.853 9.271 -20.485 1000 HA GLU 133 HA GLU 133 -5.756 8.995 -22.392 1001 1HB GLU 133 HB2 GLU 133 -7.235 11.365 -21.216 1002 2HB GLU 133 HB3 GLU 133 -5.692 11.645 -22.022 1003 1HG GLU 133 HG2 GLU 133 -6.572 10.350 -24.018 1004 2HG GLU 133 HG3 GLU 133 -8.164 10.379 -23.249 1005 H PHE 134 H PHE 134 -5.476 10.705 -19.130 1006 HA PHE 134 HA PHE 134 -2.731 10.950 -19.832 1007 1HB PHE 134 HB2 PHE 134 -2.269 11.967 -17.816 1008 2HB PHE 134 HB3 PHE 134 -3.803 12.554 -18.436 1009 HD1 PHE 134 HD1 PHE 134 -2.379 10.086 -15.956 1010 HD2 PHE 134 HD2 PHE 134 -5.525 12.882 -16.940 1011 HE1 PHE 134 HE1 PHE 134 -3.269 9.899 -13.653 1012 HE2 PHE 134 HE2 PHE 134 -6.367 12.741 -14.619 1013 HZ PHE 134 HZ PHE 134 -5.283 11.206 -12.997 1014 H ALA 135 H ALA 135 -4.370 8.216 -18.390 1015 HA ALA 135 HA ALA 135 -1.969 6.955 -17.452 1016 1HB ALA 135 HB1 ALA 135 -4.232 6.258 -16.721 1017 2HB ALA 135 HB2 ALA 135 -4.606 5.730 -18.375 1018 3HB ALA 135 HB3 ALA 135 -3.337 4.909 -17.445 1019 H GLU 136 H GLU 136 -3.791 6.822 -20.524 1020 HA GLU 136 HA GLU 136 -2.087 4.814 -21.681 1021 1HB GLU 136 HB2 GLU 136 -4.302 6.573 -22.786 1022 2HB GLU 136 HB3 GLU 136 -3.432 5.416 -23.783 1023 1HG GLU 136 HG2 GLU 136 -4.941 4.627 -21.252 1024 2HG GLU 136 HG3 GLU 136 -5.627 4.589 -22.872 1025 H THR 137 H THR 137 -2.383 8.324 -22.029 1026 HA THR 137 HA THR 137 -0.486 8.376 -24.181 1027 HB THR 137 HB THR 137 -1.012 10.737 -24.300 1028 HG1 THR 137 HG1 THR 137 -2.717 10.315 -22.088 1029 1HG2 THR 137 HG21 THR 137 -3.494 8.993 -23.917 1030 2HG2 THR 137 HG22 THR 137 -3.435 10.553 -24.771 1031 3HG2 THR 137 HG23 THR 137 -2.535 9.156 -25.395 1032 H GLY 138 H GLY 138 -0.404 8.809 -20.710 1033 1HA GLY 138 HA1 GLY 138 1.284 9.382 -19.256 1034 2HA GLY 138 HA2 GLY 138 2.461 9.235 -20.579 1035 H LYS 139 H LYS 139 -0.455 11.242 -20.361 1036 HA LYS 139 HA LYS 139 0.303 13.459 -21.676 1037 1HB LYS 139 HB2 LYS 139 -1.963 12.831 -20.604 1038 2HB LYS 139 HB3 LYS 139 -1.367 13.617 -19.147 1039 1HG LYS 139 HG2 LYS 139 -2.642 15.263 -20.167 1040 2HG LYS 139 HG3 LYS 139 -0.992 15.705 -20.580 1041 1HD LYS 139 HD2 LYS 139 -2.396 15.993 -22.529 1042 2HD LYS 139 HD3 LYS 139 -1.332 14.617 -22.850 1043 1HE LYS 139 HE2 LYS 139 -3.152 13.040 -22.320 1044 2HE LYS 139 HE3 LYS 139 -4.197 14.375 -21.814 1045 1HZ LYS 139 HZ1 LYS 139 -3.254 13.855 -24.568 1046 2HZ LYS 139 HZ2 LYS 139 -4.792 13.699 -24.009 1047 3HZ LYS 139 HZ3 LYS 139 -4.112 15.178 -24.129 Start of MODEL 3 1 1H MET 1 H1 MET 1 2.759 -1.225 -1.488 2 2H MET 1 H2 MET 1 1.954 -0.310 -2.583 3 3H MET 1 H3 MET 1 3.512 0.046 -2.202 4 HA MET 1 HA MET 1 1.191 0.208 -0.419 5 1HB MET 1 HB2 MET 1 3.358 -0.465 0.690 6 2HB MET 1 HB3 MET 1 4.019 1.114 0.276 7 1HG MET 1 HG2 MET 1 1.484 0.642 1.909 8 2HG MET 1 HG3 MET 1 3.087 0.849 2.601 9 1HE MET 1 HE1 MET 1 2.131 2.673 4.237 10 2HE MET 1 HE2 MET 1 1.232 4.108 3.699 11 3HE MET 1 HE3 MET 1 0.520 2.491 3.505 12 H GLU 2 H GLU 2 3.874 2.497 -1.441 13 HA GLU 2 HA GLU 2 1.910 4.168 -2.819 14 1HB GLU 2 HB2 GLU 2 1.737 4.928 -0.511 15 2HB GLU 2 HB3 GLU 2 3.479 5.076 -0.357 16 1HG GLU 2 HG2 GLU 2 1.982 6.679 -2.460 17 2HG GLU 2 HG3 GLU 2 1.906 7.171 -0.776 18 H ASN 3 H ASN 3 3.008 5.598 -4.253 19 HA ASN 3 HA ASN 3 5.896 5.494 -4.536 20 1HB ASN 3 HB2 ASN 3 5.551 3.445 -5.661 21 2HB ASN 3 HB3 ASN 3 4.080 4.003 -6.434 22 1HD2 ASN 3 HD22 ASN 3 4.195 5.043 -8.413 23 2HD2 ASN 3 HD21 ASN 3 5.712 5.324 -9.268 24 H LYS 4 H LYS 4 2.746 6.456 -5.828 25 HA LYS 4 HA LYS 4 3.765 9.212 -6.165 26 1HB LYS 4 HB2 LYS 4 2.051 7.653 -8.153 27 2HB LYS 4 HB3 LYS 4 2.099 9.413 -8.121 28 1HG LYS 4 HG2 LYS 4 4.504 9.438 -8.543 29 2HG LYS 4 HG3 LYS 4 4.560 7.676 -8.531 30 1HD LYS 4 HD2 LYS 4 3.054 9.392 -10.550 31 2HD LYS 4 HD3 LYS 4 4.590 8.540 -10.805 32 1HE LYS 4 HE2 LYS 4 3.326 6.391 -10.165 33 2HE LYS 4 HE3 LYS 4 1.841 7.335 -10.302 34 1HZ LYS 4 HZ1 LYS 4 2.274 7.658 -12.615 35 2HZ LYS 4 HZ2 LYS 4 3.801 7.067 -12.515 36 3HZ LYS 4 HZ3 LYS 4 2.543 6.052 -12.331 37 H ILE 5 H ILE 5 1.815 10.706 -6.111 38 HA ILE 5 HA ILE 5 -0.537 9.614 -4.689 39 HB ILE 5 HB ILE 5 1.222 11.934 -3.825 40 1HG1 ILE 5 HG12 ILE 5 0.303 9.547 -2.191 41 2HG1 ILE 5 HG13 ILE 5 1.871 9.681 -2.989 42 1HG2 ILE 5 HG21 ILE 5 -1.141 12.688 -3.712 43 2HG2 ILE 5 HG22 ILE 5 -1.562 11.231 -2.791 44 3HG2 ILE 5 HG23 ILE 5 -0.506 12.481 -2.096 45 1HD1 ILE 5 HD11 ILE 5 2.192 10.258 -0.700 46 2HD1 ILE 5 HD12 ILE 5 2.359 11.740 -1.664 47 3HD1 ILE 5 HD13 ILE 5 0.876 11.440 -0.725 48 H ILE 6 H ILE 6 -2.402 10.615 -5.484 49 HA ILE 6 HA ILE 6 -2.031 12.929 -7.280 50 HB ILE 6 HB ILE 6 -2.170 11.148 -8.775 51 1HG1 ILE 6 HG12 ILE 6 -4.896 12.496 -8.579 52 2HG1 ILE 6 HG13 ILE 6 -3.435 13.162 -9.320 53 1HG2 ILE 6 HG21 ILE 6 -4.700 10.142 -7.436 54 2HG2 ILE 6 HG22 ILE 6 -3.901 9.435 -8.855 55 3HG2 ILE 6 HG23 ILE 6 -3.096 9.370 -7.304 56 1HD1 ILE 6 HD11 ILE 6 -4.784 12.337 -11.082 57 2HD1 ILE 6 HD12 ILE 6 -3.479 11.135 -10.896 58 3HD1 ILE 6 HD13 ILE 6 -5.091 10.798 -10.256 59 H TYR 7 H TYR 7 -3.504 14.524 -6.933 60 HA TYR 7 HA TYR 7 -5.592 14.043 -4.886 61 1HB TYR 7 HB2 TYR 7 -3.330 14.990 -4.098 62 2HB TYR 7 HB3 TYR 7 -3.764 16.459 -4.946 63 HD1 TYR 7 HD1 TYR 7 -3.912 17.960 -3.147 64 HD2 TYR 7 HD2 TYR 7 -5.992 14.191 -2.841 65 HE1 TYR 7 HE1 TYR 7 -4.859 18.658 -0.973 66 HE2 TYR 7 HE2 TYR 7 -6.991 14.912 -0.712 67 HH TYR 7 HH TYR 7 -7.088 16.585 0.914 68 H PHE 8 H PHE 8 -7.426 14.248 -5.975 69 HA PHE 8 HA PHE 8 -7.744 16.102 -8.211 70 1HB PHE 8 HB2 PHE 8 -9.713 14.328 -6.703 71 2HB PHE 8 HB3 PHE 8 -10.127 15.298 -8.111 72 HD1 PHE 8 HD1 PHE 8 -8.972 14.894 -10.308 73 HD2 PHE 8 HD2 PHE 8 -8.590 12.184 -6.970 74 HE1 PHE 8 HE1 PHE 8 -7.984 13.184 -11.808 75 HE2 PHE 8 HE2 PHE 8 -7.627 10.470 -8.493 76 HZ PHE 8 HZ PHE 8 -7.303 10.974 -10.885 77 H LEU 9 H LEU 9 -8.934 17.990 -8.251 78 HA LEU 9 HA LEU 9 -9.899 19.171 -5.689 79 1HB LEU 9 HB2 LEU 9 -7.645 19.952 -7.497 80 2HB LEU 9 HB3 LEU 9 -8.819 21.221 -7.313 81 HG LEU 9 HG LEU 9 -7.001 21.545 -5.816 82 1HD1 LEU 9 HD11 LEU 9 -9.377 20.770 -4.092 83 2HD1 LEU 9 HD12 LEU 9 -8.236 22.113 -3.888 84 3HD1 LEU 9 HD13 LEU 9 -9.406 22.170 -5.196 85 1HD2 LEU 9 HD21 LEU 9 -6.453 20.066 -3.972 86 2HD2 LEU 9 HD22 LEU 9 -7.758 18.951 -4.403 87 3HD2 LEU 9 HD23 LEU 9 -6.365 19.151 -5.481 88 H CYS 10 H CYS 10 -11.827 20.313 -5.968 89 HA CYS 10 HA CYS 10 -12.374 21.586 -8.479 90 1HB CYS 10 HB2 CYS 10 -14.298 20.577 -9.210 91 2HB CYS 10 HB3 CYS 10 -13.270 19.197 -8.812 92 HG CYS 10 HG CYS 10 -14.325 18.484 -6.701 93 H THR 11 H THR 11 -14.727 22.776 -8.180 94 HA THR 11 HA THR 11 -14.364 24.363 -5.860 95 HB THR 11 HB THR 11 -16.615 25.343 -6.750 96 HG1 THR 11 HG1 THR 11 -17.017 24.785 -8.863 97 1HG2 THR 11 HG21 THR 11 -15.369 26.588 -8.405 98 2HG2 THR 11 HG22 THR 11 -14.288 26.270 -7.036 99 3HG2 THR 11 HG23 THR 11 -14.129 25.322 -8.521 100 H GLY 12 H GLY 12 -15.888 21.343 -5.988 101 1HA GLY 12 HA1 GLY 12 -16.743 21.618 -3.255 102 2HA GLY 12 HA2 GLY 12 -18.127 21.479 -4.364 103 H ASN 13 H ASN 13 -15.495 19.875 -2.843 104 HA ASN 13 HA ASN 13 -14.604 17.821 -4.379 105 1HB ASN 13 HB2 ASN 13 -13.841 18.196 -2.065 106 2HB ASN 13 HB3 ASN 13 -15.424 17.794 -1.439 107 1HD2 ASN 13 HD22 ASN 13 -12.786 16.290 -3.395 108 2HD2 ASN 13 HD21 ASN 13 -13.077 14.658 -2.794 109 H SER 14 H SER 14 -17.636 17.888 -2.637 110 HA SER 14 HA SER 14 -18.488 15.488 -2.207 111 1HB SER 14 HB2 SER 14 -20.168 17.695 -3.453 112 2HB SER 14 HB3 SER 14 -20.719 16.502 -2.267 113 HG SER 14 HG SER 14 -20.091 18.720 -1.555 114 H CYS 15 H CYS 15 -18.563 16.820 -5.548 115 HA CYS 15 HA CYS 15 -19.779 14.245 -6.429 116 1HB CYS 15 HB2 CYS 15 -20.702 15.591 -8.357 117 2HB CYS 15 HB3 CYS 15 -21.430 15.866 -6.777 118 HG CYS 15 HG CYS 15 -21.357 18.153 -7.973 119 H ARG 16 H ARG 16 -18.051 16.880 -8.185 120 HA ARG 16 HA ARG 16 -17.190 15.152 -10.187 121 1HB ARG 16 HB2 ARG 16 -15.531 17.554 -9.339 122 2HB ARG 16 HB3 ARG 16 -15.610 16.811 -10.922 123 1HG ARG 16 HG2 ARG 16 -17.961 17.617 -11.180 124 2HG ARG 16 HG3 ARG 16 -17.836 18.406 -9.583 125 1HD ARG 16 HD2 ARG 16 -15.719 19.557 -10.447 126 2HD ARG 16 HD3 ARG 16 -16.097 18.915 -12.035 127 HE ARG 16 HE ARG 16 -17.808 20.418 -12.293 128 1HH1 ARG 16 HH21 ARG 16 -16.968 20.625 -8.839 129 2HH1 ARG 16 HH22 ARG 16 -17.173 22.354 -8.776 130 1HH2 ARG 16 HH11 ARG 16 -17.894 22.671 -12.214 131 2HH2 ARG 16 HH12 ARG 16 -18.002 23.490 -10.682 132 H SER 17 H SER 17 -15.197 16.194 -7.335 133 HA SER 17 HA SER 17 -12.949 14.728 -8.239 134 1HB SER 17 HB2 SER 17 -13.407 15.448 -5.362 135 2HB SER 17 HB3 SER 17 -11.907 15.467 -6.325 136 HG SER 17 HG SER 17 -12.590 17.542 -5.936 137 H GLN 18 H GLN 18 -15.668 13.848 -6.082 138 HA GLN 18 HA GLN 18 -14.558 11.371 -5.152 139 1HB GLN 18 HB2 GLN 18 -17.436 12.336 -5.548 140 2HB GLN 18 HB3 GLN 18 -17.025 10.815 -4.776 141 1HG GLN 18 HG2 GLN 18 -16.106 13.542 -3.783 142 2HG GLN 18 HG3 GLN 18 -17.504 12.675 -3.168 143 1HE2 GLN 18 HE22 GLN 18 -15.041 13.531 -1.730 144 2HE2 GLN 18 HE21 GLN 18 -14.412 12.046 -1.027 145 H MET 19 H MET 19 -16.548 12.200 -8.051 146 HA MET 19 HA MET 19 -16.732 9.492 -9.007 147 1HB MET 19 HB2 MET 19 -16.909 12.159 -10.491 148 2HB MET 19 HB3 MET 19 -17.290 10.586 -11.201 149 1HG MET 19 HG2 MET 19 -19.131 10.247 -9.687 150 2HG MET 19 HG3 MET 19 -18.670 11.648 -8.728 151 1HE MET 19 HE1 MET 19 -20.142 10.422 -12.130 152 2HE MET 19 HE2 MET 19 -20.600 11.941 -12.933 153 3HE MET 19 HE3 MET 19 -18.885 11.521 -12.749 154 H ALA 20 H ALA 20 -14.453 12.189 -9.794 155 HA ALA 20 HA ALA 20 -12.880 10.786 -11.649 156 1HB ALA 20 HB1 ALA 20 -12.723 13.233 -11.217 157 2HB ALA 20 HB2 ALA 20 -11.966 12.895 -9.642 158 3HB ALA 20 HB3 ALA 20 -11.139 12.437 -11.142 159 H GLU 21 H GLU 21 -12.540 10.956 -8.068 160 HA GLU 21 HA GLU 21 -10.207 9.467 -7.793 161 1HB GLU 21 HB2 GLU 21 -11.279 10.812 -6.034 162 2HB GLU 21 HB3 GLU 21 -12.646 9.690 -5.965 163 1HG GLU 21 HG2 GLU 21 -11.065 7.889 -5.308 164 2HG GLU 21 HG3 GLU 21 -9.763 9.093 -5.256 165 H GLY 22 H GLY 22 -13.642 8.363 -7.869 166 1HA GLY 22 HA1 GLY 22 -13.265 5.607 -7.589 167 2HA GLY 22 HA2 GLY 22 -14.594 6.397 -8.454 168 H TRP 23 H TRP 23 -13.446 7.492 -10.748 169 HA TRP 23 HA TRP 23 -12.940 5.095 -12.311 170 1HB TRP 23 HB2 TRP 23 -12.633 8.042 -12.892 171 2HB TRP 23 HB3 TRP 23 -12.222 6.823 -14.086 172 HD1 TRP 23 HD1 TRP 23 -15.024 8.722 -12.587 173 HE1 TRP 23 HE1 TRP 23 -17.162 8.361 -13.879 174 HE3 TRP 23 HE3 TRP 23 -13.633 4.605 -15.315 175 HZ2 TRP 23 HZ2 TRP 23 -18.167 6.554 -15.909 176 HZ3 TRP 23 HZ3 TRP 23 -15.208 3.627 -16.959 177 HH2 TRP 23 HH2 TRP 23 -17.489 4.639 -17.268 178 H ALA 24 H ALA 24 -10.808 7.542 -10.789 179 HA ALA 24 HA ALA 24 -8.509 6.802 -12.232 180 1HB ALA 24 HB1 ALA 24 -8.840 8.095 -9.500 181 2HB ALA 24 HB2 ALA 24 -7.291 8.016 -10.385 182 3HB ALA 24 HB3 ALA 24 -8.670 8.924 -11.035 183 H LYS 25 H LYS 25 -9.837 5.487 -9.186 184 HA LYS 25 HA LYS 25 -7.643 3.759 -8.622 185 1HB LYS 25 HB2 LYS 25 -10.626 3.571 -8.043 186 2HB LYS 25 HB3 LYS 25 -9.471 2.386 -7.418 187 1HG LYS 25 HG2 LYS 25 -8.327 3.976 -6.092 188 2HG LYS 25 HG3 LYS 25 -9.036 5.354 -6.945 189 1HD LYS 25 HD2 LYS 25 -11.268 4.787 -6.061 190 2HD LYS 25 HD3 LYS 25 -10.557 3.437 -5.133 191 1HE LYS 25 HE2 LYS 25 -9.112 5.026 -3.898 192 2HE LYS 25 HE3 LYS 25 -9.686 6.353 -4.916 193 1HZ LYS 25 HZ1 LYS 25 -11.957 5.823 -4.038 194 2HZ LYS 25 HZ2 LYS 25 -11.227 4.900 -2.870 195 3HZ LYS 25 HZ3 LYS 25 -10.939 6.531 -3.001 196 H GLN 26 H GLN 26 -9.987 3.542 -11.210 197 HA GLN 26 HA GLN 26 -9.465 0.665 -11.669 198 1HB GLN 26 HB2 GLN 26 -11.349 2.745 -12.788 199 2HB GLN 26 HB3 GLN 26 -10.916 1.386 -13.796 200 1HG GLN 26 HG2 GLN 26 -13.053 1.231 -12.385 201 2HG GLN 26 HG3 GLN 26 -11.988 -0.165 -12.469 202 1HE2 GLN 26 HE22 GLN 26 -12.330 2.811 -10.286 203 2HE2 GLN 26 HE21 GLN 26 -12.183 1.858 -8.846 204 H TYR 27 H TYR 27 -8.898 3.823 -13.277 205 HA TYR 27 HA TYR 27 -7.372 2.570 -15.398 206 1HB TYR 27 HB2 TYR 27 -7.803 5.473 -14.620 207 2HB TYR 27 HB3 TYR 27 -6.887 4.971 -16.038 208 HD1 TYR 27 HD1 TYR 27 -10.043 6.075 -15.063 209 HD2 TYR 27 HD2 TYR 27 -8.179 3.059 -17.523 210 HE1 TYR 27 HE1 TYR 27 -12.099 5.907 -16.428 211 HE2 TYR 27 HE2 TYR 27 -10.249 2.850 -18.854 212 HH TYR 27 HH TYR 27 -12.428 3.631 -19.181 213 H LEU 28 H LEU 28 -6.462 3.978 -12.286 214 HA LEU 28 HA LEU 28 -3.584 3.904 -12.997 215 1HB LEU 28 HB2 LEU 28 -4.895 4.865 -10.433 216 2HB LEU 28 HB3 LEU 28 -3.233 5.101 -10.948 217 HG LEU 28 HG LEU 28 -5.697 6.376 -12.207 218 1HD1 LEU 28 HD11 LEU 28 -4.784 8.454 -11.336 219 2HD1 LEU 28 HD12 LEU 28 -5.005 7.292 -10.011 220 3HD1 LEU 28 HD13 LEU 28 -3.383 7.597 -10.665 221 1HD2 LEU 28 HD21 LEU 28 -2.800 6.781 -13.014 222 2HD2 LEU 28 HD22 LEU 28 -4.022 5.917 -13.966 223 3HD2 LEU 28 HD23 LEU 28 -4.221 7.634 -13.649 224 H GLY 29 H GLY 29 -3.286 3.306 -9.905 225 1HA GLY 29 HA1 GLY 29 -4.021 0.684 -9.340 226 2HA GLY 29 HA2 GLY 29 -2.529 0.585 -10.301 227 H ASP 30 H ASP 30 -1.938 -0.344 -8.004 228 HA ASP 30 HA ASP 30 -1.722 1.390 -5.800 229 1HB ASP 30 HB2 ASP 30 -1.681 -1.133 -5.778 230 2HB ASP 30 HB3 ASP 30 0.007 -1.055 -6.309 231 H GLU 31 H GLU 31 0.202 1.298 -8.593 232 HA GLU 31 HA GLU 31 2.695 2.383 -7.802 233 1HB GLU 31 HB2 GLU 31 2.002 1.459 -10.048 234 2HB GLU 31 HB3 GLU 31 0.984 2.873 -10.286 235 1HG GLU 31 HG2 GLU 31 3.111 4.286 -10.129 236 2HG GLU 31 HG3 GLU 31 4.022 2.778 -10.134 237 H TRP 32 H TRP 32 -0.474 3.690 -7.500 238 HA TRP 32 HA TRP 32 0.598 6.361 -6.825 239 1HB TRP 32 HB2 TRP 32 -2.122 5.878 -8.078 240 2HB TRP 32 HB3 TRP 32 -1.352 7.413 -7.761 241 HD1 TRP 32 HD1 TRP 32 -0.748 4.358 -10.069 242 HE1 TRP 32 HE1 TRP 32 -0.318 5.198 -12.447 243 HE3 TRP 32 HE3 TRP 32 -0.721 9.400 -9.167 244 HZ2 TRP 32 HZ2 TRP 32 -0.279 7.695 -13.826 245 HZ3 TRP 32 HZ3 TRP 32 -0.593 10.992 -11.064 246 HH2 TRP 32 HH2 TRP 32 -0.450 10.148 -13.408 247 H LYS 33 H LYS 33 -0.862 7.435 -5.288 248 HA LYS 33 HA LYS 33 -2.931 5.745 -3.955 249 1HB LYS 33 HB2 LYS 33 -0.990 7.767 -2.770 250 2HB LYS 33 HB3 LYS 33 -2.489 7.330 -1.962 251 1HG LYS 33 HG2 LYS 33 -0.357 5.312 -2.722 252 2HG LYS 33 HG3 LYS 33 -0.433 6.164 -1.181 253 1HD LYS 33 HD2 LYS 33 -1.390 4.155 -0.634 254 2HD LYS 33 HD3 LYS 33 -2.782 5.188 -0.873 255 1HE LYS 33 HE2 LYS 33 -3.127 2.939 -1.773 256 2HE LYS 33 HE3 LYS 33 -3.215 4.121 -3.079 257 1HZ LYS 33 HZ1 LYS 33 -0.663 2.788 -2.510 258 2HZ LYS 33 HZ2 LYS 33 -1.774 1.950 -3.310 259 3HZ LYS 33 HZ3 LYS 33 -1.240 3.372 -3.954 260 H VAL 34 H VAL 34 -4.905 6.660 -4.004 261 HA VAL 34 HA VAL 34 -5.091 9.288 -5.385 262 HB VAL 34 HB VAL 34 -5.455 7.954 -7.146 263 1HG1 VAL 34 HG11 VAL 34 -6.676 5.738 -5.481 264 2HG1 VAL 34 HG12 VAL 34 -6.480 5.736 -7.257 265 3HG1 VAL 34 HG13 VAL 34 -5.060 5.750 -6.223 266 1HG2 VAL 34 HG21 VAL 34 -7.741 7.761 -7.725 267 2HG2 VAL 34 HG22 VAL 34 -8.263 7.669 -6.049 268 3HG2 VAL 34 HG23 VAL 34 -7.622 9.196 -6.690 269 H TYR 35 H TYR 35 -6.080 10.708 -4.266 270 HA TYR 35 HA TYR 35 -8.599 10.040 -2.922 271 1HB TYR 35 HB2 TYR 35 -7.390 11.908 -1.166 272 2HB TYR 35 HB3 TYR 35 -7.929 10.287 -0.835 273 HD1 TYR 35 HD1 TYR 35 -6.326 8.399 -0.734 274 HD2 TYR 35 HD2 TYR 35 -5.019 12.456 -1.402 275 HE1 TYR 35 HE1 TYR 35 -4.024 7.765 -0.069 276 HE2 TYR 35 HE2 TYR 35 -2.725 11.837 -0.740 277 HH TYR 35 HH TYR 35 -1.318 10.128 0.016 278 H SER 36 H SER 36 -9.621 12.273 -2.196 279 HA SER 36 HA SER 36 -9.006 14.342 -4.237 280 1HB SER 36 HB2 SER 36 -11.389 14.479 -4.685 281 2HB SER 36 HB3 SER 36 -10.761 12.889 -5.139 282 HG SER 36 HG SER 36 -11.737 11.996 -3.400 283 H ALA 37 H ALA 37 -9.877 16.407 -3.802 284 HA ALA 37 HA ALA 37 -11.222 16.897 -1.247 285 1HB ALA 37 HB1 ALA 37 -8.736 18.418 -2.134 286 2HB ALA 37 HB2 ALA 37 -9.725 18.657 -0.667 287 3HB ALA 37 HB3 ALA 37 -8.781 17.183 -0.838 288 H GLY 38 H GLY 38 -11.154 19.700 -1.534 289 1HA GLY 38 HA1 GLY 38 -11.664 20.666 -4.138 290 2HA GLY 38 HA2 GLY 38 -13.199 20.347 -3.306 291 H ILE 39 H ILE 39 -12.827 22.875 -3.877 292 HA ILE 39 HA ILE 39 -11.516 24.589 -2.006 293 HB ILE 39 HB ILE 39 -13.950 24.790 -3.794 294 1HG1 ILE 39 HG12 ILE 39 -12.679 26.589 -4.885 295 2HG1 ILE 39 HG13 ILE 39 -11.399 26.448 -3.684 296 1HG2 ILE 39 HG21 ILE 39 -13.125 26.987 -1.872 297 2HG2 ILE 39 HG22 ILE 39 -14.220 27.190 -3.258 298 3HG2 ILE 39 HG23 ILE 39 -14.691 26.133 -1.935 299 1HD1 ILE 39 HD11 ILE 39 -12.157 24.318 -5.731 300 2HD1 ILE 39 HD12 ILE 39 -10.802 25.433 -5.837 301 3HD1 ILE 39 HD13 ILE 39 -10.806 24.211 -4.570 302 H GLU 40 H GLU 40 -14.643 22.911 -1.970 303 HA GLU 40 HA GLU 40 -14.541 22.859 0.957 304 1HB GLU 40 HB2 GLU 40 -16.866 23.439 1.237 305 2HB GLU 40 HB3 GLU 40 -16.011 24.777 0.487 306 1HG GLU 40 HG2 GLU 40 -16.990 24.346 -1.667 307 2HG GLU 40 HG3 GLU 40 -17.587 22.756 -1.183 308 H ALA 41 H ALA 41 -16.540 21.397 1.609 309 HA ALA 41 HA ALA 41 -17.179 19.194 -0.228 310 1HB ALA 41 HB1 ALA 41 -15.186 18.341 0.907 311 2HB ALA 41 HB2 ALA 41 -15.796 18.893 2.488 312 3HB ALA 41 HB3 ALA 41 -16.626 17.592 1.635 313 H HIS 42 H HIS 42 -19.166 18.318 0.398 314 HA HIS 42 HA HIS 42 -20.473 19.350 2.859 315 1HB HIS 42 HB2 HIS 42 -21.187 20.023 0.103 316 2HB HIS 42 HB3 HIS 42 -22.494 19.148 0.878 317 HD1 HIS 42 HD1 HIS 42 -20.779 22.573 0.991 318 HD2 HIS 42 HD2 HIS 42 -23.579 20.240 3.141 319 HE1 HIS 42 HE1 HIS 42 -21.965 24.148 2.580 320 H GLY 43 H GLY 43 -19.764 16.642 0.757 321 1HA GLY 43 HA1 GLY 43 -20.120 14.735 2.584 322 2HA GLY 43 HA2 GLY 43 -21.780 14.904 1.981 323 H LEU 44 H LEU 44 -20.587 12.512 1.580 324 HA LEU 44 HA LEU 44 -19.449 12.296 -1.097 325 1HB LEU 44 HB2 LEU 44 -19.089 10.566 0.663 326 2HB LEU 44 HB3 LEU 44 -20.831 10.287 0.742 327 HG LEU 44 HG LEU 44 -20.742 9.630 -1.717 328 1HD1 LEU 44 HD11 LEU 44 -18.622 10.620 -2.396 329 2HD1 LEU 44 HD12 LEU 44 -17.747 9.645 -1.192 330 3HD1 LEU 44 HD13 LEU 44 -18.533 8.867 -2.581 331 1HD2 LEU 44 HD21 LEU 44 -19.773 7.377 -1.195 332 2HD2 LEU 44 HD22 LEU 44 -19.217 8.020 0.359 333 3HD2 LEU 44 HD23 LEU 44 -20.949 7.948 0.002 334 H ASN 45 H ASN 45 -20.762 13.216 -2.695 335 HA ASN 45 HA ASN 45 -23.514 13.662 -2.326 336 1HB ASN 45 HB2 ASN 45 -21.985 14.941 -3.800 337 2HB ASN 45 HB3 ASN 45 -21.997 13.611 -4.964 338 1HD2 ASN 45 HD22 ASN 45 -23.079 16.567 -4.889 339 2HD2 ASN 45 HD21 ASN 45 -24.703 16.373 -5.501 340 HA PRO 46 HA PRO 46 -25.109 9.520 -3.279 341 1HB PRO 46 HB2 PRO 46 -27.569 11.127 -3.994 342 2HB PRO 46 HB3 PRO 46 -27.450 9.608 -3.052 343 1HG PRO 46 HG2 PRO 46 -27.756 11.981 -1.780 344 2HG PRO 46 HG3 PRO 46 -26.590 10.773 -1.149 345 1HD PRO 46 HD2 PRO 46 -26.025 13.227 -2.828 346 2HD PRO 46 HD3 PRO 46 -25.146 12.597 -1.400 347 H ASN 47 H ASN 47 -25.510 12.285 -5.558 348 HA ASN 47 HA ASN 47 -26.108 10.662 -7.847 349 1HB ASN 47 HB2 ASN 47 -26.339 12.622 -8.851 350 2HB ASN 47 HB3 ASN 47 -25.891 13.452 -7.383 351 1HD2 ASN 47 HD22 ASN 47 -25.001 12.756 -10.674 352 2HD2 ASN 47 HD21 ASN 47 -23.400 13.460 -10.623 353 H ALA 48 H ALA 48 -23.024 11.684 -6.337 354 HA ALA 48 HA ALA 48 -21.402 10.670 -8.487 355 1HB ALA 48 HB1 ALA 48 -20.715 11.255 -5.563 356 2HB ALA 48 HB2 ALA 48 -19.551 10.898 -6.842 357 3HB ALA 48 HB3 ALA 48 -20.549 12.359 -6.949 358 H VAL 49 H VAL 49 -22.650 9.343 -5.379 359 HA VAL 49 HA VAL 49 -21.211 6.892 -5.539 360 HB VAL 49 HB VAL 49 -23.905 7.289 -4.202 361 1HG1 VAL 49 HG11 VAL 49 -23.316 4.920 -4.518 362 2HG1 VAL 49 HG12 VAL 49 -21.669 5.214 -3.931 363 3HG1 VAL 49 HG13 VAL 49 -23.061 5.357 -2.828 364 1HG2 VAL 49 HG21 VAL 49 -22.484 7.565 -2.147 365 2HG2 VAL 49 HG22 VAL 49 -21.050 7.655 -3.203 366 3HG2 VAL 49 HG23 VAL 49 -22.313 8.895 -3.288 367 H LYS 50 H LYS 50 -24.610 7.682 -6.642 368 HA LYS 50 HA LYS 50 -24.896 5.053 -7.681 369 1HB LYS 50 HB2 LYS 50 -26.723 6.822 -7.125 370 2HB LYS 50 HB3 LYS 50 -26.483 7.386 -8.789 371 1HG LYS 50 HG2 LYS 50 -26.944 5.028 -9.589 372 2HG LYS 50 HG3 LYS 50 -27.192 4.538 -7.903 373 1HD LYS 50 HD2 LYS 50 -29.013 6.319 -7.780 374 2HD LYS 50 HD3 LYS 50 -28.877 6.482 -9.531 375 1HE LYS 50 HE2 LYS 50 -29.547 3.888 -8.056 376 2HE LYS 50 HE3 LYS 50 -30.742 5.009 -8.706 377 1HZ LYS 50 HZ1 LYS 50 -30.465 3.327 -10.276 378 2HZ LYS 50 HZ2 LYS 50 -29.708 4.610 -10.929 379 3HZ LYS 50 HZ3 LYS 50 -28.848 3.354 -10.274 380 H ALA 51 H ALA 51 -23.834 8.098 -9.288 381 HA ALA 51 HA ALA 51 -23.795 7.113 -11.903 382 1HB ALA 51 HB1 ALA 51 -21.884 9.124 -10.615 383 2HB ALA 51 HB2 ALA 51 -22.141 8.910 -12.358 384 3HB ALA 51 HB3 ALA 51 -23.467 9.507 -11.343 385 H MET 52 H MET 52 -21.326 6.684 -9.332 386 HA MET 52 HA MET 52 -19.544 5.277 -11.198 387 1HB MET 52 HB2 MET 52 -19.492 5.734 -8.195 388 2HB MET 52 HB3 MET 52 -18.206 4.964 -9.123 389 1HG MET 52 HG2 MET 52 -19.135 7.843 -9.336 390 2HG MET 52 HG3 MET 52 -17.599 7.254 -8.719 391 1HE MET 52 HE1 MET 52 -17.107 4.935 -11.082 392 2HE MET 52 HE2 MET 52 -15.941 5.832 -12.033 393 3HE MET 52 HE3 MET 52 -15.859 5.902 -10.265 394 H LYS 53 H LYS 53 -21.822 4.447 -8.564 395 HA LYS 53 HA LYS 53 -21.042 1.757 -8.271 396 1HB LYS 53 HB2 LYS 53 -22.467 3.209 -6.731 397 2HB LYS 53 HB3 LYS 53 -23.836 2.872 -7.804 398 1HG LYS 53 HG2 LYS 53 -23.445 0.395 -7.273 399 2HG LYS 53 HG3 LYS 53 -22.203 0.922 -6.116 400 1HD LYS 53 HD2 LYS 53 -24.055 2.416 -5.063 401 2HD LYS 53 HD3 LYS 53 -25.184 1.548 -6.101 402 1HE LYS 53 HE2 LYS 53 -25.378 0.325 -4.166 403 2HE LYS 53 HE3 LYS 53 -24.155 -0.617 -5.022 404 1HZ LYS 53 HZ1 LYS 53 -23.527 -0.232 -2.725 405 2HZ LYS 53 HZ2 LYS 53 -22.459 0.576 -3.664 406 3HZ LYS 53 HZ3 LYS 53 -23.638 1.387 -2.888 407 H GLU 54 H GLU 54 -23.341 3.279 -10.517 408 HA GLU 54 HA GLU 54 -24.338 0.862 -11.640 409 1HB GLU 54 HB2 GLU 54 -24.155 3.710 -12.672 410 2HB GLU 54 HB3 GLU 54 -24.950 2.435 -13.591 411 1HG GLU 54 HG2 GLU 54 -25.710 3.285 -10.770 412 2HG GLU 54 HG3 GLU 54 -26.482 3.866 -12.241 413 H VAL 55 H VAL 55 -21.190 2.360 -12.022 414 HA VAL 55 HA VAL 55 -20.564 0.868 -14.492 415 HB VAL 55 HB VAL 55 -18.596 2.340 -12.690 416 1HG1 VAL 55 HG11 VAL 55 -17.353 2.695 -14.810 417 2HG1 VAL 55 HG12 VAL 55 -17.545 0.987 -14.456 418 3HG1 VAL 55 HG13 VAL 55 -18.577 1.751 -15.685 419 1HG2 VAL 55 HG21 VAL 55 -18.848 4.344 -14.105 420 2HG2 VAL 55 HG22 VAL 55 -20.199 3.576 -14.967 421 3HG2 VAL 55 HG23 VAL 55 -20.332 3.993 -13.239 422 H GLY 56 H GLY 56 -20.899 0.177 -11.162 423 1HA GLY 56 HA1 GLY 56 -20.331 -1.718 -9.979 424 2HA GLY 56 HA2 GLY 56 -19.218 -2.234 -11.259 425 H ILE 57 H ILE 57 -19.105 1.108 -10.016 426 HA ILE 57 HA ILE 57 -16.531 0.508 -8.628 427 HB ILE 57 HB ILE 57 -17.358 2.983 -10.172 428 1HG1 ILE 57 HG12 ILE 57 -15.164 0.954 -10.798 429 2HG1 ILE 57 HG13 ILE 57 -16.733 0.995 -11.600 430 1HG2 ILE 57 HG21 ILE 57 -15.060 3.800 -9.647 431 2HG2 ILE 57 HG22 ILE 57 -15.963 3.510 -8.173 432 3HG2 ILE 57 HG23 ILE 57 -14.754 2.331 -8.703 433 1HD1 ILE 57 HD11 ILE 57 -15.155 2.071 -13.026 434 2HD1 ILE 57 HD12 ILE 57 -16.278 3.290 -12.415 435 3HD1 ILE 57 HD13 ILE 57 -14.631 3.174 -11.741 436 H ASP 58 H ASP 58 -17.432 0.141 -6.700 437 HA ASP 58 HA ASP 58 -19.733 1.608 -5.734 438 1HB ASP 58 HB2 ASP 58 -19.482 -0.782 -5.326 439 2HB ASP 58 HB3 ASP 58 -17.986 -0.508 -4.421 440 H ILE 59 H ILE 59 -18.665 3.797 -5.835 441 HA ILE 59 HA ILE 59 -16.540 4.323 -3.990 442 HB ILE 59 HB ILE 59 -16.657 6.586 -4.528 443 1HG1 ILE 59 HG12 ILE 59 -19.219 6.287 -6.099 444 2HG1 ILE 59 HG13 ILE 59 -19.202 6.799 -4.417 445 1HG2 ILE 59 HG21 ILE 59 -17.265 5.074 -7.070 446 2HG2 ILE 59 HG22 ILE 59 -16.327 6.575 -6.907 447 3HG2 ILE 59 HG23 ILE 59 -15.704 5.071 -6.216 448 1HD1 ILE 59 HD11 ILE 59 -19.263 8.792 -5.648 449 2HD1 ILE 59 HD12 ILE 59 -17.622 8.654 -5.016 450 3HD1 ILE 59 HD13 ILE 59 -17.936 8.294 -6.726 451 H SER 60 H SER 60 -19.612 3.492 -3.150 452 HA SER 60 HA SER 60 -20.497 5.319 -1.284 453 1HB SER 60 HB2 SER 60 -20.459 2.316 -0.814 454 2HB SER 60 HB3 SER 60 -21.660 3.495 -0.268 455 HG SER 60 HG SER 60 -21.310 2.229 -2.720 456 H ASN 61 H ASN 61 -17.697 3.206 -1.165 457 HA ASN 61 HA ASN 61 -17.164 3.276 1.634 458 1HB ASN 61 HB2 ASN 61 -15.187 2.121 1.123 459 2HB ASN 61 HB3 ASN 61 -16.331 1.554 -0.078 460 1HD2 ASN 61 HD22 ASN 61 -15.980 2.265 -2.397 461 2HD2 ASN 61 HD21 ASN 61 -14.430 2.925 -2.826 462 H GLN 62 H GLN 62 -16.652 5.730 -0.810 463 HA GLN 62 HA GLN 62 -14.225 6.814 0.341 464 1HB GLN 62 HB2 GLN 62 -16.091 7.938 -1.793 465 2HB GLN 62 HB3 GLN 62 -14.486 8.557 -1.359 466 1HG GLN 62 HG2 GLN 62 -13.494 6.367 -2.008 467 2HG GLN 62 HG3 GLN 62 -15.080 5.828 -2.558 468 1HE2 GLN 62 HE22 GLN 62 -15.057 9.076 -3.522 469 2HE2 GLN 62 HE21 GLN 62 -14.517 8.767 -5.163 470 H THR 63 H THR 63 -14.308 9.288 0.817 471 HA THR 63 HA THR 63 -16.763 10.295 1.960 472 HB THR 63 HB THR 63 -15.393 10.968 4.087 473 HG1 THR 63 HG1 THR 63 -13.392 10.104 3.475 474 1HG2 THR 63 HG21 THR 63 -16.195 9.084 5.326 475 2HG2 THR 63 HG22 THR 63 -17.367 9.399 4.033 476 3HG2 THR 63 HG23 THR 63 -16.224 8.049 3.884 477 H SER 64 H SER 64 -16.509 12.687 2.465 478 HA SER 64 HA SER 64 -14.753 13.849 0.434 479 1HB SER 64 HB2 SER 64 -16.472 15.709 0.686 480 2HB SER 64 HB3 SER 64 -17.090 14.171 0.094 481 HG SER 64 HG SER 64 -17.307 15.163 2.753 482 H ASP 65 H ASP 65 -13.663 15.838 0.821 483 HA ASP 65 HA ASP 65 -13.391 16.910 3.499 484 1HB ASP 65 HB2 ASP 65 -11.765 14.918 3.427 485 2HB ASP 65 HB3 ASP 65 -10.901 15.787 2.153 486 H ILE 66 H ILE 66 -11.979 18.887 3.416 487 HA ILE 66 HA ILE 66 -12.102 20.167 0.746 488 HB ILE 66 HB ILE 66 -12.178 22.216 1.805 489 1HG1 ILE 66 HG12 ILE 66 -11.252 20.898 4.380 490 2HG1 ILE 66 HG13 ILE 66 -10.384 22.091 3.391 491 1HG2 ILE 66 HG21 ILE 66 -13.754 20.542 3.801 492 2HG2 ILE 66 HG22 ILE 66 -14.176 22.119 3.105 493 3HG2 ILE 66 HG23 ILE 66 -14.198 20.658 2.099 494 1HD1 ILE 66 HD11 ILE 66 -12.862 22.538 5.072 495 2HD1 ILE 66 HD12 ILE 66 -11.257 23.265 5.272 496 3HD1 ILE 66 HD13 ILE 66 -12.272 23.717 3.873 497 H ILE 67 H ILE 67 -10.167 21.520 0.206 498 HA ILE 67 HA ILE 67 -8.031 19.787 -0.037 499 HB ILE 67 HB ILE 67 -8.576 21.436 -1.626 500 1HG1 ILE 67 HG12 ILE 67 -6.220 20.523 -1.389 501 2HG1 ILE 67 HG13 ILE 67 -6.501 21.877 -2.459 502 1HG2 ILE 67 HG21 ILE 67 -8.032 23.823 -1.435 503 2HG2 ILE 67 HG22 ILE 67 -9.327 23.329 -0.344 504 3HG2 ILE 67 HG23 ILE 67 -7.690 23.611 0.293 505 1HD1 ILE 67 HD11 ILE 67 -5.503 23.461 -0.960 506 2HD1 ILE 67 HD12 ILE 67 -5.350 22.256 0.329 507 3HD1 ILE 67 HD13 ILE 67 -4.402 22.089 -1.150 508 H ASP 68 H ASP 68 -6.336 19.199 1.011 509 HA ASP 68 HA ASP 68 -5.436 20.707 3.413 510 1HB ASP 68 HB2 ASP 68 -6.100 18.385 3.848 511 2HB ASP 68 HB3 ASP 68 -4.982 17.810 2.604 512 H SER 69 H SER 69 -3.776 22.040 2.920 513 HA SER 69 HA SER 69 -2.464 21.991 0.466 514 1HB SER 69 HB2 SER 69 -1.472 23.352 2.991 515 2HB SER 69 HB3 SER 69 -1.240 23.869 1.307 516 HG SER 69 HG SER 69 -2.928 25.012 2.429 517 H ASP 70 H ASP 70 -1.642 20.111 3.330 518 HA ASP 70 HA ASP 70 1.186 19.972 2.650 519 1HB ASP 70 HB2 ASP 70 0.600 19.855 5.001 520 2HB ASP 70 HB3 ASP 70 -0.434 18.454 4.715 521 H ILE 71 H ILE 71 -1.761 17.954 2.349 522 HA ILE 71 HA ILE 71 -0.367 15.774 1.035 523 HB ILE 71 HB ILE 71 -3.307 16.577 0.901 524 1HG1 ILE 71 HG12 ILE 71 -1.803 14.355 2.364 525 2HG1 ILE 71 HG13 ILE 71 -2.416 15.828 3.123 526 1HG2 ILE 71 HG21 ILE 71 -3.632 14.287 -0.092 527 2HG2 ILE 71 HG22 ILE 71 -2.677 15.308 -1.141 528 3HG2 ILE 71 HG23 ILE 71 -1.856 14.090 -0.144 529 1HD1 ILE 71 HD11 ILE 71 -4.065 13.560 1.957 530 2HD1 ILE 71 HD12 ILE 71 -3.957 14.086 3.641 531 3HD1 ILE 71 HD13 ILE 71 -4.751 15.133 2.445 532 H LEU 72 H LEU 72 -2.062 18.708 -0.161 533 HA LEU 72 HA LEU 72 -1.687 18.353 -2.909 534 1HB LEU 72 HB2 LEU 72 -2.943 20.190 -1.679 535 2HB LEU 72 HB3 LEU 72 -1.387 20.925 -1.324 536 HG LEU 72 HG LEU 72 -1.118 20.770 -4.007 537 1HD1 LEU 72 HD11 LEU 72 -3.296 21.360 -5.067 538 2HD1 LEU 72 HD12 LEU 72 -3.308 19.718 -4.417 539 3HD1 LEU 72 HD13 LEU 72 -4.128 21.027 -3.543 540 1HD2 LEU 72 HD21 LEU 72 -0.905 22.812 -2.705 541 2HD2 LEU 72 HD22 LEU 72 -1.985 23.117 -4.072 542 3HD2 LEU 72 HD23 LEU 72 -2.659 22.870 -2.448 543 H ASN 73 H ASN 73 0.619 19.827 -0.542 544 HA ASN 73 HA ASN 73 2.646 20.243 -2.508 545 1HB ASN 73 HB2 ASN 73 2.519 20.449 0.503 546 2HB ASN 73 HB3 ASN 73 4.090 20.425 -0.281 547 1HD2 ASN 73 HD22 ASN 73 1.010 22.227 -0.175 548 2HD2 ASN 73 HD21 ASN 73 1.562 23.587 -1.133 549 H ASN 74 H ASN 74 1.710 17.288 -0.993 550 HA ASN 74 HA ASN 74 4.423 16.073 -1.302 551 1HB ASN 74 HB2 ASN 74 1.827 15.172 0.009 552 2HB ASN 74 HB3 ASN 74 3.036 14.003 -0.475 553 1HD2 ASN 74 HD22 ASN 74 2.266 16.452 1.858 554 2HD2 ASN 74 HD21 ASN 74 3.623 16.137 2.916 555 H ALA 75 H ALA 75 1.393 16.511 -2.984 556 HA ALA 75 HA ALA 75 1.202 13.946 -4.075 557 1HB ALA 75 HB1 ALA 75 -0.682 15.460 -3.866 558 2HB ALA 75 HB2 ALA 75 0.034 16.557 -5.067 559 3HB ALA 75 HB3 ALA 75 -0.499 14.928 -5.551 560 H ASP 76 H ASP 76 1.585 13.164 -6.252 561 HA ASP 76 HA ASP 76 3.964 14.297 -7.607 562 1HB ASP 76 HB2 ASP 76 3.584 11.810 -7.505 563 2HB ASP 76 HB3 ASP 76 2.106 12.036 -8.462 564 H LEU 77 H LEU 77 0.436 14.121 -7.854 565 HA LEU 77 HA LEU 77 0.425 16.065 -10.074 566 1HB LEU 77 HB2 LEU 77 0.344 13.914 -11.152 567 2HB LEU 77 HB3 LEU 77 -0.868 13.324 -10.007 568 HG LEU 77 HG LEU 77 -2.545 14.825 -10.921 569 1HD1 LEU 77 HD11 LEU 77 -2.214 16.145 -12.915 570 2HD1 LEU 77 HD12 LEU 77 -1.031 16.695 -11.747 571 3HD1 LEU 77 HD13 LEU 77 -0.544 15.617 -13.061 572 1HD2 LEU 77 HD21 LEU 77 -2.195 12.567 -11.928 573 2HD2 LEU 77 HD22 LEU 77 -2.865 13.727 -13.078 574 3HD2 LEU 77 HD23 LEU 77 -1.148 13.281 -13.152 575 H VAL 78 H VAL 78 -1.202 17.416 -10.025 576 HA VAL 78 HA VAL 78 -3.430 17.132 -8.068 577 HB VAL 78 HB VAL 78 -1.523 19.431 -8.615 578 1HG1 VAL 78 HG11 VAL 78 -2.929 20.930 -7.290 579 2HG1 VAL 78 HG12 VAL 78 -3.828 20.406 -8.706 580 3HG1 VAL 78 HG13 VAL 78 -4.185 19.673 -7.128 581 1HG2 VAL 78 HG21 VAL 78 -2.530 18.148 -6.030 582 2HG2 VAL 78 HG22 VAL 78 -0.970 17.833 -6.793 583 3HG2 VAL 78 HG23 VAL 78 -1.313 19.452 -6.165 584 H VAL 79 H VAL 79 -5.346 17.275 -9.103 585 HA VAL 79 HA VAL 79 -5.335 18.237 -11.929 586 HB VAL 79 HB VAL 79 -7.022 15.998 -10.775 587 1HG1 VAL 79 HG11 VAL 79 -7.993 17.162 -12.729 588 2HG1 VAL 79 HG12 VAL 79 -6.487 16.907 -13.637 589 3HG1 VAL 79 HG13 VAL 79 -7.499 15.519 -13.157 590 1HG2 VAL 79 HG21 VAL 79 -4.757 15.172 -10.767 591 2HG2 VAL 79 HG22 VAL 79 -5.602 14.458 -12.138 592 3HG2 VAL 79 HG23 VAL 79 -4.473 15.800 -12.415 593 H THR 80 H THR 80 -6.557 20.051 -12.129 594 HA THR 80 HA THR 80 -8.641 20.597 -10.077 595 HB THR 80 HB THR 80 -8.372 22.970 -11.019 596 HG1 THR 80 HG1 THR 80 -7.133 22.573 -12.838 597 1HG2 THR 80 HG21 THR 80 -7.559 22.363 -8.824 598 2HG2 THR 80 HG22 THR 80 -6.151 21.516 -9.503 599 3HG2 THR 80 HG23 THR 80 -6.282 23.273 -9.614 600 H LEU 81 H LEU 81 -10.386 19.609 -10.713 601 HA LEU 81 HA LEU 81 -10.978 18.946 -13.435 602 1HB LEU 81 HB2 LEU 81 -12.628 18.728 -10.888 603 2HB LEU 81 HB3 LEU 81 -13.042 17.939 -12.401 604 HG LEU 81 HG LEU 81 -10.469 17.365 -10.867 605 1HD1 LEU 81 HD11 LEU 81 -12.427 16.738 -9.525 606 2HD1 LEU 81 HD12 LEU 81 -13.083 15.806 -10.894 607 3HD1 LEU 81 HD13 LEU 81 -11.565 15.310 -10.116 608 1HD2 LEU 81 HD21 LEU 81 -10.342 16.795 -13.271 609 2HD2 LEU 81 HD22 LEU 81 -10.401 15.330 -12.285 610 3HD2 LEU 81 HD23 LEU 81 -11.849 15.878 -13.149 611 H CYS 82 H CYS 82 -11.489 22.024 -12.099 612 HA CYS 82 HA CYS 82 -13.388 22.542 -14.172 613 1HB CYS 82 HB2 CYS 82 -15.182 23.510 -12.797 614 2HB CYS 82 HB3 CYS 82 -14.997 21.783 -12.501 615 HG CYS 82 HG CYS 82 -15.533 23.374 -10.296 616 H GLY 83 H GLY 83 -13.886 24.906 -14.309 617 1HA GLY 83 HA1 GLY 83 -11.600 26.257 -14.884 618 2HA GLY 83 HA2 GLY 83 -13.155 27.024 -14.609 619 H ASP 84 H ASP 84 -13.719 27.280 -12.154 620 HA ASP 84 HA ASP 84 -11.824 29.186 -11.231 621 1HB ASP 84 HB2 ASP 84 -14.232 29.390 -10.851 622 2HB ASP 84 HB3 ASP 84 -14.215 27.958 -9.823 623 H ALA 85 H ALA 85 -12.256 25.769 -10.404 624 HA ALA 85 HA ALA 85 -10.975 25.850 -7.876 625 1HB ALA 85 HB1 ALA 85 -11.145 23.542 -9.863 626 2HB ALA 85 HB2 ALA 85 -10.696 23.410 -8.148 627 3HB ALA 85 HB3 ALA 85 -12.329 23.937 -8.591 628 H ALA 86 H ALA 86 -9.619 26.021 -11.090 629 HA ALA 86 HA ALA 86 -7.037 24.986 -10.574 630 1HB ALA 86 HB1 ALA 86 -7.950 25.451 -12.796 631 2HB ALA 86 HB2 ALA 86 -7.875 27.202 -12.465 632 3HB ALA 86 HB3 ALA 86 -6.378 26.245 -12.553 633 H ASP 87 H ASP 87 -8.501 28.045 -9.571 634 HA ASP 87 HA ASP 87 -6.066 29.434 -8.995 635 1HB ASP 87 HB2 ASP 87 -8.260 30.552 -9.210 636 2HB ASP 87 HB3 ASP 87 -8.839 29.691 -7.777 637 H LYS 88 H LYS 88 -7.919 26.959 -7.276 638 HA LYS 88 HA LYS 88 -6.725 27.667 -4.694 639 1HB LYS 88 HB2 LYS 88 -9.154 26.986 -5.033 640 2HB LYS 88 HB3 LYS 88 -8.567 25.343 -5.318 641 1HG LYS 88 HG2 LYS 88 -9.261 25.447 -3.064 642 2HG LYS 88 HG3 LYS 88 -7.499 25.443 -3.007 643 1HD LYS 88 HD2 LYS 88 -7.453 27.853 -2.571 644 2HD LYS 88 HD3 LYS 88 -9.213 27.964 -2.825 645 1HE LYS 88 HE2 LYS 88 -9.588 26.418 -0.940 646 2HE LYS 88 HE3 LYS 88 -7.844 26.290 -0.676 647 1HZ LYS 88 HZ1 LYS 88 -7.817 28.669 -0.148 648 2HZ LYS 88 HZ2 LYS 88 -9.429 28.786 -0.391 649 3HZ LYS 88 HZ3 LYS 88 -8.851 27.889 0.839 650 H CYS 89 H CYS 89 -4.577 27.256 -5.864 651 HA CYS 89 HA CYS 89 -3.668 24.509 -5.106 652 1HB CYS 89 HB2 CYS 89 -2.628 26.154 -7.443 653 2HB CYS 89 HB3 CYS 89 -2.005 24.593 -6.883 654 HG CYS 89 HG CYS 89 -4.906 25.421 -8.206 655 HA PRO 90 HA PRO 90 -1.499 27.802 -2.624 656 1HB PRO 90 HB2 PRO 90 -1.630 26.596 -0.179 657 2HB PRO 90 HB3 PRO 90 -2.933 27.628 -0.849 658 1HG PRO 90 HG2 PRO 90 -2.708 24.612 -0.965 659 2HG PRO 90 HG3 PRO 90 -4.128 25.579 -0.437 660 1HD PRO 90 HD2 PRO 90 -3.997 24.600 -2.947 661 2HD PRO 90 HD3 PRO 90 -4.592 26.258 -2.668 662 H MET 91 H MET 91 0.126 27.106 -3.985 663 HA MET 91 HA MET 91 2.281 26.723 -4.326 664 1HB MET 91 HB2 MET 91 2.653 27.344 -2.013 665 2HB MET 91 HB3 MET 91 2.377 25.686 -1.470 666 1HG MET 91 HG2 MET 91 4.722 26.259 -1.549 667 2HG MET 91 HG3 MET 91 4.312 24.894 -2.581 668 1HE MET 91 HE1 MET 91 6.800 25.163 -3.444 669 2HE MET 91 HE2 MET 91 7.415 26.578 -4.331 670 3HE MET 91 HE3 MET 91 7.095 26.689 -2.586 671 H THR 92 H THR 92 2.563 25.329 -5.924 672 HA THR 92 HA THR 92 2.590 22.421 -5.348 673 HB THR 92 HB THR 92 1.492 22.035 -7.579 674 HG1 THR 92 HG1 THR 92 1.674 24.198 -8.372 675 1HG2 THR 92 HG21 THR 92 -0.271 23.482 -5.585 676 2HG2 THR 92 HG22 THR 92 -0.737 22.207 -6.735 677 3HG2 THR 92 HG23 THR 92 0.326 21.825 -5.373 678 HA PRO 93 HA PRO 93 6.528 24.014 -7.206 679 1HB PRO 93 HB2 PRO 93 8.225 22.307 -5.831 680 2HB PRO 93 HB3 PRO 93 7.617 23.853 -5.181 681 1HG PRO 93 HG2 PRO 93 6.549 21.059 -4.707 682 2HG PRO 93 HG3 PRO 93 6.876 22.339 -3.496 683 1HD PRO 93 HD2 PRO 93 4.387 21.879 -4.459 684 2HD PRO 93 HD3 PRO 93 4.943 23.538 -4.111 685 HA PRO 94 HA PRO 94 7.079 21.214 -10.483 686 1HB PRO 94 HB2 PRO 94 9.892 20.560 -9.579 687 2HB PRO 94 HB3 PRO 94 9.300 20.907 -11.239 688 1HG PRO 94 HG2 PRO 94 10.487 22.870 -9.816 689 2HG PRO 94 HG3 PRO 94 8.970 23.225 -10.707 690 1HD PRO 94 HD2 PRO 94 9.344 22.676 -7.766 691 2HD PRO 94 HD3 PRO 94 8.296 23.883 -8.567 692 H HIS 95 H HIS 95 7.993 19.627 -7.409 693 HA HIS 95 HA HIS 95 7.874 16.910 -8.268 694 1HB HIS 95 HB2 HIS 95 8.586 17.663 -6.009 695 2HB HIS 95 HB3 HIS 95 6.940 18.182 -5.652 696 HD1 HIS 95 HD1 HIS 95 5.052 15.963 -5.639 697 HD2 HIS 95 HD2 HIS 95 9.204 15.212 -5.418 698 HE1 HIS 95 HE1 HIS 95 5.310 13.606 -4.762 699 H VAL 96 H VAL 96 5.400 19.324 -7.634 700 HA VAL 96 HA VAL 96 3.157 17.429 -7.779 701 HB VAL 96 HB VAL 96 3.117 20.387 -7.014 702 1HG1 VAL 96 HG11 VAL 96 1.089 19.710 -5.824 703 2HG1 VAL 96 HG12 VAL 96 0.986 19.263 -7.537 704 3HG1 VAL 96 HG13 VAL 96 1.351 18.026 -6.311 705 1HG2 VAL 96 HG21 VAL 96 3.203 19.797 -4.655 706 2HG2 VAL 96 HG22 VAL 96 3.649 18.137 -5.057 707 3HG2 VAL 96 HG23 VAL 96 4.737 19.480 -5.461 708 H LYS 97 H LYS 97 3.256 17.094 -10.085 709 HA LYS 97 HA LYS 97 3.250 19.377 -11.882 710 1HB LYS 97 HB2 LYS 97 3.333 17.887 -13.610 711 2HB LYS 97 HB3 LYS 97 4.094 16.958 -12.329 712 1HG LYS 97 HG2 LYS 97 1.650 15.991 -11.965 713 2HG LYS 97 HG3 LYS 97 1.367 16.653 -13.589 714 1HD LYS 97 HD2 LYS 97 3.430 15.327 -14.342 715 2HD LYS 97 HD3 LYS 97 3.438 14.603 -12.726 716 1HE LYS 97 HE2 LYS 97 2.345 13.052 -14.164 717 2HE LYS 97 HE3 LYS 97 1.105 13.751 -13.129 718 1HZ LYS 97 HZ1 LYS 97 0.515 13.579 -15.548 719 2HZ LYS 97 HZ2 LYS 97 0.412 15.150 -15.055 720 3HZ LYS 97 HZ3 LYS 97 1.674 14.566 -15.945 721 H ARG 98 H ARG 98 1.355 19.607 -13.424 722 HA ARG 98 HA ARG 98 -1.191 19.632 -11.881 723 1HB ARG 98 HB2 ARG 98 0.289 21.892 -13.300 724 2HB ARG 98 HB3 ARG 98 -1.404 22.017 -12.881 725 1HG ARG 98 HG2 ARG 98 0.800 21.495 -10.829 726 2HG ARG 98 HG3 ARG 98 0.232 23.101 -11.260 727 1HD ARG 98 HD2 ARG 98 -1.590 20.926 -10.158 728 2HD ARG 98 HD3 ARG 98 -0.781 22.138 -9.167 729 HE ARG 98 HE ARG 98 -2.055 23.861 -10.109 730 1HH1 ARG 98 HH21 ARG 98 -3.290 20.648 -11.143 731 2HH1 ARG 98 HH22 ARG 98 -4.631 21.334 -11.988 732 1HH2 ARG 98 HH11 ARG 98 -3.965 24.678 -11.109 733 2HH2 ARG 98 HH12 ARG 98 -5.116 23.548 -11.773 734 H GLU 99 H GLU 99 -2.961 19.137 -13.017 735 HA GLU 99 HA GLU 99 -3.035 19.503 -15.956 736 1HB GLU 99 HB2 GLU 99 -3.464 16.960 -14.434 737 2HB GLU 99 HB3 GLU 99 -4.774 17.403 -15.495 738 1HG GLU 99 HG2 GLU 99 -3.306 15.920 -16.653 739 2HG GLU 99 HG3 GLU 99 -3.320 17.497 -17.425 740 H HIS 100 H HIS 100 -5.311 19.944 -16.632 741 HA HIS 100 HA HIS 100 -7.130 20.804 -14.494 742 1HB HIS 100 HB2 HIS 100 -5.563 22.676 -14.662 743 2HB HIS 100 HB3 HIS 100 -5.681 22.666 -16.419 744 HD1 HIS 100 HD1 HIS 100 -8.915 22.633 -14.245 745 HD2 HIS 100 HD2 HIS 100 -6.549 25.108 -16.713 746 HE1 HIS 100 HE1 HIS 100 -10.254 24.709 -14.664 747 H TRP 101 H TRP 101 -9.218 20.866 -15.199 748 HA TRP 101 HA TRP 101 -9.890 20.601 -18.060 749 1HB TRP 101 HB2 TRP 101 -10.994 18.692 -15.997 750 2HB TRP 101 HB3 TRP 101 -11.137 18.630 -17.752 751 HD1 TRP 101 HD1 TRP 101 -8.968 17.574 -14.905 752 HE1 TRP 101 HE1 TRP 101 -7.010 16.134 -15.688 753 HE3 TRP 101 HE3 TRP 101 -9.405 18.321 -19.950 754 HZ2 TRP 101 HZ2 TRP 101 -5.768 15.401 -18.197 755 HZ3 TRP 101 HZ3 TRP 101 -7.826 17.222 -21.516 756 HH2 TRP 101 HH2 TRP 101 -6.015 15.745 -20.647 757 H GLY 102 H GLY 102 -12.535 20.456 -17.991 758 1HA GLY 102 HA1 GLY 102 -13.466 22.693 -16.232 759 2HA GLY 102 HA2 GLY 102 -13.547 22.799 -17.982 760 H PHE 103 H PHE 103 -15.050 21.503 -15.117 761 HA PHE 103 HA PHE 103 -17.276 20.504 -16.781 762 1HB PHE 103 HB2 PHE 103 -16.021 19.103 -14.391 763 2HB PHE 103 HB3 PHE 103 -17.570 18.660 -15.097 764 HD1 PHE 103 HD1 PHE 103 -17.705 17.746 -17.425 765 HD2 PHE 103 HD2 PHE 103 -13.923 18.454 -15.479 766 HE1 PHE 103 HE1 PHE 103 -16.554 16.400 -19.158 767 HE2 PHE 103 HE2 PHE 103 -12.771 17.140 -17.230 768 HZ PHE 103 HZ PHE 103 -14.080 16.137 -19.092 769 H ASP 104 H ASP 104 -19.306 20.842 -15.979 770 HA ASP 104 HA ASP 104 -19.668 22.830 -13.860 771 1HB ASP 104 HB2 ASP 104 -21.094 22.632 -15.954 772 2HB ASP 104 HB3 ASP 104 -21.716 21.115 -15.291 773 H ASP 105 H ASP 105 -21.390 22.160 -12.121 774 HA ASP 105 HA ASP 105 -20.538 19.730 -10.700 775 1HB ASP 105 HB2 ASP 105 -21.122 21.823 -9.535 776 2HB ASP 105 HB3 ASP 105 -22.769 21.720 -10.166 777 HA PRO 106 HA PRO 106 -23.556 17.649 -13.318 778 1HB PRO 106 HB2 PRO 106 -23.366 15.062 -12.370 779 2HB PRO 106 HB3 PRO 106 -22.142 15.817 -13.432 780 1HG PRO 106 HG2 PRO 106 -22.103 15.608 -10.403 781 2HG PRO 106 HG3 PRO 106 -20.786 15.205 -11.556 782 1HD PRO 106 HD2 PRO 106 -20.867 17.593 -10.274 783 2HD PRO 106 HD3 PRO 106 -20.349 17.494 -11.984 784 H ALA 107 H ALA 107 -23.705 17.549 -9.767 785 HA ALA 107 HA ALA 107 -26.234 16.197 -9.651 786 1HB ALA 107 HB1 ALA 107 -24.864 17.948 -7.571 787 2HB ALA 107 HB2 ALA 107 -26.214 16.831 -7.283 788 3HB ALA 107 HB3 ALA 107 -24.631 16.199 -7.782 789 H ARG 108 H ARG 108 -25.344 19.477 -10.340 790 HA ARG 108 HA ARG 108 -28.085 20.483 -9.798 791 1HB ARG 108 HB2 ARG 108 -25.387 21.881 -10.153 792 2HB ARG 108 HB3 ARG 108 -26.931 22.733 -10.208 793 1HG ARG 108 HG2 ARG 108 -26.439 22.986 -7.997 794 2HG ARG 108 HG3 ARG 108 -27.473 21.558 -7.977 795 1HD ARG 108 HD2 ARG 108 -25.211 20.215 -7.999 796 2HD ARG 108 HD3 ARG 108 -24.489 21.768 -7.556 797 HE ARG 108 HE ARG 108 -26.739 21.216 -5.886 798 1HH1 ARG 108 HH21 ARG 108 -23.327 20.251 -6.301 799 2HH1 ARG 108 HH22 ARG 108 -23.187 19.645 -4.687 800 1HH2 ARG 108 HH12 ARG 108 -26.519 20.423 -3.755 801 2HH2 ARG 108 HH11 ARG 108 -25.033 19.748 -3.213 802 H ALA 109 H ALA 109 -26.631 18.962 -12.313 803 HA ALA 109 HA ALA 109 -27.389 20.578 -14.523 804 1HB ALA 109 HB1 ALA 109 -25.965 18.530 -14.697 805 2HB ALA 109 HB2 ALA 109 -27.363 17.533 -14.222 806 3HB ALA 109 HB3 ALA 109 -27.400 18.434 -15.750 807 H GLN 110 H GLN 110 -29.409 20.549 -15.648 808 HA GLN 110 HA GLN 110 -31.735 19.315 -14.354 809 1HB GLN 110 HB2 GLN 110 -32.784 21.471 -13.763 810 2HB GLN 110 HB3 GLN 110 -31.314 21.153 -12.860 811 1HG GLN 110 HG2 GLN 110 -30.100 22.677 -14.575 812 2HG GLN 110 HG3 GLN 110 -31.713 23.141 -15.127 813 1HE2 GLN 110 HE21 GLN 110 -29.608 22.924 -12.213 814 2HE2 GLN 110 HE22 GLN 110 -30.325 24.288 -11.372 815 H GLY 111 H GLY 111 -33.773 20.003 -15.403 816 1HA GLY 111 HA1 GLY 111 -34.491 21.331 -17.552 817 2HA GLY 111 HA2 GLY 111 -33.501 20.080 -18.341 818 H THR 112 H THR 112 -33.906 17.874 -16.833 819 HA THR 112 HA THR 112 -36.465 17.359 -15.825 820 HB THR 112 HB THR 112 -37.267 17.277 -18.102 821 HG1 THR 112 HG1 THR 112 -38.198 15.685 -17.041 822 1HG2 THR 112 HG21 THR 112 -34.966 15.409 -18.738 823 2HG2 THR 112 HG22 THR 112 -36.374 15.679 -19.785 824 3HG2 THR 112 HG23 THR 112 -35.278 17.017 -19.428 825 H GLU 113 H GLU 113 -36.424 14.901 -15.177 826 HA GLU 113 HA GLU 113 -34.012 14.473 -13.751 827 1HB GLU 113 HB2 GLU 113 -36.147 13.587 -13.004 828 2HB GLU 113 HB3 GLU 113 -36.299 12.586 -14.456 829 1HG GLU 113 HG2 GLU 113 -34.375 11.238 -13.805 830 2HG GLU 113 HG3 GLU 113 -34.042 12.298 -12.429 831 H GLU 114 H GLU 114 -35.163 13.135 -16.844 832 HA GLU 114 HA GLU 114 -32.933 11.367 -17.120 833 1HB GLU 114 HB2 GLU 114 -33.685 10.985 -19.396 834 2HB GLU 114 HB3 GLU 114 -35.018 10.892 -18.248 835 1HG GLU 114 HG2 GLU 114 -35.765 13.156 -18.901 836 2HG GLU 114 HG3 GLU 114 -34.411 13.289 -20.032 837 H GLU 115 H GLU 115 -33.318 14.796 -17.820 838 HA GLU 115 HA GLU 115 -31.038 14.943 -19.588 839 1HB GLU 115 HB2 GLU 115 -32.934 16.575 -19.647 840 2HB GLU 115 HB3 GLU 115 -32.456 17.150 -18.049 841 1HG GLU 115 HG2 GLU 115 -31.607 18.692 -19.639 842 2HG GLU 115 HG3 GLU 115 -30.226 17.814 -19.004 843 H LYS 116 H LYS 116 -31.763 15.641 -16.141 844 HA LYS 116 HA LYS 116 -29.163 16.346 -15.294 845 1HB LYS 116 HB2 LYS 116 -31.074 16.751 -13.901 846 2HB LYS 116 HB3 LYS 116 -31.539 15.049 -13.915 847 1HG LYS 116 HG2 LYS 116 -29.615 14.424 -12.610 848 2HG LYS 116 HG3 LYS 116 -28.977 16.078 -12.630 849 1HD LYS 116 HD2 LYS 116 -31.743 15.509 -11.527 850 2HD LYS 116 HD3 LYS 116 -30.301 15.123 -10.561 851 1HE LYS 116 HE2 LYS 116 -29.548 17.524 -10.895 852 2HE LYS 116 HE3 LYS 116 -31.129 17.848 -11.609 853 1HZ LYS 116 HZ1 LYS 116 -32.134 17.157 -9.488 854 2HZ LYS 116 HZ2 LYS 116 -30.647 16.908 -8.841 855 3HZ LYS 116 HZ3 LYS 116 -31.105 18.405 -9.275 856 H TRP 117 H TRP 117 -30.720 13.110 -15.433 857 HA TRP 117 HA TRP 117 -28.397 11.716 -14.545 858 1HB TRP 117 HB2 TRP 117 -30.671 10.741 -14.552 859 2HB TRP 117 HB3 TRP 117 -30.651 10.699 -16.317 860 HD1 TRP 117 HD1 TRP 117 -29.191 8.831 -17.478 861 HE1 TRP 117 HE1 TRP 117 -28.062 6.671 -16.654 862 HE3 TRP 117 HE3 TRP 117 -29.299 9.727 -12.442 863 HZ2 TRP 117 HZ2 TRP 117 -27.080 5.620 -14.179 864 HZ3 TRP 117 HZ3 TRP 117 -28.123 8.205 -10.883 865 HH2 TRP 117 HH2 TRP 117 -26.998 6.150 -11.732 866 H ALA 118 H ALA 118 -29.510 12.529 -17.909 867 HA ALA 118 HA ALA 118 -27.406 11.201 -19.241 868 1HB ALA 118 HB1 ALA 118 -27.865 12.764 -21.101 869 2HB ALA 118 HB2 ALA 118 -29.365 12.114 -20.410 870 3HB ALA 118 HB3 ALA 118 -28.853 13.771 -20.022 871 H PHE 119 H PHE 119 -27.471 14.398 -17.627 872 HA PHE 119 HA PHE 119 -24.884 15.192 -18.508 873 1HB PHE 119 HB2 PHE 119 -26.799 16.541 -17.343 874 2HB PHE 119 HB3 PHE 119 -26.041 16.011 -15.848 875 HD1 PHE 119 HD1 PHE 119 -25.810 18.194 -18.780 876 HD2 PHE 119 HD2 PHE 119 -23.708 16.760 -15.303 877 HE1 PHE 119 HE1 PHE 119 -24.247 20.111 -18.936 878 HE2 PHE 119 HE2 PHE 119 -22.187 18.730 -15.407 879 HZ PHE 119 HZ PHE 119 -22.425 20.373 -17.276 880 H PHE 120 H PHE 120 -25.977 13.293 -15.605 881 HA PHE 120 HA PHE 120 -23.421 12.943 -14.421 882 1HB PHE 120 HB2 PHE 120 -25.547 10.786 -14.566 883 2HB PHE 120 HB3 PHE 120 -24.212 10.896 -13.459 884 HD1 PHE 120 HD1 PHE 120 -25.458 14.222 -13.396 885 HD2 PHE 120 HD2 PHE 120 -26.451 10.181 -12.238 886 HE1 PHE 120 HE1 PHE 120 -27.040 15.074 -11.715 887 HE2 PHE 120 HE2 PHE 120 -28.046 11.060 -10.556 888 HZ PHE 120 HZ PHE 120 -28.357 13.515 -10.306 889 H GLN 121 H GLN 121 -25.106 11.072 -17.024 890 HA GLN 121 HA GLN 121 -23.097 9.139 -17.430 891 1HB GLN 121 HB2 GLN 121 -25.079 10.283 -19.436 892 2HB GLN 121 HB3 GLN 121 -24.060 8.892 -19.734 893 1HG GLN 121 HG2 GLN 121 -26.150 9.081 -17.525 894 2HG GLN 121 HG3 GLN 121 -26.359 8.260 -19.065 895 1HE2 GLN 121 HE22 GLN 121 -25.811 7.586 -15.900 896 2HE2 GLN 121 HE21 GLN 121 -24.844 6.139 -16.063 897 H ARG 122 H ARG 122 -23.516 12.272 -19.120 898 HA ARG 122 HA ARG 122 -21.214 11.979 -20.776 899 1HB ARG 122 HB2 ARG 122 -22.878 14.349 -19.879 900 2HB ARG 122 HB3 ARG 122 -21.299 14.649 -20.594 901 1HG ARG 122 HG2 ARG 122 -22.861 14.787 -22.358 902 2HG ARG 122 HG3 ARG 122 -21.912 13.316 -22.591 903 1HD ARG 122 HD2 ARG 122 -23.805 11.985 -21.624 904 2HD ARG 122 HD3 ARG 122 -24.737 13.474 -21.453 905 HE ARG 122 HE ARG 122 -24.087 12.004 -23.917 906 1HH1 ARG 122 HH21 ARG 122 -25.502 14.968 -22.558 907 2HH1 ARG 122 HH22 ARG 122 -26.393 15.361 -23.981 908 1HH2 ARG 122 HH11 ARG 122 -25.266 12.534 -25.811 909 2HH2 ARG 122 HH12 ARG 122 -26.249 13.947 -25.870 910 H VAL 123 H VAL 123 -21.556 13.598 -17.570 911 HA VAL 123 HA VAL 123 -18.812 14.362 -17.510 912 HB VAL 123 HB VAL 123 -20.890 14.057 -15.298 913 1HG1 VAL 123 HG11 VAL 123 -18.117 15.326 -15.125 914 2HG1 VAL 123 HG12 VAL 123 -19.399 15.486 -13.903 915 3HG1 VAL 123 HG13 VAL 123 -18.683 13.904 -14.221 916 1HG2 VAL 123 HG21 VAL 123 -21.335 15.842 -17.002 917 2HG2 VAL 123 HG22 VAL 123 -20.930 16.541 -15.430 918 3HG2 VAL 123 HG23 VAL 123 -19.719 16.504 -16.723 919 H ARG 124 H ARG 124 -20.406 11.349 -16.107 920 HA ARG 124 HA ARG 124 -17.928 10.525 -15.008 921 1HB ARG 124 HB2 ARG 124 -18.860 8.343 -14.675 922 2HB ARG 124 HB3 ARG 124 -20.119 9.522 -14.336 923 1HG ARG 124 HG2 ARG 124 -21.161 8.997 -16.512 924 2HG ARG 124 HG3 ARG 124 -19.872 7.840 -16.866 925 1HD ARG 124 HD2 ARG 124 -20.513 6.597 -14.764 926 2HD ARG 124 HD3 ARG 124 -21.924 7.665 -14.631 927 HE ARG 124 HE ARG 124 -21.976 6.648 -17.234 928 1HH1 ARG 124 HH21 ARG 124 -22.159 5.243 -13.963 929 2HH1 ARG 124 HH22 ARG 124 -23.021 3.839 -14.502 930 1HH2 ARG 124 HH11 ARG 124 -23.306 4.916 -17.844 931 2HH2 ARG 124 HH12 ARG 124 -23.560 3.571 -16.783 932 H ASP 125 H ASP 125 -19.325 9.901 -18.229 933 HA ASP 125 HA ASP 125 -17.315 8.129 -19.126 934 1HB ASP 125 HB2 ASP 125 -19.401 8.440 -20.345 935 2HB ASP 125 HB3 ASP 125 -19.000 10.128 -20.679 936 H GLU 126 H GLU 126 -17.458 11.745 -19.250 937 HA GLU 126 HA GLU 126 -14.951 11.832 -20.626 938 1HB GLU 126 HB2 GLU 126 -16.815 13.899 -19.517 939 2HB GLU 126 HB3 GLU 126 -15.159 14.369 -19.894 940 1HG GLU 126 HG2 GLU 126 -16.917 12.934 -21.900 941 2HG GLU 126 HG3 GLU 126 -16.846 14.688 -21.743 942 H ILE 127 H ILE 127 -15.827 12.198 -17.163 943 HA ILE 127 HA ILE 127 -13.197 12.919 -16.325 944 HB ILE 127 HB ILE 127 -15.663 12.474 -15.044 945 1HG1 ILE 127 HG12 ILE 127 -14.393 13.103 -12.931 946 2HG1 ILE 127 HG13 ILE 127 -12.930 13.137 -13.918 947 1HG2 ILE 127 HG21 ILE 127 -13.724 10.514 -13.830 948 2HG2 ILE 127 HG22 ILE 127 -15.285 11.041 -13.163 949 3HG2 ILE 127 HG23 ILE 127 -15.250 10.157 -14.690 950 1HD1 ILE 127 HD11 ILE 127 -14.060 15.383 -13.665 951 2HD1 ILE 127 HD12 ILE 127 -13.974 14.876 -15.371 952 3HD1 ILE 127 HD13 ILE 127 -15.497 14.721 -14.467 953 H GLY 128 H GLY 128 -14.757 9.738 -16.936 954 1HA GLY 128 HA1 GLY 128 -12.592 8.113 -16.172 955 2HA GLY 128 HA2 GLY 128 -13.857 7.690 -17.350 956 H ASN 129 H ASN 129 -13.462 9.448 -19.425 957 HA ASN 129 HA ASN 129 -11.186 8.361 -20.726 958 1HB ASN 129 HB2 ASN 129 -13.087 10.571 -21.478 959 2HB ASN 129 HB3 ASN 129 -11.607 10.310 -22.404 960 1HD2 ASN 129 HD22 ASN 129 -14.643 8.802 -21.420 961 2HD2 ASN 129 HD21 ASN 129 -14.612 7.530 -22.627 962 H ARG 130 H ARG 130 -11.573 11.417 -18.972 963 HA ARG 130 HA ARG 130 -9.085 12.594 -19.691 964 1HB ARG 130 HB2 ARG 130 -11.113 12.961 -17.544 965 2HB ARG 130 HB3 ARG 130 -9.482 13.198 -16.962 966 1HG ARG 130 HG2 ARG 130 -10.064 15.287 -17.548 967 2HG ARG 130 HG3 ARG 130 -9.129 14.779 -18.941 968 1HD ARG 130 HD2 ARG 130 -12.142 15.057 -18.662 969 2HD ARG 130 HD3 ARG 130 -11.086 16.096 -19.616 970 HE ARG 130 HE ARG 130 -12.444 13.786 -20.464 971 1HH1 ARG 130 HH21 ARG 130 -9.120 15.050 -20.889 972 2HH1 ARG 130 HH22 ARG 130 -8.822 14.035 -22.277 973 1HH2 ARG 130 HH11 ARG 130 -12.199 12.948 -22.461 974 2HH2 ARG 130 HH12 ARG 130 -10.569 12.707 -23.133 975 H LEU 131 H LEU 131 -9.879 10.341 -17.031 976 HA LEU 131 HA LEU 131 -7.204 10.271 -15.996 977 1HB LEU 131 HB2 LEU 131 -9.588 8.383 -15.743 978 2HB LEU 131 HB3 LEU 131 -8.167 8.298 -14.707 979 HG LEU 131 HG LEU 131 -9.777 10.896 -14.931 980 1HD1 LEU 131 HD11 LEU 131 -11.357 9.151 -14.392 981 2HD1 LEU 131 HD12 LEU 131 -10.315 8.612 -13.051 982 3HD1 LEU 131 HD13 LEU 131 -11.076 10.218 -13.013 983 1HD2 LEU 131 HD21 LEU 131 -7.757 11.259 -13.854 984 2HD2 LEU 131 HD22 LEU 131 -8.957 11.107 -12.575 985 3HD2 LEU 131 HD23 LEU 131 -7.838 9.755 -12.920 986 H LYS 132 H LYS 132 -9.080 8.110 -18.138 987 HA LYS 132 HA LYS 132 -7.107 6.181 -18.634 988 1HB LYS 132 HB2 LYS 132 -9.290 5.721 -19.315 989 2HB LYS 132 HB3 LYS 132 -9.510 7.258 -20.096 990 1HG LYS 132 HG2 LYS 132 -7.620 5.218 -21.300 991 2HG LYS 132 HG3 LYS 132 -9.369 5.096 -21.494 992 1HD LYS 132 HD2 LYS 132 -9.155 7.657 -22.280 993 2HD LYS 132 HD3 LYS 132 -7.489 7.174 -22.593 994 1HE LYS 132 HE2 LYS 132 -8.653 6.902 -24.626 995 2HE LYS 132 HE3 LYS 132 -8.360 5.276 -24.004 996 1HZ LYS 132 HZ1 LYS 132 -10.619 5.566 -24.844 997 2HZ LYS 132 HZ2 LYS 132 -10.673 5.226 -23.256 998 3HZ LYS 132 HZ3 LYS 132 -10.939 6.761 -23.780 999 H GLU 133 H GLU 133 -7.637 9.291 -20.342 1000 HA GLU 133 HA GLU 133 -5.507 8.887 -22.199 1001 1HB GLU 133 HB2 GLU 133 -6.821 11.390 -21.083 1002 2HB GLU 133 HB3 GLU 133 -5.447 11.464 -22.203 1003 1HG GLU 133 HG2 GLU 133 -6.628 10.430 -23.965 1004 2HG GLU 133 HG3 GLU 133 -7.903 9.836 -22.908 1005 H PHE 134 H PHE 134 -5.332 10.686 -18.965 1006 HA PHE 134 HA PHE 134 -2.557 10.976 -19.579 1007 1HB PHE 134 HB2 PHE 134 -2.164 11.974 -17.537 1008 2HB PHE 134 HB3 PHE 134 -3.664 12.580 -18.202 1009 HD1 PHE 134 HD1 PHE 134 -5.366 12.974 -16.696 1010 HD2 PHE 134 HD2 PHE 134 -2.394 9.989 -15.740 1011 HE1 PHE 134 HE1 PHE 134 -6.289 12.772 -14.417 1012 HE2 PHE 134 HE2 PHE 134 -3.381 9.724 -13.489 1013 HZ PHE 134 HZ PHE 134 -5.377 11.070 -12.846 1014 H ALA 135 H ALA 135 -4.282 8.289 -18.113 1015 HA ALA 135 HA ALA 135 -1.950 7.012 -17.049 1016 1HB ALA 135 HB1 ALA 135 -4.584 5.809 -18.003 1017 2HB ALA 135 HB2 ALA 135 -3.368 5.003 -16.994 1018 3HB ALA 135 HB3 ALA 135 -4.249 6.408 -16.363 1019 H GLU 136 H GLU 136 -3.657 6.781 -20.180 1020 HA GLU 136 HA GLU 136 -1.948 4.719 -21.225 1021 1HB GLU 136 HB2 GLU 136 -4.077 6.497 -22.454 1022 2HB GLU 136 HB3 GLU 136 -3.183 5.313 -23.396 1023 1HG GLU 136 HG2 GLU 136 -4.820 4.584 -20.927 1024 2HG GLU 136 HG3 GLU 136 -5.428 4.529 -22.576 1025 H THR 137 H THR 137 -2.186 8.218 -21.706 1026 HA THR 137 HA THR 137 -0.165 8.223 -23.723 1027 HB THR 137 HB THR 137 -0.560 10.593 -23.837 1028 HG1 THR 137 HG1 THR 137 -2.391 10.250 -21.721 1029 1HG2 THR 137 HG21 THR 137 -3.123 8.929 -23.595 1030 2HG2 THR 137 HG22 THR 137 -2.989 10.513 -24.399 1031 3HG2 THR 137 HG23 THR 137 -2.101 9.108 -25.021 1032 H GLY 138 H GLY 138 -0.268 8.549 -20.253 1033 1HA GLY 138 HA1 GLY 138 1.417 8.641 -18.703 1034 2HA GLY 138 HA2 GLY 138 2.629 8.703 -19.995 1035 H LYS 139 H LYS 139 -0.061 10.986 -20.019 1036 HA LYS 139 HA LYS 139 1.618 13.261 -20.150 1037 1HB LYS 139 HB2 LYS 139 -0.723 13.014 -21.027 1038 2HB LYS 139 HB3 LYS 139 -1.318 13.156 -19.363 1039 1HG LYS 139 HG2 LYS 139 -0.344 15.396 -19.168 1040 2HG LYS 139 HG3 LYS 139 0.364 15.266 -20.783 1041 1HD LYS 139 HD2 LYS 139 -2.625 15.265 -20.151 1042 2HD LYS 139 HD3 LYS 139 -1.687 16.643 -20.750 1043 1HE LYS 139 HE2 LYS 139 -1.069 15.266 -22.780 1044 2HE LYS 139 HE3 LYS 139 -2.177 14.008 -22.215 1045 1HZ LYS 139 HZ1 LYS 139 -2.957 16.782 -22.912 1046 2HZ LYS 139 HZ2 LYS 139 -3.216 15.467 -23.834 1047 3HZ LYS 139 HZ3 LYS 139 -3.986 15.614 -22.406 Start of MODEL 4 1 1H MET 1 H1 MET 1 -1.019 0.733 1.686 2 2H MET 1 H2 MET 1 -0.798 2.356 1.790 3 3H MET 1 H3 MET 1 -1.911 1.757 0.755 4 HA MET 1 HA MET 1 1.000 1.436 0.557 5 1HB MET 1 HB2 MET 1 -1.202 0.321 -1.241 6 2HB MET 1 HB3 MET 1 0.485 0.478 -1.720 7 1HG MET 1 HG2 MET 1 0.232 -1.757 -1.046 8 2HG MET 1 HG3 MET 1 1.169 -0.950 0.199 9 1HE MET 1 HE1 MET 1 -2.786 -1.314 -0.523 10 2HE MET 1 HE2 MET 1 -2.033 -2.908 -0.756 11 3HE MET 1 HE3 MET 1 -3.134 -2.635 0.610 12 H GLU 2 H GLU 2 2.044 2.927 -0.759 13 HA GLU 2 HA GLU 2 0.571 4.735 -2.494 14 1HB GLU 2 HB2 GLU 2 0.286 5.781 -0.281 15 2HB GLU 2 HB3 GLU 2 2.016 5.675 0.034 16 1HG GLU 2 HG2 GLU 2 2.503 7.357 -1.626 17 2HG GLU 2 HG3 GLU 2 0.860 7.320 -2.250 18 H ASN 3 H ASN 3 2.093 5.812 -3.897 19 HA ASN 3 HA ASN 3 4.951 5.253 -3.717 20 1HB ASN 3 HB2 ASN 3 4.471 3.169 -4.654 21 2HB ASN 3 HB3 ASN 3 3.268 3.808 -5.749 22 1HD2 ASN 3 HD22 ASN 3 3.951 4.703 -7.753 23 2HD2 ASN 3 HD21 ASN 3 5.631 4.680 -8.271 24 H LYS 4 H LYS 4 2.278 6.285 -5.825 25 HA LYS 4 HA LYS 4 3.582 8.940 -6.199 26 1HB LYS 4 HB2 LYS 4 2.136 7.204 -8.247 27 2HB LYS 4 HB3 LYS 4 2.211 8.952 -8.420 28 1HG LYS 4 HG2 LYS 4 4.520 9.014 -8.719 29 2HG LYS 4 HG3 LYS 4 4.788 7.447 -7.961 30 1HD LYS 4 HD2 LYS 4 5.160 7.412 -10.400 31 2HD LYS 4 HD3 LYS 4 3.954 6.252 -9.840 32 1HE LYS 4 HE2 LYS 4 2.130 7.702 -10.599 33 2HE LYS 4 HE3 LYS 4 3.291 8.936 -11.119 34 1HZ LYS 4 HZ1 LYS 4 3.147 6.169 -12.214 35 2HZ LYS 4 HZ2 LYS 4 2.535 7.507 -12.946 36 3HZ LYS 4 HZ3 LYS 4 4.147 7.360 -12.737 37 H ILE 5 H ILE 5 1.786 10.614 -6.630 38 HA ILE 5 HA ILE 5 -0.617 9.981 -4.979 39 HB ILE 5 HB ILE 5 1.447 12.187 -4.579 40 1HG1 ILE 5 HG12 ILE 5 0.508 9.975 -2.721 41 2HG1 ILE 5 HG13 ILE 5 2.058 10.041 -3.555 42 1HG2 ILE 5 HG21 ILE 5 -0.044 13.060 -2.736 43 2HG2 ILE 5 HG22 ILE 5 -0.803 13.174 -4.324 44 3HG2 ILE 5 HG23 ILE 5 -1.274 11.889 -3.252 45 1HD1 ILE 5 HD11 ILE 5 2.513 10.709 -1.346 46 2HD1 ILE 5 HD12 ILE 5 2.576 12.189 -2.320 47 3HD1 ILE 5 HD13 ILE 5 1.157 11.841 -1.295 48 H ILE 6 H ILE 6 -2.378 10.656 -5.997 49 HA ILE 6 HA ILE 6 -2.209 12.968 -7.843 50 HB ILE 6 HB ILE 6 -2.410 11.144 -9.306 51 1HG1 ILE 6 HG12 ILE 6 -5.193 12.306 -8.845 52 2HG1 ILE 6 HG13 ILE 6 -3.871 13.068 -9.734 53 1HG2 ILE 6 HG21 ILE 6 -4.039 9.330 -9.129 54 2HG2 ILE 6 HG22 ILE 6 -3.026 9.352 -7.701 55 3HG2 ILE 6 HG23 ILE 6 -4.671 10.017 -7.628 56 1HD1 ILE 6 HD11 ILE 6 -5.373 12.134 -11.339 57 2HD1 ILE 6 HD12 ILE 6 -3.943 11.083 -11.331 58 3HD1 ILE 6 HD13 ILE 6 -5.439 10.582 -10.498 59 H TYR 7 H TYR 7 -3.643 14.523 -7.345 60 HA TYR 7 HA TYR 7 -5.583 13.970 -5.152 61 1HB TYR 7 HB2 TYR 7 -3.400 14.661 -4.362 62 2HB TYR 7 HB3 TYR 7 -3.476 16.132 -5.343 63 HD1 TYR 7 HD1 TYR 7 -5.500 17.781 -4.811 64 HD2 TYR 7 HD2 TYR 7 -4.144 14.631 -2.193 65 HE1 TYR 7 HE1 TYR 7 -6.550 18.922 -2.881 66 HE2 TYR 7 HE2 TYR 7 -5.151 15.788 -0.261 67 HH TYR 7 HH TYR 7 -6.431 17.521 0.436 68 H PHE 8 H PHE 8 -7.554 14.308 -6.170 69 HA PHE 8 HA PHE 8 -7.929 16.245 -8.296 70 1HB PHE 8 HB2 PHE 8 -9.844 14.494 -6.695 71 2HB PHE 8 HB3 PHE 8 -10.331 15.526 -8.022 72 HD1 PHE 8 HD1 PHE 8 -9.028 15.205 -10.282 73 HD2 PHE 8 HD2 PHE 8 -9.252 12.230 -7.170 74 HE1 PHE 8 HE1 PHE 8 -8.465 13.437 -11.932 75 HE2 PHE 8 HE2 PHE 8 -8.622 10.482 -8.819 76 HZ PHE 8 HZ PHE 8 -8.218 11.085 -11.177 77 H LEU 9 H LEU 9 -9.295 18.087 -8.228 78 HA LEU 9 HA LEU 9 -10.062 19.183 -5.588 79 1HB LEU 9 HB2 LEU 9 -7.626 19.660 -6.165 80 2HB LEU 9 HB3 LEU 9 -8.167 20.523 -7.583 81 HG LEU 9 HG LEU 9 -7.448 21.954 -5.737 82 1HD1 LEU 9 HD11 LEU 9 -9.132 23.597 -5.801 83 2HD1 LEU 9 HD12 LEU 9 -9.227 22.748 -7.344 84 3HD1 LEU 9 HD13 LEU 9 -10.423 22.418 -6.056 85 1HD2 LEU 9 HD21 LEU 9 -8.767 22.223 -3.703 86 2HD2 LEU 9 HD22 LEU 9 -9.794 20.856 -4.164 87 3HD2 LEU 9 HD23 LEU 9 -8.077 20.587 -3.837 88 H CYS 10 H CYS 10 -12.071 20.291 -5.835 89 HA CYS 10 HA CYS 10 -12.553 21.754 -8.325 90 1HB CYS 10 HB2 CYS 10 -14.755 20.750 -8.758 91 2HB CYS 10 HB3 CYS 10 -13.464 19.550 -8.867 92 HG CYS 10 HG CYS 10 -13.771 18.385 -6.698 93 H THR 11 H THR 11 -14.940 22.892 -8.037 94 HA THR 11 HA THR 11 -14.670 24.482 -5.703 95 HB THR 11 HB THR 11 -16.994 25.324 -6.562 96 HG1 THR 11 HG1 THR 11 -17.338 24.827 -8.704 97 1HG2 THR 11 HG21 THR 11 -15.863 26.732 -8.151 98 2HG2 THR 11 HG22 THR 11 -14.735 26.420 -6.820 99 3HG2 THR 11 HG23 THR 11 -14.552 25.562 -8.362 100 H GLY 12 H GLY 12 -16.028 21.375 -5.878 101 1HA GLY 12 HA1 GLY 12 -16.812 21.548 -3.144 102 2HA GLY 12 HA2 GLY 12 -18.245 21.409 -4.184 103 H ASN 13 H ASN 13 -15.659 19.768 -2.727 104 HA ASN 13 HA ASN 13 -14.680 17.799 -4.356 105 1HB ASN 13 HB2 ASN 13 -14.071 18.212 -1.981 106 2HB ASN 13 HB3 ASN 13 -15.588 17.519 -1.452 107 1HD2 ASN 13 HD22 ASN 13 -13.136 16.641 -0.543 108 2HD2 ASN 13 HD21 ASN 13 -12.765 15.045 -1.163 109 H SER 14 H SER 14 -17.673 17.695 -2.542 110 HA SER 14 HA SER 14 -18.537 15.286 -2.322 111 1HB SER 14 HB2 SER 14 -20.266 17.577 -3.305 112 2HB SER 14 HB3 SER 14 -20.743 16.280 -2.188 113 HG SER 14 HG SER 14 -20.065 18.490 -1.389 114 H CYS 15 H CYS 15 -18.656 16.860 -5.554 115 HA CYS 15 HA CYS 15 -19.839 14.340 -6.612 116 1HB CYS 15 HB2 CYS 15 -20.588 15.809 -8.548 117 2HB CYS 15 HB3 CYS 15 -21.457 15.922 -7.023 118 HG CYS 15 HG CYS 15 -21.390 18.301 -7.932 119 H ARG 16 H ARG 16 -17.877 17.003 -8.130 120 HA ARG 16 HA ARG 16 -17.004 15.219 -10.132 121 1HB ARG 16 HB2 ARG 16 -15.496 17.743 -9.286 122 2HB ARG 16 HB3 ARG 16 -15.212 16.796 -10.720 123 1HG ARG 16 HG2 ARG 16 -16.376 18.551 -11.521 124 2HG ARG 16 HG3 ARG 16 -17.622 17.306 -11.432 125 1HD ARG 16 HD2 ARG 16 -18.776 18.419 -9.762 126 2HD ARG 16 HD3 ARG 16 -17.298 19.070 -9.026 127 HE ARG 16 HE ARG 16 -18.265 20.086 -11.652 128 1HH1 ARG 16 HH21 ARG 16 -17.902 20.789 -8.180 129 2HH1 ARG 16 HH22 ARG 16 -17.653 22.496 -8.427 130 1HH2 ARG 16 HH11 ARG 16 -17.841 22.302 -11.951 131 2HH2 ARG 16 HH12 ARG 16 -17.917 23.390 -10.593 132 H SER 17 H SER 17 -15.074 16.238 -7.222 133 HA SER 17 HA SER 17 -12.826 14.694 -7.994 134 1HB SER 17 HB2 SER 17 -13.658 15.580 -5.220 135 2HB SER 17 HB3 SER 17 -12.030 15.102 -5.742 136 HG SER 17 HG SER 17 -12.310 17.363 -5.664 137 H GLN 18 H GLN 18 -15.712 13.824 -6.052 138 HA GLN 18 HA GLN 18 -14.705 11.294 -5.163 139 1HB GLN 18 HB2 GLN 18 -17.556 12.319 -5.638 140 2HB GLN 18 HB3 GLN 18 -17.180 10.792 -4.850 141 1HG GLN 18 HG2 GLN 18 -16.345 13.545 -3.852 142 2HG GLN 18 HG3 GLN 18 -17.660 12.578 -3.211 143 1HE2 GLN 18 HE22 GLN 18 -14.749 13.524 -2.301 144 2HE2 GLN 18 HE21 GLN 18 -14.234 12.096 -1.402 145 H MET 19 H MET 19 -16.619 12.198 -8.089 146 HA MET 19 HA MET 19 -16.844 9.500 -9.078 147 1HB MET 19 HB2 MET 19 -16.961 12.200 -10.511 148 2HB MET 19 HB3 MET 19 -17.362 10.646 -11.258 149 1HG MET 19 HG2 MET 19 -19.214 10.299 -9.753 150 2HG MET 19 HG3 MET 19 -18.749 11.686 -8.775 151 1HE MET 19 HE1 MET 19 -20.671 12.027 -12.985 152 2HE MET 19 HE2 MET 19 -18.973 11.545 -12.798 153 3HE MET 19 HE3 MET 19 -20.270 10.496 -12.176 154 H ALA 20 H ALA 20 -14.513 12.165 -9.814 155 HA ALA 20 HA ALA 20 -12.964 10.774 -11.702 156 1HB ALA 20 HB1 ALA 20 -11.984 12.816 -9.660 157 2HB ALA 20 HB2 ALA 20 -11.257 12.426 -11.233 158 3HB ALA 20 HB3 ALA 20 -12.832 13.230 -11.164 159 H GLU 21 H GLU 21 -12.651 10.870 -8.122 160 HA GLU 21 HA GLU 21 -10.290 9.350 -7.940 161 1HB GLU 21 HB2 GLU 21 -11.067 10.593 -6.058 162 2HB GLU 21 HB3 GLU 21 -12.609 9.720 -6.005 163 1HG GLU 21 HG2 GLU 21 -11.531 7.676 -5.384 164 2HG GLU 21 HG3 GLU 21 -9.925 8.348 -5.625 165 H GLY 22 H GLY 22 -13.720 8.233 -8.011 166 1HA GLY 22 HA1 GLY 22 -13.251 5.502 -7.658 167 2HA GLY 22 HA2 GLY 22 -14.594 6.202 -8.565 168 H TRP 23 H TRP 23 -13.279 7.343 -10.835 169 HA TRP 23 HA TRP 23 -12.705 4.924 -12.346 170 1HB TRP 23 HB2 TRP 23 -12.252 7.851 -13.059 171 2HB TRP 23 HB3 TRP 23 -12.002 6.506 -14.155 172 HD1 TRP 23 HD1 TRP 23 -14.706 8.613 -12.617 173 HE1 TRP 23 HE1 TRP 23 -16.889 8.294 -13.852 174 HE3 TRP 23 HE3 TRP 23 -13.418 4.579 -15.502 175 HZ2 TRP 23 HZ2 TRP 23 -17.975 6.518 -15.857 176 HZ3 TRP 23 HZ3 TRP 23 -15.037 3.660 -17.143 177 HH2 TRP 23 HH2 TRP 23 -17.317 4.664 -17.345 178 H ALA 24 H ALA 24 -10.628 7.485 -10.922 179 HA ALA 24 HA ALA 24 -8.297 6.749 -12.295 180 1HB ALA 24 HB1 ALA 24 -7.121 8.051 -10.548 181 2HB ALA 24 HB2 ALA 24 -8.640 8.864 -10.971 182 3HB ALA 24 HB3 ALA 24 -8.532 7.920 -9.479 183 H LYS 25 H LYS 25 -9.641 5.451 -9.273 184 HA LYS 25 HA LYS 25 -7.441 3.853 -8.493 185 1HB LYS 25 HB2 LYS 25 -10.444 3.495 -8.164 186 2HB LYS 25 HB3 LYS 25 -9.274 2.388 -7.432 187 1HG LYS 25 HG2 LYS 25 -8.295 4.100 -6.082 188 2HG LYS 25 HG3 LYS 25 -9.134 5.389 -6.954 189 1HD LYS 25 HD2 LYS 25 -11.315 4.545 -6.153 190 2HD LYS 25 HD3 LYS 25 -10.484 3.272 -5.219 191 1HE LYS 25 HE2 LYS 25 -9.318 4.945 -3.873 192 2HE LYS 25 HE3 LYS 25 -9.888 6.241 -4.931 193 1HZ LYS 25 HZ1 LYS 25 -11.248 6.323 -3.082 194 2HZ LYS 25 HZ2 LYS 25 -12.187 5.631 -4.211 195 3HZ LYS 25 HZ3 LYS 25 -11.516 4.682 -3.030 196 H GLN 26 H GLN 26 -9.833 3.290 -11.063 197 HA GLN 26 HA GLN 26 -9.097 0.499 -11.445 198 1HB GLN 26 HB2 GLN 26 -10.331 2.393 -13.459 199 2HB GLN 26 HB3 GLN 26 -10.251 0.642 -13.546 200 1HG GLN 26 HG2 GLN 26 -11.749 0.524 -11.519 201 2HG GLN 26 HG3 GLN 26 -11.928 2.294 -11.613 202 1HE2 GLN 26 HE22 GLN 26 -12.135 2.929 -14.172 203 2HE2 GLN 26 HE21 GLN 26 -13.481 2.121 -14.962 204 H TYR 27 H TYR 27 -8.530 3.488 -13.298 205 HA TYR 27 HA TYR 27 -6.821 2.202 -15.179 206 1HB TYR 27 HB2 TYR 27 -7.271 5.154 -14.605 207 2HB TYR 27 HB3 TYR 27 -6.379 4.540 -15.988 208 HD1 TYR 27 HD1 TYR 27 -7.648 2.645 -17.413 209 HD2 TYR 27 HD2 TYR 27 -9.565 5.654 -14.983 210 HE1 TYR 27 HE1 TYR 27 -9.705 2.427 -18.770 211 HE2 TYR 27 HE2 TYR 27 -11.578 5.519 -16.399 212 HH TYR 27 HH TYR 27 -12.620 4.452 -18.205 213 H LEU 28 H LEU 28 -5.964 4.196 -12.317 214 HA LEU 28 HA LEU 28 -3.197 4.403 -13.267 215 1HB LEU 28 HB2 LEU 28 -4.518 5.385 -10.711 216 2HB LEU 28 HB3 LEU 28 -2.904 5.781 -11.252 217 HG LEU 28 HG LEU 28 -5.489 6.591 -12.615 218 1HD1 LEU 28 HD11 LEU 28 -4.847 7.823 -10.578 219 2HD1 LEU 28 HD12 LEU 28 -3.270 8.208 -11.300 220 3HD1 LEU 28 HD13 LEU 28 -4.758 8.844 -12.027 221 1HD2 LEU 28 HD21 LEU 28 -4.068 7.916 -14.177 222 2HD2 LEU 28 HD22 LEU 28 -2.626 7.107 -13.527 223 3HD2 LEU 28 HD23 LEU 28 -3.866 6.179 -14.396 224 H GLY 29 H GLY 29 -4.870 2.755 -10.605 225 1HA GLY 29 HA1 GLY 29 -4.378 0.691 -9.705 226 2HA GLY 29 HA2 GLY 29 -2.930 0.603 -10.706 227 H ASP 30 H ASP 30 -2.298 -0.414 -8.606 228 HA ASP 30 HA ASP 30 -2.093 0.905 -6.143 229 1HB ASP 30 HB2 ASP 30 -2.071 -1.532 -6.503 230 2HB ASP 30 HB3 ASP 30 -0.482 -1.411 -7.267 231 H GLU 31 H GLU 31 -0.028 1.233 -8.890 232 HA GLU 31 HA GLU 31 2.384 2.178 -7.682 233 1HB GLU 31 HB2 GLU 31 1.924 1.459 -10.105 234 2HB GLU 31 HB3 GLU 31 1.088 2.991 -10.329 235 1HG GLU 31 HG2 GLU 31 3.268 4.146 -9.699 236 2HG GLU 31 HG3 GLU 31 4.038 2.562 -9.712 237 H TRP 32 H TRP 32 -0.779 3.497 -7.518 238 HA TRP 32 HA TRP 32 0.316 6.152 -6.755 239 1HB TRP 32 HB2 TRP 32 -2.302 5.677 -8.202 240 2HB TRP 32 HB3 TRP 32 -1.600 7.218 -7.768 241 HD1 TRP 32 HD1 TRP 32 -0.749 4.250 -10.084 242 HE1 TRP 32 HE1 TRP 32 -0.164 5.167 -12.393 243 HE3 TRP 32 HE3 TRP 32 -0.762 9.252 -8.989 244 HZ2 TRP 32 HZ2 TRP 32 0.023 7.711 -13.663 245 HZ3 TRP 32 HZ3 TRP 32 -0.479 10.910 -10.814 246 HH2 TRP 32 HH2 TRP 32 -0.175 10.139 -13.157 247 H LYS 33 H LYS 33 -1.209 7.360 -5.399 248 HA LYS 33 HA LYS 33 -3.333 5.807 -4.047 249 1HB LYS 33 HB2 LYS 33 -1.085 6.326 -2.715 250 2HB LYS 33 HB3 LYS 33 -1.788 7.937 -2.551 251 1HG LYS 33 HG2 LYS 33 -3.080 5.298 -1.698 252 2HG LYS 33 HG3 LYS 33 -2.155 6.344 -0.642 253 1HD LYS 33 HD2 LYS 33 -3.977 7.439 -0.076 254 2HD LYS 33 HD3 LYS 33 -4.159 8.046 -1.717 255 1HE LYS 33 HE2 LYS 33 -5.496 6.012 -2.306 256 2HE LYS 33 HE3 LYS 33 -5.233 5.375 -0.675 257 1HZ LYS 33 HZ1 LYS 33 -7.378 6.435 -0.825 258 2HZ LYS 33 HZ2 LYS 33 -6.450 7.307 0.191 259 3HZ LYS 33 HZ3 LYS 33 -6.727 7.847 -1.339 260 H VAL 34 H VAL 34 -5.193 7.042 -3.918 261 HA VAL 34 HA VAL 34 -5.167 9.514 -5.568 262 HB VAL 34 HB VAL 34 -7.442 7.526 -5.229 263 1HG1 VAL 34 HG11 VAL 34 -6.845 9.528 -7.452 264 2HG1 VAL 34 HG12 VAL 34 -8.262 8.469 -7.312 265 3HG1 VAL 34 HG13 VAL 34 -8.021 9.771 -6.143 266 1HG2 VAL 34 HG21 VAL 34 -5.668 6.177 -6.176 267 2HG2 VAL 34 HG22 VAL 34 -6.807 6.570 -7.459 268 3HG2 VAL 34 HG23 VAL 34 -5.265 7.445 -7.361 269 H TYR 35 H TYR 35 -6.318 11.290 -4.840 270 HA TYR 35 HA TYR 35 -7.950 11.026 -2.374 271 1HB TYR 35 HB2 TYR 35 -5.930 13.229 -2.914 272 2HB TYR 35 HB3 TYR 35 -6.993 13.124 -1.521 273 HD1 TYR 35 HD1 TYR 35 -6.529 11.519 0.319 274 HD2 TYR 35 HD2 TYR 35 -3.929 11.872 -3.104 275 HE1 TYR 35 HE1 TYR 35 -4.755 10.303 1.544 276 HE2 TYR 35 HE2 TYR 35 -2.168 10.693 -1.902 277 HH TYR 35 HH TYR 35 -1.554 9.490 0.110 278 H SER 36 H SER 36 -9.471 12.739 -2.178 279 HA SER 36 HA SER 36 -9.972 14.428 -4.550 280 1HB SER 36 HB2 SER 36 -12.451 13.794 -4.038 281 2HB SER 36 HB3 SER 36 -11.453 12.640 -4.936 282 HG SER 36 HG SER 36 -11.258 11.373 -3.190 283 H ALA 37 H ALA 37 -10.068 16.514 -3.880 284 HA ALA 37 HA ALA 37 -11.353 17.113 -1.280 285 1HB ALA 37 HB1 ALA 37 -8.837 18.449 -2.240 286 2HB ALA 37 HB2 ALA 37 -9.726 18.636 -0.700 287 3HB ALA 37 HB3 ALA 37 -8.896 17.123 -1.037 288 H GLY 38 H GLY 38 -11.415 19.799 -1.396 289 1HA GLY 38 HA1 GLY 38 -11.930 20.886 -3.991 290 2HA GLY 38 HA2 GLY 38 -13.433 20.518 -3.140 291 H ILE 39 H ILE 39 -13.078 23.053 -3.716 292 HA ILE 39 HA ILE 39 -11.883 24.807 -1.818 293 HB ILE 39 HB ILE 39 -14.318 24.874 -3.610 294 1HG1 ILE 39 HG12 ILE 39 -13.211 26.773 -4.671 295 2HG1 ILE 39 HG13 ILE 39 -11.944 26.765 -3.451 296 1HG2 ILE 39 HG21 ILE 39 -14.788 27.232 -3.024 297 2HG2 ILE 39 HG22 ILE 39 -15.194 26.107 -1.738 298 3HG2 ILE 39 HG23 ILE 39 -13.702 27.082 -1.625 299 1HD1 ILE 39 HD11 ILE 39 -11.213 25.812 -5.605 300 2HD1 ILE 39 HD12 ILE 39 -11.111 24.598 -4.329 301 3HD1 ILE 39 HD13 ILE 39 -12.453 24.566 -5.501 302 H GLU 40 H GLU 40 -14.928 22.970 -1.810 303 HA GLU 40 HA GLU 40 -14.852 22.862 1.107 304 1HB GLU 40 HB2 GLU 40 -17.146 23.513 1.415 305 2HB GLU 40 HB3 GLU 40 -16.268 24.815 0.615 306 1HG GLU 40 HG2 GLU 40 -17.213 23.996 -1.593 307 2HG GLU 40 HG3 GLU 40 -18.218 22.853 -0.699 308 H ALA 41 H ALA 41 -16.853 21.358 1.718 309 HA ALA 41 HA ALA 41 -17.538 19.292 -0.236 310 1HB ALA 41 HB1 ALA 41 -15.438 18.426 0.762 311 2HB ALA 41 HB2 ALA 41 -16.085 18.704 2.396 312 3HB ALA 41 HB3 ALA 41 -16.839 17.497 1.339 313 H HIS 42 H HIS 42 -19.359 18.074 0.613 314 HA HIS 42 HA HIS 42 -20.727 19.232 3.009 315 1HB HIS 42 HB2 HIS 42 -22.015 18.624 0.315 316 2HB HIS 42 HB3 HIS 42 -22.855 19.139 1.774 317 HD1 HIS 42 HD1 HIS 42 -21.734 20.661 -1.304 318 HD2 HIS 42 HD2 HIS 42 -21.646 21.671 2.783 319 HE1 HIS 42 HE1 HIS 42 -21.442 23.184 -1.197 320 H GLY 43 H GLY 43 -20.212 16.457 0.795 321 1HA GLY 43 HA1 GLY 43 -20.144 14.529 2.782 322 2HA GLY 43 HA2 GLY 43 -21.829 14.590 2.218 323 H LEU 44 H LEU 44 -20.927 12.298 1.607 324 HA LEU 44 HA LEU 44 -19.584 12.201 -1.010 325 1HB LEU 44 HB2 LEU 44 -19.330 10.372 0.684 326 2HB LEU 44 HB3 LEU 44 -21.074 10.104 0.642 327 HG LEU 44 HG LEU 44 -20.844 9.604 -1.842 328 1HD1 LEU 44 HD11 LEU 44 -18.702 10.647 -2.333 329 2HD1 LEU 44 HD12 LEU 44 -17.884 9.610 -1.149 330 3HD1 LEU 44 HD13 LEU 44 -18.579 8.912 -2.630 331 1HD2 LEU 44 HD21 LEU 44 -21.121 7.803 -0.244 332 2HD2 LEU 44 HD22 LEU 44 -19.883 7.318 -1.419 333 3HD2 LEU 44 HD23 LEU 44 -19.408 7.861 0.196 334 H ASN 45 H ASN 45 -20.834 13.178 -2.636 335 HA ASN 45 HA ASN 45 -23.596 13.692 -2.314 336 1HB ASN 45 HB2 ASN 45 -22.012 14.970 -3.738 337 2HB ASN 45 HB3 ASN 45 -22.028 13.656 -4.922 338 1HD2 ASN 45 HD22 ASN 45 -22.974 16.598 -4.988 339 2HD2 ASN 45 HD21 ASN 45 -24.616 16.469 -5.567 340 HA PRO 46 HA PRO 46 -25.224 9.594 -3.384 341 1HB PRO 46 HB2 PRO 46 -27.634 11.257 -4.140 342 2HB PRO 46 HB3 PRO 46 -27.571 9.716 -3.228 343 1HG PRO 46 HG2 PRO 46 -27.872 12.065 -1.912 344 2HG PRO 46 HG3 PRO 46 -26.743 10.823 -1.277 345 1HD PRO 46 HD2 PRO 46 -26.093 13.301 -2.888 346 2HD PRO 46 HD3 PRO 46 -25.263 12.629 -1.448 347 H ASN 47 H ASN 47 -25.498 12.408 -5.618 348 HA ASN 47 HA ASN 47 -26.047 10.872 -7.974 349 1HB ASN 47 HB2 ASN 47 -26.199 12.923 -8.840 350 2HB ASN 47 HB3 ASN 47 -25.598 13.653 -7.383 351 1HD2 ASN 47 HD22 ASN 47 -24.796 12.704 -10.701 352 2HD2 ASN 47 HD21 ASN 47 -23.173 13.355 -10.692 353 H ALA 48 H ALA 48 -22.991 11.736 -6.327 354 HA ALA 48 HA ALA 48 -21.326 10.738 -8.450 355 1HB ALA 48 HB1 ALA 48 -20.688 11.129 -5.481 356 2HB ALA 48 HB2 ALA 48 -19.515 10.869 -6.781 357 3HB ALA 48 HB3 ALA 48 -20.497 12.342 -6.766 358 H VAL 49 H VAL 49 -22.709 9.357 -5.422 359 HA VAL 49 HA VAL 49 -21.335 6.876 -5.658 360 HB VAL 49 HB VAL 49 -24.041 7.252 -4.327 361 1HG1 VAL 49 HG11 VAL 49 -23.386 4.900 -4.669 362 2HG1 VAL 49 HG12 VAL 49 -21.771 5.220 -4.013 363 3HG1 VAL 49 HG13 VAL 49 -23.206 5.319 -2.965 364 1HG2 VAL 49 HG21 VAL 49 -21.219 7.680 -3.288 365 2HG2 VAL 49 HG22 VAL 49 -22.526 8.879 -3.356 366 3HG2 VAL 49 HG23 VAL 49 -22.658 7.519 -2.245 367 H LYS 50 H LYS 50 -24.712 7.798 -6.737 368 HA LYS 50 HA LYS 50 -25.081 5.174 -7.769 369 1HB LYS 50 HB2 LYS 50 -26.905 6.793 -7.140 370 2HB LYS 50 HB3 LYS 50 -26.606 7.647 -8.664 371 1HG LYS 50 HG2 LYS 50 -27.110 5.554 -9.918 372 2HG LYS 50 HG3 LYS 50 -27.326 4.679 -8.396 373 1HD LYS 50 HD2 LYS 50 -29.280 6.047 -7.838 374 2HD LYS 50 HD3 LYS 50 -28.997 7.078 -9.241 375 1HE LYS 50 HE2 LYS 50 -30.807 5.592 -9.744 376 2HE LYS 50 HE3 LYS 50 -29.433 5.184 -10.771 377 1HZ LYS 50 HZ1 LYS 50 -29.055 3.216 -9.504 378 2HZ LYS 50 HZ2 LYS 50 -30.059 3.702 -8.281 379 3HZ LYS 50 HZ3 LYS 50 -30.656 3.285 -9.734 380 H ALA 51 H ALA 51 -23.924 8.185 -9.390 381 HA ALA 51 HA ALA 51 -23.975 7.170 -12.007 382 1HB ALA 51 HB1 ALA 51 -21.969 9.121 -10.770 383 2HB ALA 51 HB2 ALA 51 -22.279 8.912 -12.506 384 3HB ALA 51 HB3 ALA 51 -23.555 9.560 -11.454 385 H MET 52 H MET 52 -21.419 6.788 -9.498 386 HA MET 52 HA MET 52 -19.694 5.323 -11.332 387 1HB MET 52 HB2 MET 52 -19.669 5.819 -8.331 388 2HB MET 52 HB3 MET 52 -18.370 5.047 -9.234 389 1HG MET 52 HG2 MET 52 -19.355 7.906 -9.544 390 2HG MET 52 HG3 MET 52 -17.823 7.384 -8.861 391 1HE MET 52 HE1 MET 52 -16.853 5.202 -10.703 392 2HE MET 52 HE2 MET 52 -15.939 5.985 -11.974 393 3HE MET 52 HE3 MET 52 -15.759 6.544 -10.301 394 H LYS 53 H LYS 53 -21.954 4.516 -8.674 395 HA LYS 53 HA LYS 53 -21.172 1.818 -8.402 396 1HB LYS 53 HB2 LYS 53 -22.444 3.259 -6.761 397 2HB LYS 53 HB3 LYS 53 -23.890 3.029 -7.759 398 1HG LYS 53 HG2 LYS 53 -23.618 0.520 -7.315 399 2HG LYS 53 HG3 LYS 53 -22.297 0.944 -6.205 400 1HD LYS 53 HD2 LYS 53 -23.998 2.506 -5.022 401 2HD LYS 53 HD3 LYS 53 -25.229 1.756 -6.041 402 1HE LYS 53 HE2 LYS 53 -25.429 0.485 -4.136 403 2HE LYS 53 HE3 LYS 53 -24.317 -0.512 -5.079 404 1HZ LYS 53 HZ1 LYS 53 -23.563 -0.252 -2.799 405 2HZ LYS 53 HZ2 LYS 53 -22.481 0.509 -3.765 406 3HZ LYS 53 HZ3 LYS 53 -23.554 1.378 -2.913 407 H GLU 54 H GLU 54 -23.646 3.345 -10.474 408 HA GLU 54 HA GLU 54 -24.731 0.907 -11.467 409 1HB GLU 54 HB2 GLU 54 -24.674 3.726 -12.590 410 2HB GLU 54 HB3 GLU 54 -25.532 2.408 -13.382 411 1HG GLU 54 HG2 GLU 54 -26.048 3.377 -10.546 412 2HG GLU 54 HG3 GLU 54 -27.001 3.811 -11.964 413 H VAL 55 H VAL 55 -21.652 2.438 -12.122 414 HA VAL 55 HA VAL 55 -21.247 0.902 -14.620 415 HB VAL 55 HB VAL 55 -19.533 2.970 -13.172 416 1HG1 VAL 55 HG11 VAL 55 -18.257 3.139 -15.299 417 2HG1 VAL 55 HG12 VAL 55 -18.022 1.598 -14.495 418 3HG1 VAL 55 HG13 VAL 55 -19.106 1.698 -15.905 419 1HG2 VAL 55 HG21 VAL 55 -21.213 3.182 -15.713 420 2HG2 VAL 55 HG22 VAL 55 -21.598 3.950 -14.164 421 3HG2 VAL 55 HG23 VAL 55 -20.155 4.441 -15.042 422 H GLY 56 H GLY 56 -21.204 0.250 -11.335 423 1HA GLY 56 HA1 GLY 56 -20.465 -1.651 -10.281 424 2HA GLY 56 HA2 GLY 56 -19.408 -2.047 -11.645 425 H ILE 57 H ILE 57 -19.276 1.227 -10.289 426 HA ILE 57 HA ILE 57 -16.689 0.581 -8.950 427 HB ILE 57 HB ILE 57 -17.527 3.148 -10.332 428 1HG1 ILE 57 HG12 ILE 57 -15.530 1.002 -11.177 429 2HG1 ILE 57 HG13 ILE 57 -17.046 1.413 -11.984 430 1HG2 ILE 57 HG21 ILE 57 -16.040 3.453 -8.319 431 2HG2 ILE 57 HG22 ILE 57 -14.872 2.323 -9.029 432 3HG2 ILE 57 HG23 ILE 57 -15.203 3.881 -9.802 433 1HD1 ILE 57 HD11 ILE 57 -14.531 3.109 -11.857 434 2HD1 ILE 57 HD12 ILE 57 -15.343 2.412 -13.268 435 3HD1 ILE 57 HD13 ILE 57 -16.121 3.730 -12.400 436 H ASP 58 H ASP 58 -17.576 0.122 -7.015 437 HA ASP 58 HA ASP 58 -19.823 1.608 -5.932 438 1HB ASP 58 HB2 ASP 58 -19.640 -0.799 -5.605 439 2HB ASP 58 HB3 ASP 58 -18.098 -0.603 -4.756 440 H ILE 59 H ILE 59 -18.801 3.768 -5.922 441 HA ILE 59 HA ILE 59 -16.602 4.223 -4.112 442 HB ILE 59 HB ILE 59 -16.726 6.493 -4.634 443 1HG1 ILE 59 HG12 ILE 59 -19.327 6.220 -6.151 444 2HG1 ILE 59 HG13 ILE 59 -19.282 6.700 -4.457 445 1HG2 ILE 59 HG21 ILE 59 -15.832 5.002 -6.380 446 2HG2 ILE 59 HG22 ILE 59 -17.416 5.037 -7.189 447 3HG2 ILE 59 HG23 ILE 59 -16.465 6.524 -7.022 448 1HD1 ILE 59 HD11 ILE 59 -17.695 8.559 -5.056 449 2HD1 ILE 59 HD12 ILE 59 -18.054 8.227 -6.765 450 3HD1 ILE 59 HD13 ILE 59 -19.348 8.717 -5.650 451 H SER 60 H SER 60 -19.628 3.319 -3.232 452 HA SER 60 HA SER 60 -20.615 5.220 -1.496 453 1HB SER 60 HB2 SER 60 -20.611 2.234 -0.928 454 2HB SER 60 HB3 SER 60 -21.817 3.436 -0.440 455 HG SER 60 HG SER 60 -21.361 2.179 -2.899 456 H ASN 61 H ASN 61 -17.775 3.190 -1.052 457 HA ASN 61 HA ASN 61 -17.554 3.511 1.804 458 1HB ASN 61 HB2 ASN 61 -16.667 1.551 0.550 459 2HB ASN 61 HB3 ASN 61 -15.518 2.609 -0.273 460 1HD2 ASN 61 HD22 ASN 61 -13.467 2.434 0.633 461 2HD2 ASN 61 HD21 ASN 61 -13.147 2.171 2.325 462 H GLN 62 H GLN 62 -16.774 5.639 -0.850 463 HA GLN 62 HA GLN 62 -14.417 6.833 0.286 464 1HB GLN 62 HB2 GLN 62 -16.298 7.842 -1.886 465 2HB GLN 62 HB3 GLN 62 -14.738 8.553 -1.433 466 1HG GLN 62 HG2 GLN 62 -13.592 6.454 -2.023 467 2HG GLN 62 HG3 GLN 62 -15.127 5.765 -2.559 468 1HE2 GLN 62 HE22 GLN 62 -15.134 9.089 -3.518 469 2HE2 GLN 62 HE21 GLN 62 -14.645 8.767 -5.177 470 H THR 63 H THR 63 -14.495 9.297 0.695 471 HA THR 63 HA THR 63 -16.954 10.383 1.746 472 HB THR 63 HB THR 63 -15.661 11.138 3.863 473 HG1 THR 63 HG1 THR 63 -14.013 9.828 4.534 474 1HG2 THR 63 HG21 THR 63 -16.414 9.275 5.168 475 2HG2 THR 63 HG22 THR 63 -17.565 9.482 3.837 476 3HG2 THR 63 HG23 THR 63 -16.362 8.178 3.773 477 H SER 64 H SER 64 -16.629 12.758 2.237 478 HA SER 64 HA SER 64 -14.705 13.894 0.285 479 1HB SER 64 HB2 SER 64 -17.362 14.971 1.289 480 2HB SER 64 HB3 SER 64 -16.366 15.642 -0.019 481 HG SER 64 HG SER 64 -18.248 14.185 -0.506 482 H ASP 65 H ASP 65 -13.665 15.820 0.807 483 HA ASP 65 HA ASP 65 -13.636 16.923 3.534 484 1HB ASP 65 HB2 ASP 65 -11.944 14.979 3.369 485 2HB ASP 65 HB3 ASP 65 -11.108 15.948 2.139 486 H ILE 66 H ILE 66 -12.300 18.985 3.522 487 HA ILE 66 HA ILE 66 -12.411 20.290 0.865 488 HB ILE 66 HB ILE 66 -12.468 22.320 1.953 489 1HG1 ILE 66 HG12 ILE 66 -11.567 20.953 4.516 490 2HG1 ILE 66 HG13 ILE 66 -10.665 22.134 3.543 491 1HG2 ILE 66 HG21 ILE 66 -14.500 20.749 2.232 492 2HG2 ILE 66 HG22 ILE 66 -14.043 20.617 3.928 493 3HG2 ILE 66 HG23 ILE 66 -14.468 22.199 3.253 494 1HD1 ILE 66 HD11 ILE 66 -13.148 22.615 5.206 495 2HD1 ILE 66 HD12 ILE 66 -11.537 23.328 5.410 496 3HD1 ILE 66 HD13 ILE 66 -12.545 23.787 4.008 497 H ILE 67 H ILE 67 -10.453 21.693 0.374 498 HA ILE 67 HA ILE 67 -8.344 19.964 0.020 499 HB ILE 67 HB ILE 67 -8.893 21.732 -1.457 500 1HG1 ILE 67 HG12 ILE 67 -6.561 20.688 -1.319 501 2HG1 ILE 67 HG13 ILE 67 -6.822 22.083 -2.335 502 1HG2 ILE 67 HG21 ILE 67 -7.836 23.742 0.552 503 2HG2 ILE 67 HG22 ILE 67 -8.221 24.075 -1.147 504 3HG2 ILE 67 HG23 ILE 67 -9.510 23.572 -0.046 505 1HD1 ILE 67 HD11 ILE 67 -4.685 22.172 -1.030 506 2HD1 ILE 67 HD12 ILE 67 -5.739 23.581 -0.820 507 3HD1 ILE 67 HD13 ILE 67 -5.622 22.365 0.451 508 H ASP 68 H ASP 68 -6.398 19.602 0.740 509 HA ASP 68 HA ASP 68 -5.539 20.750 3.340 510 1HB ASP 68 HB2 ASP 68 -6.537 18.459 3.645 511 2HB ASP 68 HB3 ASP 68 -5.276 17.815 2.570 512 H SER 69 H SER 69 -3.809 21.941 2.722 513 HA SER 69 HA SER 69 -2.196 21.469 0.450 514 1HB SER 69 HB2 SER 69 -0.631 23.062 1.825 515 2HB SER 69 HB3 SER 69 -2.171 23.653 1.190 516 HG SER 69 HG SER 69 -1.855 24.227 3.390 517 H ASP 70 H ASP 70 -2.153 19.927 3.634 518 HA ASP 70 HA ASP 70 0.617 19.305 3.711 519 1HB ASP 70 HB2 ASP 70 -0.907 19.155 5.659 520 2HB ASP 70 HB3 ASP 70 -1.700 17.761 4.907 521 H ILE 71 H ILE 71 -1.970 17.941 1.768 522 HA ILE 71 HA ILE 71 -0.117 15.732 0.965 523 HB ILE 71 HB ILE 71 -3.125 15.844 0.760 524 1HG1 ILE 71 HG12 ILE 71 -1.210 13.970 2.211 525 2HG1 ILE 71 HG13 ILE 71 -2.050 15.316 3.000 526 1HG2 ILE 71 HG21 ILE 71 -2.950 13.591 -0.262 527 2HG2 ILE 71 HG22 ILE 71 -2.065 14.738 -1.262 528 3HG2 ILE 71 HG23 ILE 71 -1.176 13.665 -0.176 529 1HD1 ILE 71 HD11 ILE 71 -3.345 12.839 1.829 530 2HD1 ILE 71 HD12 ILE 71 -3.237 13.318 3.528 531 3HD1 ILE 71 HD13 ILE 71 -4.240 14.268 2.410 532 H LEU 72 H LEU 72 -2.418 18.213 -0.303 533 HA LEU 72 HA LEU 72 -1.786 17.878 -2.979 534 1HB LEU 72 HB2 LEU 72 -3.608 19.136 -2.512 535 2HB LEU 72 HB3 LEU 72 -2.840 20.119 -1.301 536 HG LEU 72 HG LEU 72 -1.833 20.492 -4.108 537 1HD1 LEU 72 HD11 LEU 72 -4.580 21.482 -3.262 538 2HD1 LEU 72 HD12 LEU 72 -3.698 21.956 -4.730 539 3HD1 LEU 72 HD13 LEU 72 -4.235 20.286 -4.524 540 1HD2 LEU 72 HD21 LEU 72 -2.027 22.925 -3.282 541 2HD2 LEU 72 HD22 LEU 72 -2.525 22.274 -1.728 542 3HD2 LEU 72 HD23 LEU 72 -0.913 21.905 -2.361 543 H ASN 73 H ASN 73 0.141 19.873 -0.627 544 HA ASN 73 HA ASN 73 1.906 20.803 -2.666 545 1HB ASN 73 HB2 ASN 73 3.080 21.874 -1.040 546 2HB ASN 73 HB3 ASN 73 1.589 21.633 -0.142 547 1HD2 ASN 73 HD22 ASN 73 1.547 19.701 1.346 548 2HD2 ASN 73 HD21 ASN 73 3.054 19.104 2.023 549 H ASN 74 H ASN 74 1.646 17.661 -1.358 550 HA ASN 74 HA ASN 74 4.511 16.985 -1.920 551 1HB ASN 74 HB2 ASN 74 2.368 15.633 -0.218 552 2HB ASN 74 HB3 ASN 74 3.858 14.835 -0.678 553 1HD2 ASN 74 HD22 ASN 74 2.469 16.618 1.785 554 2HD2 ASN 74 HD21 ASN 74 3.961 17.079 2.574 555 H ALA 75 H ALA 75 1.421 16.919 -3.346 556 HA ALA 75 HA ALA 75 1.337 14.240 -4.183 557 1HB ALA 75 HB1 ALA 75 -0.476 15.060 -5.714 558 2HB ALA 75 HB2 ALA 75 -0.655 15.619 -4.039 559 3HB ALA 75 HB3 ALA 75 -0.035 16.726 -5.278 560 H ASP 76 H ASP 76 1.566 13.389 -6.444 561 HA ASP 76 HA ASP 76 3.980 14.501 -7.774 562 1HB ASP 76 HB2 ASP 76 3.726 12.034 -7.580 563 2HB ASP 76 HB3 ASP 76 2.224 12.124 -8.508 564 H LEU 77 H LEU 77 0.448 14.244 -8.057 565 HA LEU 77 HA LEU 77 0.457 16.271 -10.202 566 1HB LEU 77 HB2 LEU 77 0.383 14.209 -11.375 567 2HB LEU 77 HB3 LEU 77 -0.810 13.528 -10.252 568 HG LEU 77 HG LEU 77 -2.488 15.223 -11.129 569 1HD1 LEU 77 HD11 LEU 77 -0.397 15.596 -13.320 570 2HD1 LEU 77 HD12 LEU 77 -2.030 16.257 -13.315 571 3HD1 LEU 77 HD13 LEU 77 -0.862 16.844 -12.135 572 1HD2 LEU 77 HD21 LEU 77 -1.298 13.253 -13.117 573 2HD2 LEU 77 HD22 LEU 77 -2.475 12.880 -11.850 574 3HD2 LEU 77 HD23 LEU 77 -2.933 13.948 -13.184 575 H VAL 78 H VAL 78 -1.154 17.630 -10.089 576 HA VAL 78 HA VAL 78 -3.462 17.162 -8.263 577 HB VAL 78 HB VAL 78 -1.758 19.631 -8.707 578 1HG1 VAL 78 HG11 VAL 78 -3.431 20.988 -7.481 579 2HG1 VAL 78 HG12 VAL 78 -4.056 20.451 -9.043 580 3HG1 VAL 78 HG13 VAL 78 -4.587 19.636 -7.550 581 1HG2 VAL 78 HG21 VAL 78 -1.669 19.720 -6.309 582 2HG2 VAL 78 HG22 VAL 78 -2.931 18.465 -6.138 583 3HG2 VAL 78 HG23 VAL 78 -1.336 18.040 -6.766 584 H VAL 79 H VAL 79 -5.386 17.372 -9.317 585 HA VAL 79 HA VAL 79 -5.397 18.458 -12.073 586 HB VAL 79 HB VAL 79 -7.186 16.489 -12.408 587 1HG1 VAL 79 HG11 VAL 79 -5.392 15.277 -13.641 588 2HG1 VAL 79 HG12 VAL 79 -5.545 17.005 -13.971 589 3HG1 VAL 79 HG13 VAL 79 -4.221 16.415 -12.933 590 1HG2 VAL 79 HG21 VAL 79 -6.572 15.377 -10.180 591 2HG2 VAL 79 HG22 VAL 79 -6.306 14.348 -11.604 592 3HG2 VAL 79 HG23 VAL 79 -4.935 15.126 -10.813 593 H THR 80 H THR 80 -6.608 20.193 -11.905 594 HA THR 80 HA THR 80 -8.752 20.263 -9.911 595 HB THR 80 HB THR 80 -9.117 22.541 -10.587 596 HG1 THR 80 HG1 THR 80 -8.788 22.805 -12.661 597 1HG2 THR 80 HG21 THR 80 -6.841 23.487 -10.176 598 2HG2 THR 80 HG22 THR 80 -7.274 22.194 -9.038 599 3HG2 THR 80 HG23 THR 80 -6.129 21.898 -10.360 600 H LEU 81 H LEU 81 -10.968 20.250 -10.527 601 HA LEU 81 HA LEU 81 -11.448 18.988 -13.198 602 1HB LEU 81 HB2 LEU 81 -12.957 18.593 -10.609 603 2HB LEU 81 HB3 LEU 81 -13.272 17.774 -12.128 604 HG LEU 81 HG LEU 81 -10.677 17.511 -10.526 605 1HD1 LEU 81 HD11 LEU 81 -12.555 16.561 -9.324 606 2HD1 LEU 81 HD12 LEU 81 -13.052 15.631 -10.766 607 3HD1 LEU 81 HD13 LEU 81 -11.515 15.277 -9.951 608 1HD2 LEU 81 HD21 LEU 81 -11.702 16.094 -13.022 609 2HD2 LEU 81 HD22 LEU 81 -10.231 17.083 -12.867 610 3HD2 LEU 81 HD23 LEU 81 -10.336 15.521 -12.057 611 H CYS 82 H CYS 82 -11.804 21.971 -11.874 612 HA CYS 82 HA CYS 82 -13.689 22.589 -13.896 613 1HB CYS 82 HB2 CYS 82 -15.358 23.744 -12.540 614 2HB CYS 82 HB3 CYS 82 -15.315 22.002 -12.230 615 HG CYS 82 HG CYS 82 -15.753 23.554 -10.016 616 H GLY 83 H GLY 83 -13.475 24.828 -14.482 617 1HA GLY 83 HA1 GLY 83 -10.804 25.618 -14.348 618 2HA GLY 83 HA2 GLY 83 -12.141 26.615 -14.940 619 H ASP 84 H ASP 84 -13.626 27.055 -12.618 620 HA ASP 84 HA ASP 84 -12.225 29.252 -11.528 621 1HB ASP 84 HB2 ASP 84 -14.683 29.080 -11.623 622 2HB ASP 84 HB3 ASP 84 -14.650 27.792 -10.413 623 H ALA 85 H ALA 85 -12.465 25.899 -10.384 624 HA ALA 85 HA ALA 85 -11.676 26.385 -7.694 625 1HB ALA 85 HB1 ALA 85 -11.250 23.980 -7.613 626 2HB ALA 85 HB2 ALA 85 -12.758 24.298 -8.456 627 3HB ALA 85 HB3 ALA 85 -11.299 23.869 -9.383 628 H ALA 86 H ALA 86 -9.783 26.179 -10.668 629 HA ALA 86 HA ALA 86 -7.336 25.359 -9.474 630 1HB ALA 86 HB1 ALA 86 -7.881 25.230 -11.908 631 2HB ALA 86 HB2 ALA 86 -7.782 27.008 -11.994 632 3HB ALA 86 HB3 ALA 86 -6.335 26.055 -11.596 633 H ASP 87 H ASP 87 -8.946 28.415 -9.362 634 HA ASP 87 HA ASP 87 -6.736 30.136 -8.822 635 1HB ASP 87 HB2 ASP 87 -9.070 30.894 -9.303 636 2HB ASP 87 HB3 ASP 87 -9.586 30.187 -7.759 637 H LYS 88 H LYS 88 -8.572 27.820 -6.864 638 HA LYS 88 HA LYS 88 -7.808 28.976 -4.310 639 1HB LYS 88 HB2 LYS 88 -9.908 27.710 -4.624 640 2HB LYS 88 HB3 LYS 88 -8.981 26.263 -5.051 641 1HG LYS 88 HG2 LYS 88 -9.827 26.056 -2.840 642 2HG LYS 88 HG3 LYS 88 -8.074 26.127 -2.791 643 1HD LYS 88 HD2 LYS 88 -8.151 28.464 -2.014 644 2HD LYS 88 HD3 LYS 88 -9.923 28.494 -2.217 645 1HE LYS 88 HE2 LYS 88 -10.148 26.660 -0.585 646 2HE LYS 88 HE3 LYS 88 -8.393 26.592 -0.388 647 1HZ LYS 88 HZ1 LYS 88 -10.095 28.918 0.332 648 2HZ LYS 88 HZ2 LYS 88 -9.431 27.871 1.388 649 3HZ LYS 88 HZ3 LYS 88 -8.472 28.854 0.513 650 H CYS 89 H CYS 89 -6.560 26.363 -6.336 651 HA CYS 89 HA CYS 89 -5.236 24.775 -4.631 652 1HB CYS 89 HB2 CYS 89 -4.244 25.702 -7.334 653 2HB CYS 89 HB3 CYS 89 -3.674 24.253 -6.476 654 HG CYS 89 HG CYS 89 -5.316 23.512 -8.348 655 HA PRO 90 HA PRO 90 -2.199 27.731 -2.960 656 1HB PRO 90 HB2 PRO 90 -1.712 26.557 -0.572 657 2HB PRO 90 HB3 PRO 90 -3.267 27.343 -0.963 658 1HG PRO 90 HG2 PRO 90 -2.605 24.402 -1.069 659 2HG PRO 90 HG3 PRO 90 -4.036 25.189 -0.320 660 1HD PRO 90 HD2 PRO 90 -4.047 24.115 -2.866 661 2HD PRO 90 HD3 PRO 90 -5.079 25.479 -2.361 662 H MET 91 H MET 91 -0.004 26.545 -1.452 663 HA MET 91 HA MET 91 1.939 26.466 -3.309 664 1HB MET 91 HB2 MET 91 1.920 24.959 -0.659 665 2HB MET 91 HB3 MET 91 3.349 25.284 -1.638 666 1HG MET 91 HG2 MET 91 3.373 26.928 0.017 667 2HG MET 91 HG3 MET 91 2.847 27.753 -1.446 668 1HE MET 91 HE1 MET 91 1.068 29.772 1.398 669 2HE MET 91 HE2 MET 91 2.686 29.038 1.437 670 3HE MET 91 HE3 MET 91 2.113 29.851 -0.038 671 H THR 92 H THR 92 2.108 25.297 -5.094 672 HA THR 92 HA THR 92 2.108 22.336 -4.947 673 HB THR 92 HB THR 92 1.034 22.513 -7.336 674 HG1 THR 92 HG1 THR 92 -0.003 24.821 -6.005 675 1HG2 THR 92 HG21 THR 92 -1.156 22.228 -6.410 676 2HG2 THR 92 HG22 THR 92 0.034 21.420 -5.368 677 3HG2 THR 92 HG23 THR 92 -0.640 22.980 -4.887 678 HA PRO 93 HA PRO 93 6.002 24.348 -6.492 679 1HB PRO 93 HB2 PRO 93 7.785 22.693 -5.184 680 2HB PRO 93 HB3 PRO 93 7.007 24.111 -4.422 681 1HG PRO 93 HG2 PRO 93 6.152 21.204 -4.269 682 2HG PRO 93 HG3 PRO 93 6.362 22.367 -2.920 683 1HD PRO 93 HD2 PRO 93 3.932 21.871 -3.990 684 2HD PRO 93 HD3 PRO 93 4.386 23.527 -3.491 685 HA PRO 94 HA PRO 94 6.763 21.922 -9.975 686 1HB PRO 94 HB2 PRO 94 9.626 21.430 -9.130 687 2HB PRO 94 HB3 PRO 94 9.000 21.886 -10.750 688 1HG PRO 94 HG2 PRO 94 10.018 23.796 -9.134 689 2HG PRO 94 HG3 PRO 94 8.474 24.104 -9.997 690 1HD PRO 94 HD2 PRO 94 8.899 23.312 -7.118 691 2HD PRO 94 HD3 PRO 94 7.746 24.489 -7.813 692 H HIS 95 H HIS 95 7.767 20.123 -7.068 693 HA HIS 95 HA HIS 95 7.936 17.501 -8.168 694 1HB HIS 95 HB2 HIS 95 8.464 18.088 -5.818 695 2HB HIS 95 HB3 HIS 95 6.767 18.460 -5.513 696 HD1 HIS 95 HD1 HIS 95 5.043 16.153 -5.746 697 HD2 HIS 95 HD2 HIS 95 9.223 15.627 -5.426 698 HE1 HIS 95 HE1 HIS 95 5.411 13.757 -5.034 699 H VAL 96 H VAL 96 5.198 19.583 -7.331 700 HA VAL 96 HA VAL 96 3.169 17.580 -7.980 701 HB VAL 96 HB VAL 96 2.668 20.482 -7.162 702 1HG1 VAL 96 HG11 VAL 96 0.653 19.414 -6.194 703 2HG1 VAL 96 HG12 VAL 96 0.785 19.166 -7.944 704 3HG1 VAL 96 HG13 VAL 96 1.196 17.851 -6.824 705 1HG2 VAL 96 HG21 VAL 96 3.254 18.310 -5.145 706 2HG2 VAL 96 HG22 VAL 96 4.211 19.773 -5.435 707 3HG2 VAL 96 HG23 VAL 96 2.561 19.902 -4.833 708 H LYS 97 H LYS 97 3.141 17.324 -10.237 709 HA LYS 97 HA LYS 97 3.239 19.720 -11.939 710 1HB LYS 97 HB2 LYS 97 3.072 18.303 -13.791 711 2HB LYS 97 HB3 LYS 97 4.163 17.528 -12.657 712 1HG LYS 97 HG2 LYS 97 1.729 16.324 -12.046 713 2HG LYS 97 HG3 LYS 97 1.585 16.626 -13.784 714 1HD LYS 97 HD2 LYS 97 3.905 15.560 -14.039 715 2HD LYS 97 HD3 LYS 97 3.815 15.145 -12.317 716 1HE LYS 97 HE2 LYS 97 1.579 13.968 -12.922 717 2HE LYS 97 HE3 LYS 97 2.083 14.148 -14.611 718 1HZ LYS 97 HZ1 LYS 97 2.798 12.013 -13.770 719 2HZ LYS 97 HZ2 LYS 97 4.151 12.915 -13.927 720 3HZ LYS 97 HZ3 LYS 97 3.470 12.669 -12.440 721 H ARG 98 H ARG 98 1.312 20.214 -13.304 722 HA ARG 98 HA ARG 98 -1.239 19.739 -11.853 723 1HB ARG 98 HB2 ARG 98 -0.025 22.417 -12.624 724 2HB ARG 98 HB3 ARG 98 -1.761 22.193 -12.372 725 1HG ARG 98 HG2 ARG 98 -1.396 21.408 -10.082 726 2HG ARG 98 HG3 ARG 98 0.357 21.516 -10.288 727 1HD ARG 98 HD2 ARG 98 -0.416 23.394 -9.024 728 2HD ARG 98 HD3 ARG 98 0.180 23.968 -10.584 729 HE ARG 98 HE ARG 98 -2.418 23.777 -11.163 730 1HH1 ARG 98 HH21 ARG 98 -0.968 25.112 -8.180 731 2HH1 ARG 98 HH22 ARG 98 -2.136 26.375 -8.041 732 1HH2 ARG 98 HH11 ARG 98 -3.981 25.291 -10.916 733 2HH2 ARG 98 HH12 ARG 98 -4.025 26.413 -9.588 734 H GLU 99 H GLU 99 -3.049 19.781 -13.059 735 HA GLU 99 HA GLU 99 -3.001 20.367 -15.931 736 1HB GLU 99 HB2 GLU 99 -3.174 17.665 -14.718 737 2HB GLU 99 HB3 GLU 99 -4.626 18.073 -15.632 738 1HG GLU 99 HG2 GLU 99 -1.817 18.187 -16.771 739 2HG GLU 99 HG3 GLU 99 -2.921 16.806 -16.893 740 H HIS 100 H HIS 100 -5.194 21.048 -16.531 741 HA HIS 100 HA HIS 100 -6.991 21.510 -14.205 742 1HB HIS 100 HB2 HIS 100 -6.191 23.597 -16.264 743 2HB HIS 100 HB3 HIS 100 -7.305 23.813 -14.920 744 HD1 HIS 100 HD1 HIS 100 -4.247 25.200 -15.606 745 HD2 HIS 100 HD2 HIS 100 -5.525 22.681 -12.495 746 HE1 HIS 100 HE1 HIS 100 -2.661 25.602 -13.661 747 H TRP 101 H TRP 101 -8.756 20.383 -14.682 748 HA TRP 101 HA TRP 101 -9.728 20.235 -17.488 749 1HB TRP 101 HB2 TRP 101 -10.400 18.449 -15.133 750 2HB TRP 101 HB3 TRP 101 -10.858 18.228 -16.813 751 HD1 TRP 101 HD1 TRP 101 -7.534 19.057 -17.460 752 HE1 TRP 101 HE1 TRP 101 -5.901 17.168 -17.514 753 HE3 TRP 101 HE3 TRP 101 -10.342 15.611 -14.940 754 HZ2 TRP 101 HZ2 TRP 101 -5.693 14.503 -16.355 755 HZ3 TRP 101 HZ3 TRP 101 -9.361 13.425 -14.345 756 HH2 TRP 101 HH2 TRP 101 -7.037 12.846 -15.043 757 H GLY 102 H GLY 102 -12.274 20.078 -17.492 758 1HA GLY 102 HA1 GLY 102 -13.327 22.323 -15.810 759 2HA GLY 102 HA2 GLY 102 -13.337 22.397 -17.547 760 H PHE 103 H PHE 103 -15.002 21.172 -14.733 761 HA PHE 103 HA PHE 103 -17.199 20.323 -16.502 762 1HB PHE 103 HB2 PHE 103 -16.200 18.844 -14.036 763 2HB PHE 103 HB3 PHE 103 -17.657 18.446 -14.934 764 HD1 PHE 103 HD1 PHE 103 -17.510 17.603 -17.296 765 HD2 PHE 103 HD2 PHE 103 -13.990 18.177 -14.870 766 HE1 PHE 103 HE1 PHE 103 -16.178 16.292 -18.909 767 HE2 PHE 103 HE2 PHE 103 -12.653 16.884 -16.503 768 HZ PHE 103 HZ PHE 103 -13.740 15.924 -18.524 769 H ASP 104 H ASP 104 -19.233 20.788 -15.864 770 HA ASP 104 HA ASP 104 -19.690 22.764 -13.780 771 1HB ASP 104 HB2 ASP 104 -21.008 22.564 -15.918 772 2HB ASP 104 HB3 ASP 104 -21.661 21.036 -15.317 773 H ASP 105 H ASP 105 -21.493 22.183 -12.094 774 HA ASP 105 HA ASP 105 -20.718 19.784 -10.569 775 1HB ASP 105 HB2 ASP 105 -21.263 21.901 -9.453 776 2HB ASP 105 HB3 ASP 105 -22.903 21.833 -10.105 777 HA PRO 106 HA PRO 106 -23.657 17.731 -13.272 778 1HB PRO 106 HB2 PRO 106 -23.489 15.139 -12.313 779 2HB PRO 106 HB3 PRO 106 -22.276 15.891 -13.389 780 1HG PRO 106 HG2 PRO 106 -22.209 15.646 -10.369 781 2HG PRO 106 HG3 PRO 106 -20.897 15.287 -11.540 782 1HD PRO 106 HD2 PRO 106 -21.019 17.646 -10.197 783 2HD PRO 106 HD3 PRO 106 -20.475 17.579 -11.901 784 H ALA 107 H ALA 107 -23.853 17.533 -9.700 785 HA ALA 107 HA ALA 107 -26.453 16.332 -9.654 786 1HB ALA 107 HB1 ALA 107 -24.908 16.191 -7.762 787 2HB ALA 107 HB2 ALA 107 -24.983 17.953 -7.536 788 3HB ALA 107 HB3 ALA 107 -26.432 16.958 -7.268 789 H ARG 108 H ARG 108 -25.438 19.532 -10.433 790 HA ARG 108 HA ARG 108 -28.218 20.568 -10.101 791 1HB ARG 108 HB2 ARG 108 -25.561 22.061 -9.850 792 2HB ARG 108 HB3 ARG 108 -27.154 22.820 -9.918 793 1HG ARG 108 HG2 ARG 108 -26.984 22.706 -7.666 794 2HG ARG 108 HG3 ARG 108 -27.744 21.142 -7.978 795 1HD ARG 108 HD2 ARG 108 -25.314 20.198 -8.001 796 2HD ARG 108 HD3 ARG 108 -24.859 21.757 -7.296 797 HE ARG 108 HE ARG 108 -27.058 20.631 -5.858 798 1HH1 ARG 108 HH11 ARG 108 -23.536 20.221 -6.250 799 2HH1 ARG 108 HH12 ARG 108 -23.326 19.509 -4.686 800 1HH2 ARG 108 HH21 ARG 108 -26.766 19.649 -3.810 801 2HH2 ARG 108 HH22 ARG 108 -25.207 19.149 -3.285 802 H ALA 109 H ALA 109 -26.724 19.095 -12.377 803 HA ALA 109 HA ALA 109 -26.494 20.856 -14.526 804 1HB ALA 109 HB1 ALA 109 -27.476 17.970 -14.532 805 2HB ALA 109 HB2 ALA 109 -26.882 18.859 -15.953 806 3HB ALA 109 HB3 ALA 109 -25.788 18.514 -14.598 807 H GLN 110 H GLN 110 -29.415 19.509 -13.104 808 HA GLN 110 HA GLN 110 -31.624 19.943 -13.320 809 1HB GLN 110 HB2 GLN 110 -30.482 22.640 -14.093 810 2HB GLN 110 HB3 GLN 110 -32.197 22.379 -13.788 811 1HG GLN 110 HG2 GLN 110 -31.876 21.808 -11.518 812 2HG GLN 110 HG3 GLN 110 -30.137 21.616 -11.701 813 1HE2 GLN 110 HE22 GLN 110 -28.796 23.499 -12.050 814 2HE2 GLN 110 HE21 GLN 110 -29.346 25.091 -11.542 815 H GLY 111 H GLY 111 -33.078 21.566 -15.188 816 1HA GLY 111 HA1 GLY 111 -33.736 21.628 -17.459 817 2HA GLY 111 HA2 GLY 111 -32.723 20.216 -17.804 818 H THR 112 H THR 112 -33.312 18.180 -16.546 819 HA THR 112 HA THR 112 -35.826 17.925 -15.261 820 HB THR 112 HB THR 112 -36.804 17.893 -17.455 821 HG1 THR 112 HG1 THR 112 -37.843 16.007 -17.295 822 1HG2 THR 112 HG21 THR 112 -34.937 17.350 -18.909 823 2HG2 THR 112 HG22 THR 112 -34.822 15.719 -18.210 824 3HG2 THR 112 HG23 THR 112 -36.240 16.188 -19.165 825 H GLU 113 H GLU 113 -35.990 15.532 -14.491 826 HA GLU 113 HA GLU 113 -33.505 14.970 -13.240 827 1HB GLU 113 HB2 GLU 113 -35.626 14.355 -12.235 828 2HB GLU 113 HB3 GLU 113 -36.001 13.258 -13.574 829 1HG GLU 113 HG2 GLU 113 -34.142 11.799 -12.985 830 2HG GLU 113 HG3 GLU 113 -33.572 12.938 -11.759 831 H GLU 114 H GLU 114 -35.055 13.526 -16.096 832 HA GLU 114 HA GLU 114 -33.043 11.518 -16.431 833 1HB GLU 114 HB2 GLU 114 -34.031 11.111 -18.625 834 2HB GLU 114 HB3 GLU 114 -35.251 11.194 -17.358 835 1HG GLU 114 HG2 GLU 114 -35.833 13.504 -18.056 836 2HG GLU 114 HG3 GLU 114 -34.606 13.435 -19.325 837 H GLU 115 H GLU 115 -33.236 14.897 -17.430 838 HA GLU 115 HA GLU 115 -31.051 14.682 -19.307 839 1HB GLU 115 HB2 GLU 115 -32.764 16.315 -19.686 840 2HB GLU 115 HB3 GLU 115 -32.475 17.084 -18.117 841 1HG GLU 115 HG2 GLU 115 -30.428 17.995 -18.777 842 2HG GLU 115 HG3 GLU 115 -30.216 16.853 -20.112 843 H LYS 116 H LYS 116 -31.523 15.659 -15.905 844 HA LYS 116 HA LYS 116 -28.863 16.423 -15.345 845 1HB LYS 116 HB2 LYS 116 -30.707 17.011 -13.904 846 2HB LYS 116 HB3 LYS 116 -31.152 15.319 -13.671 847 1HG LYS 116 HG2 LYS 116 -29.099 14.875 -12.488 848 2HG LYS 116 HG3 LYS 116 -28.550 16.554 -12.695 849 1HD LYS 116 HD2 LYS 116 -31.022 15.616 -11.181 850 2HD LYS 116 HD3 LYS 116 -29.449 16.006 -10.453 851 1HE LYS 116 HE2 LYS 116 -29.745 18.349 -11.488 852 2HE LYS 116 HE3 LYS 116 -31.442 17.890 -11.754 853 1HZ LYS 116 HZ1 LYS 116 -29.997 18.064 -9.171 854 2HZ LYS 116 HZ2 LYS 116 -31.240 19.012 -9.650 855 3HZ LYS 116 HZ3 LYS 116 -31.519 17.444 -9.303 856 H TRP 117 H TRP 117 -30.497 13.238 -15.020 857 HA TRP 117 HA TRP 117 -28.160 11.801 -14.257 858 1HB TRP 117 HB2 TRP 117 -30.388 10.832 -14.039 859 2HB TRP 117 HB3 TRP 117 -30.620 10.868 -15.786 860 HD1 TRP 117 HD1 TRP 117 -29.310 9.064 -17.248 861 HE1 TRP 117 HE1 TRP 117 -28.228 6.805 -16.699 862 HE3 TRP 117 HE3 TRP 117 -28.848 9.598 -12.184 863 HZ2 TRP 117 HZ2 TRP 117 -26.948 5.592 -14.453 864 HZ3 TRP 117 HZ3 TRP 117 -27.463 7.991 -10.904 865 HH2 TRP 117 HH2 TRP 117 -26.473 6.003 -12.033 866 H ALA 118 H ALA 118 -29.506 12.500 -17.539 867 HA ALA 118 HA ALA 118 -27.613 11.038 -19.009 868 1HB ALA 118 HB1 ALA 118 -29.670 11.985 -19.974 869 2HB ALA 118 HB2 ALA 118 -29.034 13.630 -19.759 870 3HB ALA 118 HB3 ALA 118 -28.248 12.521 -20.887 871 H PHE 119 H PHE 119 -27.402 14.364 -17.670 872 HA PHE 119 HA PHE 119 -24.828 14.902 -18.766 873 1HB PHE 119 HB2 PHE 119 -26.457 16.608 -17.942 874 2HB PHE 119 HB3 PHE 119 -26.110 16.106 -16.292 875 HD1 PHE 119 HD1 PHE 119 -24.119 16.854 -15.170 876 HD2 PHE 119 HD2 PHE 119 -24.633 17.625 -19.374 877 HE1 PHE 119 HE1 PHE 119 -22.249 18.505 -15.089 878 HE2 PHE 119 HE2 PHE 119 -22.718 19.203 -19.317 879 HZ PHE 119 HZ PHE 119 -21.525 19.644 -17.185 880 H PHE 120 H PHE 120 -25.842 13.320 -15.643 881 HA PHE 120 HA PHE 120 -23.252 13.052 -14.511 882 1HB PHE 120 HB2 PHE 120 -25.277 10.801 -14.533 883 2HB PHE 120 HB3 PHE 120 -23.924 11.018 -13.469 884 HD1 PHE 120 HD1 PHE 120 -26.139 10.205 -12.211 885 HD2 PHE 120 HD2 PHE 120 -25.296 14.259 -13.435 886 HE1 PHE 120 HE1 PHE 120 -27.751 11.053 -10.528 887 HE2 PHE 120 HE2 PHE 120 -26.860 15.080 -11.726 888 HZ PHE 120 HZ PHE 120 -28.148 13.500 -10.315 889 H GLN 121 H GLN 121 -24.962 11.074 -17.033 890 HA GLN 121 HA GLN 121 -22.897 9.182 -17.344 891 1HB GLN 121 HB2 GLN 121 -24.745 10.044 -19.589 892 2HB GLN 121 HB3 GLN 121 -23.860 8.537 -19.433 893 1HG GLN 121 HG2 GLN 121 -26.296 9.433 -17.887 894 2HG GLN 121 HG3 GLN 121 -26.108 8.031 -18.909 895 1HE2 GLN 121 HE22 GLN 121 -25.859 9.214 -15.664 896 2HE2 GLN 121 HE21 GLN 121 -25.198 7.755 -14.954 897 H ARG 122 H ARG 122 -23.302 12.333 -18.978 898 HA ARG 122 HA ARG 122 -21.040 12.001 -20.720 899 1HB ARG 122 HB2 ARG 122 -22.542 14.466 -19.747 900 2HB ARG 122 HB3 ARG 122 -21.015 14.621 -20.602 901 1HG ARG 122 HG2 ARG 122 -22.682 14.857 -22.246 902 2HG ARG 122 HG3 ARG 122 -21.927 13.275 -22.497 903 1HD ARG 122 HD2 ARG 122 -23.831 12.235 -21.236 904 2HD ARG 122 HD3 ARG 122 -24.591 13.839 -21.123 905 HE ARG 122 HE ARG 122 -24.196 13.493 -23.815 906 1HH1 ARG 122 HH11 ARG 122 -25.783 11.621 -21.268 907 2HH1 ARG 122 HH12 ARG 122 -26.856 10.773 -22.340 908 1HH2 ARG 122 HH21 ARG 122 -25.679 12.437 -25.255 909 2HH2 ARG 122 HH22 ARG 122 -26.828 11.306 -24.656 910 H VAL 123 H VAL 123 -21.357 13.638 -17.507 911 HA VAL 123 HA VAL 123 -18.629 14.382 -17.463 912 HB VAL 123 HB VAL 123 -20.635 13.979 -15.194 913 1HG1 VAL 123 HG11 VAL 123 -19.135 15.414 -13.814 914 2HG1 VAL 123 HG12 VAL 123 -18.383 13.866 -14.201 915 3HG1 VAL 123 HG13 VAL 123 -17.895 15.328 -15.086 916 1HG2 VAL 123 HG21 VAL 123 -20.733 16.463 -15.250 917 2HG2 VAL 123 HG22 VAL 123 -19.598 16.485 -16.612 918 3HG2 VAL 123 HG23 VAL 123 -21.213 15.785 -16.806 919 H ARG 124 H ARG 124 -20.184 11.365 -16.071 920 HA ARG 124 HA ARG 124 -17.692 10.500 -15.035 921 1HB ARG 124 HB2 ARG 124 -18.669 8.320 -14.722 922 2HB ARG 124 HB3 ARG 124 -19.896 9.523 -14.343 923 1HG ARG 124 HG2 ARG 124 -20.950 9.130 -16.531 924 2HG ARG 124 HG3 ARG 124 -19.710 7.948 -16.946 925 1HD ARG 124 HD2 ARG 124 -20.416 6.570 -14.979 926 2HD ARG 124 HD3 ARG 124 -21.707 7.726 -14.674 927 HE ARG 124 HE ARG 124 -22.969 6.726 -16.262 928 1HH1 ARG 124 HH21 ARG 124 -19.621 5.840 -17.151 929 2HH1 ARG 124 HH22 ARG 124 -20.133 4.824 -18.446 930 1HH2 ARG 124 HH11 ARG 124 -23.583 5.482 -17.938 931 2HH2 ARG 124 HH12 ARG 124 -22.446 4.581 -18.902 932 H ASP 125 H ASP 125 -19.150 9.958 -18.250 933 HA ASP 125 HA ASP 125 -17.202 8.135 -19.184 934 1HB ASP 125 HB2 ASP 125 -19.289 8.500 -20.383 935 2HB ASP 125 HB3 ASP 125 -18.852 10.178 -20.718 936 H GLU 126 H GLU 126 -17.284 11.751 -19.353 937 HA GLU 126 HA GLU 126 -14.810 11.958 -20.708 938 1HB GLU 126 HB2 GLU 126 -16.469 13.930 -19.114 939 2HB GLU 126 HB3 GLU 126 -14.940 14.356 -19.906 940 1HG GLU 126 HG2 GLU 126 -15.838 13.579 -22.086 941 2HG GLU 126 HG3 GLU 126 -17.392 13.240 -21.333 942 H ILE 127 H ILE 127 -15.624 12.056 -17.173 943 HA ILE 127 HA ILE 127 -12.970 12.718 -16.387 944 HB ILE 127 HB ILE 127 -15.431 12.390 -15.090 945 1HG1 ILE 127 HG12 ILE 127 -14.195 12.981 -12.987 946 2HG1 ILE 127 HG13 ILE 127 -12.685 12.887 -13.911 947 1HG2 ILE 127 HG21 ILE 127 -15.159 10.944 -13.217 948 2HG2 ILE 127 HG22 ILE 127 -15.176 10.068 -14.745 949 3HG2 ILE 127 HG23 ILE 127 -13.630 10.320 -13.885 950 1HD1 ILE 127 HD11 ILE 127 -15.102 14.626 -14.627 951 2HD1 ILE 127 HD12 ILE 127 -13.690 15.206 -13.725 952 3HD1 ILE 127 HD13 ILE 127 -13.504 14.663 -15.410 953 H GLY 128 H GLY 128 -14.596 9.550 -16.882 954 1HA GLY 128 HA1 GLY 128 -12.399 7.938 -16.083 955 2HA GLY 128 HA2 GLY 128 -13.748 7.452 -17.140 956 H ASN 129 H ASN 129 -13.455 9.161 -19.299 957 HA ASN 129 HA ASN 129 -11.378 8.076 -20.859 958 1HB ASN 129 HB2 ASN 129 -13.260 8.989 -21.977 959 2HB ASN 129 HB3 ASN 129 -13.114 10.527 -21.128 960 1HD2 ASN 129 HD22 ASN 129 -12.284 12.152 -22.313 961 2HD2 ASN 129 HD21 ASN 129 -10.888 11.967 -23.392 962 H ARG 130 H ARG 130 -11.408 11.257 -19.123 963 HA ARG 130 HA ARG 130 -8.763 11.932 -19.963 964 1HB ARG 130 HB2 ARG 130 -10.623 12.878 -17.792 965 2HB ARG 130 HB3 ARG 130 -8.920 13.285 -17.645 966 1HG ARG 130 HG2 ARG 130 -10.337 15.020 -18.774 967 2HG ARG 130 HG3 ARG 130 -8.866 14.547 -19.629 968 1HD ARG 130 HD2 ARG 130 -10.092 13.248 -21.244 969 2HD ARG 130 HD3 ARG 130 -11.563 13.339 -20.285 970 HE ARG 130 HE ARG 130 -11.997 15.453 -20.943 971 1HH1 ARG 130 HH21 ARG 130 -8.936 14.370 -22.473 972 2HH1 ARG 130 HH22 ARG 130 -8.852 15.742 -23.520 973 1HH2 ARG 130 HH11 ARG 130 -11.854 17.239 -22.388 974 2HH2 ARG 130 HH12 ARG 130 -10.543 17.378 -23.491 975 H LEU 131 H LEU 131 -9.847 9.938 -17.169 976 HA LEU 131 HA LEU 131 -7.132 9.718 -16.160 977 1HB LEU 131 HB2 LEU 131 -9.702 8.256 -15.585 978 2HB LEU 131 HB3 LEU 131 -8.175 7.509 -15.135 979 HG LEU 131 HG LEU 131 -9.017 8.651 -13.278 980 1HD1 LEU 131 HD11 LEU 131 -6.693 10.371 -14.199 981 2HD1 LEU 131 HD12 LEU 131 -7.084 9.832 -12.569 982 3HD1 LEU 131 HD13 LEU 131 -6.521 8.658 -13.756 983 1HD2 LEU 131 HD21 LEU 131 -9.294 11.104 -13.137 984 2HD2 LEU 131 HD22 LEU 131 -9.057 11.206 -14.893 985 3HD2 LEU 131 HD23 LEU 131 -10.442 10.324 -14.214 986 H LYS 132 H LYS 132 -9.071 7.704 -18.399 987 HA LYS 132 HA LYS 132 -7.081 5.763 -18.918 988 1HB LYS 132 HB2 LYS 132 -9.189 5.243 -19.641 989 2HB LYS 132 HB3 LYS 132 -9.529 6.810 -20.316 990 1HG LYS 132 HG2 LYS 132 -7.540 4.934 -21.640 991 2HG LYS 132 HG3 LYS 132 -9.289 4.780 -21.856 992 1HD LYS 132 HD2 LYS 132 -9.113 7.391 -22.452 993 2HD LYS 132 HD3 LYS 132 -7.455 6.940 -22.862 994 1HE LYS 132 HE2 LYS 132 -10.041 5.832 -24.031 995 2HE LYS 132 HE3 LYS 132 -8.852 6.863 -24.830 996 1HZ LYS 132 HZ1 LYS 132 -8.505 4.034 -24.065 997 2HZ LYS 132 HZ2 LYS 132 -8.475 4.672 -25.563 998 3HZ LYS 132 HZ3 LYS 132 -7.243 4.974 -24.515 999 H GLU 133 H GLU 133 -7.649 8.923 -20.535 1000 HA GLU 133 HA GLU 133 -5.416 8.801 -22.299 1001 1HB GLU 133 HB2 GLU 133 -6.692 11.155 -20.853 1002 2HB GLU 133 HB3 GLU 133 -5.420 11.325 -22.065 1003 1HG GLU 133 HG2 GLU 133 -6.801 10.614 -23.833 1004 2HG GLU 133 HG3 GLU 133 -8.033 9.962 -22.757 1005 H PHE 134 H PHE 134 -5.566 10.170 -18.901 1006 HA PHE 134 HA PHE 134 -2.868 10.893 -18.936 1007 1HB PHE 134 HB2 PHE 134 -4.559 11.461 -17.135 1008 2HB PHE 134 HB3 PHE 134 -4.300 9.846 -16.460 1009 HD1 PHE 134 HD1 PHE 134 -1.841 9.172 -15.868 1010 HD2 PHE 134 HD2 PHE 134 -3.047 13.243 -16.666 1011 HE1 PHE 134 HE1 PHE 134 0.414 9.945 -15.280 1012 HE2 PHE 134 HE2 PHE 134 -0.816 14.032 -15.931 1013 HZ PHE 134 HZ PHE 134 0.943 12.389 -15.321 1014 H ALA 135 H ALA 135 -4.327 7.778 -18.068 1015 HA ALA 135 HA ALA 135 -1.938 6.594 -17.122 1016 1HB ALA 135 HB1 ALA 135 -3.225 4.488 -17.201 1017 2HB ALA 135 HB2 ALA 135 -4.269 5.802 -16.611 1018 3HB ALA 135 HB3 ALA 135 -4.422 5.230 -18.283 1019 H GLU 136 H GLU 136 -3.439 6.641 -20.361 1020 HA GLU 136 HA GLU 136 -1.521 4.750 -21.442 1021 1HB GLU 136 HB2 GLU 136 -3.760 6.369 -22.699 1022 2HB GLU 136 HB3 GLU 136 -2.700 5.286 -23.610 1023 1HG GLU 136 HG2 GLU 136 -3.362 3.404 -22.088 1024 2HG GLU 136 HG3 GLU 136 -4.576 4.452 -21.356 1025 H THR 137 H THR 137 -2.032 8.256 -21.576 1026 HA THR 137 HA THR 137 -0.038 8.534 -23.616 1027 HB THR 137 HB THR 137 -0.718 10.839 -23.716 1028 HG1 THR 137 HG1 THR 137 -2.498 10.248 -21.622 1029 1HG2 THR 137 HG21 THR 137 -2.048 9.202 -24.958 1030 2HG2 THR 137 HG22 THR 137 -3.089 8.915 -23.558 1031 3HG2 THR 137 HG23 THR 137 -3.087 10.507 -24.353 1032 H GLY 138 H GLY 138 -0.213 8.880 -20.129 1033 1HA GLY 138 HA1 GLY 138 1.312 9.565 -18.558 1034 2HA GLY 138 HA2 GLY 138 2.603 9.487 -19.779 1035 H LYS 139 H LYS 139 -0.449 11.283 -19.766 1036 HA LYS 139 HA LYS 139 0.167 13.415 -21.214 1037 1HB LYS 139 HB2 LYS 139 -2.053 12.782 -20.313 1038 2HB LYS 139 HB3 LYS 139 -1.626 13.519 -18.764 1039 1HG LYS 139 HG2 LYS 139 -1.413 15.711 -19.808 1040 2HG LYS 139 HG3 LYS 139 -1.703 15.022 -21.415 1041 1HD LYS 139 HD2 LYS 139 -3.693 15.024 -19.102 1042 2HD LYS 139 HD3 LYS 139 -3.683 16.164 -20.454 1043 1HE LYS 139 HE2 LYS 139 -4.042 14.289 -22.052 1044 2HE LYS 139 HE3 LYS 139 -4.104 13.150 -20.705 1045 1HZ LYS 139 HZ1 LYS 139 -6.341 13.850 -21.418 1046 2HZ LYS 139 HZ2 LYS 139 -6.056 14.320 -19.876 1047 3HZ LYS 139 HZ3 LYS 139 -5.982 15.411 -21.096 Start of MODEL 5 1 1H MET 1 H1 MET 1 0.636 1.390 2.091 2 2H MET 1 H2 MET 1 -0.455 0.631 1.141 3 3H MET 1 H3 MET 1 0.672 -0.244 1.957 4 HA MET 1 HA MET 1 2.439 0.757 0.686 5 1HB MET 1 HB2 MET 1 1.465 -1.385 -0.095 6 2HB MET 1 HB3 MET 1 0.283 -0.502 -1.069 7 1HG MET 1 HG2 MET 1 2.168 -1.318 -2.415 8 2HG MET 1 HG3 MET 1 2.069 0.437 -2.453 9 1HE MET 1 HE1 MET 1 5.894 -0.107 -2.845 10 2HE MET 1 HE2 MET 1 4.572 -1.066 -3.548 11 3HE MET 1 HE3 MET 1 4.440 0.706 -3.464 12 H GLU 2 H GLU 2 3.157 2.411 -0.620 13 HA GLU 2 HA GLU 2 1.276 4.183 -2.029 14 1HB GLU 2 HB2 GLU 2 3.235 5.015 0.167 15 2HB GLU 2 HB3 GLU 2 2.601 6.141 -1.035 16 1HG GLU 2 HG2 GLU 2 0.341 5.870 -0.241 17 2HG GLU 2 HG3 GLU 2 0.809 4.560 0.847 18 H ASN 3 H ASN 3 2.547 5.487 -3.603 19 HA ASN 3 HA ASN 3 5.376 4.928 -3.965 20 1HB ASN 3 HB2 ASN 3 4.655 2.928 -5.024 21 2HB ASN 3 HB3 ASN 3 3.375 3.749 -5.895 22 1HD2 ASN 3 HD22 ASN 3 3.854 4.633 -7.911 23 2HD2 ASN 3 HD21 ASN 3 5.475 4.663 -8.602 24 H LYS 4 H LYS 4 2.397 6.180 -5.468 25 HA LYS 4 HA LYS 4 3.669 8.861 -5.702 26 1HB LYS 4 HB2 LYS 4 2.013 7.436 -7.834 27 2HB LYS 4 HB3 LYS 4 2.229 9.185 -7.808 28 1HG LYS 4 HG2 LYS 4 4.662 8.961 -7.977 29 2HG LYS 4 HG3 LYS 4 4.526 7.202 -7.992 30 1HD LYS 4 HD2 LYS 4 3.406 9.094 -10.108 31 2HD LYS 4 HD3 LYS 4 4.862 8.090 -10.240 32 1HE LYS 4 HE2 LYS 4 3.336 6.075 -9.764 33 2HE LYS 4 HE3 LYS 4 1.967 7.161 -10.016 34 1HZ LYS 4 HZ1 LYS 4 4.088 6.745 -12.049 35 2HZ LYS 4 HZ2 LYS 4 2.744 5.831 -11.994 36 3HZ LYS 4 HZ3 LYS 4 2.626 7.456 -12.270 37 H ILE 5 H ILE 5 1.804 10.530 -5.943 38 HA ILE 5 HA ILE 5 -0.699 9.663 -4.619 39 HB ILE 5 HB ILE 5 1.151 11.901 -3.724 40 1HG1 ILE 5 HG12 ILE 5 -0.050 9.591 -2.149 41 2HG1 ILE 5 HG13 ILE 5 1.605 9.671 -2.758 42 1HG2 ILE 5 HG21 ILE 5 -1.754 11.427 -2.915 43 2HG2 ILE 5 HG22 ILE 5 -0.672 12.623 -2.147 44 3HG2 ILE 5 HG23 ILE 5 -1.152 12.821 -3.818 45 1HD1 ILE 5 HD11 ILE 5 1.706 10.255 -0.463 46 2HD1 ILE 5 HD12 ILE 5 1.978 11.746 -1.384 47 3HD1 ILE 5 HD13 ILE 5 0.403 11.440 -0.605 48 H ILE 6 H ILE 6 -2.418 10.573 -5.654 49 HA ILE 6 HA ILE 6 -1.964 12.898 -7.437 50 HB ILE 6 HB ILE 6 -2.159 11.158 -8.963 51 1HG1 ILE 6 HG12 ILE 6 -4.936 12.383 -8.650 52 2HG1 ILE 6 HG13 ILE 6 -3.539 13.127 -9.433 53 1HG2 ILE 6 HG21 ILE 6 -2.916 9.317 -7.517 54 2HG2 ILE 6 HG22 ILE 6 -4.531 10.044 -7.422 55 3HG2 ILE 6 HG23 ILE 6 -3.905 9.404 -8.956 56 1HD1 ILE 6 HD11 ILE 6 -5.127 10.709 -10.364 57 2HD1 ILE 6 HD12 ILE 6 -4.935 12.270 -11.166 58 3HD1 ILE 6 HD13 ILE 6 -3.556 11.156 -11.070 59 H TYR 7 H TYR 7 -3.398 14.557 -6.957 60 HA TYR 7 HA TYR 7 -5.503 14.025 -4.909 61 1HB TYR 7 HB2 TYR 7 -3.356 14.908 -4.014 62 2HB TYR 7 HB3 TYR 7 -3.541 16.339 -5.016 63 HD1 TYR 7 HD1 TYR 7 -5.756 14.366 -2.661 64 HD2 TYR 7 HD2 TYR 7 -4.129 18.201 -3.742 65 HE1 TYR 7 HE1 TYR 7 -6.799 15.363 -0.648 66 HE2 TYR 7 HE2 TYR 7 -5.158 19.205 -1.723 67 HH TYR 7 HH TYR 7 -7.008 17.290 0.663 68 H PHE 8 H PHE 8 -7.411 14.321 -5.951 69 HA PHE 8 HA PHE 8 -7.656 16.166 -8.215 70 1HB PHE 8 HB2 PHE 8 -9.682 14.475 -6.680 71 2HB PHE 8 HB3 PHE 8 -10.093 15.498 -8.049 72 HD1 PHE 8 HD1 PHE 8 -8.942 15.109 -10.288 73 HD2 PHE 8 HD2 PHE 8 -8.789 12.263 -7.053 74 HE1 PHE 8 HE1 PHE 8 -8.164 13.361 -11.869 75 HE2 PHE 8 HE2 PHE 8 -8.018 10.519 -8.648 76 HZ PHE 8 HZ PHE 8 -7.678 11.069 -11.031 77 H LEU 9 H LEU 9 -8.824 18.084 -8.287 78 HA LEU 9 HA LEU 9 -9.770 19.284 -5.756 79 1HB LEU 9 HB2 LEU 9 -7.291 19.733 -6.223 80 2HB LEU 9 HB3 LEU 9 -7.763 20.536 -7.703 81 HG LEU 9 HG LEU 9 -7.197 22.090 -5.924 82 1HD1 LEU 9 HD11 LEU 9 -10.196 22.410 -6.221 83 2HD1 LEU 9 HD12 LEU 9 -8.936 23.643 -6.100 84 3HD1 LEU 9 HD13 LEU 9 -9.069 22.681 -7.574 85 1HD2 LEU 9 HD21 LEU 9 -8.547 22.354 -3.918 86 2HD2 LEU 9 HD22 LEU 9 -9.512 20.930 -4.337 87 3HD2 LEU 9 HD23 LEU 9 -7.787 20.743 -3.986 88 H CYS 10 H CYS 10 -11.743 20.292 -6.188 89 HA CYS 10 HA CYS 10 -12.195 21.476 -8.836 90 1HB CYS 10 HB2 CYS 10 -13.013 18.951 -8.641 91 2HB CYS 10 HB3 CYS 10 -14.374 19.669 -7.767 92 HG CYS 10 HG CYS 10 -14.893 19.249 -10.345 93 H THR 11 H THR 11 -14.599 22.646 -8.693 94 HA THR 11 HA THR 11 -14.358 24.403 -6.443 95 HB THR 11 HB THR 11 -16.578 25.284 -7.380 96 HG1 THR 11 HG1 THR 11 -17.044 24.640 -9.440 97 1HG2 THR 11 HG21 THR 11 -15.407 26.497 -9.078 98 2HG2 THR 11 HG22 THR 11 -14.235 26.173 -7.786 99 3HG2 THR 11 HG23 THR 11 -14.207 25.205 -9.277 100 H GLY 12 H GLY 12 -15.817 21.338 -6.668 101 1HA GLY 12 HA1 GLY 12 -16.561 21.540 -3.910 102 2HA GLY 12 HA2 GLY 12 -17.957 21.210 -4.968 103 H ASN 13 H ASN 13 -15.733 19.713 -3.133 104 HA ASN 13 HA ASN 13 -14.483 17.716 -4.710 105 1HB ASN 13 HB2 ASN 13 -13.976 18.320 -2.336 106 2HB ASN 13 HB3 ASN 13 -15.491 17.606 -1.823 107 1HD2 ASN 13 HD22 ASN 13 -13.011 16.868 -0.799 108 2HD2 ASN 13 HD21 ASN 13 -12.610 15.234 -1.283 109 H SER 14 H SER 14 -17.554 17.754 -2.989 110 HA SER 14 HA SER 14 -18.428 15.358 -2.673 111 1HB SER 14 HB2 SER 14 -20.180 17.542 -3.811 112 2HB SER 14 HB3 SER 14 -20.624 16.328 -2.600 113 HG SER 14 HG SER 14 -20.050 18.578 -1.971 114 H CYS 15 H CYS 15 -18.342 16.666 -5.959 115 HA CYS 15 HA CYS 15 -19.834 14.256 -6.906 116 1HB CYS 15 HB2 CYS 15 -19.821 16.966 -8.286 117 2HB CYS 15 HB3 CYS 15 -20.844 15.567 -8.626 118 HG CYS 15 HG CYS 15 -21.983 17.759 -7.554 119 H ARG 16 H ARG 16 -17.774 16.841 -8.365 120 HA ARG 16 HA ARG 16 -16.940 15.071 -10.448 121 1HB ARG 16 HB2 ARG 16 -16.047 17.825 -9.530 122 2HB ARG 16 HB3 ARG 16 -15.272 17.017 -10.901 123 1HG ARG 16 HG2 ARG 16 -17.201 17.005 -12.222 124 2HG ARG 16 HG3 ARG 16 -18.294 17.216 -10.855 125 1HD ARG 16 HD2 ARG 16 -16.360 19.364 -11.786 126 2HD ARG 16 HD3 ARG 16 -18.029 19.234 -12.334 127 HE ARG 16 HE ARG 16 -18.441 19.239 -9.666 128 1HH1 ARG 16 HH21 ARG 16 -16.780 21.546 -11.800 129 2HH1 ARG 16 HH22 ARG 16 -16.727 22.778 -10.557 130 1HH2 ARG 16 HH11 ARG 16 -18.597 20.873 -8.247 131 2HH2 ARG 16 HH12 ARG 16 -17.810 22.425 -8.535 132 H SER 17 H SER 17 -15.062 16.281 -7.569 133 HA SER 17 HA SER 17 -12.728 14.850 -8.328 134 1HB SER 17 HB2 SER 17 -13.553 15.609 -5.520 135 2HB SER 17 HB3 SER 17 -11.913 15.367 -6.155 136 HG SER 17 HG SER 17 -12.412 17.563 -5.986 137 H GLN 18 H GLN 18 -15.476 13.975 -6.156 138 HA GLN 18 HA GLN 18 -14.500 11.472 -5.336 139 1HB GLN 18 HB2 GLN 18 -17.360 12.440 -5.829 140 2HB GLN 18 HB3 GLN 18 -16.977 10.911 -5.050 141 1HG GLN 18 HG2 GLN 18 -16.149 13.651 -4.024 142 2HG GLN 18 HG3 GLN 18 -17.479 12.693 -3.408 143 1HE2 GLN 18 HE22 GLN 18 -14.563 13.615 -2.484 144 2HE2 GLN 18 HE21 GLN 18 -14.136 12.210 -1.502 145 H MET 19 H MET 19 -16.473 12.173 -8.310 146 HA MET 19 HA MET 19 -16.499 9.396 -9.117 147 1HB MET 19 HB2 MET 19 -16.894 11.936 -10.759 148 2HB MET 19 HB3 MET 19 -17.113 10.284 -11.356 149 1HG MET 19 HG2 MET 19 -18.746 9.972 -9.377 150 2HG MET 19 HG3 MET 19 -18.747 11.722 -9.263 151 1HE MET 19 HE1 MET 19 -18.476 12.301 -12.625 152 2HE MET 19 HE2 MET 19 -20.193 12.687 -12.857 153 3HE MET 19 HE3 MET 19 -19.333 13.285 -11.415 154 H ALA 20 H ALA 20 -14.329 12.182 -9.997 155 HA ALA 20 HA ALA 20 -12.737 10.829 -11.863 156 1HB ALA 20 HB1 ALA 20 -11.046 12.508 -11.391 157 2HB ALA 20 HB2 ALA 20 -12.637 13.289 -11.354 158 3HB ALA 20 HB3 ALA 20 -11.798 12.906 -9.839 159 H GLU 21 H GLU 21 -12.375 10.973 -8.298 160 HA GLU 21 HA GLU 21 -10.023 9.438 -8.117 161 1HB GLU 21 HB2 GLU 21 -10.709 10.707 -6.289 162 2HB GLU 21 HB3 GLU 21 -12.327 9.978 -6.218 163 1HG GLU 21 HG2 GLU 21 -11.330 7.851 -5.510 164 2HG GLU 21 HG3 GLU 21 -9.720 8.560 -5.560 165 H GLY 22 H GLY 22 -13.482 8.384 -8.075 166 1HA GLY 22 HA1 GLY 22 -13.153 5.634 -7.773 167 2HA GLY 22 HA2 GLY 22 -14.433 6.428 -8.703 168 H TRP 23 H TRP 23 -13.118 7.502 -10.947 169 HA TRP 23 HA TRP 23 -12.562 5.061 -12.425 170 1HB TRP 23 HB2 TRP 23 -12.120 7.965 -13.171 171 2HB TRP 23 HB3 TRP 23 -11.880 6.609 -14.259 172 HD1 TRP 23 HD1 TRP 23 -14.530 8.750 -12.707 173 HE1 TRP 23 HE1 TRP 23 -16.752 8.408 -13.847 174 HE3 TRP 23 HE3 TRP 23 -13.379 4.600 -15.502 175 HZ2 TRP 23 HZ2 TRP 23 -17.856 6.733 -15.901 176 HZ3 TRP 23 HZ3 TRP 23 -15.040 3.712 -17.111 177 HH2 TRP 23 HH2 TRP 23 -17.288 4.798 -17.327 178 H ALA 24 H ALA 24 -10.461 7.587 -10.952 179 HA ALA 24 HA ALA 24 -8.162 6.777 -12.345 180 1HB ALA 24 HB1 ALA 24 -8.348 8.088 -9.594 181 2HB ALA 24 HB2 ALA 24 -6.911 8.079 -10.639 182 3HB ALA 24 HB3 ALA 24 -8.373 8.940 -11.145 183 H LYS 25 H LYS 25 -9.515 5.549 -9.288 184 HA LYS 25 HA LYS 25 -7.332 3.890 -8.562 185 1HB LYS 25 HB2 LYS 25 -10.330 3.626 -8.155 186 2HB LYS 25 HB3 LYS 25 -9.179 2.483 -7.447 187 1HG LYS 25 HG2 LYS 25 -8.128 4.159 -6.115 188 2HG LYS 25 HG3 LYS 25 -8.899 5.480 -7.003 189 1HD LYS 25 HD2 LYS 25 -11.119 4.769 -6.189 190 2HD LYS 25 HD3 LYS 25 -10.356 3.468 -5.235 191 1HE LYS 25 HE2 LYS 25 -9.073 5.127 -3.942 192 2HE LYS 25 HE3 LYS 25 -9.653 6.423 -4.996 193 1HZ LYS 25 HZ1 LYS 25 -10.975 6.546 -3.127 194 2HZ LYS 25 HZ2 LYS 25 -11.939 5.827 -4.216 195 3HZ LYS 25 HZ3 LYS 25 -11.238 4.906 -3.029 196 H GLN 26 H GLN 26 -9.766 3.415 -11.080 197 HA GLN 26 HA GLN 26 -9.129 0.585 -11.498 198 1HB GLN 26 HB2 GLN 26 -10.858 2.654 -12.888 199 2HB GLN 26 HB3 GLN 26 -10.443 1.173 -13.712 200 1HG GLN 26 HG2 GLN 26 -12.682 1.388 -12.370 201 2HG GLN 26 HG3 GLN 26 -11.787 -0.128 -12.438 202 1HE2 GLN 26 HE22 GLN 26 -12.036 2.851 -10.292 203 2HE2 GLN 26 HE21 GLN 26 -11.910 1.915 -8.836 204 H TYR 27 H TYR 27 -8.491 3.676 -13.185 205 HA TYR 27 HA TYR 27 -6.966 2.368 -15.249 206 1HB TYR 27 HB2 TYR 27 -7.426 5.277 -14.508 207 2HB TYR 27 HB3 TYR 27 -6.479 4.790 -15.911 208 HD1 TYR 27 HD1 TYR 27 -9.613 5.940 -15.053 209 HD2 TYR 27 HD2 TYR 27 -7.762 2.812 -17.378 210 HE1 TYR 27 HE1 TYR 27 -11.632 5.797 -16.477 211 HE2 TYR 27 HE2 TYR 27 -9.800 2.619 -18.758 212 HH TYR 27 HH TYR 27 -11.954 3.436 -19.158 213 H LEU 28 H LEU 28 -5.974 4.131 -12.293 214 HA LEU 28 HA LEU 28 -3.207 4.305 -13.279 215 1HB LEU 28 HB2 LEU 28 -4.434 5.316 -10.686 216 2HB LEU 28 HB3 LEU 28 -2.864 5.714 -11.338 217 HG LEU 28 HG LEU 28 -5.537 6.565 -12.469 218 1HD1 LEU 28 HD11 LEU 28 -4.629 7.787 -10.491 219 2HD1 LEU 28 HD12 LEU 28 -3.167 8.166 -11.421 220 3HD1 LEU 28 HD13 LEU 28 -4.741 8.800 -11.947 221 1HD2 LEU 28 HD21 LEU 28 -4.084 6.072 -14.384 222 2HD2 LEU 28 HD22 LEU 28 -4.307 7.803 -14.178 223 3HD2 LEU 28 HD23 LEU 28 -2.779 7.043 -13.664 224 H GLY 29 H GLY 29 -5.004 2.646 -10.714 225 1HA GLY 29 HA1 GLY 29 -4.511 0.657 -9.660 226 2HA GLY 29 HA2 GLY 29 -2.993 0.558 -10.555 227 H ASP 30 H ASP 30 -2.620 -0.291 -8.219 228 HA ASP 30 HA ASP 30 -2.487 1.490 -6.033 229 1HB ASP 30 HB2 ASP 30 -2.760 -0.992 -5.940 230 2HB ASP 30 HB3 ASP 30 -1.056 -1.165 -6.382 231 H GLU 31 H GLU 31 -0.401 1.371 -8.643 232 HA GLU 31 HA GLU 31 2.129 2.129 -7.532 233 1HB GLU 31 HB2 GLU 31 1.622 1.304 -9.866 234 2HB GLU 31 HB3 GLU 31 0.757 2.798 -10.184 235 1HG GLU 31 HG2 GLU 31 2.960 4.027 -9.787 236 2HG GLU 31 HG3 GLU 31 3.741 2.448 -9.708 237 H TRP 32 H TRP 32 -0.902 3.656 -7.350 238 HA TRP 32 HA TRP 32 0.326 6.235 -6.587 239 1HB TRP 32 HB2 TRP 32 -2.328 6.004 -8.038 240 2HB TRP 32 HB3 TRP 32 -1.408 7.452 -7.688 241 HD1 TRP 32 HD1 TRP 32 -0.888 4.259 -9.830 242 HE1 TRP 32 HE1 TRP 32 -0.157 4.917 -12.170 243 HE3 TRP 32 HE3 TRP 32 -0.722 9.328 -9.199 244 HZ2 TRP 32 HZ2 TRP 32 0.223 7.326 -13.660 245 HZ3 TRP 32 HZ3 TRP 32 -0.333 10.801 -11.133 246 HH2 TRP 32 HH2 TRP 32 0.142 9.789 -13.411 247 H LYS 33 H LYS 33 -0.995 7.355 -5.027 248 HA LYS 33 HA LYS 33 -3.244 5.816 -3.853 249 1HB LYS 33 HB2 LYS 33 -1.015 6.489 -2.402 250 2HB LYS 33 HB3 LYS 33 -1.910 8.007 -2.289 251 1HG LYS 33 HG2 LYS 33 -2.667 6.852 -0.420 252 2HG LYS 33 HG3 LYS 33 -3.944 6.508 -1.576 253 1HD LYS 33 HD2 LYS 33 -1.663 4.706 -0.676 254 2HD LYS 33 HD3 LYS 33 -3.375 4.516 -0.316 255 1HE LYS 33 HE2 LYS 33 -3.819 4.005 -2.731 256 2HE LYS 33 HE3 LYS 33 -2.102 4.214 -3.073 257 1HZ LYS 33 HZ1 LYS 33 -3.243 2.131 -1.311 258 2HZ LYS 33 HZ2 LYS 33 -2.511 1.880 -2.756 259 3HZ LYS 33 HZ3 LYS 33 -1.635 2.411 -1.491 260 H VAL 34 H VAL 34 -5.158 6.991 -3.588 261 HA VAL 34 HA VAL 34 -5.237 9.420 -5.316 262 HB VAL 34 HB VAL 34 -7.302 7.195 -5.286 263 1HG1 VAL 34 HG11 VAL 34 -6.544 9.053 -7.561 264 2HG1 VAL 34 HG12 VAL 34 -8.004 8.064 -7.364 265 3HG1 VAL 34 HG13 VAL 34 -7.756 9.486 -6.337 266 1HG2 VAL 34 HG21 VAL 34 -6.288 6.251 -7.365 267 2HG2 VAL 34 HG22 VAL 34 -4.845 7.244 -7.088 268 3HG2 VAL 34 HG23 VAL 34 -5.299 5.964 -5.932 269 H TYR 35 H TYR 35 -6.256 11.102 -4.363 270 HA TYR 35 HA TYR 35 -8.528 10.558 -2.588 271 1HB TYR 35 HB2 TYR 35 -6.871 12.756 -1.536 272 2HB TYR 35 HB3 TYR 35 -7.837 11.576 -0.706 273 HD1 TYR 35 HD1 TYR 35 -6.811 9.297 -0.141 274 HD2 TYR 35 HD2 TYR 35 -4.518 12.563 -1.775 275 HE1 TYR 35 HE1 TYR 35 -4.729 8.292 0.764 276 HE2 TYR 35 HE2 TYR 35 -2.467 11.630 -0.814 277 HH TYR 35 HH TYR 35 -1.520 9.887 0.438 278 H SER 36 H SER 36 -9.651 12.684 -2.086 279 HA SER 36 HA SER 36 -9.563 14.558 -4.402 280 1HB SER 36 HB2 SER 36 -11.935 13.192 -3.036 281 2HB SER 36 HB3 SER 36 -12.054 14.452 -4.263 282 HG SER 36 HG SER 36 -11.140 11.808 -4.439 283 H ALA 37 H ALA 37 -9.905 16.666 -3.911 284 HA ALA 37 HA ALA 37 -11.247 17.408 -1.397 285 1HB ALA 37 HB1 ALA 37 -8.891 17.539 -0.936 286 2HB ALA 37 HB2 ALA 37 -8.658 18.638 -2.337 287 3HB ALA 37 HB3 ALA 37 -9.697 19.100 -0.954 288 H GLY 38 H GLY 38 -11.397 20.054 -1.698 289 1HA GLY 38 HA1 GLY 38 -11.721 20.981 -4.372 290 2HA GLY 38 HA2 GLY 38 -13.290 20.632 -3.628 291 H ILE 39 H ILE 39 -12.946 23.130 -4.288 292 HA ILE 39 HA ILE 39 -11.904 24.976 -2.374 293 HB ILE 39 HB ILE 39 -14.162 24.966 -4.384 294 1HG1 ILE 39 HG12 ILE 39 -12.936 26.801 -5.422 295 2HG1 ILE 39 HG13 ILE 39 -11.792 26.831 -4.083 296 1HG2 ILE 39 HG21 ILE 39 -14.666 27.342 -3.961 297 2HG2 ILE 39 HG22 ILE 39 -15.181 26.295 -2.647 298 3HG2 ILE 39 HG23 ILE 39 -13.698 27.271 -2.470 299 1HD1 ILE 39 HD11 ILE 39 -10.908 24.624 -4.780 300 2HD1 ILE 39 HD12 ILE 39 -12.132 24.552 -6.081 301 3HD1 ILE 39 HD13 ILE 39 -10.868 25.778 -6.107 302 H GLU 40 H GLU 40 -14.952 23.120 -2.555 303 HA GLU 40 HA GLU 40 -15.030 23.153 0.379 304 1HB GLU 40 HB2 GLU 40 -17.367 23.724 0.529 305 2HB GLU 40 HB3 GLU 40 -16.480 25.030 -0.244 306 1HG GLU 40 HG2 GLU 40 -17.289 24.293 -2.470 307 2HG GLU 40 HG3 GLU 40 -18.154 22.941 -1.733 308 H ALA 41 H ALA 41 -17.012 21.666 1.003 309 HA ALA 41 HA ALA 41 -17.598 19.444 -0.800 310 1HB ALA 41 HB1 ALA 41 -16.220 19.082 1.909 311 2HB ALA 41 HB2 ALA 41 -16.934 17.789 0.931 312 3HB ALA 41 HB3 ALA 41 -15.523 18.683 0.323 313 H HIS 42 H HIS 42 -19.484 18.344 0.044 314 HA HIS 42 HA HIS 42 -20.756 19.482 2.474 315 1HB HIS 42 HB2 HIS 42 -22.937 19.616 1.341 316 2HB HIS 42 HB3 HIS 42 -21.756 20.755 0.717 317 HD1 HIS 42 HD1 HIS 42 -23.382 17.389 -0.372 318 HD2 HIS 42 HD2 HIS 42 -21.403 20.792 -1.865 319 HE1 HIS 42 HE1 HIS 42 -23.502 17.232 -2.904 320 H GLY 43 H GLY 43 -20.171 16.720 0.347 321 1HA GLY 43 HA1 GLY 43 -20.193 14.911 2.403 322 2HA GLY 43 HA2 GLY 43 -21.855 14.878 1.777 323 H LEU 44 H LEU 44 -20.823 12.577 1.375 324 HA LEU 44 HA LEU 44 -19.448 12.367 -1.234 325 1HB LEU 44 HB2 LEU 44 -19.044 10.655 0.531 326 2HB LEU 44 HB3 LEU 44 -20.775 10.318 0.607 327 HG LEU 44 HG LEU 44 -20.664 9.659 -1.854 328 1HD1 LEU 44 HD11 LEU 44 -18.433 8.986 -2.720 329 2HD1 LEU 44 HD12 LEU 44 -18.574 10.734 -2.511 330 3HD1 LEU 44 HD13 LEU 44 -17.676 9.773 -1.318 331 1HD2 LEU 44 HD21 LEU 44 -20.820 7.962 -0.154 332 2HD2 LEU 44 HD22 LEU 44 -19.599 7.444 -1.334 333 3HD2 LEU 44 HD23 LEU 44 -19.099 8.104 0.230 334 H ASN 45 H ASN 45 -20.836 13.264 -2.845 335 HA ASN 45 HA ASN 45 -23.608 13.537 -2.433 336 1HB ASN 45 HB2 ASN 45 -22.197 14.875 -4.010 337 2HB ASN 45 HB3 ASN 45 -22.226 13.523 -5.145 338 1HD2 ASN 45 HD21 ASN 45 -23.394 16.326 -5.320 339 2HD2 ASN 45 HD22 ASN 45 -25.109 16.101 -5.574 340 HA PRO 46 HA PRO 46 -24.866 9.254 -3.257 341 1HB PRO 46 HB2 PRO 46 -27.505 10.623 -3.799 342 2HB PRO 46 HB3 PRO 46 -27.180 9.129 -2.864 343 1HG PRO 46 HG2 PRO 46 -27.621 11.475 -1.578 344 2HG PRO 46 HG3 PRO 46 -26.307 10.384 -1.026 345 1HD PRO 46 HD2 PRO 46 -26.087 12.857 -2.759 346 2HD PRO 46 HD3 PRO 46 -25.066 12.344 -1.381 347 H ASN 47 H ASN 47 -25.561 11.996 -5.481 348 HA ASN 47 HA ASN 47 -26.221 10.366 -7.738 349 1HB ASN 47 HB2 ASN 47 -26.458 12.271 -8.832 350 2HB ASN 47 HB3 ASN 47 -26.234 13.101 -7.314 351 1HD2 ASN 47 HD22 ASN 47 -25.156 12.854 -10.547 352 2HD2 ASN 47 HD21 ASN 47 -23.604 13.633 -10.359 353 H ALA 48 H ALA 48 -23.095 11.455 -6.391 354 HA ALA 48 HA ALA 48 -21.551 10.506 -8.639 355 1HB ALA 48 HB1 ALA 48 -20.708 12.250 -7.108 356 2HB ALA 48 HB2 ALA 48 -20.694 11.088 -5.761 357 3HB ALA 48 HB3 ALA 48 -19.619 10.851 -7.146 358 H VAL 49 H VAL 49 -22.583 9.172 -5.465 359 HA VAL 49 HA VAL 49 -21.098 6.753 -5.634 360 HB VAL 49 HB VAL 49 -23.780 7.138 -4.256 361 1HG1 VAL 49 HG11 VAL 49 -22.961 5.255 -2.850 362 2HG1 VAL 49 HG12 VAL 49 -23.138 4.765 -4.539 363 3HG1 VAL 49 HG13 VAL 49 -21.525 5.108 -3.888 364 1HG2 VAL 49 HG21 VAL 49 -20.931 7.563 -3.271 365 2HG2 VAL 49 HG22 VAL 49 -22.201 8.792 -3.402 366 3HG2 VAL 49 HG23 VAL 49 -22.368 7.497 -2.220 367 H LYS 50 H LYS 50 -24.543 7.459 -6.635 368 HA LYS 50 HA LYS 50 -24.868 4.820 -7.607 369 1HB LYS 50 HB2 LYS 50 -26.646 6.486 -6.896 370 2HB LYS 50 HB3 LYS 50 -26.422 7.296 -8.457 371 1HG LYS 50 HG2 LYS 50 -26.996 5.146 -9.609 372 2HG LYS 50 HG3 LYS 50 -27.231 4.363 -8.048 373 1HD LYS 50 HD2 LYS 50 -28.724 6.862 -8.904 374 2HD LYS 50 HD3 LYS 50 -29.324 5.247 -9.283 375 1HE LYS 50 HE2 LYS 50 -28.798 6.310 -6.461 376 2HE LYS 50 HE3 LYS 50 -30.369 6.330 -7.260 377 1HZ LYS 50 HZ1 LYS 50 -30.172 4.426 -5.821 378 2HZ LYS 50 HZ2 LYS 50 -30.302 3.912 -7.358 379 3HZ LYS 50 HZ3 LYS 50 -28.853 3.873 -6.597 380 H ALA 51 H ALA 51 -23.919 7.867 -9.309 381 HA ALA 51 HA ALA 51 -23.980 6.831 -11.916 382 1HB ALA 51 HB1 ALA 51 -22.380 8.636 -12.466 383 2HB ALA 51 HB2 ALA 51 -23.664 9.234 -11.404 384 3HB ALA 51 HB3 ALA 51 -22.044 8.880 -10.742 385 H MET 52 H MET 52 -21.249 6.736 -9.510 386 HA MET 52 HA MET 52 -19.529 5.317 -11.350 387 1HB MET 52 HB2 MET 52 -19.445 5.763 -8.350 388 2HB MET 52 HB3 MET 52 -18.161 4.982 -9.281 389 1HG MET 52 HG2 MET 52 -19.135 7.834 -9.578 390 2HG MET 52 HG3 MET 52 -17.599 7.303 -8.910 391 1HE MET 52 HE1 MET 52 -16.962 4.936 -11.231 392 2HE MET 52 HE2 MET 52 -15.783 5.873 -12.136 393 3HE MET 52 HE3 MET 52 -15.787 5.954 -10.367 394 H LYS 53 H LYS 53 -21.751 4.293 -8.697 395 HA LYS 53 HA LYS 53 -20.926 1.599 -8.664 396 1HB LYS 53 HB2 LYS 53 -22.193 2.835 -6.918 397 2HB LYS 53 HB3 LYS 53 -23.635 2.789 -7.943 398 1HG LYS 53 HG2 LYS 53 -23.687 0.342 -7.809 399 2HG LYS 53 HG3 LYS 53 -22.159 0.316 -6.909 400 1HD LYS 53 HD2 LYS 53 -24.680 1.736 -5.952 401 2HD LYS 53 HD3 LYS 53 -24.263 0.067 -5.510 402 1HE LYS 53 HE2 LYS 53 -22.128 0.869 -4.500 403 2HE LYS 53 HE3 LYS 53 -22.553 2.528 -4.916 404 1HZ LYS 53 HZ1 LYS 53 -24.512 2.289 -3.454 405 2HZ LYS 53 HZ2 LYS 53 -23.997 0.798 -3.005 406 3HZ LYS 53 HZ3 LYS 53 -23.088 2.120 -2.665 407 H GLU 54 H GLU 54 -23.235 3.277 -10.790 408 HA GLU 54 HA GLU 54 -24.232 0.939 -12.074 409 1HB GLU 54 HB2 GLU 54 -24.026 3.863 -12.873 410 2HB GLU 54 HB3 GLU 54 -24.676 2.666 -13.987 411 1HG GLU 54 HG2 GLU 54 -25.751 3.080 -11.171 412 2HG GLU 54 HG3 GLU 54 -26.370 3.914 -12.591 413 H VAL 55 H VAL 55 -21.085 2.439 -12.277 414 HA VAL 55 HA VAL 55 -20.362 0.934 -14.717 415 HB VAL 55 HB VAL 55 -18.431 2.507 -12.974 416 1HG1 VAL 55 HG11 VAL 55 -17.458 1.187 -14.844 417 2HG1 VAL 55 HG12 VAL 55 -18.534 2.016 -15.988 418 3HG1 VAL 55 HG13 VAL 55 -17.277 2.911 -15.104 419 1HG2 VAL 55 HG21 VAL 55 -20.197 4.122 -13.374 420 2HG2 VAL 55 HG22 VAL 55 -18.856 4.495 -14.440 421 3HG2 VAL 55 HG23 VAL 55 -20.303 3.670 -15.085 422 H GLY 56 H GLY 56 -20.829 0.169 -11.474 423 1HA GLY 56 HA1 GLY 56 -20.204 -1.648 -10.234 424 2HA GLY 56 HA2 GLY 56 -19.095 -2.174 -11.511 425 H ILE 57 H ILE 57 -18.913 1.156 -10.277 426 HA ILE 57 HA ILE 57 -16.363 0.503 -8.861 427 HB ILE 57 HB ILE 57 -17.181 3.005 -10.358 428 1HG1 ILE 57 HG12 ILE 57 -14.969 0.988 -10.967 429 2HG1 ILE 57 HG13 ILE 57 -16.519 1.046 -11.804 430 1HG2 ILE 57 HG21 ILE 57 -14.900 3.835 -9.787 431 2HG2 ILE 57 HG22 ILE 57 -15.818 3.518 -8.329 432 3HG2 ILE 57 HG23 ILE 57 -14.590 2.356 -8.859 433 1HD1 ILE 57 HD11 ILE 57 -14.878 2.122 -13.172 434 2HD1 ILE 57 HD12 ILE 57 -16.035 3.333 -12.601 435 3HD1 ILE 57 HD13 ILE 57 -14.411 3.226 -11.867 436 H ASP 58 H ASP 58 -17.211 0.122 -6.901 437 HA ASP 58 HA ASP 58 -19.428 1.690 -5.830 438 1HB ASP 58 HB2 ASP 58 -19.340 -0.678 -5.357 439 2HB ASP 58 HB3 ASP 58 -17.742 -0.516 -4.607 440 H ILE 59 H ILE 59 -18.528 3.817 -5.828 441 HA ILE 59 HA ILE 59 -16.269 4.378 -4.109 442 HB ILE 59 HB ILE 59 -16.491 6.630 -4.689 443 1HG1 ILE 59 HG12 ILE 59 -19.100 6.202 -6.147 444 2HG1 ILE 59 HG13 ILE 59 -19.046 6.743 -4.470 445 1HG2 ILE 59 HG21 ILE 59 -17.191 5.097 -7.198 446 2HG2 ILE 59 HG22 ILE 59 -16.257 6.599 -7.070 447 3HG2 ILE 59 HG23 ILE 59 -15.590 5.099 -6.416 448 1HD1 ILE 59 HD11 ILE 59 -17.903 8.238 -6.848 449 2HD1 ILE 59 HD12 ILE 59 -19.238 8.706 -5.776 450 3HD1 ILE 59 HD13 ILE 59 -17.587 8.664 -5.152 451 H SER 60 H SER 60 -19.210 3.322 -3.058 452 HA SER 60 HA SER 60 -20.178 5.346 -1.397 453 1HB SER 60 HB2 SER 60 -20.166 2.406 -0.643 454 2HB SER 60 HB3 SER 60 -21.326 3.652 -0.156 455 HG SER 60 HG SER 60 -20.928 2.357 -2.622 456 H ASN 61 H ASN 61 -17.337 3.321 -0.975 457 HA ASN 61 HA ASN 61 -16.994 3.712 1.849 458 1HB ASN 61 HB2 ASN 61 -16.079 1.778 0.578 459 2HB ASN 61 HB3 ASN 61 -15.008 2.872 -0.303 460 1HD2 ASN 61 HD22 ASN 61 -12.919 2.799 0.515 461 2HD2 ASN 61 HD21 ASN 61 -12.514 2.565 2.194 462 H GLN 62 H GLN 62 -16.407 5.839 -0.851 463 HA GLN 62 HA GLN 62 -14.064 7.141 0.198 464 1HB GLN 62 HB2 GLN 62 -16.022 8.044 -1.949 465 2HB GLN 62 HB3 GLN 62 -14.453 8.781 -1.563 466 1HG GLN 62 HG2 GLN 62 -13.318 6.657 -2.114 467 2HG GLN 62 HG3 GLN 62 -14.864 5.962 -2.608 468 1HE2 GLN 62 HE22 GLN 62 -14.939 9.234 -3.660 469 2HE2 GLN 62 HE21 GLN 62 -14.434 8.891 -5.311 470 H THR 63 H THR 63 -14.257 9.634 0.527 471 HA THR 63 HA THR 63 -16.737 10.616 1.631 472 HB THR 63 HB THR 63 -15.377 11.491 3.691 473 HG1 THR 63 HG1 THR 63 -13.348 10.670 3.103 474 1HG2 THR 63 HG21 THR 63 -16.069 9.668 5.078 475 2HG2 THR 63 HG22 THR 63 -17.278 9.842 3.793 476 3HG2 THR 63 HG23 THR 63 -16.080 8.533 3.715 477 H SER 64 H SER 64 -16.600 13.014 1.947 478 HA SER 64 HA SER 64 -14.661 14.196 0.043 479 1HB SER 64 HB2 SER 64 -17.374 15.194 0.977 480 2HB SER 64 HB3 SER 64 -16.371 15.887 -0.312 481 HG SER 64 HG SER 64 -18.183 14.363 -0.838 482 H ASP 65 H ASP 65 -13.731 16.195 0.559 483 HA ASP 65 HA ASP 65 -13.831 17.372 3.236 484 1HB ASP 65 HB2 ASP 65 -12.096 15.452 3.267 485 2HB ASP 65 HB3 ASP 65 -11.200 16.386 2.054 486 H ILE 66 H ILE 66 -12.505 19.456 3.188 487 HA ILE 66 HA ILE 66 -12.467 20.600 0.454 488 HB ILE 66 HB ILE 66 -12.650 22.690 1.398 489 1HG1 ILE 66 HG12 ILE 66 -11.894 21.522 4.101 490 2HG1 ILE 66 HG13 ILE 66 -10.964 22.670 3.114 491 1HG2 ILE 66 HG21 ILE 66 -14.658 21.093 1.633 492 2HG2 ILE 66 HG22 ILE 66 -14.325 21.075 3.364 493 3HG2 ILE 66 HG23 ILE 66 -14.734 22.601 2.562 494 1HD1 ILE 66 HD11 ILE 66 -11.997 23.945 4.843 495 2HD1 ILE 66 HD12 ILE 66 -12.919 24.283 3.349 496 3HD1 ILE 66 HD13 ILE 66 -13.568 23.168 4.576 497 H ILE 67 H ILE 67 -10.506 22.008 0.009 498 HA ILE 67 HA ILE 67 -8.346 20.294 -0.084 499 HB ILE 67 HB ILE 67 -8.838 21.969 -1.700 500 1HG1 ILE 67 HG12 ILE 67 -6.550 20.933 -1.423 501 2HG1 ILE 67 HG13 ILE 67 -6.721 22.319 -2.476 502 1HG2 ILE 67 HG21 ILE 67 -7.855 24.101 0.222 503 2HG2 ILE 67 HG22 ILE 67 -8.193 24.317 -1.504 504 3HG2 ILE 67 HG23 ILE 67 -9.516 23.888 -0.411 505 1HD1 ILE 67 HD11 ILE 67 -5.687 23.814 -0.919 506 2HD1 ILE 67 HD12 ILE 67 -5.612 22.581 0.341 507 3HD1 ILE 67 HD13 ILE 67 -4.648 22.394 -1.126 508 H ASP 68 H ASP 68 -6.598 19.818 0.917 509 HA ASP 68 HA ASP 68 -5.817 21.356 3.345 510 1HB ASP 68 HB2 ASP 68 -6.856 19.166 3.906 511 2HB ASP 68 HB3 ASP 68 -5.618 18.349 2.939 512 H SER 69 H SER 69 -3.951 22.366 2.893 513 HA SER 69 HA SER 69 -2.370 21.872 0.620 514 1HB SER 69 HB2 SER 69 -0.732 23.382 1.980 515 2HB SER 69 HB3 SER 69 -2.261 24.034 1.382 516 HG SER 69 HG SER 69 -1.887 24.565 3.582 517 H ASP 70 H ASP 70 -2.407 20.306 3.766 518 HA ASP 70 HA ASP 70 0.288 19.443 3.890 519 1HB ASP 70 HB2 ASP 70 -1.273 19.458 5.807 520 2HB ASP 70 HB3 ASP 70 -2.183 18.140 5.053 521 H ILE 71 H ILE 71 -2.395 18.265 1.933 522 HA ILE 71 HA ILE 71 -0.798 15.815 1.259 523 HB ILE 71 HB ILE 71 -3.727 16.471 0.808 524 1HG1 ILE 71 HG12 ILE 71 -2.262 14.292 2.379 525 2HG1 ILE 71 HG13 ILE 71 -2.979 15.741 3.103 526 1HG2 ILE 71 HG21 ILE 71 -2.089 14.057 -0.117 527 2HG2 ILE 71 HG22 ILE 71 -3.864 14.212 -0.232 528 3HG2 ILE 71 HG23 ILE 71 -2.837 15.270 -1.178 529 1HD1 ILE 71 HD11 ILE 71 -5.219 15.008 2.258 530 2HD1 ILE 71 HD12 ILE 71 -4.466 13.461 1.769 531 3HD1 ILE 71 HD13 ILE 71 -4.481 13.941 3.474 532 H LEU 72 H LEU 72 -2.450 18.658 -0.146 533 HA LEU 72 HA LEU 72 -1.847 18.397 -2.824 534 1HB LEU 72 HB2 LEU 72 -3.173 20.178 -1.702 535 2HB LEU 72 HB3 LEU 72 -1.690 20.798 -1.005 536 HG LEU 72 HG LEU 72 -1.053 20.973 -3.675 537 1HD1 LEU 72 HD11 LEU 72 -4.044 21.587 -3.435 538 2HD1 LEU 72 HD12 LEU 72 -3.012 21.947 -4.830 539 3HD1 LEU 72 HD13 LEU 72 -3.337 20.267 -4.382 540 1HD2 LEU 72 HD21 LEU 72 -0.754 22.702 -1.993 541 2HD2 LEU 72 HD22 LEU 72 -1.646 23.387 -3.369 542 3HD2 LEU 72 HD23 LEU 72 -2.505 22.941 -1.872 543 H ASN 73 H ASN 73 0.317 19.897 -0.327 544 HA ASN 73 HA ASN 73 2.426 20.417 -2.123 545 1HB ASN 73 HB2 ASN 73 3.669 21.138 -0.319 546 2HB ASN 73 HB3 ASN 73 2.026 21.341 0.291 547 1HD2 ASN 73 HD22 ASN 73 1.201 19.695 1.753 548 2HD2 ASN 73 HD21 ASN 73 2.285 18.652 2.666 549 H ASN 74 H ASN 74 1.481 17.322 -0.948 550 HA ASN 74 HA ASN 74 4.239 16.189 -1.195 551 1HB ASN 74 HB2 ASN 74 1.720 15.220 0.225 552 2HB ASN 74 HB3 ASN 74 3.062 14.152 -0.143 553 1HD2 ASN 74 HD22 ASN 74 1.852 16.228 2.250 554 2HD2 ASN 74 HD21 ASN 74 3.340 16.385 3.154 555 H ALA 75 H ALA 75 1.152 16.477 -2.770 556 HA ALA 75 HA ALA 75 1.022 13.927 -3.946 557 1HB ALA 75 HB1 ALA 75 -0.668 14.914 -5.387 558 2HB ALA 75 HB2 ALA 75 -0.878 15.505 -3.728 559 3HB ALA 75 HB3 ALA 75 -0.125 16.553 -4.955 560 H ASP 76 H ASP 76 1.735 13.158 -6.012 561 HA ASP 76 HA ASP 76 4.068 14.460 -7.223 562 1HB ASP 76 HB2 ASP 76 3.752 11.990 -7.371 563 2HB ASP 76 HB3 ASP 76 2.246 12.242 -8.268 564 H LEU 77 H LEU 77 0.576 14.318 -7.631 565 HA LEU 77 HA LEU 77 0.618 16.379 -9.748 566 1HB LEU 77 HB2 LEU 77 0.558 14.272 -10.900 567 2HB LEU 77 HB3 LEU 77 -0.637 13.624 -9.776 568 HG LEU 77 HG LEU 77 -2.337 15.193 -10.632 569 1HD1 LEU 77 HD11 LEU 77 -0.383 15.859 -12.878 570 2HD1 LEU 77 HD12 LEU 77 -2.048 16.426 -12.690 571 3HD1 LEU 77 HD13 LEU 77 -0.813 16.986 -11.575 572 1HD2 LEU 77 HD21 LEU 77 -2.682 13.985 -12.749 573 2HD2 LEU 77 HD22 LEU 77 -0.963 13.532 -12.760 574 3HD2 LEU 77 HD23 LEU 77 -2.045 12.882 -11.518 575 H VAL 78 H VAL 78 -1.022 17.705 -9.675 576 HA VAL 78 HA VAL 78 -3.345 17.211 -7.882 577 HB VAL 78 HB VAL 78 -1.727 19.730 -8.419 578 1HG1 VAL 78 HG11 VAL 78 -3.408 20.962 -7.041 579 2HG1 VAL 78 HG12 VAL 78 -4.120 20.371 -8.540 580 3HG1 VAL 78 HG13 VAL 78 -4.443 19.516 -7.014 581 1HG2 VAL 78 HG21 VAL 78 -0.952 18.227 -6.575 582 2HG2 VAL 78 HG22 VAL 78 -1.498 19.794 -5.979 583 3HG2 VAL 78 HG23 VAL 78 -2.540 18.357 -5.811 584 H VAL 79 H VAL 79 -5.283 17.332 -9.003 585 HA VAL 79 HA VAL 79 -5.114 18.204 -11.864 586 HB VAL 79 HB VAL 79 -6.959 16.066 -10.766 587 1HG1 VAL 79 HG11 VAL 79 -7.756 17.284 -12.772 588 2HG1 VAL 79 HG12 VAL 79 -6.238 16.908 -13.608 589 3HG1 VAL 79 HG13 VAL 79 -7.360 15.602 -13.152 590 1HG2 VAL 79 HG21 VAL 79 -4.342 15.742 -12.278 591 2HG2 VAL 79 HG22 VAL 79 -4.717 15.144 -10.642 592 3HG2 VAL 79 HG23 VAL 79 -5.541 14.453 -12.040 593 H THR 80 H THR 80 -6.000 20.147 -11.975 594 HA THR 80 HA THR 80 -8.174 20.919 -10.138 595 HB THR 80 HB THR 80 -7.728 23.165 -11.508 596 HG1 THR 80 HG1 THR 80 -5.996 22.104 -12.814 597 1HG2 THR 80 HG21 THR 80 -7.468 22.917 -9.113 598 2HG2 THR 80 HG22 THR 80 -6.003 21.929 -9.314 599 3HG2 THR 80 HG23 THR 80 -5.991 23.647 -9.735 600 H LEU 81 H LEU 81 -9.820 19.716 -10.783 601 HA LEU 81 HA LEU 81 -10.409 18.951 -13.442 602 1HB LEU 81 HB2 LEU 81 -12.033 18.948 -10.882 603 2HB LEU 81 HB3 LEU 81 -12.611 18.199 -12.364 604 HG LEU 81 HG LEU 81 -10.066 17.373 -10.902 605 1HD1 LEU 81 HD11 LEU 81 -11.380 15.414 -10.160 606 2HD1 LEU 81 HD12 LEU 81 -12.055 16.924 -9.532 607 3HD1 LEU 81 HD13 LEU 81 -12.836 16.101 -10.903 608 1HD2 LEU 81 HD21 LEU 81 -9.990 16.747 -13.279 609 2HD2 LEU 81 HD22 LEU 81 -10.266 15.307 -12.300 610 3HD2 LEU 81 HD23 LEU 81 -11.612 16.053 -13.178 611 H CYS 82 H CYS 82 -11.023 22.113 -12.175 612 HA CYS 82 HA CYS 82 -12.713 22.585 -14.457 613 1HB CYS 82 HB2 CYS 82 -14.376 21.845 -12.808 614 2HB CYS 82 HB3 CYS 82 -13.891 23.160 -11.710 615 HG CYS 82 HG CYS 82 -16.213 23.222 -13.397 616 H GLY 83 H GLY 83 -13.045 24.889 -14.830 617 1HA GLY 83 HA1 GLY 83 -10.636 26.206 -15.042 618 2HA GLY 83 HA2 GLY 83 -12.216 26.955 -15.212 619 H ASP 84 H ASP 84 -13.361 27.238 -12.919 620 HA ASP 84 HA ASP 84 -11.868 29.303 -11.657 621 1HB ASP 84 HB2 ASP 84 -14.322 29.273 -11.814 622 2HB ASP 84 HB3 ASP 84 -14.389 27.875 -10.740 623 H ALA 85 H ALA 85 -12.108 25.866 -10.935 624 HA ALA 85 HA ALA 85 -11.521 25.965 -8.167 625 1HB ALA 85 HB1 ALA 85 -11.061 23.623 -8.336 626 2HB ALA 85 HB2 ALA 85 -12.361 23.942 -9.494 627 3HB ALA 85 HB3 ALA 85 -10.693 23.727 -10.064 628 H ALA 86 H ALA 86 -9.452 26.171 -11.018 629 HA ALA 86 HA ALA 86 -6.975 25.532 -9.789 630 1HB ALA 86 HB1 ALA 86 -7.634 27.246 -12.215 631 2HB ALA 86 HB2 ALA 86 -6.019 26.649 -11.809 632 3HB ALA 86 HB3 ALA 86 -7.312 25.490 -12.197 633 H ASP 87 H ASP 87 -8.892 28.450 -9.504 634 HA ASP 87 HA ASP 87 -6.798 30.295 -8.924 635 1HB ASP 87 HB2 ASP 87 -9.164 30.912 -9.423 636 2HB ASP 87 HB3 ASP 87 -9.653 30.174 -7.887 637 H LYS 88 H LYS 88 -8.350 27.755 -7.036 638 HA LYS 88 HA LYS 88 -7.808 28.978 -4.466 639 1HB LYS 88 HB2 LYS 88 -9.750 27.527 -4.965 640 2HB LYS 88 HB3 LYS 88 -8.661 26.151 -5.206 641 1HG LYS 88 HG2 LYS 88 -9.732 26.003 -3.073 642 2HG LYS 88 HG3 LYS 88 -8.005 26.249 -2.839 643 1HD LYS 88 HD2 LYS 88 -8.366 28.602 -2.249 644 2HD LYS 88 HD3 LYS 88 -10.093 28.476 -2.676 645 1HE LYS 88 HE2 LYS 88 -10.407 26.762 -0.934 646 2HE LYS 88 HE3 LYS 88 -8.692 26.846 -0.514 647 1HZ LYS 88 HZ1 LYS 88 -10.625 29.080 -0.216 648 2HZ LYS 88 HZ2 LYS 88 -10.037 28.171 1.001 649 3HZ LYS 88 HZ3 LYS 88 -9.039 29.154 0.171 650 H CYS 89 H CYS 89 -6.061 26.594 -6.409 651 HA CYS 89 HA CYS 89 -4.764 25.115 -4.565 652 1HB CYS 89 HB2 CYS 89 -3.657 26.187 -7.177 653 2HB CYS 89 HB3 CYS 89 -2.878 24.917 -6.215 654 HG CYS 89 HG CYS 89 -4.172 23.775 -8.149 655 HA PRO 90 HA PRO 90 -2.868 28.480 -2.377 656 1HB PRO 90 HB2 PRO 90 -1.914 27.172 -0.142 657 2HB PRO 90 HB3 PRO 90 -3.599 27.717 -0.434 658 1HG PRO 90 HG2 PRO 90 -2.442 24.963 -0.818 659 2HG PRO 90 HG3 PRO 90 -4.032 25.419 -0.111 660 1HD PRO 90 HD2 PRO 90 -3.796 24.574 -2.693 661 2HD PRO 90 HD3 PRO 90 -4.976 25.812 -2.202 662 H MET 91 H MET 91 -0.935 25.556 -3.044 663 HA MET 91 HA MET 91 0.998 27.136 -4.387 664 1HB MET 91 HB2 MET 91 1.621 27.048 -1.686 665 2HB MET 91 HB3 MET 91 2.441 25.600 -2.245 666 1HG MET 91 HG2 MET 91 2.778 28.430 -3.307 667 2HG MET 91 HG3 MET 91 3.908 27.554 -2.280 668 1HE MET 91 HE1 MET 91 5.924 28.172 -3.839 669 2HE MET 91 HE2 MET 91 5.933 27.918 -5.598 670 3HE MET 91 HE3 MET 91 4.815 29.098 -4.878 671 H THR 92 H THR 92 1.565 25.794 -6.108 672 HA THR 92 HA THR 92 1.870 22.890 -5.570 673 HB THR 92 HB THR 92 0.915 22.412 -7.825 674 HG1 THR 92 HG1 THR 92 0.847 24.662 -8.521 675 1HG2 THR 92 HG21 THR 92 -0.261 21.985 -5.683 676 2HG2 THR 92 HG22 THR 92 -0.993 23.599 -5.771 677 3HG2 THR 92 HG23 THR 92 -1.380 22.377 -6.990 678 HA PRO 93 HA PRO 93 5.679 24.873 -7.212 679 1HB PRO 93 HB2 PRO 93 7.501 23.464 -5.710 680 2HB PRO 93 HB3 PRO 93 6.561 24.838 -5.063 681 1HG PRO 93 HG2 PRO 93 5.977 21.876 -4.803 682 2HG PRO 93 HG3 PRO 93 6.002 23.116 -3.508 683 1HD PRO 93 HD2 PRO 93 3.699 22.313 -4.716 684 2HD PRO 93 HD3 PRO 93 3.932 24.000 -4.188 685 HA PRO 94 HA PRO 94 6.910 22.049 -10.365 686 1HB PRO 94 HB2 PRO 94 9.662 21.836 -9.123 687 2HB PRO 94 HB3 PRO 94 9.228 22.001 -10.857 688 1HG PRO 94 HG2 PRO 94 9.979 24.190 -9.469 689 2HG PRO 94 HG3 PRO 94 8.536 24.283 -10.533 690 1HD PRO 94 HD2 PRO 94 8.655 23.958 -7.538 691 2HD PRO 94 HD3 PRO 94 7.548 24.963 -8.521 692 H HIS 95 H HIS 95 7.824 20.869 -7.119 693 HA HIS 95 HA HIS 95 8.109 18.103 -7.815 694 1HB HIS 95 HB2 HIS 95 7.347 19.356 -5.147 695 2HB HIS 95 HB3 HIS 95 7.996 17.739 -5.396 696 HD1 HIS 95 HD1 HIS 95 10.626 17.919 -6.752 697 HD2 HIS 95 HD2 HIS 95 9.140 21.069 -4.381 698 HE1 HIS 95 HE1 HIS 95 12.632 19.349 -6.124 699 H VAL 96 H VAL 96 5.344 20.026 -7.868 700 HA VAL 96 HA VAL 96 3.397 17.823 -7.424 701 HB VAL 96 HB VAL 96 3.184 20.744 -6.535 702 1HG1 VAL 96 HG11 VAL 96 1.039 19.643 -7.099 703 2HG1 VAL 96 HG12 VAL 96 1.407 18.358 -5.931 704 3HG1 VAL 96 HG13 VAL 96 1.167 20.029 -5.377 705 1HG2 VAL 96 HG21 VAL 96 3.297 19.924 -4.206 706 2HG2 VAL 96 HG22 VAL 96 3.775 18.323 -4.801 707 3HG2 VAL 96 HG23 VAL 96 4.822 19.732 -5.067 708 H LYS 97 H LYS 97 3.420 17.538 -9.707 709 HA LYS 97 HA LYS 97 3.280 19.816 -11.483 710 1HB LYS 97 HB2 LYS 97 3.432 18.317 -13.232 711 2HB LYS 97 HB3 LYS 97 4.293 17.490 -11.945 712 1HG LYS 97 HG2 LYS 97 1.913 16.342 -11.541 713 2HG LYS 97 HG3 LYS 97 1.628 16.874 -13.210 714 1HD LYS 97 HD2 LYS 97 3.762 15.665 -13.865 715 2HD LYS 97 HD3 LYS 97 3.877 15.099 -12.186 716 1HE LYS 97 HE2 LYS 97 1.412 14.234 -12.615 717 2HE LYS 97 HE3 LYS 97 1.838 14.368 -14.321 718 1HZ LYS 97 HZ1 LYS 97 3.203 12.751 -12.225 719 2HZ LYS 97 HZ2 LYS 97 2.341 12.162 -13.492 720 3HZ LYS 97 HZ3 LYS 97 3.775 12.894 -13.769 721 H ARG 98 H ARG 98 1.436 19.961 -13.065 722 HA ARG 98 HA ARG 98 -1.170 19.724 -11.652 723 1HB ARG 98 HB2 ARG 98 0.115 22.113 -13.025 724 2HB ARG 98 HB3 ARG 98 -1.627 22.011 -12.828 725 1HG ARG 98 HG2 ARG 98 0.293 21.762 -10.473 726 2HG ARG 98 HG3 ARG 98 -0.325 23.307 -11.036 727 1HD ARG 98 HD2 ARG 98 -2.096 20.980 -10.163 728 2HD ARG 98 HD3 ARG 98 -1.615 22.310 -9.113 729 HE ARG 98 HE ARG 98 -3.677 22.311 -11.145 730 1HH1 ARG 98 HH21 ARG 98 -1.500 24.459 -9.260 731 2HH1 ARG 98 HH22 ARG 98 -2.335 25.888 -9.741 732 1HH2 ARG 98 HH11 ARG 98 -4.749 24.147 -11.709 733 2HH2 ARG 98 HH12 ARG 98 -4.220 25.729 -11.194 734 H GLU 99 H GLU 99 -2.969 19.495 -12.912 735 HA GLU 99 HA GLU 99 -2.745 19.516 -15.810 736 1HB GLU 99 HB2 GLU 99 -2.333 17.136 -15.102 737 2HB GLU 99 HB3 GLU 99 -3.894 17.133 -14.275 738 1HG GLU 99 HG2 GLU 99 -3.878 16.019 -16.499 739 2HG GLU 99 HG3 GLU 99 -5.076 17.307 -16.334 740 H HIS 100 H HIS 100 -4.980 19.876 -16.710 741 HA HIS 100 HA HIS 100 -6.852 20.959 -14.676 742 1HB HIS 100 HB2 HIS 100 -5.036 22.631 -15.158 743 2HB HIS 100 HB3 HIS 100 -5.500 22.605 -16.855 744 HD1 HIS 100 HD1 HIS 100 -8.185 22.857 -14.058 745 HD2 HIS 100 HD2 HIS 100 -6.067 25.191 -16.858 746 HE1 HIS 100 HE1 HIS 100 -9.155 25.191 -13.937 747 H TRP 101 H TRP 101 -8.943 21.041 -15.304 748 HA TRP 101 HA TRP 101 -9.703 20.712 -18.144 749 1HB TRP 101 HB2 TRP 101 -10.883 19.003 -15.956 750 2HB TRP 101 HB3 TRP 101 -11.109 18.884 -17.701 751 HD1 TRP 101 HD1 TRP 101 -8.907 17.756 -14.899 752 HE1 TRP 101 HE1 TRP 101 -7.074 16.176 -15.695 753 HE3 TRP 101 HE3 TRP 101 -9.442 18.403 -19.952 754 HZ2 TRP 101 HZ2 TRP 101 -5.939 15.318 -18.213 755 HZ3 TRP 101 HZ3 TRP 101 -7.947 17.203 -21.525 756 HH2 TRP 101 HH2 TRP 101 -6.194 15.648 -20.662 757 H GLY 102 H GLY 102 -12.491 20.583 -17.749 758 1HA GLY 102 HA1 GLY 102 -13.111 23.179 -16.394 759 2HA GLY 102 HA2 GLY 102 -13.417 22.916 -18.097 760 H PHE 103 H PHE 103 -14.008 20.620 -15.329 761 HA PHE 103 HA PHE 103 -16.550 19.995 -16.572 762 1HB PHE 103 HB2 PHE 103 -15.095 18.879 -14.160 763 2HB PHE 103 HB3 PHE 103 -16.702 18.339 -14.652 764 HD1 PHE 103 HD1 PHE 103 -13.130 18.184 -15.458 765 HD2 PHE 103 HD2 PHE 103 -17.102 17.392 -16.939 766 HE1 PHE 103 HE1 PHE 103 -12.164 16.953 -17.362 767 HE2 PHE 103 HE2 PHE 103 -16.140 16.132 -18.838 768 HZ PHE 103 HZ PHE 103 -13.681 15.932 -19.084 769 H ASP 104 H ASP 104 -18.406 20.928 -16.245 770 HA ASP 104 HA ASP 104 -19.036 22.621 -13.958 771 1HB ASP 104 HB2 ASP 104 -19.998 23.005 -16.222 772 2HB ASP 104 HB3 ASP 104 -20.770 21.412 -16.148 773 H ASP 105 H ASP 105 -20.741 22.077 -12.387 774 HA ASP 105 HA ASP 105 -20.153 19.458 -11.362 775 1HB ASP 105 HB2 ASP 105 -20.455 21.581 -9.994 776 2HB ASP 105 HB3 ASP 105 -22.193 21.350 -10.190 777 HA PRO 106 HA PRO 106 -23.492 17.643 -13.547 778 1HB PRO 106 HB2 PRO 106 -23.440 15.042 -12.575 779 2HB PRO 106 HB3 PRO 106 -22.261 15.705 -13.742 780 1HG PRO 106 HG2 PRO 106 -21.993 15.447 -10.739 781 2HG PRO 106 HG3 PRO 106 -20.794 15.027 -12.004 782 1HD PRO 106 HD2 PRO 106 -20.684 17.378 -10.638 783 2HD PRO 106 HD3 PRO 106 -20.254 17.291 -12.376 784 H ALA 107 H ALA 107 -23.499 17.465 -9.989 785 HA ALA 107 HA ALA 107 -26.170 16.486 -9.764 786 1HB ALA 107 HB1 ALA 107 -24.523 16.339 -7.949 787 2HB ALA 107 HB2 ALA 107 -24.527 18.110 -7.783 788 3HB ALA 107 HB3 ALA 107 -25.995 17.181 -7.421 789 H ARG 108 H ARG 108 -24.957 19.610 -10.649 790 HA ARG 108 HA ARG 108 -27.506 20.972 -9.965 791 1HB ARG 108 HB2 ARG 108 -24.721 22.006 -10.698 792 2HB ARG 108 HB3 ARG 108 -26.154 23.026 -10.614 793 1HG ARG 108 HG2 ARG 108 -25.288 23.345 -8.530 794 2HG ARG 108 HG3 ARG 108 -26.512 22.104 -8.247 795 1HD ARG 108 HD2 ARG 108 -24.643 20.383 -8.286 796 2HD ARG 108 HD3 ARG 108 -23.493 21.725 -8.399 797 HE ARG 108 HE ARG 108 -25.135 22.281 -6.215 798 1HH1 ARG 108 HH21 ARG 108 -22.794 19.715 -7.092 799 2HH1 ARG 108 HH22 ARG 108 -22.420 19.360 -5.427 800 1HH2 ARG 108 HH11 ARG 108 -24.626 21.721 -4.036 801 2HH2 ARG 108 HH12 ARG 108 -23.487 20.447 -3.715 802 H ALA 109 H ALA 109 -26.358 19.178 -12.533 803 HA ALA 109 HA ALA 109 -27.146 20.772 -14.747 804 1HB ALA 109 HB1 ALA 109 -27.266 17.743 -14.339 805 2HB ALA 109 HB2 ALA 109 -27.341 18.590 -15.898 806 3HB ALA 109 HB3 ALA 109 -25.849 18.645 -14.928 807 H GLN 110 H GLN 110 -29.208 20.713 -15.828 808 HA GLN 110 HA GLN 110 -31.542 19.684 -14.407 809 1HB GLN 110 HB2 GLN 110 -32.495 21.914 -13.919 810 2HB GLN 110 HB3 GLN 110 -31.030 21.579 -13.015 811 1HG GLN 110 HG2 GLN 110 -29.783 22.950 -14.858 812 2HG GLN 110 HG3 GLN 110 -31.393 23.480 -15.354 813 1HE2 GLN 110 HE22 GLN 110 -29.148 23.272 -12.534 814 2HE2 GLN 110 HE21 GLN 110 -29.762 24.699 -11.721 815 H GLY 111 H GLY 111 -33.565 20.373 -15.478 816 1HA GLY 111 HA1 GLY 111 -34.254 21.608 -17.697 817 2HA GLY 111 HA2 GLY 111 -33.307 20.283 -18.418 818 H THR 112 H THR 112 -33.772 18.168 -16.815 819 HA THR 112 HA THR 112 -36.333 17.802 -15.755 820 HB THR 112 HB THR 112 -37.163 17.639 -18.020 821 HG1 THR 112 HG1 THR 112 -38.151 16.148 -16.863 822 1HG2 THR 112 HG21 THR 112 -34.958 15.634 -18.572 823 2HG2 THR 112 HG22 THR 112 -36.359 15.919 -19.624 824 3HG2 THR 112 HG23 THR 112 -35.197 17.218 -19.342 825 H GLU 113 H GLU 113 -36.388 15.393 -14.969 826 HA GLU 113 HA GLU 113 -33.984 14.952 -13.541 827 1HB GLU 113 HB2 GLU 113 -36.147 14.199 -12.731 828 2HB GLU 113 HB3 GLU 113 -36.349 13.119 -14.120 829 1HG GLU 113 HG2 GLU 113 -34.474 11.738 -13.393 830 2HG GLU 113 HG3 GLU 113 -34.095 12.864 -12.084 831 H GLU 114 H GLU 114 -35.214 13.476 -16.537 832 HA GLU 114 HA GLU 114 -33.065 11.599 -16.720 833 1HB GLU 114 HB2 GLU 114 -33.858 11.115 -18.964 834 2HB GLU 114 HB3 GLU 114 -35.181 11.147 -17.801 835 1HG GLU 114 HG2 GLU 114 -35.837 13.400 -18.581 836 2HG GLU 114 HG3 GLU 114 -34.494 13.405 -19.733 837 H GLU 115 H GLU 115 -33.336 14.985 -17.657 838 HA GLU 115 HA GLU 115 -31.065 14.933 -19.441 839 1HB GLU 115 HB2 GLU 115 -32.897 16.625 -19.601 840 2HB GLU 115 HB3 GLU 115 -32.399 17.282 -18.042 841 1HG GLU 115 HG2 GLU 115 -31.502 18.696 -19.719 842 2HG GLU 115 HG3 GLU 115 -30.148 17.810 -19.036 843 H LYS 116 H LYS 116 -31.737 15.863 -16.043 844 HA LYS 116 HA LYS 116 -29.106 16.556 -15.275 845 1HB LYS 116 HB2 LYS 116 -30.954 17.136 -13.875 846 2HB LYS 116 HB3 LYS 116 -31.513 15.464 -13.781 847 1HG LYS 116 HG2 LYS 116 -29.600 14.810 -12.479 848 2HG LYS 116 HG3 LYS 116 -28.877 16.426 -12.600 849 1HD LYS 116 HD2 LYS 116 -31.635 16.044 -11.397 850 2HD LYS 116 HD3 LYS 116 -30.181 15.644 -10.455 851 1HE LYS 116 HE2 LYS 116 -29.329 17.983 -10.928 852 2HE LYS 116 HE3 LYS 116 -30.910 18.348 -11.621 853 1HZ LYS 116 HZ1 LYS 116 -30.409 17.525 -8.820 854 2HZ LYS 116 HZ2 LYS 116 -30.795 19.022 -9.321 855 3HZ LYS 116 HZ3 LYS 116 -31.894 17.823 -9.447 856 H TRP 117 H TRP 117 -30.761 13.367 -15.149 857 HA TRP 117 HA TRP 117 -28.492 11.948 -14.190 858 1HB TRP 117 HB2 TRP 117 -30.744 10.984 -14.143 859 2HB TRP 117 HB3 TRP 117 -30.800 10.955 -15.906 860 HD1 TRP 117 HD1 TRP 117 -29.419 9.070 -17.157 861 HE1 TRP 117 HE1 TRP 117 -28.318 6.878 -16.412 862 HE3 TRP 117 HE3 TRP 117 -29.370 9.850 -12.099 863 HZ2 TRP 117 HZ2 TRP 117 -27.241 5.769 -14.003 864 HZ3 TRP 117 HZ3 TRP 117 -28.154 8.281 -10.616 865 HH2 TRP 117 HH2 TRP 117 -27.074 6.238 -11.557 866 H ALA 118 H ALA 118 -29.591 12.573 -17.591 867 HA ALA 118 HA ALA 118 -27.580 11.070 -18.856 868 1HB ALA 118 HB1 ALA 118 -27.990 12.563 -20.810 869 2HB ALA 118 HB2 ALA 118 -29.499 11.998 -20.068 870 3HB ALA 118 HB3 ALA 118 -28.926 13.653 -19.772 871 H PHE 119 H PHE 119 -27.483 14.435 -17.621 872 HA PHE 119 HA PHE 119 -24.875 15.029 -18.541 873 1HB PHE 119 HB2 PHE 119 -26.745 16.557 -17.602 874 2HB PHE 119 HB3 PHE 119 -26.099 16.154 -16.020 875 HD1 PHE 119 HD1 PHE 119 -25.746 18.199 -18.994 876 HD2 PHE 119 HD2 PHE 119 -23.655 16.760 -15.514 877 HE1 PHE 119 HE1 PHE 119 -24.143 20.082 -19.177 878 HE2 PHE 119 HE2 PHE 119 -22.089 18.691 -15.653 879 HZ PHE 119 HZ PHE 119 -22.320 20.335 -17.509 880 H PHE 120 H PHE 120 -25.994 13.379 -15.500 881 HA PHE 120 HA PHE 120 -23.471 13.204 -14.209 882 1HB PHE 120 HB2 PHE 120 -25.479 10.930 -14.292 883 2HB PHE 120 HB3 PHE 120 -24.203 11.197 -13.146 884 HD1 PHE 120 HD1 PHE 120 -25.493 14.438 -13.232 885 HD2 PHE 120 HD2 PHE 120 -26.610 10.420 -12.119 886 HE1 PHE 120 HE1 PHE 120 -27.085 15.326 -11.583 887 HE2 PHE 120 HE2 PHE 120 -28.266 11.334 -10.514 888 HZ PHE 120 HZ PHE 120 -28.492 13.792 -10.226 889 H GLN 121 H GLN 121 -25.059 10.898 -16.526 890 HA GLN 121 HA GLN 121 -22.882 9.212 -16.820 891 1HB GLN 121 HB2 GLN 121 -24.892 9.811 -18.996 892 2HB GLN 121 HB3 GLN 121 -23.920 8.355 -18.805 893 1HG GLN 121 HG2 GLN 121 -26.195 9.271 -16.994 894 2HG GLN 121 HG3 GLN 121 -26.215 7.948 -18.128 895 1HE2 GLN 121 HE22 GLN 121 -26.052 5.968 -17.140 896 2HE2 GLN 121 HE21 GLN 121 -25.298 5.702 -15.582 897 H ARG 122 H ARG 122 -23.534 12.158 -18.743 898 HA ARG 122 HA ARG 122 -21.312 11.815 -20.504 899 1HB ARG 122 HB2 ARG 122 -22.962 14.214 -19.665 900 2HB ARG 122 HB3 ARG 122 -21.422 14.488 -20.466 901 1HG ARG 122 HG2 ARG 122 -23.053 14.515 -22.166 902 2HG ARG 122 HG3 ARG 122 -22.115 13.028 -22.354 903 1HD ARG 122 HD2 ARG 122 -23.957 11.793 -21.159 904 2HD ARG 122 HD3 ARG 122 -24.885 13.312 -21.124 905 HE ARG 122 HE ARG 122 -24.265 12.965 -23.782 906 1HH1 ARG 122 HH21 ARG 122 -25.907 11.000 -21.339 907 2HH1 ARG 122 HH22 ARG 122 -26.948 10.197 -22.460 908 1HH2 ARG 122 HH11 ARG 122 -25.654 11.907 -25.295 909 2HH2 ARG 122 HH12 ARG 122 -26.801 10.739 -24.765 910 H VAL 123 H VAL 123 -21.514 13.617 -17.373 911 HA VAL 123 HA VAL 123 -18.767 14.399 -17.536 912 HB VAL 123 HB VAL 123 -20.679 14.245 -15.163 913 1HG1 VAL 123 HG11 VAL 123 -17.924 15.562 -15.310 914 2HG1 VAL 123 HG12 VAL 123 -19.099 15.777 -13.996 915 3HG1 VAL 123 HG13 VAL 123 -18.372 14.192 -14.277 916 1HG2 VAL 123 HG21 VAL 123 -19.665 16.596 -16.848 917 2HG2 VAL 123 HG22 VAL 123 -21.292 15.903 -16.930 918 3HG2 VAL 123 HG23 VAL 123 -20.751 16.717 -15.457 919 H ARG 124 H ARG 124 -20.265 11.488 -15.829 920 HA ARG 124 HA ARG 124 -17.686 10.707 -14.911 921 1HB ARG 124 HB2 ARG 124 -18.519 8.439 -14.594 922 2HB ARG 124 HB3 ARG 124 -19.603 9.635 -13.886 923 1HG ARG 124 HG2 ARG 124 -21.231 9.271 -15.565 924 2HG ARG 124 HG3 ARG 124 -20.115 8.380 -16.611 925 1HD ARG 124 HD2 ARG 124 -19.980 6.590 -14.841 926 2HD ARG 124 HD3 ARG 124 -21.219 7.456 -13.946 927 HE ARG 124 HE ARG 124 -22.833 6.858 -15.461 928 1HH1 ARG 124 HH11 ARG 124 -19.673 5.839 -16.766 929 2HH1 ARG 124 HH12 ARG 124 -20.346 4.898 -18.041 930 1HH2 ARG 124 HH21 ARG 124 -23.709 5.527 -17.141 931 2HH2 ARG 124 HH22 ARG 124 -22.670 4.702 -18.244 932 H ASP 125 H ASP 125 -19.331 10.015 -17.998 933 HA ASP 125 HA ASP 125 -17.451 8.129 -18.944 934 1HB ASP 125 HB2 ASP 125 -19.579 8.475 -20.073 935 2HB ASP 125 HB3 ASP 125 -19.131 10.132 -20.498 936 H GLU 126 H GLU 126 -17.483 11.738 -19.251 937 HA GLU 126 HA GLU 126 -15.022 11.702 -20.680 938 1HB GLU 126 HB2 GLU 126 -16.803 13.840 -19.590 939 2HB GLU 126 HB3 GLU 126 -15.138 14.274 -19.990 940 1HG GLU 126 HG2 GLU 126 -16.874 12.771 -21.963 941 2HG GLU 126 HG3 GLU 126 -16.908 14.527 -21.826 942 H ILE 127 H ILE 127 -15.758 12.039 -17.213 943 HA ILE 127 HA ILE 127 -13.082 12.808 -16.508 944 HB ILE 127 HB ILE 127 -15.486 12.545 -15.116 945 1HG1 ILE 127 HG12 ILE 127 -14.160 13.175 -13.072 946 2HG1 ILE 127 HG13 ILE 127 -12.692 13.034 -14.051 947 1HG2 ILE 127 HG21 ILE 127 -15.224 10.226 -14.705 948 2HG2 ILE 127 HG22 ILE 127 -13.652 10.507 -13.905 949 3HG2 ILE 127 HG23 ILE 127 -15.157 11.150 -13.205 950 1HD1 ILE 127 HD11 ILE 127 -13.535 14.810 -15.549 951 2HD1 ILE 127 HD12 ILE 127 -15.100 14.814 -14.702 952 3HD1 ILE 127 HD13 ILE 127 -13.646 15.371 -13.863 953 H GLY 128 H GLY 128 -14.702 9.623 -16.883 954 1HA GLY 128 HA1 GLY 128 -12.466 8.018 -16.167 955 2HA GLY 128 HA2 GLY 128 -13.850 7.532 -17.178 956 H ASN 129 H ASN 129 -13.675 9.164 -19.357 957 HA ASN 129 HA ASN 129 -11.642 8.111 -20.982 958 1HB ASN 129 HB2 ASN 129 -13.811 9.100 -21.720 959 2HB ASN 129 HB3 ASN 129 -13.186 10.695 -21.291 960 1HD2 ASN 129 HD21 ASN 129 -13.489 11.473 -23.373 961 2HD2 ASN 129 HD22 ASN 129 -12.531 10.922 -24.749 962 H ARG 130 H ARG 130 -11.682 11.106 -19.034 963 HA ARG 130 HA ARG 130 -9.257 12.240 -20.002 964 1HB ARG 130 HB2 ARG 130 -11.118 12.749 -17.796 965 2HB ARG 130 HB3 ARG 130 -9.505 12.676 -17.144 966 1HG ARG 130 HG2 ARG 130 -9.655 14.873 -17.593 967 2HG ARG 130 HG3 ARG 130 -8.866 14.319 -19.065 968 1HD ARG 130 HD2 ARG 130 -11.776 15.028 -18.599 969 2HD ARG 130 HD3 ARG 130 -10.650 15.921 -19.620 970 HE ARG 130 HE ARG 130 -12.319 13.692 -20.302 971 1HH1 ARG 130 HH21 ARG 130 -8.998 14.827 -21.087 972 2HH1 ARG 130 HH22 ARG 130 -8.954 13.791 -22.510 973 1HH2 ARG 130 HH11 ARG 130 -12.303 12.902 -22.468 974 2HH2 ARG 130 HH12 ARG 130 -10.708 12.700 -23.218 975 H LEU 131 H LEU 131 -9.918 10.027 -17.293 976 HA LEU 131 HA LEU 131 -7.143 9.883 -16.580 977 1HB LEU 131 HB2 LEU 131 -9.617 8.350 -15.737 978 2HB LEU 131 HB3 LEU 131 -8.031 8.024 -15.017 979 HG LEU 131 HG LEU 131 -9.039 10.898 -15.161 980 1HD1 LEU 131 HD11 LEU 131 -10.034 10.652 -12.939 981 2HD1 LEU 131 HD12 LEU 131 -10.886 9.742 -14.193 982 3HD1 LEU 131 HD13 LEU 131 -9.822 8.888 -13.052 983 1HD2 LEU 131 HD21 LEU 131 -7.606 11.214 -13.254 984 2HD2 LEU 131 HD22 LEU 131 -7.238 9.471 -13.167 985 3HD2 LEU 131 HD23 LEU 131 -6.672 10.450 -14.531 986 H LYS 132 H LYS 132 -9.228 7.855 -18.631 987 HA LYS 132 HA LYS 132 -7.300 5.849 -19.165 988 1HB LYS 132 HB2 LYS 132 -9.404 5.299 -19.853 989 2HB LYS 132 HB3 LYS 132 -9.790 6.876 -20.475 990 1HG LYS 132 HG2 LYS 132 -7.772 5.127 -21.934 991 2HG LYS 132 HG3 LYS 132 -9.507 4.830 -22.061 992 1HD LYS 132 HD2 LYS 132 -9.481 7.516 -22.558 993 2HD LYS 132 HD3 LYS 132 -7.894 7.071 -23.202 994 1HE LYS 132 HE2 LYS 132 -8.896 5.468 -24.724 995 2HE LYS 132 HE3 LYS 132 -10.467 5.617 -23.924 996 1HZ LYS 132 HZ1 LYS 132 -10.555 7.934 -24.645 997 2HZ LYS 132 HZ2 LYS 132 -9.145 7.758 -25.479 998 3HZ LYS 132 HZ3 LYS 132 -10.465 6.910 -25.923 999 H GLU 133 H GLU 133 -7.864 8.946 -20.934 1000 HA GLU 133 HA GLU 133 -5.622 8.512 -22.697 1001 1HB GLU 133 HB2 GLU 133 -6.921 11.099 -21.722 1002 2HB GLU 133 HB3 GLU 133 -5.630 11.015 -22.933 1003 1HG GLU 133 HG2 GLU 133 -7.062 9.645 -24.402 1004 2HG GLU 133 HG3 GLU 133 -8.388 9.755 -23.246 1005 H PHE 134 H PHE 134 -5.854 10.312 -19.590 1006 HA PHE 134 HA PHE 134 -3.182 11.137 -19.514 1007 1HB PHE 134 HB2 PHE 134 -4.812 12.050 -18.053 1008 2HB PHE 134 HB3 PHE 134 -5.254 10.462 -17.432 1009 HD1 PHE 134 HD1 PHE 134 -2.789 13.197 -17.178 1010 HD2 PHE 134 HD2 PHE 134 -4.007 9.311 -15.763 1011 HE1 PHE 134 HE1 PHE 134 -1.218 13.398 -15.270 1012 HE2 PHE 134 HE2 PHE 134 -2.471 9.536 -13.821 1013 HZ PHE 134 HZ PHE 134 -1.064 11.561 -13.599 1014 H ALA 135 H ALA 135 -4.588 8.010 -18.546 1015 HA ALA 135 HA ALA 135 -2.150 6.962 -17.455 1016 1HB ALA 135 HB1 ALA 135 -4.650 5.514 -18.421 1017 2HB ALA 135 HB2 ALA 135 -3.345 4.805 -17.447 1018 3HB ALA 135 HB3 ALA 135 -4.345 6.102 -16.770 1019 H GLU 136 H GLU 136 -3.822 6.553 -20.581 1020 HA GLU 136 HA GLU 136 -1.988 4.620 -21.620 1021 1HB GLU 136 HB2 GLU 136 -4.145 6.341 -22.885 1022 2HB GLU 136 HB3 GLU 136 -3.180 5.211 -23.825 1023 1HG GLU 136 HG2 GLU 136 -4.851 4.366 -21.416 1024 2HG GLU 136 HG3 GLU 136 -5.419 4.330 -23.080 1025 H THR 137 H THR 137 -2.261 8.132 -21.949 1026 HA THR 137 HA THR 137 -0.146 8.217 -23.882 1027 HB THR 137 HB THR 137 -0.617 10.550 -24.042 1028 HG1 THR 137 HG1 THR 137 -2.551 10.176 -22.026 1029 1HG2 THR 137 HG21 THR 137 -3.153 8.838 -23.941 1030 2HG2 THR 137 HG22 THR 137 -2.999 10.417 -24.746 1031 3HG2 THR 137 HG23 THR 137 -2.047 9.025 -25.306 1032 H GLY 138 H GLY 138 -0.514 8.565 -20.398 1033 1HA GLY 138 HA1 GLY 138 0.918 9.032 -18.715 1034 2HA GLY 138 HA2 GLY 138 2.300 8.841 -19.825 1035 H LYS 139 H LYS 139 -0.536 10.986 -19.999 1036 HA LYS 139 HA LYS 139 0.673 13.190 -21.091 1037 1HB LYS 139 HB2 LYS 139 -1.824 12.698 -20.728 1038 2HB LYS 139 HB3 LYS 139 -1.618 13.344 -19.110 1039 1HG LYS 139 HG2 LYS 139 -2.495 15.083 -20.498 1040 2HG LYS 139 HG3 LYS 139 -0.835 15.497 -20.068 1041 1HD LYS 139 HD2 LYS 139 -1.365 16.056 -22.406 1042 2HD LYS 139 HD3 LYS 139 -0.050 14.885 -22.308 1043 1HE LYS 139 HE2 LYS 139 -1.637 13.043 -22.826 1044 2HE LYS 139 HE3 LYS 139 -2.975 14.198 -22.864 1045 1HZ LYS 139 HZ1 LYS 139 -2.173 13.700 -25.083 1046 2HZ LYS 139 HZ2 LYS 139 -1.905 15.272 -24.760 1047 3HZ LYS 139 HZ3 LYS 139 -0.666 14.207 -24.724 Start of MODEL 6 1 1H MET 1 H1 MET 1 3.496 -2.949 -5.260 2 2H MET 1 H2 MET 1 2.284 -1.866 -5.519 3 3H MET 1 H3 MET 1 3.649 -1.791 -6.422 4 HA MET 1 HA MET 1 3.423 -1.268 -3.551 5 1HB MET 1 HB2 MET 1 5.589 -2.323 -4.140 6 2HB MET 1 HB3 MET 1 5.886 -1.063 -5.344 7 1HG MET 1 HG2 MET 1 7.101 -0.686 -3.230 8 2HG MET 1 HG3 MET 1 6.011 0.634 -3.619 9 1HE MET 1 HE1 MET 1 7.347 0.416 -0.809 10 2HE MET 1 HE2 MET 1 6.170 1.671 -1.259 11 3HE MET 1 HE3 MET 1 5.967 0.764 0.256 12 H GLU 2 H GLU 2 3.205 0.906 -2.982 13 HA GLU 2 HA GLU 2 2.164 2.738 -4.931 14 1HB GLU 2 HB2 GLU 2 2.091 4.308 -3.047 15 2HB GLU 2 HB3 GLU 2 1.410 2.739 -2.621 16 1HG GLU 2 HG2 GLU 2 3.621 2.164 -1.504 17 2HG GLU 2 HG3 GLU 2 4.154 3.814 -1.827 18 H ASN 3 H ASN 3 3.066 4.722 -5.670 19 HA ASN 3 HA ASN 3 5.952 5.207 -5.211 20 1HB ASN 3 HB2 ASN 3 4.748 5.198 -8.008 21 2HB ASN 3 HB3 ASN 3 6.401 5.591 -7.567 22 1HD2 ASN 3 HD22 ASN 3 4.018 3.039 -7.742 23 2HD2 ASN 3 HD21 ASN 3 5.110 1.673 -7.706 24 H LYS 4 H LYS 4 2.864 6.289 -6.612 25 HA LYS 4 HA LYS 4 3.725 9.149 -6.296 26 1HB LYS 4 HB2 LYS 4 2.082 7.757 -8.447 27 2HB LYS 4 HB3 LYS 4 2.169 9.513 -8.301 28 1HG LYS 4 HG2 LYS 4 4.585 9.515 -8.621 29 2HG LYS 4 HG3 LYS 4 4.626 7.751 -8.688 30 1HD LYS 4 HD2 LYS 4 3.184 9.545 -10.691 31 2HD LYS 4 HD3 LYS 4 4.764 8.767 -10.921 32 1HE LYS 4 HE2 LYS 4 3.581 6.540 -10.429 33 2HE LYS 4 HE3 LYS 4 2.055 7.422 -10.563 34 1HZ LYS 4 HZ1 LYS 4 4.082 7.279 -12.726 35 2HZ LYS 4 HZ2 LYS 4 2.799 6.278 -12.610 36 3HZ LYS 4 HZ3 LYS 4 2.564 7.896 -12.847 37 H ILE 5 H ILE 5 1.848 10.670 -6.284 38 HA ILE 5 HA ILE 5 -0.602 9.632 -4.982 39 HB ILE 5 HB ILE 5 1.188 11.936 -4.080 40 1HG1 ILE 5 HG12 ILE 5 -0.044 9.733 -2.392 41 2HG1 ILE 5 HG13 ILE 5 1.562 9.609 -3.118 42 1HG2 ILE 5 HG21 ILE 5 -1.115 12.828 -4.173 43 2HG2 ILE 5 HG22 ILE 5 -1.711 11.427 -3.276 44 3HG2 ILE 5 HG23 ILE 5 -0.634 12.623 -2.503 45 1HD1 ILE 5 HD11 ILE 5 1.830 10.295 -0.842 46 2HD1 ILE 5 HD12 ILE 5 2.245 11.677 -1.872 47 3HD1 ILE 5 HD13 ILE 5 0.682 11.626 -1.018 48 H ILE 6 H ILE 6 -2.385 10.546 -5.899 49 HA ILE 6 HA ILE 6 -2.003 12.918 -7.629 50 HB ILE 6 HB ILE 6 -2.370 11.185 -9.162 51 1HG1 ILE 6 HG12 ILE 6 -5.041 12.579 -8.692 52 2HG1 ILE 6 HG13 ILE 6 -3.636 13.266 -9.515 53 1HG2 ILE 6 HG21 ILE 6 -4.283 9.586 -9.026 54 2HG2 ILE 6 HG22 ILE 6 -3.118 9.384 -7.729 55 3HG2 ILE 6 HG23 ILE 6 -4.656 10.222 -7.417 56 1HD1 ILE 6 HD11 ILE 6 -5.391 10.968 -10.440 57 2HD1 ILE 6 HD12 ILE 6 -5.156 12.546 -11.203 58 3HD1 ILE 6 HD13 ILE 6 -3.834 11.357 -11.202 59 H TYR 7 H TYR 7 -3.455 14.563 -7.163 60 HA TYR 7 HA TYR 7 -5.458 14.060 -5.018 61 1HB TYR 7 HB2 TYR 7 -3.281 14.970 -4.196 62 2HB TYR 7 HB3 TYR 7 -3.541 16.404 -5.175 63 HD1 TYR 7 HD1 TYR 7 -4.136 18.231 -3.840 64 HD2 TYR 7 HD2 TYR 7 -5.633 14.329 -2.786 65 HE1 TYR 7 HE1 TYR 7 -5.138 19.165 -1.774 66 HE2 TYR 7 HE2 TYR 7 -6.660 15.264 -0.740 67 HH TYR 7 HH TYR 7 -6.899 17.163 0.603 68 H PHE 8 H PHE 8 -7.353 14.307 -6.069 69 HA PHE 8 HA PHE 8 -7.761 16.205 -8.240 70 1HB PHE 8 HB2 PHE 8 -9.629 14.468 -6.549 71 2HB PHE 8 HB3 PHE 8 -10.158 15.441 -7.909 72 HD1 PHE 8 HD1 PHE 8 -8.863 12.215 -6.933 73 HD2 PHE 8 HD2 PHE 8 -8.992 15.057 -10.161 74 HE1 PHE 8 HE1 PHE 8 -8.176 10.448 -8.538 75 HE2 PHE 8 HE2 PHE 8 -8.294 13.287 -11.761 76 HZ PHE 8 HZ PHE 8 -7.875 10.991 -10.931 77 H LEU 9 H LEU 9 -8.895 18.095 -8.204 78 HA LEU 9 HA LEU 9 -9.817 19.214 -5.613 79 1HB LEU 9 HB2 LEU 9 -7.400 19.772 -6.152 80 2HB LEU 9 HB3 LEU 9 -7.915 20.485 -7.662 81 HG LEU 9 HG LEU 9 -7.350 22.128 -5.955 82 1HD1 LEU 9 HD11 LEU 9 -9.247 22.563 -7.665 83 2HD1 LEU 9 HD12 LEU 9 -10.348 22.410 -6.275 84 3HD1 LEU 9 HD13 LEU 9 -9.087 23.644 -6.279 85 1HD2 LEU 9 HD21 LEU 9 -8.671 22.464 -3.956 86 2HD2 LEU 9 HD22 LEU 9 -9.706 21.077 -4.341 87 3HD2 LEU 9 HD23 LEU 9 -7.994 20.815 -3.974 88 H CYS 10 H CYS 10 -11.840 20.228 -5.956 89 HA CYS 10 HA CYS 10 -12.431 21.370 -8.586 90 1HB CYS 10 HB2 CYS 10 -13.170 18.836 -8.450 91 2HB CYS 10 HB3 CYS 10 -14.495 19.455 -7.457 92 HG CYS 10 HG CYS 10 -15.210 19.113 -9.981 93 H THR 11 H THR 11 -14.779 22.520 -8.405 94 HA THR 11 HA THR 11 -14.593 24.211 -6.105 95 HB THR 11 HB THR 11 -16.849 25.065 -7.130 96 HG1 THR 11 HG1 THR 11 -16.948 24.591 -9.341 97 1HG2 THR 11 HG21 THR 11 -15.564 26.412 -8.693 98 2HG2 THR 11 HG22 THR 11 -14.604 26.173 -7.222 99 3HG2 THR 11 HG23 THR 11 -14.238 25.239 -8.682 100 H GLY 12 H GLY 12 -15.991 21.149 -6.362 101 1HA GLY 12 HA1 GLY 12 -16.868 21.341 -3.642 102 2HA GLY 12 HA2 GLY 12 -18.218 21.013 -4.761 103 H ASN 13 H ASN 13 -15.941 19.557 -2.878 104 HA ASN 13 HA ASN 13 -14.698 17.592 -4.499 105 1HB ASN 13 HB2 ASN 13 -13.946 18.112 -2.203 106 2HB ASN 13 HB3 ASN 13 -15.492 17.610 -1.551 107 1HD2 ASN 13 HD22 ASN 13 -12.717 16.257 -3.441 108 2HD2 ASN 13 HD21 ASN 13 -12.941 14.616 -2.821 109 H SER 14 H SER 14 -17.686 17.529 -2.645 110 HA SER 14 HA SER 14 -18.379 15.045 -2.245 111 1HB SER 14 HB2 SER 14 -20.285 17.210 -3.192 112 2HB SER 14 HB3 SER 14 -20.622 15.938 -2.004 113 HG SER 14 HG SER 14 -20.026 18.183 -1.291 114 H CYS 15 H CYS 15 -18.413 16.254 -5.544 115 HA CYS 15 HA CYS 15 -19.686 13.704 -6.358 116 1HB CYS 15 HB2 CYS 15 -20.808 14.989 -8.245 117 2HB CYS 15 HB3 CYS 15 -21.476 15.245 -6.632 118 HG CYS 15 HG CYS 15 -21.529 17.534 -7.961 119 H ARG 16 H ARG 16 -18.200 16.511 -8.046 120 HA ARG 16 HA ARG 16 -17.238 14.917 -10.146 121 1HB ARG 16 HB2 ARG 16 -16.412 17.669 -9.127 122 2HB ARG 16 HB3 ARG 16 -15.679 16.962 -10.572 123 1HG ARG 16 HG2 ARG 16 -17.743 16.824 -11.736 124 2HG ARG 16 HG3 ARG 16 -18.702 17.143 -10.290 125 1HD ARG 16 HD2 ARG 16 -16.757 19.166 -11.442 126 2HD ARG 16 HD3 ARG 16 -18.443 19.063 -11.947 127 HE ARG 16 HE ARG 16 -18.696 19.217 -9.232 128 1HH1 ARG 16 HH21 ARG 16 -17.054 21.304 -11.613 129 2HH1 ARG 16 HH22 ARG 16 -16.954 22.643 -10.489 130 1HH2 ARG 16 HH11 ARG 16 -19.059 21.147 -8.111 131 2HH2 ARG 16 HH12 ARG 16 -18.037 22.537 -8.460 132 H SER 17 H SER 17 -15.325 16.053 -7.277 133 HA SER 17 HA SER 17 -12.988 14.708 -8.213 134 1HB SER 17 HB2 SER 17 -13.512 15.442 -5.353 135 2HB SER 17 HB3 SER 17 -11.991 15.502 -6.279 136 HG SER 17 HG SER 17 -12.773 17.570 -5.950 137 H GLN 18 H GLN 18 -15.640 13.754 -6.002 138 HA GLN 18 HA GLN 18 -14.439 11.327 -5.091 139 1HB GLN 18 HB2 GLN 18 -17.355 12.190 -5.432 140 2HB GLN 18 HB3 GLN 18 -16.873 10.676 -4.685 141 1HG GLN 18 HG2 GLN 18 -16.057 13.406 -3.652 142 2HG GLN 18 HG3 GLN 18 -17.394 12.453 -3.029 143 1HE2 GLN 18 HE22 GLN 18 -15.055 13.371 -1.555 144 2HE2 GLN 18 HE21 GLN 18 -14.232 11.941 -0.969 145 H MET 19 H MET 19 -16.501 11.992 -7.999 146 HA MET 19 HA MET 19 -16.512 9.249 -8.895 147 1HB MET 19 HB2 MET 19 -16.845 11.847 -10.463 148 2HB MET 19 HB3 MET 19 -17.079 10.221 -11.116 149 1HG MET 19 HG2 MET 19 -18.774 9.866 -9.214 150 2HG MET 19 HG3 MET 19 -18.725 11.606 -8.997 151 1HE MET 19 HE1 MET 19 -20.176 12.946 -12.385 152 2HE MET 19 HE2 MET 19 -19.528 13.373 -10.782 153 3HE MET 19 HE3 MET 19 -18.454 12.695 -12.029 154 H ALA 20 H ALA 20 -14.380 12.068 -9.704 155 HA ALA 20 HA ALA 20 -12.774 10.780 -11.603 156 1HB ALA 20 HB1 ALA 20 -11.124 12.490 -11.136 157 2HB ALA 20 HB2 ALA 20 -12.728 13.237 -11.038 158 3HB ALA 20 HB3 ALA 20 -11.843 12.836 -9.552 159 H GLU 21 H GLU 21 -12.401 10.898 -8.058 160 HA GLU 21 HA GLU 21 -10.034 9.408 -7.797 161 1HB GLU 21 HB2 GLU 21 -11.007 10.726 -6.015 162 2HB GLU 21 HB3 GLU 21 -12.450 9.706 -5.964 163 1HG GLU 21 HG2 GLU 21 -11.107 7.792 -5.267 164 2HG GLU 21 HG3 GLU 21 -9.637 8.759 -5.324 165 H GLY 22 H GLY 22 -13.450 8.247 -7.989 166 1HA GLY 22 HA1 GLY 22 -12.884 5.508 -7.534 167 2HA GLY 22 HA2 GLY 22 -14.301 6.154 -8.358 168 H TRP 23 H TRP 23 -13.153 7.312 -10.720 169 HA TRP 23 HA TRP 23 -12.613 4.887 -12.239 170 1HB TRP 23 HB2 TRP 23 -12.260 7.808 -13.021 171 2HB TRP 23 HB3 TRP 23 -12.045 6.450 -14.105 172 HD1 TRP 23 HD1 TRP 23 -14.704 8.532 -12.449 173 HE1 TRP 23 HE1 TRP 23 -16.918 8.243 -13.636 174 HE3 TRP 23 HE3 TRP 23 -13.512 4.547 -15.447 175 HZ2 TRP 23 HZ2 TRP 23 -18.045 6.569 -15.688 176 HZ3 TRP 23 HZ3 TRP 23 -15.187 3.669 -17.055 177 HH2 TRP 23 HH2 TRP 23 -17.469 4.709 -17.175 178 H ALA 24 H ALA 24 -10.547 7.494 -10.899 179 HA ALA 24 HA ALA 24 -8.225 6.840 -12.318 180 1HB ALA 24 HB1 ALA 24 -8.470 7.943 -9.473 181 2HB ALA 24 HB2 ALA 24 -7.053 8.104 -10.529 182 3HB ALA 24 HB3 ALA 24 -8.577 8.909 -10.948 183 H LYS 25 H LYS 25 -9.444 5.488 -9.259 184 HA LYS 25 HA LYS 25 -7.173 3.929 -8.610 185 1HB LYS 25 HB2 LYS 25 -10.139 3.550 -8.063 186 2HB LYS 25 HB3 LYS 25 -8.910 2.466 -7.397 187 1HG LYS 25 HG2 LYS 25 -7.866 4.194 -6.130 188 2HG LYS 25 HG3 LYS 25 -8.726 5.473 -6.991 189 1HD LYS 25 HD2 LYS 25 -10.879 4.675 -6.056 190 2HD LYS 25 HD3 LYS 25 -10.005 3.436 -5.117 191 1HE LYS 25 HE2 LYS 25 -8.741 5.196 -3.931 192 2HE LYS 25 HE3 LYS 25 -9.463 6.432 -4.969 193 1HZ LYS 25 HZ1 LYS 25 -10.840 4.849 -2.896 194 2HZ LYS 25 HZ2 LYS 25 -10.679 6.498 -3.006 195 3HZ LYS 25 HZ3 LYS 25 -11.656 5.721 -4.041 196 H GLN 26 H GLN 26 -9.629 3.368 -11.098 197 HA GLN 26 HA GLN 26 -8.866 0.582 -11.523 198 1HB GLN 26 HB2 GLN 26 -10.213 2.449 -13.484 199 2HB GLN 26 HB3 GLN 26 -10.114 0.699 -13.556 200 1HG GLN 26 HG2 GLN 26 -11.540 0.586 -11.477 201 2HG GLN 26 HG3 GLN 26 -11.737 2.353 -11.576 202 1HE2 GLN 26 HE22 GLN 26 -12.042 2.969 -14.132 203 2HE2 GLN 26 HE21 GLN 26 -13.408 2.144 -14.865 204 H TYR 27 H TYR 27 -8.446 3.598 -13.386 205 HA TYR 27 HA TYR 27 -6.768 2.365 -15.327 206 1HB TYR 27 HB2 TYR 27 -7.274 5.305 -14.730 207 2HB TYR 27 HB3 TYR 27 -6.421 4.710 -16.145 208 HD1 TYR 27 HD1 TYR 27 -7.700 2.784 -17.518 209 HD2 TYR 27 HD2 TYR 27 -9.590 5.759 -15.026 210 HE1 TYR 27 HE1 TYR 27 -9.803 2.510 -18.792 211 HE2 TYR 27 HE2 TYR 27 -11.659 5.558 -16.350 212 HH TYR 27 HH TYR 27 -12.746 4.459 -18.110 213 H LEU 28 H LEU 28 -5.889 4.431 -12.530 214 HA LEU 28 HA LEU 28 -3.144 4.719 -13.474 215 1HB LEU 28 HB2 LEU 28 -4.413 5.430 -10.798 216 2HB LEU 28 HB3 LEU 28 -2.825 5.913 -11.346 217 HG LEU 28 HG LEU 28 -5.467 6.805 -12.532 218 1HD1 LEU 28 HD11 LEU 28 -4.781 8.994 -11.709 219 2HD1 LEU 28 HD12 LEU 28 -4.758 7.816 -10.380 220 3HD1 LEU 28 HD13 LEU 28 -3.237 8.337 -11.134 221 1HD2 LEU 28 HD21 LEU 28 -3.909 6.623 -14.398 222 2HD2 LEU 28 HD22 LEU 28 -4.103 8.324 -13.978 223 3HD2 LEU 28 HD23 LEU 28 -2.642 7.453 -13.473 224 H GLY 29 H GLY 29 -4.786 2.854 -10.953 225 1HA GLY 29 HA1 GLY 29 -4.292 0.726 -10.207 226 2HA GLY 29 HA2 GLY 29 -2.799 0.736 -11.146 227 H ASP 30 H ASP 30 -2.375 -0.411 -8.970 228 HA ASP 30 HA ASP 30 -2.181 0.905 -6.504 229 1HB ASP 30 HB2 ASP 30 -2.221 -1.535 -6.860 230 2HB ASP 30 HB3 ASP 30 -0.608 -1.453 -7.581 231 H GLU 31 H GLU 31 -0.057 1.153 -9.208 232 HA GLU 31 HA GLU 31 2.397 1.987 -8.067 233 1HB GLU 31 HB2 GLU 31 2.090 1.483 -10.426 234 2HB GLU 31 HB3 GLU 31 0.866 2.730 -10.600 235 1HG GLU 31 HG2 GLU 31 2.602 4.478 -10.198 236 2HG GLU 31 HG3 GLU 31 3.826 3.212 -10.090 237 H TRP 32 H TRP 32 -0.734 3.492 -7.902 238 HA TRP 32 HA TRP 32 0.524 6.010 -6.924 239 1HB TRP 32 HB2 TRP 32 -2.156 5.772 -8.332 240 2HB TRP 32 HB3 TRP 32 -1.351 7.242 -7.837 241 HD1 TRP 32 HD1 TRP 32 -0.602 4.346 -10.297 242 HE1 TRP 32 HE1 TRP 32 -0.064 5.332 -12.583 243 HE3 TRP 32 HE3 TRP 32 -0.713 9.318 -9.071 244 HZ2 TRP 32 HZ2 TRP 32 0.038 7.912 -13.793 245 HZ3 TRP 32 HZ3 TRP 32 -0.498 11.026 -10.858 246 HH2 TRP 32 HH2 TRP 32 -0.199 10.323 -13.225 247 H LYS 33 H LYS 33 -0.766 7.168 -5.437 248 HA LYS 33 HA LYS 33 -2.873 5.692 -3.902 249 1HB LYS 33 HB2 LYS 33 -0.867 7.811 -3.084 250 2HB LYS 33 HB3 LYS 33 -2.312 7.379 -2.137 251 1HG LYS 33 HG2 LYS 33 -1.497 4.920 -2.375 252 2HG LYS 33 HG3 LYS 33 0.058 5.612 -2.874 253 1HD LYS 33 HD2 LYS 33 -1.460 6.184 -0.314 254 2HD LYS 33 HD3 LYS 33 -0.092 5.059 -0.464 255 1HE LYS 33 HE2 LYS 33 1.187 7.148 -1.449 256 2HE LYS 33 HE3 LYS 33 -0.083 8.099 -0.669 257 1HZ LYS 33 HZ1 LYS 33 0.587 6.962 1.441 258 2HZ LYS 33 HZ2 LYS 33 1.808 6.212 0.615 259 3HZ LYS 33 HZ3 LYS 33 1.808 7.839 0.797 260 H VAL 34 H VAL 34 -4.799 6.922 -3.600 261 HA VAL 34 HA VAL 34 -5.039 9.307 -5.381 262 HB VAL 34 HB VAL 34 -7.020 7.002 -5.355 263 1HG1 VAL 34 HG11 VAL 34 -7.997 8.025 -7.240 264 2HG1 VAL 34 HG12 VAL 34 -7.670 9.385 -6.157 265 3HG1 VAL 34 HG13 VAL 34 -6.599 9.077 -7.529 266 1HG2 VAL 34 HG21 VAL 34 -4.751 7.398 -7.348 267 2HG2 VAL 34 HG22 VAL 34 -5.026 5.990 -6.299 268 3HG2 VAL 34 HG23 VAL 34 -6.155 6.342 -7.604 269 H TYR 35 H TYR 35 -5.952 10.922 -4.322 270 HA TYR 35 HA TYR 35 -8.253 10.351 -2.575 271 1HB TYR 35 HB2 TYR 35 -6.679 12.599 -1.531 272 2HB TYR 35 HB3 TYR 35 -7.542 11.343 -0.691 273 HD1 TYR 35 HD1 TYR 35 -4.327 12.540 -1.901 274 HD2 TYR 35 HD2 TYR 35 -6.352 9.166 -0.133 275 HE1 TYR 35 HE1 TYR 35 -2.180 11.714 -1.056 276 HE2 TYR 35 HE2 TYR 35 -4.182 8.281 0.668 277 HH TYR 35 HH TYR 35 -1.906 8.686 0.885 278 H SER 36 H SER 36 -9.392 12.533 -2.108 279 HA SER 36 HA SER 36 -9.003 14.496 -4.275 280 1HB SER 36 HB2 SER 36 -11.427 14.428 -4.695 281 2HB SER 36 HB3 SER 36 -10.651 12.904 -5.141 282 HG SER 36 HG SER 36 -11.506 11.931 -3.401 283 H ALA 37 H ALA 37 -9.833 16.548 -3.797 284 HA ALA 37 HA ALA 37 -11.276 16.955 -1.264 285 1HB ALA 37 HB1 ALA 37 -9.854 18.742 -0.619 286 2HB ALA 37 HB2 ALA 37 -8.858 17.305 -0.814 287 3HB ALA 37 HB3 ALA 37 -8.833 18.574 -2.079 288 H GLY 38 H GLY 38 -11.372 19.761 -1.515 289 1HA GLY 38 HA1 GLY 38 -11.881 20.668 -4.164 290 2HA GLY 38 HA2 GLY 38 -13.400 20.292 -3.337 291 H ILE 39 H ILE 39 -13.111 22.832 -4.008 292 HA ILE 39 HA ILE 39 -11.994 24.637 -2.088 293 HB ILE 39 HB ILE 39 -14.308 24.694 -4.035 294 1HG1 ILE 39 HG12 ILE 39 -13.078 26.583 -5.022 295 2HG1 ILE 39 HG13 ILE 39 -11.872 26.496 -3.738 296 1HG2 ILE 39 HG21 ILE 39 -14.772 27.065 -3.525 297 2HG2 ILE 39 HG22 ILE 39 -15.258 25.983 -2.230 298 3HG2 ILE 39 HG23 ILE 39 -13.760 26.938 -2.069 299 1HD1 ILE 39 HD11 ILE 39 -11.116 25.547 -5.903 300 2HD1 ILE 39 HD12 ILE 39 -11.065 24.348 -4.603 301 3HD1 ILE 39 HD13 ILE 39 -12.378 24.321 -5.809 302 H GLU 40 H GLU 40 -15.040 22.776 -2.201 303 HA GLU 40 HA GLU 40 -15.070 22.797 0.731 304 1HB GLU 40 HB2 GLU 40 -17.398 23.391 0.926 305 2HB GLU 40 HB3 GLU 40 -16.490 24.690 0.166 306 1HG GLU 40 HG2 GLU 40 -17.324 23.931 -2.081 307 2HG GLU 40 HG3 GLU 40 -18.286 22.680 -1.288 308 H ALA 41 H ALA 41 -16.945 21.247 1.455 309 HA ALA 41 HA ALA 41 -17.437 18.930 -0.296 310 1HB ALA 41 HB1 ALA 41 -15.817 18.817 2.295 311 2HB ALA 41 HB2 ALA 41 -16.429 17.422 1.399 312 3HB ALA 41 HB3 ALA 41 -15.207 18.476 0.658 313 H HIS 42 H HIS 42 -19.069 17.604 0.654 314 HA HIS 42 HA HIS 42 -20.374 18.536 3.180 315 1HB HIS 42 HB2 HIS 42 -21.724 17.852 0.531 316 2HB HIS 42 HB3 HIS 42 -22.565 17.932 2.068 317 HD1 HIS 42 HD1 HIS 42 -20.336 20.814 2.232 318 HD2 HIS 42 HD2 HIS 42 -23.904 19.773 0.254 319 HE1 HIS 42 HE1 HIS 42 -21.483 23.009 1.618 320 H GLY 43 H GLY 43 -19.663 15.866 0.860 321 1HA GLY 43 HA1 GLY 43 -19.378 13.752 2.576 322 2HA GLY 43 HA2 GLY 43 -21.138 13.908 2.384 323 H LEU 44 H LEU 44 -20.596 11.672 1.331 324 HA LEU 44 HA LEU 44 -19.735 11.829 -1.487 325 1HB LEU 44 HB2 LEU 44 -20.595 9.695 0.437 326 2HB LEU 44 HB3 LEU 44 -21.067 9.449 -1.229 327 HG LEU 44 HG LEU 44 -18.906 8.419 -0.556 328 1HD1 LEU 44 HD11 LEU 44 -18.873 10.325 -2.917 329 2HD1 LEU 44 HD12 LEU 44 -17.724 8.996 -2.651 330 3HD1 LEU 44 HD13 LEU 44 -19.435 8.633 -2.855 331 1HD2 LEU 44 HD21 LEU 44 -17.761 11.228 -0.656 332 2HD2 LEU 44 HD22 LEU 44 -17.981 10.253 0.814 333 3HD2 LEU 44 HD23 LEU 44 -16.868 9.726 -0.461 334 H ASN 45 H ASN 45 -21.101 12.954 -2.855 335 HA ASN 45 HA ASN 45 -23.841 13.453 -2.122 336 1HB ASN 45 HB2 ASN 45 -22.333 14.976 -3.492 337 2HB ASN 45 HB3 ASN 45 -22.516 13.844 -4.838 338 1HD2 ASN 45 HD22 ASN 45 -24.286 14.270 -6.196 339 2HD2 ASN 45 HD21 ASN 45 -25.690 15.189 -5.700 340 HA PRO 46 HA PRO 46 -25.181 9.499 -3.390 341 1HB PRO 46 HB2 PRO 46 -27.899 9.806 -3.829 342 2HB PRO 46 HB3 PRO 46 -27.111 9.738 -2.225 343 1HG PRO 46 HG2 PRO 46 -27.916 12.189 -3.809 344 2HG PRO 46 HG3 PRO 46 -28.177 11.856 -2.066 345 1HD PRO 46 HD2 PRO 46 -26.127 13.402 -2.942 346 2HD PRO 46 HD3 PRO 46 -25.902 12.289 -1.556 347 H ASN 47 H ASN 47 -25.958 12.164 -5.661 348 HA ASN 47 HA ASN 47 -26.548 10.447 -7.861 349 1HB ASN 47 HB2 ASN 47 -26.658 12.270 -9.131 350 2HB ASN 47 HB3 ASN 47 -26.654 13.161 -7.627 351 1HD2 ASN 47 HD22 ASN 47 -25.273 13.011 -10.707 352 2HD2 ASN 47 HD21 ASN 47 -23.744 13.788 -10.364 353 H ALA 48 H ALA 48 -23.438 11.572 -6.514 354 HA ALA 48 HA ALA 48 -21.888 10.577 -8.741 355 1HB ALA 48 HB1 ALA 48 -19.968 11.025 -7.202 356 2HB ALA 48 HB2 ALA 48 -21.076 12.405 -7.378 357 3HB ALA 48 HB3 ALA 48 -21.107 11.403 -5.902 358 H VAL 49 H VAL 49 -22.914 9.367 -5.560 359 HA VAL 49 HA VAL 49 -21.415 6.932 -5.544 360 HB VAL 49 HB VAL 49 -24.053 7.703 -4.262 361 1HG1 VAL 49 HG11 VAL 49 -24.214 5.315 -4.551 362 2HG1 VAL 49 HG12 VAL 49 -22.516 5.089 -4.109 363 3HG1 VAL 49 HG13 VAL 49 -23.703 5.603 -2.883 364 1HG2 VAL 49 HG21 VAL 49 -22.717 7.760 -2.228 365 2HG2 VAL 49 HG22 VAL 49 -21.283 7.201 -3.115 366 3HG2 VAL 49 HG23 VAL 49 -21.963 8.808 -3.443 367 H LYS 50 H LYS 50 -24.847 7.571 -6.655 368 HA LYS 50 HA LYS 50 -25.069 4.920 -7.632 369 1HB LYS 50 HB2 LYS 50 -26.965 6.547 -7.105 370 2HB LYS 50 HB3 LYS 50 -26.665 7.289 -8.689 371 1HG LYS 50 HG2 LYS 50 -27.031 5.029 -9.754 372 2HG LYS 50 HG3 LYS 50 -27.355 4.357 -8.148 373 1HD LYS 50 HD2 LYS 50 -29.308 5.901 -7.919 374 2HD LYS 50 HD3 LYS 50 -28.943 6.565 -9.514 375 1HE LYS 50 HE2 LYS 50 -30.734 5.018 -9.798 376 2HE LYS 50 HE3 LYS 50 -29.293 4.315 -10.534 377 1HZ LYS 50 HZ1 LYS 50 -30.529 2.703 -9.217 378 2HZ LYS 50 HZ2 LYS 50 -29.058 2.915 -8.551 379 3HZ LYS 50 HZ3 LYS 50 -30.382 3.596 -7.867 380 H ALA 51 H ALA 51 -24.098 7.941 -9.317 381 HA ALA 51 HA ALA 51 -23.993 6.979 -11.918 382 1HB ALA 51 HB1 ALA 51 -22.141 8.951 -10.495 383 2HB ALA 51 HB2 ALA 51 -22.231 8.752 -12.257 384 3HB ALA 51 HB3 ALA 51 -23.643 9.345 -11.362 385 H MET 52 H MET 52 -21.368 6.754 -9.423 386 HA MET 52 HA MET 52 -19.634 5.273 -11.189 387 1HB MET 52 HB2 MET 52 -19.687 5.790 -8.198 388 2HB MET 52 HB3 MET 52 -18.354 5.010 -9.050 389 1HG MET 52 HG2 MET 52 -19.398 7.826 -9.542 390 2HG MET 52 HG3 MET 52 -17.905 7.404 -8.714 391 1HE MET 52 HE1 MET 52 -15.724 6.653 -9.839 392 2HE MET 52 HE2 MET 52 -16.637 5.197 -10.282 393 3HE MET 52 HE3 MET 52 -15.639 5.999 -11.490 394 H LYS 53 H LYS 53 -21.920 4.390 -8.566 395 HA LYS 53 HA LYS 53 -21.145 1.695 -8.353 396 1HB LYS 53 HB2 LYS 53 -22.885 3.270 -6.978 397 2HB LYS 53 HB3 LYS 53 -24.047 2.350 -7.932 398 1HG LYS 53 HG2 LYS 53 -22.969 0.248 -6.999 399 2HG LYS 53 HG3 LYS 53 -21.879 1.289 -6.056 400 1HD LYS 53 HD2 LYS 53 -24.015 2.385 -5.073 401 2HD LYS 53 HD3 LYS 53 -24.905 1.078 -5.850 402 1HE LYS 53 HE2 LYS 53 -24.644 0.208 -3.739 403 2HE LYS 53 HE3 LYS 53 -23.262 -0.515 -4.562 404 1HZ LYS 53 HZ1 LYS 53 -22.672 0.412 -2.403 405 2HZ LYS 53 HZ2 LYS 53 -21.860 1.248 -3.538 406 3HZ LYS 53 HZ3 LYS 53 -23.177 1.900 -2.826 407 H GLU 54 H GLU 54 -23.408 3.268 -10.588 408 HA GLU 54 HA GLU 54 -24.305 0.907 -11.894 409 1HB GLU 54 HB2 GLU 54 -24.200 3.854 -12.636 410 2HB GLU 54 HB3 GLU 54 -24.845 2.663 -13.760 411 1HG GLU 54 HG2 GLU 54 -25.878 3.022 -10.919 412 2HG GLU 54 HG3 GLU 54 -26.554 3.832 -12.328 413 H VAL 55 H VAL 55 -21.219 2.577 -12.160 414 HA VAL 55 HA VAL 55 -20.508 1.309 -14.726 415 HB VAL 55 HB VAL 55 -18.643 2.526 -12.638 416 1HG1 VAL 55 HG11 VAL 55 -18.282 2.083 -15.629 417 2HG1 VAL 55 HG12 VAL 55 -17.138 2.916 -14.554 418 3HG1 VAL 55 HG13 VAL 55 -17.454 1.202 -14.326 419 1HG2 VAL 55 HG21 VAL 55 -18.668 4.610 -13.917 420 2HG2 VAL 55 HG22 VAL 55 -19.900 3.950 -15.020 421 3HG2 VAL 55 HG23 VAL 55 -20.270 4.250 -13.306 422 H GLY 56 H GLY 56 -20.594 0.547 -11.309 423 1HA GLY 56 HA1 GLY 56 -20.248 -1.617 -10.398 424 2HA GLY 56 HA2 GLY 56 -19.101 -2.004 -11.691 425 H ILE 57 H ILE 57 -19.040 1.195 -10.098 426 HA ILE 57 HA ILE 57 -16.512 0.466 -8.676 427 HB ILE 57 HB ILE 57 -17.259 3.072 -10.052 428 1HG1 ILE 57 HG12 ILE 57 -15.102 1.062 -10.832 429 2HG1 ILE 57 HG13 ILE 57 -16.636 1.296 -11.674 430 1HG2 ILE 57 HG21 ILE 57 -14.968 3.807 -9.381 431 2HG2 ILE 57 HG22 ILE 57 -15.921 3.401 -7.965 432 3HG2 ILE 57 HG23 ILE 57 -14.704 2.257 -8.568 433 1HD1 ILE 57 HD11 ILE 57 -15.088 2.518 -12.933 434 2HD1 ILE 57 HD12 ILE 57 -15.983 3.727 -12.025 435 3HD1 ILE 57 HD13 ILE 57 -14.335 3.255 -11.508 436 H ASP 58 H ASP 58 -17.302 0.234 -6.602 437 HA ASP 58 HA ASP 58 -19.436 2.018 -5.625 438 1HB ASP 58 HB2 ASP 58 -19.257 -0.144 -4.498 439 2HB ASP 58 HB3 ASP 58 -17.568 0.197 -4.045 440 H ILE 59 H ILE 59 -19.070 4.030 -4.920 441 HA ILE 59 HA ILE 59 -16.363 4.740 -3.997 442 HB ILE 59 HB ILE 59 -16.662 6.987 -4.711 443 1HG1 ILE 59 HG12 ILE 59 -19.272 6.323 -6.107 444 2HG1 ILE 59 HG13 ILE 59 -19.255 6.910 -4.458 445 1HG2 ILE 59 HG21 ILE 59 -17.282 5.169 -7.048 446 2HG2 ILE 59 HG22 ILE 59 -16.469 6.754 -7.097 447 3HG2 ILE 59 HG23 ILE 59 -15.687 5.383 -6.298 448 1HD1 ILE 59 HD11 ILE 59 -17.916 8.889 -5.195 449 2HD1 ILE 59 HD12 ILE 59 -18.242 8.429 -6.870 450 3HD1 ILE 59 HD13 ILE 59 -19.581 8.826 -5.763 451 H SER 60 H SER 60 -19.409 3.957 -2.890 452 HA SER 60 HA SER 60 -20.024 6.153 -1.245 453 1HB SER 60 HB2 SER 60 -20.624 3.304 -0.374 454 2HB SER 60 HB3 SER 60 -21.645 4.742 -0.252 455 HG SER 60 HG SER 60 -21.045 3.091 -2.480 456 H ASN 61 H ASN 61 -17.811 3.446 -0.893 457 HA ASN 61 HA ASN 61 -17.181 3.612 1.865 458 1HB ASN 61 HB2 ASN 61 -15.301 2.219 1.334 459 2HB ASN 61 HB3 ASN 61 -16.645 1.685 0.336 460 1HD2 ASN 61 HD22 ASN 61 -16.568 2.114 -1.979 461 2HD2 ASN 61 HD21 ASN 61 -15.079 2.578 -2.771 462 H GLN 62 H GLN 62 -16.375 5.866 -0.657 463 HA GLN 62 HA GLN 62 -13.836 6.723 0.447 464 1HB GLN 62 HB2 GLN 62 -15.635 8.055 -1.615 465 2HB GLN 62 HB3 GLN 62 -13.947 8.461 -1.265 466 1HG GLN 62 HG2 GLN 62 -13.294 6.144 -1.962 467 2HG GLN 62 HG3 GLN 62 -14.963 5.836 -2.430 468 1HE2 GLN 62 HE22 GLN 62 -14.780 8.965 -3.482 469 2HE2 GLN 62 HE21 GLN 62 -14.256 8.617 -5.116 470 H THR 63 H THR 63 -13.811 9.308 0.835 471 HA THR 63 HA THR 63 -16.137 10.247 2.312 472 HB THR 63 HB THR 63 -14.439 11.015 4.155 473 HG1 THR 63 HG1 THR 63 -12.547 10.225 3.197 474 1HG2 THR 63 HG21 THR 63 -14.886 9.059 5.507 475 2HG2 THR 63 HG22 THR 63 -16.311 9.412 4.515 476 3HG2 THR 63 HG23 THR 63 -15.229 8.075 4.068 477 H SER 64 H SER 64 -16.108 12.590 2.581 478 HA SER 64 HA SER 64 -14.505 13.882 0.467 479 1HB SER 64 HB2 SER 64 -17.162 14.622 1.768 480 2HB SER 64 HB3 SER 64 -16.389 15.482 0.427 481 HG SER 64 HG SER 64 -17.980 13.961 -0.276 482 H ASP 65 H ASP 65 -13.539 15.884 0.831 483 HA ASP 65 HA ASP 65 -13.509 17.100 3.479 484 1HB ASP 65 HB2 ASP 65 -11.754 15.220 3.527 485 2HB ASP 65 HB3 ASP 65 -10.913 16.098 2.238 486 H ILE 66 H ILE 66 -12.301 19.186 3.359 487 HA ILE 66 HA ILE 66 -12.378 20.321 0.631 488 HB ILE 66 HB ILE 66 -12.551 22.409 1.585 489 1HG1 ILE 66 HG12 ILE 66 -11.665 21.258 4.251 490 2HG1 ILE 66 HG13 ILE 66 -10.799 22.423 3.225 491 1HG2 ILE 66 HG21 ILE 66 -14.576 22.291 2.858 492 2HG2 ILE 66 HG22 ILE 66 -14.524 20.812 1.882 493 3HG2 ILE 66 HG23 ILE 66 -14.120 20.748 3.600 494 1HD1 ILE 66 HD11 ILE 66 -13.344 22.875 4.801 495 2HD1 ILE 66 HD12 ILE 66 -11.776 23.682 4.996 496 3HD1 ILE 66 HD13 ILE 66 -12.771 24.000 3.546 497 H ILE 67 H ILE 67 -10.480 21.736 0.089 498 HA ILE 67 HA ILE 67 -8.290 20.096 -0.137 499 HB ILE 67 HB ILE 67 -8.871 21.752 -1.707 500 1HG1 ILE 67 HG12 ILE 67 -6.484 20.915 -1.430 501 2HG1 ILE 67 HG13 ILE 67 -6.791 22.257 -2.505 502 1HG2 ILE 67 HG21 ILE 67 -9.711 23.589 -0.420 503 2HG2 ILE 67 HG22 ILE 67 -8.103 23.908 0.282 504 3HG2 ILE 67 HG23 ILE 67 -8.396 24.150 -1.451 505 1HD1 ILE 67 HD11 ILE 67 -5.850 23.865 -1.043 506 2HD1 ILE 67 HD12 ILE 67 -5.756 22.735 0.314 507 3HD1 ILE 67 HD13 ILE 67 -4.730 22.490 -1.098 508 H ASP 68 H ASP 68 -6.420 19.728 0.749 509 HA ASP 68 HA ASP 68 -5.611 21.237 3.186 510 1HB ASP 68 HB2 ASP 68 -6.541 19.013 3.744 511 2HB ASP 68 HB3 ASP 68 -5.350 18.251 2.678 512 H SER 69 H SER 69 -3.773 22.301 2.758 513 HA SER 69 HA SER 69 -2.198 21.958 0.451 514 1HB SER 69 HB2 SER 69 -0.568 23.394 1.912 515 2HB SER 69 HB3 SER 69 -2.086 24.069 1.308 516 HG SER 69 HG SER 69 -1.767 24.505 3.539 517 H ASP 70 H ASP 70 -2.134 20.344 3.583 518 HA ASP 70 HA ASP 70 0.572 19.452 3.490 519 1HB ASP 70 HB2 ASP 70 -0.825 19.756 5.548 520 2HB ASP 70 HB3 ASP 70 -1.718 18.299 5.096 521 H ILE 71 H ILE 71 -1.894 18.509 1.470 522 HA ILE 71 HA ILE 71 -0.472 15.927 0.895 523 HB ILE 71 HB ILE 71 -3.441 16.568 0.577 524 1HG1 ILE 71 HG12 ILE 71 -1.995 14.336 2.075 525 2HG1 ILE 71 HG13 ILE 71 -2.665 15.788 2.835 526 1HG2 ILE 71 HG21 ILE 71 -1.900 14.134 -0.446 527 2HG2 ILE 71 HG22 ILE 71 -3.665 14.355 -0.506 528 3HG2 ILE 71 HG23 ILE 71 -2.633 15.397 -1.458 529 1HD1 ILE 71 HD11 ILE 71 -4.223 14.018 3.199 530 2HD1 ILE 71 HD12 ILE 71 -4.947 15.113 2.004 531 3HD1 ILE 71 HD13 ILE 71 -4.238 13.558 1.493 532 H LEU 72 H LEU 72 -2.380 18.676 -0.419 533 HA LEU 72 HA LEU 72 -1.869 18.514 -3.093 534 1HB LEU 72 HB2 LEU 72 -3.209 20.251 -1.911 535 2HB LEU 72 HB3 LEU 72 -1.726 20.887 -1.228 536 HG LEU 72 HG LEU 72 -1.071 21.237 -3.805 537 1HD1 LEU 72 HD11 LEU 72 -4.120 21.445 -3.784 538 2HD1 LEU 72 HD12 LEU 72 -3.048 21.957 -5.100 539 3HD1 LEU 72 HD13 LEU 72 -3.173 20.242 -4.680 540 1HD2 LEU 72 HD21 LEU 72 -2.898 23.016 -2.168 541 2HD2 LEU 72 HD22 LEU 72 -1.130 22.941 -2.058 542 3HD2 LEU 72 HD23 LEU 72 -1.908 23.546 -3.543 543 H ASN 73 H ASN 73 0.342 20.098 -0.715 544 HA ASN 73 HA ASN 73 2.215 20.833 -2.690 545 1HB ASN 73 HB2 ASN 73 3.434 21.826 -1.042 546 2HB ASN 73 HB3 ASN 73 1.845 21.794 -0.284 547 1HD2 ASN 73 HD22 ASN 73 1.465 20.020 1.309 548 2HD2 ASN 73 HD21 ASN 73 2.833 19.510 2.287 549 H ASN 74 H ASN 74 1.718 17.686 -1.645 550 HA ASN 74 HA ASN 74 4.474 16.888 -2.408 551 1HB ASN 74 HB2 ASN 74 4.481 15.160 -0.660 552 2HB ASN 74 HB3 ASN 74 4.445 16.783 0.008 553 1HD2 ASN 74 HD22 ASN 74 2.684 17.452 1.222 554 2HD2 ASN 74 HD21 ASN 74 1.437 16.358 1.767 555 H ALA 75 H ALA 75 1.341 16.762 -3.380 556 HA ALA 75 HA ALA 75 1.135 14.000 -4.104 557 1HB ALA 75 HB1 ALA 75 -0.104 16.487 -5.345 558 2HB ALA 75 HB2 ALA 75 -0.591 14.810 -5.673 559 3HB ALA 75 HB3 ALA 75 -0.826 15.500 -4.056 560 H ASP 76 H ASP 76 1.636 13.146 -6.334 561 HA ASP 76 HA ASP 76 4.041 14.379 -7.531 562 1HB ASP 76 HB2 ASP 76 3.780 11.906 -7.514 563 2HB ASP 76 HB3 ASP 76 2.309 12.061 -8.485 564 H LEU 77 H LEU 77 0.547 14.161 -7.993 565 HA LEU 77 HA LEU 77 0.625 16.225 -10.104 566 1HB LEU 77 HB2 LEU 77 0.573 14.169 -11.310 567 2HB LEU 77 HB3 LEU 77 -0.632 13.475 -10.212 568 HG LEU 77 HG LEU 77 -2.309 15.136 -11.067 569 1HD1 LEU 77 HD11 LEU 77 -0.721 16.837 -12.008 570 2HD1 LEU 77 HD12 LEU 77 -0.244 15.654 -13.250 571 3HD1 LEU 77 HD13 LEU 77 -1.894 16.274 -13.195 572 1HD2 LEU 77 HD21 LEU 77 -2.200 12.814 -11.888 573 2HD2 LEU 77 HD22 LEU 77 -2.711 13.921 -13.170 574 3HD2 LEU 77 HD23 LEU 77 -1.048 13.295 -13.141 575 H VAL 78 H VAL 78 -1.044 17.558 -10.048 576 HA VAL 78 HA VAL 78 -3.344 17.093 -8.203 577 HB VAL 78 HB VAL 78 -1.653 19.577 -8.725 578 1HG1 VAL 78 HG11 VAL 78 -4.029 20.308 -8.798 579 2HG1 VAL 78 HG12 VAL 78 -4.334 19.493 -7.249 580 3HG1 VAL 78 HG13 VAL 78 -3.226 20.886 -7.341 581 1HG2 VAL 78 HG21 VAL 78 -0.948 18.017 -6.881 582 2HG2 VAL 78 HG22 VAL 78 -1.354 19.645 -6.323 583 3HG2 VAL 78 HG23 VAL 78 -2.499 18.296 -6.085 584 H VAL 79 H VAL 79 -5.329 17.367 -9.336 585 HA VAL 79 HA VAL 79 -5.101 18.909 -11.848 586 HB VAL 79 HB VAL 79 -6.517 17.599 -13.162 587 1HG1 VAL 79 HG11 VAL 79 -4.468 15.681 -11.984 588 2HG1 VAL 79 HG12 VAL 79 -5.122 15.706 -13.637 589 3HG1 VAL 79 HG13 VAL 79 -4.076 17.023 -13.077 590 1HG2 VAL 79 HG21 VAL 79 -7.326 15.371 -12.524 591 2HG2 VAL 79 HG22 VAL 79 -6.728 15.627 -10.864 592 3HG2 VAL 79 HG23 VAL 79 -8.028 16.653 -11.538 593 H THR 80 H THR 80 -6.535 20.401 -12.154 594 HA THR 80 HA THR 80 -8.526 20.829 -9.999 595 HB THR 80 HB THR 80 -8.446 23.191 -10.997 596 HG1 THR 80 HG1 THR 80 -7.399 22.746 -12.921 597 1HG2 THR 80 HG21 THR 80 -6.114 21.813 -9.588 598 2HG2 THR 80 HG22 THR 80 -6.106 23.548 -9.914 599 3HG2 THR 80 HG23 THR 80 -7.375 22.845 -8.904 600 H LEU 81 H LEU 81 -10.227 19.684 -10.561 601 HA LEU 81 HA LEU 81 -10.771 18.772 -13.188 602 1HB LEU 81 HB2 LEU 81 -12.405 18.794 -10.630 603 2HB LEU 81 HB3 LEU 81 -12.906 17.923 -12.076 604 HG LEU 81 HG LEU 81 -10.300 17.406 -10.560 605 1HD1 LEU 81 HD11 LEU 81 -11.408 15.348 -9.780 606 2HD1 LEU 81 HD12 LEU 81 -12.203 16.805 -9.174 607 3HD1 LEU 81 HD13 LEU 81 -12.934 15.885 -10.515 608 1HD2 LEU 81 HD21 LEU 81 -11.679 15.955 -12.858 609 2HD2 LEU 81 HD22 LEU 81 -10.074 16.731 -12.866 610 3HD2 LEU 81 HD23 LEU 81 -10.347 15.268 -11.922 611 H CYS 82 H CYS 82 -11.522 21.882 -11.941 612 HA CYS 82 HA CYS 82 -13.083 22.337 -14.322 613 1HB CYS 82 HB2 CYS 82 -14.822 21.726 -12.663 614 2HB CYS 82 HB3 CYS 82 -14.280 23.056 -11.612 615 HG CYS 82 HG CYS 82 -16.541 23.611 -12.956 616 H GLY 83 H GLY 83 -12.871 24.538 -14.982 617 1HA GLY 83 HA1 GLY 83 -10.328 25.556 -14.477 618 2HA GLY 83 HA2 GLY 83 -11.627 26.412 -15.327 619 H ASP 84 H ASP 84 -13.487 26.663 -13.124 620 HA ASP 84 HA ASP 84 -12.417 28.991 -11.857 621 1HB ASP 84 HB2 ASP 84 -14.833 28.595 -12.309 622 2HB ASP 84 HB3 ASP 84 -14.849 27.355 -11.051 623 H ALA 85 H ALA 85 -12.290 25.597 -10.973 624 HA ALA 85 HA ALA 85 -11.772 26.013 -8.144 625 1HB ALA 85 HB1 ALA 85 -10.973 23.564 -9.762 626 2HB ALA 85 HB2 ALA 85 -11.415 23.682 -8.054 627 3HB ALA 85 HB3 ALA 85 -12.661 23.843 -9.303 628 H ALA 86 H ALA 86 -9.882 26.180 -11.100 629 HA ALA 86 HA ALA 86 -7.447 25.190 -10.116 630 1HB ALA 86 HB1 ALA 86 -8.046 25.398 -12.513 631 2HB ALA 86 HB2 ALA 86 -7.876 27.170 -12.380 632 3HB ALA 86 HB3 ALA 86 -6.468 26.125 -12.140 633 H ASP 87 H ASP 87 -8.865 28.322 -9.566 634 HA ASP 87 HA ASP 87 -6.534 29.807 -8.916 635 1HB ASP 87 HB2 ASP 87 -8.759 30.818 -9.137 636 2HB ASP 87 HB3 ASP 87 -9.338 29.895 -7.745 637 H LYS 88 H LYS 88 -8.273 27.268 -7.162 638 HA LYS 88 HA LYS 88 -7.006 27.969 -4.616 639 1HB LYS 88 HB2 LYS 88 -9.451 27.278 -4.932 640 2HB LYS 88 HB3 LYS 88 -8.857 25.646 -5.223 641 1HG LYS 88 HG2 LYS 88 -9.535 25.743 -2.974 642 2HG LYS 88 HG3 LYS 88 -7.765 25.744 -2.930 643 1HD LYS 88 HD2 LYS 88 -7.729 28.153 -2.484 644 2HD LYS 88 HD3 LYS 88 -9.492 28.254 -2.723 645 1HE LYS 88 HE2 LYS 88 -9.837 26.692 -0.841 646 2HE LYS 88 HE3 LYS 88 -8.091 26.587 -0.588 647 1HZ LYS 88 HZ1 LYS 88 -8.095 28.967 -0.057 648 2HZ LYS 88 HZ2 LYS 88 -9.711 29.059 -0.287 649 3HZ LYS 88 HZ3 LYS 88 -9.109 28.169 0.936 650 H CYS 89 H CYS 89 -4.892 27.574 -5.914 651 HA CYS 89 HA CYS 89 -3.927 24.833 -5.183 652 1HB CYS 89 HB2 CYS 89 -2.910 26.569 -7.467 653 2HB CYS 89 HB3 CYS 89 -2.208 25.041 -6.917 654 HG CYS 89 HG CYS 89 -5.075 25.734 -8.359 655 HA PRO 90 HA PRO 90 -2.312 28.345 -2.656 656 1HB PRO 90 HB2 PRO 90 -2.066 27.001 -0.216 657 2HB PRO 90 HB3 PRO 90 -3.483 27.924 -0.793 658 1HG PRO 90 HG2 PRO 90 -2.998 24.953 -0.921 659 2HG PRO 90 HG3 PRO 90 -4.511 25.816 -0.507 660 1HD PRO 90 HD2 PRO 90 -4.144 24.775 -2.979 661 2HD PRO 90 HD3 PRO 90 -4.940 26.357 -2.759 662 H MET 91 H MET 91 -0.876 25.108 -2.969 663 HA MET 91 HA MET 91 1.714 26.311 -3.296 664 1HB MET 91 HB2 MET 91 1.579 26.170 -0.817 665 2HB MET 91 HB3 MET 91 1.314 24.429 -0.920 666 1HG MET 91 HG2 MET 91 3.531 24.049 -1.699 667 2HG MET 91 HG3 MET 91 3.737 25.729 -2.192 668 1HE MET 91 HE1 MET 91 3.807 24.431 2.278 669 2HE MET 91 HE2 MET 91 2.327 24.403 1.299 670 3HE MET 91 HE3 MET 91 3.653 23.262 0.957 671 H THR 92 H THR 92 1.818 25.373 -5.332 672 HA THR 92 HA THR 92 2.076 22.405 -5.407 673 HB THR 92 HB THR 92 1.111 22.502 -7.726 674 HG1 THR 92 HG1 THR 92 1.210 24.785 -8.014 675 1HG2 THR 92 HG21 THR 92 -1.189 22.475 -7.019 676 2HG2 THR 92 HG22 THR 92 -0.172 21.694 -5.799 677 3HG2 THR 92 HG23 THR 92 -0.787 23.340 -5.522 678 HA PRO 93 HA PRO 93 5.964 24.591 -6.761 679 1HB PRO 93 HB2 PRO 93 7.749 22.986 -5.405 680 2HB PRO 93 HB3 PRO 93 6.901 24.368 -4.652 681 1HG PRO 93 HG2 PRO 93 6.143 21.432 -4.556 682 2HG PRO 93 HG3 PRO 93 6.275 22.586 -3.189 683 1HD PRO 93 HD2 PRO 93 3.890 22.020 -4.347 684 2HD PRO 93 HD3 PRO 93 4.274 23.676 -3.796 685 HA PRO 94 HA PRO 94 6.961 21.924 -10.136 686 1HB PRO 94 HB2 PRO 94 9.810 21.690 -9.139 687 2HB PRO 94 HB3 PRO 94 9.226 21.999 -10.807 688 1HG PRO 94 HG2 PRO 94 10.084 24.062 -9.286 689 2HG PRO 94 HG3 PRO 94 8.570 24.234 -10.236 690 1HD PRO 94 HD2 PRO 94 8.890 23.644 -7.292 691 2HD PRO 94 HD3 PRO 94 7.738 24.742 -8.108 692 H HIS 95 H HIS 95 7.874 20.584 -6.993 693 HA HIS 95 HA HIS 95 8.235 17.859 -7.775 694 1HB HIS 95 HB2 HIS 95 7.107 18.964 -5.172 695 2HB HIS 95 HB3 HIS 95 7.823 17.375 -5.416 696 HD1 HIS 95 HD1 HIS 95 10.606 17.763 -6.486 697 HD2 HIS 95 HD2 HIS 95 8.736 20.574 -3.964 698 HE1 HIS 95 HE1 HIS 95 12.469 19.162 -5.467 699 H VAL 96 H VAL 96 5.462 19.825 -7.941 700 HA VAL 96 HA VAL 96 3.501 17.589 -7.892 701 HB VAL 96 HB VAL 96 3.074 20.497 -7.035 702 1HG1 VAL 96 HG11 VAL 96 1.028 19.648 -6.056 703 2HG1 VAL 96 HG12 VAL 96 1.086 19.261 -7.781 704 3HG1 VAL 96 HG13 VAL 96 1.425 18.000 -6.576 705 1HG2 VAL 96 HG21 VAL 96 3.004 19.760 -4.704 706 2HG2 VAL 96 HG22 VAL 96 3.687 18.193 -5.170 707 3HG2 VAL 96 HG23 VAL 96 4.624 19.681 -5.394 708 H LYS 97 H LYS 97 3.386 17.303 -10.155 709 HA LYS 97 HA LYS 97 3.365 19.659 -11.900 710 1HB LYS 97 HB2 LYS 97 3.315 18.199 -13.710 711 2HB LYS 97 HB3 LYS 97 4.361 17.439 -12.526 712 1HG LYS 97 HG2 LYS 97 1.930 16.242 -11.951 713 2HG LYS 97 HG3 LYS 97 1.778 16.555 -13.690 714 1HD LYS 97 HD2 LYS 97 4.097 15.468 -13.941 715 2HD LYS 97 HD3 LYS 97 3.970 15.026 -12.226 716 1HE LYS 97 HE2 LYS 97 1.707 13.926 -12.896 717 2HE LYS 97 HE3 LYS 97 2.258 14.106 -14.568 718 1HZ LYS 97 HZ1 LYS 97 2.873 11.939 -13.707 719 2HZ LYS 97 HZ2 LYS 97 4.259 12.793 -13.868 720 3HZ LYS 97 HZ3 LYS 97 3.572 12.584 -12.380 721 H ARG 98 H ARG 98 1.433 19.896 -13.398 722 HA ARG 98 HA ARG 98 -1.090 19.482 -11.929 723 1HB ARG 98 HB2 ARG 98 0.232 22.107 -12.610 724 2HB ARG 98 HB3 ARG 98 -1.509 21.984 -12.826 725 1HG ARG 98 HG2 ARG 98 -1.662 21.061 -10.454 726 2HG ARG 98 HG3 ARG 98 0.037 21.437 -10.256 727 1HD ARG 98 HD2 ARG 98 -1.561 23.137 -9.293 728 2HD ARG 98 HD3 ARG 98 -0.340 23.772 -10.385 729 HE ARG 98 HE ARG 98 -2.061 24.807 -11.354 730 1HH1 ARG 98 HH21 ARG 98 -3.320 21.492 -10.839 731 2HH1 ARG 98 HH22 ARG 98 -4.745 21.819 -11.786 732 1HH2 ARG 98 HH11 ARG 98 -4.074 25.175 -12.381 733 2HH2 ARG 98 HH12 ARG 98 -5.265 23.901 -12.396 734 H GLU 99 H GLU 99 -2.980 19.647 -13.085 735 HA GLU 99 HA GLU 99 -2.931 20.162 -15.938 736 1HB GLU 99 HB2 GLU 99 -2.849 17.471 -15.055 737 2HB GLU 99 HB3 GLU 99 -4.555 17.758 -15.405 738 1HG GLU 99 HG2 GLU 99 -2.227 18.272 -17.313 739 2HG GLU 99 HG3 GLU 99 -3.224 16.818 -17.283 740 H HIS 100 H HIS 100 -5.360 20.260 -16.635 741 HA HIS 100 HA HIS 100 -7.127 21.167 -14.473 742 1HB HIS 100 HB2 HIS 100 -7.268 23.434 -15.428 743 2HB HIS 100 HB3 HIS 100 -5.696 23.076 -14.740 744 HD1 HIS 100 HD1 HIS 100 -4.847 21.585 -17.822 745 HD2 HIS 100 HD2 HIS 100 -6.068 25.478 -16.719 746 HE1 HIS 100 HE1 HIS 100 -3.954 23.150 -19.597 747 H TRP 101 H TRP 101 -9.119 20.569 -14.974 748 HA TRP 101 HA TRP 101 -9.930 20.317 -17.842 749 1HB TRP 101 HB2 TRP 101 -10.864 18.558 -15.574 750 2HB TRP 101 HB3 TRP 101 -11.272 18.443 -17.288 751 HD1 TRP 101 HD1 TRP 101 -8.207 18.843 -18.316 752 HE1 TRP 101 HE1 TRP 101 -6.439 17.087 -18.040 753 HE3 TRP 101 HE3 TRP 101 -10.659 15.856 -14.982 754 HZ2 TRP 101 HZ2 TRP 101 -6.028 14.709 -16.412 755 HZ3 TRP 101 HZ3 TRP 101 -9.546 13.834 -14.077 756 HH2 TRP 101 HH2 TRP 101 -7.215 13.272 -14.750 757 H GLY 102 H GLY 102 -12.678 20.124 -17.583 758 1HA GLY 102 HA1 GLY 102 -13.395 22.773 -16.369 759 2HA GLY 102 HA2 GLY 102 -13.639 22.417 -18.067 760 H PHE 103 H PHE 103 -14.273 20.317 -15.175 761 HA PHE 103 HA PHE 103 -16.827 19.631 -16.382 762 1HB PHE 103 HB2 PHE 103 -15.356 18.563 -13.959 763 2HB PHE 103 HB3 PHE 103 -16.931 17.978 -14.505 764 HD1 PHE 103 HD1 PHE 103 -13.345 17.737 -15.058 765 HD2 PHE 103 HD2 PHE 103 -17.188 17.234 -16.952 766 HE1 PHE 103 HE1 PHE 103 -12.276 16.497 -16.914 767 HE2 PHE 103 HE2 PHE 103 -16.116 16.031 -18.812 768 HZ PHE 103 HZ PHE 103 -13.643 15.645 -18.803 769 H ASP 104 H ASP 104 -18.461 20.920 -16.180 770 HA ASP 104 HA ASP 104 -19.109 22.590 -13.933 771 1HB ASP 104 HB2 ASP 104 -19.992 22.921 -16.239 772 2HB ASP 104 HB3 ASP 104 -20.845 21.373 -16.108 773 H ASP 105 H ASP 105 -20.919 22.209 -12.441 774 HA ASP 105 HA ASP 105 -20.457 19.693 -11.161 775 1HB ASP 105 HB2 ASP 105 -20.819 21.946 -10.062 776 2HB ASP 105 HB3 ASP 105 -22.548 21.704 -10.329 777 HA PRO 106 HA PRO 106 -23.712 17.737 -13.460 778 1HB PRO 106 HB2 PRO 106 -23.585 15.168 -12.444 779 2HB PRO 106 HB3 PRO 106 -22.386 15.845 -13.583 780 1HG PRO 106 HG2 PRO 106 -22.202 15.657 -10.563 781 2HG PRO 106 HG3 PRO 106 -20.959 15.235 -11.783 782 1HD PRO 106 HD2 PRO 106 -20.963 17.627 -10.474 783 2HD PRO 106 HD3 PRO 106 -20.450 17.494 -12.187 784 H ALA 107 H ALA 107 -23.670 17.601 -9.894 785 HA ALA 107 HA ALA 107 -26.320 16.553 -9.641 786 1HB ALA 107 HB1 ALA 107 -26.100 17.198 -7.275 787 2HB ALA 107 HB2 ALA 107 -24.635 16.377 -7.855 788 3HB ALA 107 HB3 ALA 107 -24.647 18.138 -7.653 789 H ARG 108 H ARG 108 -25.169 19.683 -10.528 790 HA ARG 108 HA ARG 108 -27.804 20.943 -9.917 791 1HB ARG 108 HB2 ARG 108 -25.047 22.214 -10.291 792 2HB ARG 108 HB3 ARG 108 -26.562 23.092 -10.101 793 1HG ARG 108 HG2 ARG 108 -25.831 23.170 -7.961 794 2HG ARG 108 HG3 ARG 108 -26.853 21.728 -7.899 795 1HD ARG 108 HD2 ARG 108 -24.778 20.330 -8.166 796 2HD ARG 108 HD3 ARG 108 -23.813 21.814 -8.129 797 HE ARG 108 HE ARG 108 -25.376 21.893 -5.838 798 1HH1 ARG 108 HH21 ARG 108 -22.874 19.684 -7.133 799 2HH1 ARG 108 HH22 ARG 108 -22.365 19.161 -5.570 800 1HH2 ARG 108 HH11 ARG 108 -24.691 21.161 -3.780 801 2HH2 ARG 108 HH12 ARG 108 -23.433 19.997 -3.631 802 H ALA 109 H ALA 109 -26.683 19.235 -12.370 803 HA ALA 109 HA ALA 109 -26.709 20.932 -14.601 804 1HB ALA 109 HB1 ALA 109 -26.022 18.579 -14.704 805 2HB ALA 109 HB2 ALA 109 -27.686 18.047 -14.380 806 3HB ALA 109 HB3 ALA 109 -27.306 18.898 -15.890 807 H GLN 110 H GLN 110 -29.405 19.310 -12.982 808 HA GLN 110 HA GLN 110 -31.664 19.483 -13.069 809 1HB GLN 110 HB2 GLN 110 -31.013 22.423 -13.486 810 2HB GLN 110 HB3 GLN 110 -32.573 21.782 -12.963 811 1HG GLN 110 HG2 GLN 110 -31.535 20.815 -10.946 812 2HG GLN 110 HG3 GLN 110 -29.980 21.512 -11.393 813 1HE2 GLN 110 HE22 GLN 110 -32.242 22.020 -9.181 814 2HE2 GLN 110 HE21 GLN 110 -32.293 23.763 -9.131 815 H GLY 111 H GLY 111 -33.414 21.129 -14.502 816 1HA GLY 111 HA1 GLY 111 -33.955 21.857 -16.731 817 2HA GLY 111 HA2 GLY 111 -32.939 20.569 -17.395 818 H THR 112 H THR 112 -33.562 18.302 -16.703 819 HA THR 112 HA THR 112 -36.169 17.785 -15.677 820 HB THR 112 HB THR 112 -36.876 18.173 -17.969 821 HG1 THR 112 HG1 THR 112 -37.998 16.558 -17.096 822 1HG2 THR 112 HG21 THR 112 -36.120 16.781 -19.852 823 2HG2 THR 112 HG22 THR 112 -34.835 17.824 -19.236 824 3HG2 THR 112 HG23 THR 112 -34.844 16.089 -18.832 825 H GLU 113 H GLU 113 -36.289 15.393 -15.139 826 HA GLU 113 HA GLU 113 -33.843 14.786 -13.883 827 1HB GLU 113 HB2 GLU 113 -35.969 14.028 -13.000 828 2HB GLU 113 HB3 GLU 113 -36.254 13.008 -14.424 829 1HG GLU 113 HG2 GLU 113 -34.354 11.597 -13.882 830 2HG GLU 113 HG3 GLU 113 -33.852 12.677 -12.573 831 H GLU 114 H GLU 114 -35.198 13.533 -16.920 832 HA GLU 114 HA GLU 114 -33.126 11.610 -17.310 833 1HB GLU 114 HB2 GLU 114 -33.945 11.393 -19.586 834 2HB GLU 114 HB3 GLU 114 -35.278 11.407 -18.434 835 1HG GLU 114 HG2 GLU 114 -35.722 13.800 -18.998 836 2HG GLU 114 HG3 GLU 114 -34.405 13.757 -20.175 837 H GLU 115 H GLU 115 -33.306 15.075 -17.979 838 HA GLU 115 HA GLU 115 -30.995 15.094 -19.708 839 1HB GLU 115 HB2 GLU 115 -32.665 16.756 -20.044 840 2HB GLU 115 HB3 GLU 115 -32.574 17.304 -18.362 841 1HG GLU 115 HG2 GLU 115 -30.485 18.322 -18.657 842 2HG GLU 115 HG3 GLU 115 -30.135 17.420 -20.140 843 H LYS 116 H LYS 116 -31.735 15.818 -16.293 844 HA LYS 116 HA LYS 116 -29.190 16.530 -15.396 845 1HB LYS 116 HB2 LYS 116 -31.409 16.818 -14.295 846 2HB LYS 116 HB3 LYS 116 -31.483 15.078 -13.986 847 1HG LYS 116 HG2 LYS 116 -29.594 15.183 -12.523 848 2HG LYS 116 HG3 LYS 116 -29.284 16.886 -12.950 849 1HD LYS 116 HD2 LYS 116 -31.753 17.257 -12.055 850 2HD LYS 116 HD3 LYS 116 -31.506 15.674 -11.277 851 1HE LYS 116 HE2 LYS 116 -29.289 16.674 -10.396 852 2HE LYS 116 HE3 LYS 116 -29.889 18.234 -10.979 853 1HZ LYS 116 HZ1 LYS 116 -31.202 16.556 -8.912 854 2HZ LYS 116 HZ2 LYS 116 -30.368 17.929 -8.639 855 3HZ LYS 116 HZ3 LYS 116 -31.783 17.983 -9.454 856 H TRP 117 H TRP 117 -30.752 13.296 -15.463 857 HA TRP 117 HA TRP 117 -28.467 11.856 -14.565 858 1HB TRP 117 HB2 TRP 117 -30.758 10.914 -14.632 859 2HB TRP 117 HB3 TRP 117 -30.701 10.896 -16.395 860 HD1 TRP 117 HD1 TRP 117 -29.214 9.015 -17.548 861 HE1 TRP 117 HE1 TRP 117 -28.124 6.837 -16.711 862 HE3 TRP 117 HE3 TRP 117 -29.534 9.821 -12.507 863 HZ2 TRP 117 HZ2 TRP 117 -27.264 5.733 -14.219 864 HZ3 TRP 117 HZ3 TRP 117 -28.437 8.265 -10.926 865 HH2 TRP 117 HH2 TRP 117 -27.293 6.212 -11.765 866 H ALA 118 H ALA 118 -29.539 12.721 -17.930 867 HA ALA 118 HA ALA 118 -27.442 11.369 -19.243 868 1HB ALA 118 HB1 ALA 118 -27.880 12.914 -21.122 869 2HB ALA 118 HB2 ALA 118 -29.390 12.297 -20.421 870 3HB ALA 118 HB3 ALA 118 -28.846 13.950 -20.060 871 H PHE 119 H PHE 119 -27.459 14.575 -17.646 872 HA PHE 119 HA PHE 119 -24.842 15.306 -18.505 873 1HB PHE 119 HB2 PHE 119 -26.779 16.706 -17.402 874 2HB PHE 119 HB3 PHE 119 -26.026 16.232 -15.889 875 HD1 PHE 119 HD1 PHE 119 -23.578 16.891 -15.484 876 HD2 PHE 119 HD2 PHE 119 -25.873 18.394 -18.810 877 HE1 PHE 119 HE1 PHE 119 -22.018 18.818 -15.687 878 HE2 PHE 119 HE2 PHE 119 -24.277 20.277 -19.057 879 HZ PHE 119 HZ PHE 119 -22.357 20.494 -17.505 880 H PHE 120 H PHE 120 -26.042 13.502 -15.594 881 HA PHE 120 HA PHE 120 -23.548 13.154 -14.292 882 1HB PHE 120 HB2 PHE 120 -25.652 10.983 -14.507 883 2HB PHE 120 HB3 PHE 120 -24.399 11.148 -13.313 884 HD1 PHE 120 HD1 PHE 120 -26.866 10.451 -12.383 885 HD2 PHE 120 HD2 PHE 120 -25.544 14.449 -13.320 886 HE1 PHE 120 HE1 PHE 120 -28.574 11.382 -10.844 887 HE2 PHE 120 HE2 PHE 120 -27.203 15.356 -11.745 888 HZ PHE 120 HZ PHE 120 -28.736 13.840 -10.511 889 H GLN 121 H GLN 121 -25.147 11.234 -16.897 890 HA GLN 121 HA GLN 121 -23.147 9.283 -17.216 891 1HB GLN 121 HB2 GLN 121 -25.118 10.411 -19.242 892 2HB GLN 121 HB3 GLN 121 -24.078 9.040 -19.563 893 1HG GLN 121 HG2 GLN 121 -26.137 9.168 -17.315 894 2HG GLN 121 HG3 GLN 121 -26.380 8.385 -18.873 895 1HE2 GLN 121 HE22 GLN 121 -25.844 7.566 -15.772 896 2HE2 GLN 121 HE21 GLN 121 -24.827 6.161 -15.984 897 H ARG 122 H ARG 122 -23.483 12.407 -18.946 898 HA ARG 122 HA ARG 122 -21.159 12.070 -20.557 899 1HB ARG 122 HB2 ARG 122 -22.768 14.481 -19.673 900 2HB ARG 122 HB3 ARG 122 -21.159 14.743 -20.331 901 1HG ARG 122 HG2 ARG 122 -22.659 14.959 -22.145 902 2HG ARG 122 HG3 ARG 122 -21.751 13.458 -22.373 903 1HD ARG 122 HD2 ARG 122 -23.725 12.208 -21.413 904 2HD ARG 122 HD3 ARG 122 -24.606 13.754 -21.364 905 HE ARG 122 HE ARG 122 -23.724 13.522 -23.975 906 1HH1 ARG 122 HH11 ARG 122 -25.740 11.580 -21.811 907 2HH1 ARG 122 HH12 ARG 122 -26.707 10.894 -23.071 908 1HH2 ARG 122 HH21 ARG 122 -25.012 12.629 -25.672 909 2HH2 ARG 122 HH22 ARG 122 -26.285 11.523 -25.320 910 H VAL 123 H VAL 123 -21.497 13.694 -17.339 911 HA VAL 123 HA VAL 123 -18.722 14.340 -17.293 912 HB VAL 123 HB VAL 123 -20.756 14.200 -15.031 913 1HG1 VAL 123 HG11 VAL 123 -18.477 14.066 -14.071 914 2HG1 VAL 123 HG12 VAL 123 -17.964 15.448 -15.055 915 3HG1 VAL 123 HG13 VAL 123 -19.177 15.662 -13.774 916 1HG2 VAL 123 HG21 VAL 123 -21.256 15.915 -16.782 917 2HG2 VAL 123 HG22 VAL 123 -20.736 16.691 -15.284 918 3HG2 VAL 123 HG23 VAL 123 -19.610 16.549 -16.641 919 H ARG 124 H ARG 124 -20.420 11.398 -15.826 920 HA ARG 124 HA ARG 124 -17.956 10.511 -14.733 921 1HB ARG 124 HB2 ARG 124 -18.888 8.313 -14.453 922 2HB ARG 124 HB3 ARG 124 -20.116 9.507 -14.016 923 1HG ARG 124 HG2 ARG 124 -21.236 9.087 -16.194 924 2HG ARG 124 HG3 ARG 124 -19.976 7.922 -16.622 925 1HD ARG 124 HD2 ARG 124 -20.620 6.587 -14.581 926 2HD ARG 124 HD3 ARG 124 -22.039 7.644 -14.421 927 HE ARG 124 HE ARG 124 -22.107 6.839 -17.057 928 1HH1 ARG 124 HH21 ARG 124 -22.192 5.033 -13.977 929 2HH1 ARG 124 HH22 ARG 124 -22.821 3.604 -14.735 930 1HH2 ARG 124 HH11 ARG 124 -23.226 5.085 -17.896 931 2HH2 ARG 124 HH12 ARG 124 -23.371 3.603 -17.013 932 H ASP 125 H ASP 125 -19.392 9.926 -17.946 933 HA ASP 125 HA ASP 125 -17.485 8.021 -18.801 934 1HB ASP 125 HB2 ASP 125 -19.568 8.400 -20.013 935 2HB ASP 125 HB3 ASP 125 -19.075 10.049 -20.418 936 H GLU 126 H GLU 126 -17.488 11.620 -19.069 937 HA GLU 126 HA GLU 126 -14.999 11.678 -20.435 938 1HB GLU 126 HB2 GLU 126 -16.694 13.768 -19.085 939 2HB GLU 126 HB3 GLU 126 -15.107 14.151 -19.766 940 1HG GLU 126 HG2 GLU 126 -17.230 12.795 -21.458 941 2HG GLU 126 HG3 GLU 126 -17.174 14.540 -21.239 942 H ILE 127 H ILE 127 -15.833 11.923 -16.906 943 HA ILE 127 HA ILE 127 -13.175 12.668 -16.180 944 HB ILE 127 HB ILE 127 -15.590 12.351 -14.819 945 1HG1 ILE 127 HG12 ILE 127 -14.270 12.963 -12.747 946 2HG1 ILE 127 HG13 ILE 127 -12.810 12.890 -13.750 947 1HG2 ILE 127 HG21 ILE 127 -15.311 10.036 -14.456 948 2HG2 ILE 127 HG22 ILE 127 -13.750 10.308 -13.625 949 3HG2 ILE 127 HG23 ILE 127 -15.268 10.926 -12.932 950 1HD1 ILE 127 HD11 ILE 127 -15.297 14.596 -14.289 951 2HD1 ILE 127 HD12 ILE 127 -13.783 15.195 -13.575 952 3HD1 ILE 127 HD13 ILE 127 -13.806 14.602 -15.253 953 H GLY 128 H GLY 128 -14.749 9.481 -16.650 954 1HA GLY 128 HA1 GLY 128 -12.512 7.853 -16.025 955 2HA GLY 128 HA2 GLY 128 -13.850 7.441 -17.124 956 H ASN 129 H ASN 129 -13.601 9.279 -19.149 957 HA ASN 129 HA ASN 129 -11.552 8.279 -20.784 958 1HB ASN 129 HB2 ASN 129 -13.637 9.313 -21.600 959 2HB ASN 129 HB3 ASN 129 -13.097 10.872 -20.978 960 1HD2 ASN 129 HD22 ASN 129 -13.236 11.896 -22.955 961 2HD2 ASN 129 HD21 ASN 129 -12.205 11.482 -24.314 962 H ARG 130 H ARG 130 -11.588 11.331 -18.884 963 HA ARG 130 HA ARG 130 -9.038 12.255 -19.784 964 1HB ARG 130 HB2 ARG 130 -10.391 12.712 -17.089 965 2HB ARG 130 HB3 ARG 130 -8.959 13.547 -17.659 966 1HG ARG 130 HG2 ARG 130 -11.762 13.853 -18.780 967 2HG ARG 130 HG3 ARG 130 -10.853 14.975 -17.807 968 1HD ARG 130 HD2 ARG 130 -10.748 15.837 -19.967 969 2HD ARG 130 HD3 ARG 130 -9.161 15.119 -19.675 970 HE ARG 130 HE ARG 130 -11.358 13.684 -21.134 971 1HH1 ARG 130 HH11 ARG 130 -8.070 15.025 -21.232 972 2HH1 ARG 130 HH12 ARG 130 -7.578 14.099 -22.618 973 1HH2 ARG 130 HH21 ARG 130 -10.729 12.522 -23.034 974 2HH2 ARG 130 HH22 ARG 130 -9.120 12.721 -23.680 975 H LEU 131 H LEU 131 -9.921 10.174 -16.972 976 HA LEU 131 HA LEU 131 -7.201 9.928 -16.109 977 1HB LEU 131 HB2 LEU 131 -9.770 8.510 -15.473 978 2HB LEU 131 HB3 LEU 131 -8.268 7.676 -15.106 979 HG LEU 131 HG LEU 131 -9.021 8.849 -13.194 980 1HD1 LEU 131 HD11 LEU 131 -6.547 8.613 -13.708 981 2HD1 LEU 131 HD12 LEU 131 -6.545 10.332 -14.155 982 3HD1 LEU 131 HD13 LEU 131 -6.961 9.846 -12.519 983 1HD2 LEU 131 HD21 LEU 131 -10.276 10.690 -14.129 984 2HD2 LEU 131 HD22 LEU 131 -9.074 11.293 -12.991 985 3HD2 LEU 131 HD23 LEU 131 -8.789 11.447 -14.737 986 H LYS 132 H LYS 132 -9.182 7.890 -18.279 987 HA LYS 132 HA LYS 132 -7.234 5.930 -18.842 988 1HB LYS 132 HB2 LYS 132 -9.319 5.407 -19.593 989 2HB LYS 132 HB3 LYS 132 -9.693 7.003 -20.172 990 1HG LYS 132 HG2 LYS 132 -7.681 5.261 -21.643 991 2HG LYS 132 HG3 LYS 132 -9.423 5.051 -21.833 992 1HD LYS 132 HD2 LYS 132 -9.283 7.744 -22.215 993 2HD LYS 132 HD3 LYS 132 -7.685 7.279 -22.818 994 1HE LYS 132 HE2 LYS 132 -8.680 5.797 -24.461 995 2HE LYS 132 HE3 LYS 132 -10.274 5.954 -23.709 996 1HZ LYS 132 HZ1 LYS 132 -8.826 8.137 -25.087 997 2HZ LYS 132 HZ2 LYS 132 -10.147 7.355 -25.636 998 3HZ LYS 132 HZ3 LYS 132 -10.265 8.311 -24.310 999 H GLU 133 H GLU 133 -7.749 9.084 -20.487 1000 HA GLU 133 HA GLU 133 -5.523 8.791 -22.228 1001 1HB GLU 133 HB2 GLU 133 -7.490 10.765 -21.724 1002 2HB GLU 133 HB3 GLU 133 -5.974 11.545 -21.256 1003 1HG GLU 133 HG2 GLU 133 -5.007 10.963 -23.461 1004 2HG GLU 133 HG3 GLU 133 -6.506 10.113 -23.891 1005 H PHE 134 H PHE 134 -5.616 10.323 -18.920 1006 HA PHE 134 HA PHE 134 -2.889 10.999 -19.038 1007 1HB PHE 134 HB2 PHE 134 -4.537 11.699 -17.250 1008 2HB PHE 134 HB3 PHE 134 -4.308 10.113 -16.497 1009 HD1 PHE 134 HD1 PHE 134 -1.840 9.416 -15.920 1010 HD2 PHE 134 HD2 PHE 134 -2.998 13.471 -16.854 1011 HE1 PHE 134 HE1 PHE 134 0.420 10.187 -15.340 1012 HE2 PHE 134 HE2 PHE 134 -0.768 14.263 -16.121 1013 HZ PHE 134 HZ PHE 134 0.970 12.623 -15.442 1014 H ALA 135 H ALA 135 -4.438 7.947 -18.087 1015 HA ALA 135 HA ALA 135 -2.064 6.730 -17.101 1016 1HB ALA 135 HB1 ALA 135 -3.385 4.646 -17.139 1017 2HB ALA 135 HB2 ALA 135 -4.379 5.987 -16.530 1018 3HB ALA 135 HB3 ALA 135 -4.596 5.404 -18.192 1019 H GLU 136 H GLU 136 -3.621 6.769 -20.296 1020 HA GLU 136 HA GLU 136 -1.877 4.766 -21.434 1021 1HB GLU 136 HB2 GLU 136 -4.042 6.571 -22.564 1022 2HB GLU 136 HB3 GLU 136 -3.101 5.489 -23.582 1023 1HG GLU 136 HG2 GLU 136 -4.744 4.525 -21.200 1024 2HG GLU 136 HG3 GLU 136 -5.332 4.582 -22.857 1025 H THR 137 H THR 137 -2.134 8.308 -21.597 1026 HA THR 137 HA THR 137 -0.079 8.393 -23.606 1027 HB THR 137 HB THR 137 -0.589 10.739 -23.759 1028 HG1 THR 137 HG1 THR 137 -2.486 10.325 -21.714 1029 1HG2 THR 137 HG21 THR 137 -2.905 10.556 -24.537 1030 2HG2 THR 137 HG22 THR 137 -1.986 9.109 -24.987 1031 3HG2 THR 137 HG23 THR 137 -3.123 9.036 -23.634 1032 H GLY 138 H GLY 138 -0.322 8.811 -20.133 1033 1HA GLY 138 HA1 GLY 138 1.171 9.443 -18.528 1034 2HA GLY 138 HA2 GLY 138 2.499 9.229 -19.691 1035 H LYS 139 H LYS 139 -0.412 11.293 -19.846 1036 HA LYS 139 HA LYS 139 0.455 13.305 -21.315 1037 1HB LYS 139 HB2 LYS 139 -1.862 12.962 -20.359 1038 2HB LYS 139 HB3 LYS 139 -1.308 13.772 -18.897 1039 1HG LYS 139 HG2 LYS 139 -2.443 15.413 -20.188 1040 2HG LYS 139 HG3 LYS 139 -0.730 15.788 -20.257 1041 1HD LYS 139 HD2 LYS 139 -1.704 16.132 -22.454 1042 2HD LYS 139 HD3 LYS 139 -0.584 14.789 -22.531 1043 1HE LYS 139 HE2 LYS 139 -2.498 14.180 -23.819 1044 2HE LYS 139 HE3 LYS 139 -2.532 13.190 -22.362 1045 1HZ LYS 139 HZ1 LYS 139 -4.716 14.128 -22.896 1046 2HZ LYS 139 HZ2 LYS 139 -4.203 14.724 -21.461 1047 3HZ LYS 139 HZ3 LYS 139 -4.135 15.649 -22.814 Start of MODEL 7 1 1H MET 1 H1 MET 1 -0.373 1.888 2.354 2 2H MET 1 H2 MET 1 0.705 1.751 3.593 3 3H MET 1 H3 MET 1 0.404 3.221 2.906 4 HA MET 1 HA MET 1 2.509 2.383 2.197 5 1HB MET 1 HB2 MET 1 1.900 -0.034 2.308 6 2HB MET 1 HB3 MET 1 0.885 0.164 0.871 7 1HG MET 1 HG2 MET 1 2.869 0.828 -0.443 8 2HG MET 1 HG3 MET 1 3.878 0.726 1.005 9 1HE MET 1 HE1 MET 1 5.186 -2.233 -1.191 10 2HE MET 1 HE2 MET 1 4.603 -0.652 -1.755 11 3HE MET 1 HE3 MET 1 5.615 -0.759 -0.296 12 H GLU 2 H GLU 2 3.182 3.654 0.514 13 HA GLU 2 HA GLU 2 1.296 4.368 -1.653 14 1HB GLU 2 HB2 GLU 2 2.878 6.428 -0.049 15 2HB GLU 2 HB3 GLU 2 1.772 6.716 -1.381 16 1HG GLU 2 HG2 GLU 2 0.474 7.346 0.388 17 2HG GLU 2 HG3 GLU 2 -0.062 5.688 0.154 18 H ASN 3 H ASN 3 2.632 5.725 -3.316 19 HA ASN 3 HA ASN 3 5.520 5.347 -3.188 20 1HB ASN 3 HB2 ASN 3 5.205 3.315 -4.272 21 2HB ASN 3 HB3 ASN 3 3.867 3.899 -5.237 22 1HD2 ASN 3 HD22 ASN 3 4.292 4.976 -7.211 23 2HD2 ASN 3 HD21 ASN 3 5.920 5.170 -7.853 24 H LYS 4 H LYS 4 2.790 6.431 -5.252 25 HA LYS 4 HA LYS 4 3.919 9.134 -5.085 26 1HB LYS 4 HB2 LYS 4 3.968 9.633 -7.375 27 2HB LYS 4 HB3 LYS 4 4.834 8.127 -7.178 28 1HG LYS 4 HG2 LYS 4 2.488 7.047 -7.855 29 2HG LYS 4 HG3 LYS 4 2.175 8.661 -8.500 30 1HD LYS 4 HD2 LYS 4 4.328 8.498 -9.810 31 2HD LYS 4 HD3 LYS 4 4.535 6.841 -9.195 32 1HE LYS 4 HE2 LYS 4 2.277 6.275 -10.184 33 2HE LYS 4 HE3 LYS 4 2.251 7.892 -10.902 34 1HZ LYS 4 HZ1 LYS 4 4.406 7.191 -12.021 35 2HZ LYS 4 HZ2 LYS 4 4.053 5.641 -11.552 36 3HZ LYS 4 HZ3 LYS 4 3.050 6.447 -12.541 37 H ILE 5 H ILE 5 2.117 10.731 -6.097 38 HA ILE 5 HA ILE 5 -0.492 9.750 -5.016 39 HB ILE 5 HB ILE 5 1.192 12.143 -4.161 40 1HG1 ILE 5 HG12 ILE 5 -0.100 9.940 -2.507 41 2HG1 ILE 5 HG13 ILE 5 1.580 9.942 -3.026 42 1HG2 ILE 5 HG21 ILE 5 -1.080 13.016 -4.478 43 2HG2 ILE 5 HG22 ILE 5 -1.762 11.637 -3.625 44 3HG2 ILE 5 HG23 ILE 5 -0.786 12.862 -2.758 45 1HD1 ILE 5 HD11 ILE 5 0.319 11.916 -1.098 46 2HD1 ILE 5 HD12 ILE 5 1.542 10.684 -0.771 47 3HD1 ILE 5 HD13 ILE 5 1.954 12.081 -1.785 48 H ILE 6 H ILE 6 -2.305 10.592 -5.930 49 HA ILE 6 HA ILE 6 -2.036 12.840 -7.845 50 HB ILE 6 HB ILE 6 -2.227 10.942 -9.260 51 1HG1 ILE 6 HG12 ILE 6 -5.043 12.098 -9.002 52 2HG1 ILE 6 HG13 ILE 6 -3.677 12.998 -9.654 53 1HG2 ILE 6 HG21 ILE 6 -3.002 9.228 -7.670 54 2HG2 ILE 6 HG22 ILE 6 -4.611 9.981 -7.663 55 3HG2 ILE 6 HG23 ILE 6 -3.974 9.236 -9.138 56 1HD1 ILE 6 HD11 ILE 6 -4.891 10.478 -10.845 57 2HD1 ILE 6 HD12 ILE 6 -4.957 12.129 -11.486 58 3HD1 ILE 6 HD13 ILE 6 -3.412 11.273 -11.441 59 H TYR 7 H TYR 7 -3.511 14.419 -7.462 60 HA TYR 7 HA TYR 7 -5.453 13.969 -5.241 61 1HB TYR 7 HB2 TYR 7 -3.260 14.828 -4.537 62 2HB TYR 7 HB3 TYR 7 -3.452 16.227 -5.601 63 HD1 TYR 7 HD1 TYR 7 -5.346 17.905 -5.076 64 HD2 TYR 7 HD2 TYR 7 -4.222 14.701 -2.421 65 HE1 TYR 7 HE1 TYR 7 -6.404 19.101 -3.174 66 HE2 TYR 7 HE2 TYR 7 -5.211 15.918 -0.513 67 HH TYR 7 HH TYR 7 -6.392 17.726 0.154 68 H PHE 8 H PHE 8 -7.414 14.168 -6.279 69 HA PHE 8 HA PHE 8 -7.876 16.101 -8.411 70 1HB PHE 8 HB2 PHE 8 -9.741 14.282 -6.827 71 2HB PHE 8 HB3 PHE 8 -10.241 15.308 -8.155 72 HD1 PHE 8 HD1 PHE 8 -9.050 12.051 -7.291 73 HD2 PHE 8 HD2 PHE 8 -8.902 15.030 -10.407 74 HE1 PHE 8 HE1 PHE 8 -8.253 10.343 -8.904 75 HE2 PHE 8 HE2 PHE 8 -8.164 13.298 -12.026 76 HZ PHE 8 HZ PHE 8 -7.775 10.974 -11.245 77 H LEU 9 H LEU 9 -9.226 17.930 -8.275 78 HA LEU 9 HA LEU 9 -9.988 18.973 -5.609 79 1HB LEU 9 HB2 LEU 9 -7.577 19.450 -6.046 80 2HB LEU 9 HB3 LEU 9 -7.989 20.200 -7.564 81 HG LEU 9 HG LEU 9 -7.352 21.773 -5.801 82 1HD1 LEU 9 HD11 LEU 9 -10.276 22.308 -6.370 83 2HD1 LEU 9 HD12 LEU 9 -8.941 23.441 -6.160 84 3HD1 LEU 9 HD13 LEU 9 -8.997 22.446 -7.610 85 1HD2 LEU 9 HD21 LEU 9 -8.217 20.578 -3.845 86 2HD2 LEU 9 HD22 LEU 9 -8.832 22.247 -3.908 87 3HD2 LEU 9 HD23 LEU 9 -9.881 20.894 -4.357 88 H CYS 10 H CYS 10 -11.984 20.175 -5.885 89 HA CYS 10 HA CYS 10 -12.503 21.404 -8.501 90 1HB CYS 10 HB2 CYS 10 -13.331 18.901 -8.412 91 2HB CYS 10 HB3 CYS 10 -14.639 19.551 -7.412 92 HG CYS 10 HG CYS 10 -15.393 19.318 -9.930 93 H THR 11 H THR 11 -14.815 22.638 -8.342 94 HA THR 11 HA THR 11 -14.634 24.309 -6.039 95 HB THR 11 HB THR 11 -16.918 25.137 -7.011 96 HG1 THR 11 HG1 THR 11 -17.120 24.683 -9.177 97 1HG2 THR 11 HG21 THR 11 -14.814 26.372 -7.109 98 2HG2 THR 11 HG22 THR 11 -14.237 25.380 -8.447 99 3HG2 THR 11 HG23 THR 11 -15.630 26.459 -8.678 100 H GLY 12 H GLY 12 -16.069 21.267 -6.378 101 1HA GLY 12 HA1 GLY 12 -16.865 21.323 -3.619 102 2HA GLY 12 HA2 GLY 12 -18.220 20.994 -4.734 103 H ASN 13 H ASN 13 -15.844 19.525 -2.973 104 HA ASN 13 HA ASN 13 -14.615 17.577 -4.634 105 1HB ASN 13 HB2 ASN 13 -14.093 18.072 -2.227 106 2HB ASN 13 HB3 ASN 13 -15.614 17.351 -1.748 107 1HD2 ASN 13 HD22 ASN 13 -13.159 16.540 -0.737 108 2HD2 ASN 13 HD21 ASN 13 -12.733 14.949 -1.340 109 H SER 14 H SER 14 -17.658 17.675 -2.972 110 HA SER 14 HA SER 14 -18.673 15.430 -2.493 111 1HB SER 14 HB2 SER 14 -20.373 17.428 -3.979 112 2HB SER 14 HB3 SER 14 -20.765 16.531 -2.502 113 HG SER 14 HG SER 14 -20.039 18.919 -2.556 114 H CYS 15 H CYS 15 -18.405 16.293 -5.904 115 HA CYS 15 HA CYS 15 -19.461 13.630 -6.549 116 1HB CYS 15 HB2 CYS 15 -20.748 14.658 -8.510 117 2HB CYS 15 HB3 CYS 15 -21.430 14.920 -6.903 118 HG CYS 15 HG CYS 15 -21.822 17.118 -8.151 119 H ARG 16 H ARG 16 -18.072 16.558 -8.158 120 HA ARG 16 HA ARG 16 -17.056 15.042 -10.317 121 1HB ARG 16 HB2 ARG 16 -16.343 17.786 -9.214 122 2HB ARG 16 HB3 ARG 16 -15.527 17.137 -10.642 123 1HG ARG 16 HG2 ARG 16 -17.535 16.961 -11.898 124 2HG ARG 16 HG3 ARG 16 -18.566 17.200 -10.486 125 1HD ARG 16 HD2 ARG 16 -16.691 19.332 -11.578 126 2HD ARG 16 HD3 ARG 16 -18.383 19.175 -12.041 127 HE ARG 16 HE ARG 16 -18.525 19.241 -9.297 128 1HH1 ARG 16 HH21 ARG 16 -17.205 21.476 -11.748 129 2HH1 ARG 16 HH22 ARG 16 -17.248 22.831 -10.655 130 1HH2 ARG 16 HH11 ARG 16 -18.984 21.153 -8.134 131 2HH2 ARG 16 HH12 ARG 16 -18.022 22.581 -8.489 132 H SER 17 H SER 17 -15.210 16.137 -7.379 133 HA SER 17 HA SER 17 -12.853 14.738 -8.215 134 1HB SER 17 HB2 SER 17 -13.621 15.541 -5.407 135 2HB SER 17 HB3 SER 17 -11.992 15.303 -6.065 136 HG SER 17 HG SER 17 -12.541 17.491 -5.888 137 H GLN 18 H GLN 18 -15.631 13.805 -6.125 138 HA GLN 18 HA GLN 18 -14.541 11.340 -5.230 139 1HB GLN 18 HB2 GLN 18 -17.430 12.215 -5.745 140 2HB GLN 18 HB3 GLN 18 -17.002 10.704 -4.959 141 1HG GLN 18 HG2 GLN 18 -16.247 13.461 -3.924 142 2HG GLN 18 HG3 GLN 18 -17.597 12.505 -3.350 143 1HE2 GLN 18 HE22 GLN 18 -14.608 13.385 -2.431 144 2HE2 GLN 18 HE21 GLN 18 -14.205 11.983 -1.436 145 H MET 19 H MET 19 -16.469 12.030 -8.212 146 HA MET 19 HA MET 19 -16.503 9.285 -9.087 147 1HB MET 19 HB2 MET 19 -16.822 11.899 -10.627 148 2HB MET 19 HB3 MET 19 -17.023 10.292 -11.334 149 1HG MET 19 HG2 MET 19 -18.790 9.810 -9.618 150 2HG MET 19 HG3 MET 19 -18.710 11.488 -9.117 151 1HE MET 19 HE1 MET 19 -18.345 13.046 -11.948 152 2HE MET 19 HE2 MET 19 -20.050 13.388 -12.290 153 3HE MET 19 HE3 MET 19 -19.430 13.545 -10.628 154 H ALA 20 H ALA 20 -14.350 12.096 -9.900 155 HA ALA 20 HA ALA 20 -12.705 10.768 -11.740 156 1HB ALA 20 HB1 ALA 20 -12.661 13.225 -11.225 157 2HB ALA 20 HB2 ALA 20 -11.838 12.854 -9.695 158 3HB ALA 20 HB3 ALA 20 -11.058 12.473 -11.244 159 H GLU 21 H GLU 21 -12.465 10.869 -8.163 160 HA GLU 21 HA GLU 21 -10.088 9.365 -7.943 161 1HB GLU 21 HB2 GLU 21 -10.885 10.602 -6.076 162 2HB GLU 21 HB3 GLU 21 -12.439 9.753 -6.047 163 1HG GLU 21 HG2 GLU 21 -11.393 7.691 -5.401 164 2HG GLU 21 HG3 GLU 21 -9.777 8.362 -5.585 165 H GLY 22 H GLY 22 -13.539 8.244 -7.928 166 1HA GLY 22 HA1 GLY 22 -13.148 5.504 -7.709 167 2HA GLY 22 HA2 GLY 22 -14.454 6.288 -8.606 168 H TRP 23 H TRP 23 -13.203 7.417 -10.850 169 HA TRP 23 HA TRP 23 -12.655 5.014 -12.376 170 1HB TRP 23 HB2 TRP 23 -12.237 7.924 -13.124 171 2HB TRP 23 HB3 TRP 23 -12.000 6.567 -14.210 172 HD1 TRP 23 HD1 TRP 23 -14.689 8.640 -12.602 173 HE1 TRP 23 HE1 TRP 23 -16.891 8.333 -13.804 174 HE3 TRP 23 HE3 TRP 23 -13.491 4.553 -15.466 175 HZ2 TRP 23 HZ2 TRP 23 -18.000 6.620 -15.834 176 HZ3 TRP 23 HZ3 TRP 23 -15.149 3.658 -17.076 177 HH2 TRP 23 HH2 TRP 23 -17.417 4.727 -17.271 178 H ALA 24 H ALA 24 -10.487 7.520 -10.908 179 HA ALA 24 HA ALA 24 -8.221 6.610 -12.316 180 1HB ALA 24 HB1 ALA 24 -6.885 7.889 -10.715 181 2HB ALA 24 HB2 ALA 24 -8.379 8.794 -11.032 182 3HB ALA 24 HB3 ALA 24 -8.216 7.867 -9.535 183 H LYS 25 H LYS 25 -9.588 5.434 -9.236 184 HA LYS 25 HA LYS 25 -7.418 3.719 -8.575 185 1HB LYS 25 HB2 LYS 25 -10.414 3.495 -8.090 186 2HB LYS 25 HB3 LYS 25 -9.251 2.365 -7.385 187 1HG LYS 25 HG2 LYS 25 -8.200 4.054 -6.067 188 2HG LYS 25 HG3 LYS 25 -8.982 5.367 -6.957 189 1HD LYS 25 HD2 LYS 25 -11.195 4.659 -6.150 190 2HD LYS 25 HD3 LYS 25 -10.451 3.325 -5.228 191 1HE LYS 25 HE2 LYS 25 -9.186 4.926 -3.862 192 2HE LYS 25 HE3 LYS 25 -9.731 6.262 -4.884 193 1HZ LYS 25 HZ1 LYS 25 -11.373 4.701 -2.997 194 2HZ LYS 25 HZ2 LYS 25 -11.096 6.341 -3.045 195 3HZ LYS 25 HZ3 LYS 25 -12.044 5.662 -4.168 196 H GLN 26 H GLN 26 -9.834 3.372 -11.107 197 HA GLN 26 HA GLN 26 -9.350 0.491 -11.481 198 1HB GLN 26 HB2 GLN 26 -11.135 2.601 -12.698 199 2HB GLN 26 HB3 GLN 26 -10.724 1.217 -13.682 200 1HG GLN 26 HG2 GLN 26 -12.896 1.147 -12.320 201 2HG GLN 26 HG3 GLN 26 -11.873 -0.284 -12.362 202 1HE2 GLN 26 HE22 GLN 26 -12.128 2.740 -10.245 203 2HE2 GLN 26 HE21 GLN 26 -12.055 1.814 -8.780 204 H TYR 27 H TYR 27 -8.639 3.559 -13.184 205 HA TYR 27 HA TYR 27 -7.132 2.208 -15.253 206 1HB TYR 27 HB2 TYR 27 -7.511 5.123 -14.505 207 2HB TYR 27 HB3 TYR 27 -6.525 4.608 -15.871 208 HD1 TYR 27 HD1 TYR 27 -9.774 5.658 -15.006 209 HD2 TYR 27 HD2 TYR 27 -7.705 2.810 -17.498 210 HE1 TYR 27 HE1 TYR 27 -11.735 5.543 -16.503 211 HE2 TYR 27 HE2 TYR 27 -9.697 2.620 -18.946 212 HH TYR 27 HH TYR 27 -11.877 3.364 -19.350 213 H LEU 28 H LEU 28 -6.212 3.707 -12.171 214 HA LEU 28 HA LEU 28 -3.329 3.416 -12.803 215 1HB LEU 28 HB2 LEU 28 -4.664 4.711 -10.401 216 2HB LEU 28 HB3 LEU 28 -2.969 4.785 -10.853 217 HG LEU 28 HG LEU 28 -5.276 6.049 -12.391 218 1HD1 LEU 28 HD11 LEU 28 -4.303 8.156 -11.716 219 2HD1 LEU 28 HD12 LEU 28 -4.623 7.169 -10.277 220 3HD1 LEU 28 HD13 LEU 28 -2.966 7.327 -10.892 221 1HD2 LEU 28 HD21 LEU 28 -2.306 6.039 -13.047 222 2HD2 LEU 28 HD22 LEU 28 -3.613 5.344 -14.026 223 3HD2 LEU 28 HD23 LEU 28 -3.518 7.088 -13.805 224 H GLY 29 H GLY 29 -3.039 3.072 -9.668 225 1HA GLY 29 HA1 GLY 29 -3.876 0.466 -9.013 226 2HA GLY 29 HA2 GLY 29 -2.369 0.326 -9.929 227 H ASP 30 H ASP 30 -1.771 -0.623 -7.764 228 HA ASP 30 HA ASP 30 -1.671 0.805 -5.355 229 1HB ASP 30 HB2 ASP 30 -1.543 -1.637 -5.588 230 2HB ASP 30 HB3 ASP 30 0.036 -1.493 -6.366 231 H GLU 31 H GLU 31 0.481 1.039 -8.078 232 HA GLU 31 HA GLU 31 2.785 2.170 -6.832 233 1HB GLU 31 HB2 GLU 31 2.532 1.264 -9.187 234 2HB GLU 31 HB3 GLU 31 1.626 2.721 -9.605 235 1HG GLU 31 HG2 GLU 31 3.613 4.103 -9.068 236 2HG GLU 31 HG3 GLU 31 4.504 2.648 -8.595 237 H TRP 32 H TRP 32 -0.414 3.369 -6.934 238 HA TRP 32 HA TRP 32 0.501 6.168 -6.494 239 1HB TRP 32 HB2 TRP 32 -2.107 5.277 -7.764 240 2HB TRP 32 HB3 TRP 32 -1.525 6.914 -7.585 241 HD1 TRP 32 HD1 TRP 32 -0.653 3.711 -9.559 242 HE1 TRP 32 HE1 TRP 32 -0.007 4.389 -11.947 243 HE3 TRP 32 HE3 TRP 32 -0.555 8.805 -8.972 244 HZ2 TRP 32 HZ2 TRP 32 0.372 6.786 -13.434 245 HZ3 TRP 32 HZ3 TRP 32 -0.030 10.265 -10.905 246 HH2 TRP 32 HH2 TRP 32 0.373 9.252 -13.156 247 H LYS 33 H LYS 33 -0.922 7.404 -5.148 248 HA LYS 33 HA LYS 33 -3.019 5.942 -3.623 249 1HB LYS 33 HB2 LYS 33 -0.764 6.892 -2.418 250 2HB LYS 33 HB3 LYS 33 -1.728 8.369 -2.432 251 1HG LYS 33 HG2 LYS 33 -2.518 5.714 -1.160 252 2HG LYS 33 HG3 LYS 33 -1.891 7.130 -0.336 253 1HD LYS 33 HD2 LYS 33 -3.979 7.661 0.106 254 2HD LYS 33 HD3 LYS 33 -4.082 8.252 -1.550 255 1HE LYS 33 HE2 LYS 33 -4.989 6.000 -2.243 256 2HE LYS 33 HE3 LYS 33 -4.810 5.438 -0.578 257 1HZ LYS 33 HZ1 LYS 33 -6.602 7.637 -1.457 258 2HZ LYS 33 HZ2 LYS 33 -7.072 6.133 -1.002 259 3HZ LYS 33 HZ3 LYS 33 -6.417 7.137 0.099 260 H VAL 34 H VAL 34 -4.971 6.979 -3.834 261 HA VAL 34 HA VAL 34 -5.039 9.376 -5.596 262 HB VAL 34 HB VAL 34 -7.188 7.253 -5.228 263 1HG1 VAL 34 HG11 VAL 34 -7.822 9.475 -6.259 264 2HG1 VAL 34 HG12 VAL 34 -6.690 9.122 -7.579 265 3HG1 VAL 34 HG13 VAL 34 -8.087 8.066 -7.294 266 1HG2 VAL 34 HG21 VAL 34 -5.292 5.999 -6.099 267 2HG2 VAL 34 HG22 VAL 34 -6.444 6.253 -7.410 268 3HG2 VAL 34 HG23 VAL 34 -4.976 7.246 -7.329 269 H TYR 35 H TYR 35 -6.175 11.168 -4.856 270 HA TYR 35 HA TYR 35 -7.985 10.838 -2.522 271 1HB TYR 35 HB2 TYR 35 -6.052 13.155 -2.837 272 2HB TYR 35 HB3 TYR 35 -7.167 12.886 -1.516 273 HD1 TYR 35 HD1 TYR 35 -3.888 12.240 -2.849 274 HD2 TYR 35 HD2 TYR 35 -6.721 11.019 0.161 275 HE1 TYR 35 HE1 TYR 35 -2.049 11.376 -1.488 276 HE2 TYR 35 HE2 TYR 35 -4.875 10.060 1.515 277 HH TYR 35 HH TYR 35 -1.431 10.256 0.497 278 H SER 36 H SER 36 -9.466 12.645 -2.346 279 HA SER 36 HA SER 36 -9.738 14.428 -4.673 280 1HB SER 36 HB2 SER 36 -12.263 13.908 -4.442 281 2HB SER 36 HB3 SER 36 -11.249 12.725 -5.283 282 HG SER 36 HG SER 36 -11.257 11.438 -3.461 283 H ALA 37 H ALA 37 -9.960 16.473 -3.966 284 HA ALA 37 HA ALA 37 -11.310 16.986 -1.380 285 1HB ALA 37 HB1 ALA 37 -8.839 17.063 -1.129 286 2HB ALA 37 HB2 ALA 37 -8.828 18.430 -2.280 287 3HB ALA 37 HB3 ALA 37 -9.728 18.526 -0.735 288 H GLY 38 H GLY 38 -11.450 19.703 -1.489 289 1HA GLY 38 HA1 GLY 38 -12.001 20.724 -4.117 290 2HA GLY 38 HA2 GLY 38 -13.484 20.331 -3.246 291 H ILE 39 H ILE 39 -13.123 22.875 -3.951 292 HA ILE 39 HA ILE 39 -12.014 24.671 -2.021 293 HB ILE 39 HB ILE 39 -14.336 24.749 -3.966 294 1HG1 ILE 39 HG12 ILE 39 -13.078 26.596 -4.999 295 2HG1 ILE 39 HG13 ILE 39 -11.847 26.484 -3.745 296 1HG2 ILE 39 HG21 ILE 39 -14.716 27.150 -3.466 297 2HG2 ILE 39 HG22 ILE 39 -15.225 26.081 -2.167 298 3HG2 ILE 39 HG23 ILE 39 -13.695 26.987 -2.021 299 1HD1 ILE 39 HD11 ILE 39 -11.128 24.293 -4.629 300 2HD1 ILE 39 HD12 ILE 39 -12.448 24.336 -5.826 301 3HD1 ILE 39 HD13 ILE 39 -11.147 25.511 -5.912 302 H GLU 40 H GLU 40 -15.057 22.811 -2.182 303 HA GLU 40 HA GLU 40 -15.087 22.751 0.737 304 1HB GLU 40 HB2 GLU 40 -17.427 23.258 0.965 305 2HB GLU 40 HB3 GLU 40 -16.589 24.636 0.273 306 1HG GLU 40 HG2 GLU 40 -17.537 24.302 -1.885 307 2HG GLU 40 HG3 GLU 40 -18.023 22.640 -1.535 308 H ALA 41 H ALA 41 -17.034 21.182 1.334 309 HA ALA 41 HA ALA 41 -17.602 19.103 -0.658 310 1HB ALA 41 HB1 ALA 41 -16.209 18.604 2.028 311 2HB ALA 41 HB2 ALA 41 -16.956 17.354 1.028 312 3HB ALA 41 HB3 ALA 41 -15.546 18.260 0.417 313 H HIS 42 H HIS 42 -19.786 18.854 -0.475 314 HA HIS 42 HA HIS 42 -21.206 19.812 1.915 315 1HB HIS 42 HB2 HIS 42 -22.775 18.258 -0.031 316 2HB HIS 42 HB3 HIS 42 -23.078 19.836 0.660 317 HD1 HIS 42 HD1 HIS 42 -20.914 21.685 -0.739 318 HD2 HIS 42 HD2 HIS 42 -22.864 18.395 -2.546 319 HE1 HIS 42 HE1 HIS 42 -20.644 21.967 -3.238 320 H GLY 43 H GLY 43 -20.249 16.770 0.355 321 1HA GLY 43 HA1 GLY 43 -20.021 15.054 2.477 322 2HA GLY 43 HA2 GLY 43 -21.739 14.972 2.017 323 H LEU 44 H LEU 44 -20.810 12.645 1.437 324 HA LEU 44 HA LEU 44 -19.611 12.546 -1.279 325 1HB LEU 44 HB2 LEU 44 -18.939 10.793 0.235 326 2HB LEU 44 HB3 LEU 44 -20.621 10.416 0.647 327 HG LEU 44 HG LEU 44 -21.075 9.515 -1.488 328 1HD1 LEU 44 HD11 LEU 44 -19.288 9.282 -3.259 329 2HD1 LEU 44 HD12 LEU 44 -19.842 10.941 -3.043 330 3HD1 LEU 44 HD13 LEU 44 -18.300 10.418 -2.329 331 1HD2 LEU 44 HD21 LEU 44 -19.558 7.594 -1.477 332 2HD2 LEU 44 HD22 LEU 44 -18.338 8.535 -0.609 333 3HD2 LEU 44 HD23 LEU 44 -19.858 8.107 0.193 334 H ASN 45 H ASN 45 -21.050 13.295 -2.862 335 HA ASN 45 HA ASN 45 -23.801 13.544 -2.195 336 1HB ASN 45 HB2 ASN 45 -22.458 15.106 -3.638 337 2HB ASN 45 HB3 ASN 45 -22.511 13.886 -4.919 338 1HD2 ASN 45 HD22 ASN 45 -24.154 14.305 -6.380 339 2HD2 ASN 45 HD21 ASN 45 -25.688 15.047 -5.956 340 HA PRO 46 HA PRO 46 -25.100 9.431 -3.328 341 1HB PRO 46 HB2 PRO 46 -27.702 10.755 -4.107 342 2HB PRO 46 HB3 PRO 46 -27.435 9.294 -3.105 343 1HG PRO 46 HG2 PRO 46 -27.998 11.672 -1.932 344 2HG PRO 46 HG3 PRO 46 -26.723 10.612 -1.245 345 1HD PRO 46 HD2 PRO 46 -26.383 13.027 -3.041 346 2HD PRO 46 HD3 PRO 46 -25.487 12.573 -1.554 347 H ASN 47 H ASN 47 -25.777 12.092 -5.668 348 HA ASN 47 HA ASN 47 -26.265 10.411 -7.886 349 1HB ASN 47 HB2 ASN 47 -26.370 12.245 -9.104 350 2HB ASN 47 HB3 ASN 47 -26.275 13.147 -7.613 351 1HD2 ASN 47 HD22 ASN 47 -24.957 12.807 -10.745 352 2HD2 ASN 47 HD21 ASN 47 -23.411 13.564 -10.467 353 H ALA 48 H ALA 48 -23.175 11.404 -6.413 354 HA ALA 48 HA ALA 48 -21.615 10.465 -8.674 355 1HB ALA 48 HB1 ALA 48 -19.699 10.841 -7.145 356 2HB ALA 48 HB2 ALA 48 -20.811 12.227 -7.215 357 3HB ALA 48 HB3 ALA 48 -20.817 11.144 -5.801 358 H VAL 49 H VAL 49 -22.679 9.209 -5.488 359 HA VAL 49 HA VAL 49 -21.204 6.779 -5.611 360 HB VAL 49 HB VAL 49 -23.894 7.170 -4.251 361 1HG1 VAL 49 HG11 VAL 49 -22.980 5.339 -2.790 362 2HG1 VAL 49 HG12 VAL 49 -23.225 4.812 -4.458 363 3HG1 VAL 49 HG13 VAL 49 -21.589 5.190 -3.894 364 1HG2 VAL 49 HG21 VAL 49 -21.057 7.649 -3.245 365 2HG2 VAL 49 HG22 VAL 49 -22.318 8.882 -3.432 366 3HG2 VAL 49 HG23 VAL 49 -22.503 7.623 -2.215 367 H LYS 50 H LYS 50 -24.609 7.508 -6.707 368 HA LYS 50 HA LYS 50 -24.883 4.875 -7.749 369 1HB LYS 50 HB2 LYS 50 -26.718 6.637 -7.206 370 2HB LYS 50 HB3 LYS 50 -26.449 7.226 -8.856 371 1HG LYS 50 HG2 LYS 50 -26.910 4.886 -9.701 372 2HG LYS 50 HG3 LYS 50 -27.180 4.367 -8.028 373 1HD LYS 50 HD2 LYS 50 -29.001 6.135 -7.883 374 2HD LYS 50 HD3 LYS 50 -28.838 6.362 -9.624 375 1HE LYS 50 HE2 LYS 50 -29.520 3.707 -8.271 376 2HE LYS 50 HE3 LYS 50 -30.716 4.859 -8.861 377 1HZ LYS 50 HZ1 LYS 50 -28.817 3.299 -10.520 378 2HZ LYS 50 HZ2 LYS 50 -30.433 3.253 -10.515 379 3HZ LYS 50 HZ3 LYS 50 -29.695 4.576 -11.103 380 H ALA 51 H ALA 51 -23.854 7.949 -9.348 381 HA ALA 51 HA ALA 51 -23.758 7.003 -11.961 382 1HB ALA 51 HB1 ALA 51 -22.066 8.790 -12.358 383 2HB ALA 51 HB2 ALA 51 -23.437 9.376 -11.401 384 3HB ALA 51 HB3 ALA 51 -21.885 8.997 -10.608 385 H MET 52 H MET 52 -21.235 6.617 -9.403 386 HA MET 52 HA MET 52 -19.486 5.195 -11.276 387 1HB MET 52 HB2 MET 52 -19.410 5.601 -8.266 388 2HB MET 52 HB3 MET 52 -18.134 4.838 -9.217 389 1HG MET 52 HG2 MET 52 -19.061 7.710 -9.389 390 2HG MET 52 HG3 MET 52 -17.520 7.120 -8.783 391 1HE MET 52 HE1 MET 52 -16.986 4.837 -11.164 392 2HE MET 52 HE2 MET 52 -15.825 5.765 -12.098 393 3HE MET 52 HE3 MET 52 -15.756 5.814 -10.329 394 H LYS 53 H LYS 53 -21.777 4.311 -8.657 395 HA LYS 53 HA LYS 53 -20.981 1.604 -8.503 396 1HB LYS 53 HB2 LYS 53 -22.249 2.928 -6.814 397 2HB LYS 53 HB3 LYS 53 -23.698 2.800 -7.826 398 1HG LYS 53 HG2 LYS 53 -23.707 0.358 -7.498 399 2HG LYS 53 HG3 LYS 53 -22.142 0.451 -6.654 400 1HD LYS 53 HD2 LYS 53 -23.193 1.913 -4.907 401 2HD LYS 53 HD3 LYS 53 -24.737 1.786 -5.750 402 1HE LYS 53 HE2 LYS 53 -24.734 0.302 -3.853 403 2HE LYS 53 HE3 LYS 53 -24.780 -0.661 -5.333 404 1HZ LYS 53 HZ1 LYS 53 -22.490 -1.202 -5.032 405 2HZ LYS 53 HZ2 LYS 53 -22.275 -0.108 -3.828 406 3HZ LYS 53 HZ3 LYS 53 -23.203 -1.444 -3.587 407 H GLU 54 H GLU 54 -23.272 3.234 -10.665 408 HA GLU 54 HA GLU 54 -24.296 0.878 -11.896 409 1HB GLU 54 HB2 GLU 54 -24.037 3.767 -12.794 410 2HB GLU 54 HB3 GLU 54 -24.811 2.554 -13.805 411 1HG GLU 54 HG2 GLU 54 -25.666 3.266 -10.975 412 2HG GLU 54 HG3 GLU 54 -26.371 3.940 -12.439 413 H VAL 55 H VAL 55 -21.111 2.322 -12.139 414 HA VAL 55 HA VAL 55 -20.446 0.853 -14.618 415 HB VAL 55 HB VAL 55 -18.495 2.315 -12.790 416 1HG1 VAL 55 HG11 VAL 55 -17.434 0.965 -14.555 417 2HG1 VAL 55 HG12 VAL 55 -18.452 1.741 -15.787 418 3HG1 VAL 55 HG13 VAL 55 -17.232 2.675 -14.896 419 1HG2 VAL 55 HG21 VAL 55 -18.725 4.327 -14.197 420 2HG2 VAL 55 HG22 VAL 55 -20.067 3.570 -15.082 421 3HG2 VAL 55 HG23 VAL 55 -20.222 3.978 -13.355 422 H GLY 56 H GLY 56 -20.867 0.131 -11.312 423 1HA GLY 56 HA1 GLY 56 -20.318 -1.761 -10.122 424 2HA GLY 56 HA2 GLY 56 -19.187 -2.276 -11.383 425 H ILE 57 H ILE 57 -19.017 1.057 -10.168 426 HA ILE 57 HA ILE 57 -16.493 0.414 -8.708 427 HB ILE 57 HB ILE 57 -17.264 2.911 -10.237 428 1HG1 ILE 57 HG12 ILE 57 -15.088 0.853 -10.838 429 2HG1 ILE 57 HG13 ILE 57 -16.639 0.925 -11.671 430 1HG2 ILE 57 HG21 ILE 57 -14.966 3.694 -9.659 431 2HG2 ILE 57 HG22 ILE 57 -15.887 3.386 -8.200 432 3HG2 ILE 57 HG23 ILE 57 -14.686 2.204 -8.740 433 1HD1 ILE 57 HD11 ILE 57 -14.507 3.079 -11.751 434 2HD1 ILE 57 HD12 ILE 57 -14.998 1.979 -13.051 435 3HD1 ILE 57 HD13 ILE 57 -16.132 3.205 -12.475 436 H ASP 58 H ASP 58 -17.440 0.016 -6.809 437 HA ASP 58 HA ASP 58 -19.696 1.519 -5.778 438 1HB ASP 58 HB2 ASP 58 -19.495 -0.870 -5.383 439 2HB ASP 58 HB3 ASP 58 -17.942 -0.655 -4.569 440 H ILE 59 H ILE 59 -18.647 3.704 -5.843 441 HA ILE 59 HA ILE 59 -16.443 4.203 -4.052 442 HB ILE 59 HB ILE 59 -16.622 6.492 -4.584 443 1HG1 ILE 59 HG12 ILE 59 -19.195 6.082 -6.120 444 2HG1 ILE 59 HG13 ILE 59 -19.163 6.647 -4.455 445 1HG2 ILE 59 HG21 ILE 59 -15.639 4.968 -6.260 446 2HG2 ILE 59 HG22 ILE 59 -17.191 4.970 -7.127 447 3HG2 ILE 59 HG23 ILE 59 -16.260 6.472 -6.945 448 1HD1 ILE 59 HD11 ILE 59 -19.315 8.595 -5.807 449 2HD1 ILE 59 HD12 ILE 59 -17.688 8.544 -5.122 450 3HD1 ILE 59 HD13 ILE 59 -17.944 8.102 -6.821 451 H SER 60 H SER 60 -19.473 3.326 -3.167 452 HA SER 60 HA SER 60 -20.437 5.201 -1.406 453 1HB SER 60 HB2 SER 60 -20.397 2.193 -0.905 454 2HB SER 60 HB3 SER 60 -21.633 3.360 -0.403 455 HG SER 60 HG SER 60 -21.281 2.021 -2.774 456 H ASN 61 H ASN 61 -17.577 3.184 -1.031 457 HA ASN 61 HA ASN 61 -17.348 3.488 1.831 458 1HB ASN 61 HB2 ASN 61 -15.441 2.163 1.690 459 2HB ASN 61 HB3 ASN 61 -16.498 1.488 0.460 460 1HD2 ASN 61 HD22 ASN 61 -13.391 1.686 0.865 461 2HD2 ASN 61 HD21 ASN 61 -12.829 2.241 -0.689 462 H GLN 62 H GLN 62 -16.633 5.616 -0.787 463 HA GLN 62 HA GLN 62 -14.246 6.803 0.325 464 1HB GLN 62 HB2 GLN 62 -16.160 7.836 -1.812 465 2HB GLN 62 HB3 GLN 62 -14.588 8.529 -1.384 466 1HG GLN 62 HG2 GLN 62 -13.479 6.407 -2.010 467 2HG GLN 62 HG3 GLN 62 -15.030 5.761 -2.546 468 1HE2 GLN 62 HE22 GLN 62 -15.095 9.051 -3.499 469 2HE2 GLN 62 HE21 GLN 62 -14.542 8.759 -5.145 470 H THR 63 H THR 63 -14.423 9.303 0.696 471 HA THR 63 HA THR 63 -16.924 10.306 1.684 472 HB THR 63 HB THR 63 -15.655 11.203 3.802 473 HG1 THR 63 HG1 THR 63 -13.625 10.293 3.355 474 1HG2 THR 63 HG21 THR 63 -16.449 8.269 3.868 475 2HG2 THR 63 HG22 THR 63 -16.532 9.466 5.176 476 3HG2 THR 63 HG23 THR 63 -17.620 9.600 3.782 477 H SER 64 H SER 64 -16.728 12.701 2.012 478 HA SER 64 HA SER 64 -14.726 13.810 0.124 479 1HB SER 64 HB2 SER 64 -17.352 14.975 1.105 480 2HB SER 64 HB3 SER 64 -16.317 15.602 -0.192 481 HG SER 64 HG SER 64 -18.229 14.266 -0.755 482 H ASP 65 H ASP 65 -13.649 15.710 0.653 483 HA ASP 65 HA ASP 65 -13.713 16.869 3.354 484 1HB ASP 65 HB2 ASP 65 -11.974 14.966 3.300 485 2HB ASP 65 HB3 ASP 65 -11.122 15.917 2.068 486 H ILE 66 H ILE 66 -12.446 18.962 3.333 487 HA ILE 66 HA ILE 66 -12.518 20.190 0.640 488 HB ILE 66 HB ILE 66 -12.659 22.251 1.662 489 1HG1 ILE 66 HG12 ILE 66 -11.846 20.975 4.299 490 2HG1 ILE 66 HG13 ILE 66 -10.932 22.156 3.337 491 1HG2 ILE 66 HG21 ILE 66 -14.660 20.643 1.871 492 2HG2 ILE 66 HG22 ILE 66 -14.286 20.542 3.591 493 3HG2 ILE 66 HG23 ILE 66 -14.714 22.104 2.876 494 1HD1 ILE 66 HD11 ILE 66 -11.922 23.366 5.137 495 2HD1 ILE 66 HD12 ILE 66 -12.870 23.769 3.676 496 3HD1 ILE 66 HD13 ILE 66 -13.503 22.609 4.869 497 H ILE 67 H ILE 67 -10.604 21.668 0.194 498 HA ILE 67 HA ILE 67 -8.448 20.009 -0.146 499 HB ILE 67 HB ILE 67 -9.040 21.755 -1.616 500 1HG1 ILE 67 HG12 ILE 67 -6.656 20.836 -1.457 501 2HG1 ILE 67 HG13 ILE 67 -6.990 22.215 -2.475 502 1HG2 ILE 67 HG21 ILE 67 -8.488 24.128 -1.266 503 2HG2 ILE 67 HG22 ILE 67 -9.774 23.549 -0.207 504 3HG2 ILE 67 HG23 ILE 67 -8.130 23.789 0.439 505 1HD1 ILE 67 HD11 ILE 67 -5.984 23.770 -0.988 506 2HD1 ILE 67 HD12 ILE 67 -5.814 22.576 0.306 507 3HD1 ILE 67 HD13 ILE 67 -4.861 22.413 -1.174 508 H ASP 68 H ASP 68 -6.447 19.777 0.530 509 HA ASP 68 HA ASP 68 -5.667 20.873 3.174 510 1HB ASP 68 HB2 ASP 68 -6.625 18.601 3.491 511 2HB ASP 68 HB3 ASP 68 -5.431 17.954 2.346 512 H SER 69 H SER 69 -3.958 22.108 2.592 513 HA SER 69 HA SER 69 -2.279 21.709 0.355 514 1HB SER 69 HB2 SER 69 -0.803 23.329 1.751 515 2HB SER 69 HB3 SER 69 -2.371 23.877 1.147 516 HG SER 69 HG SER 69 -2.075 24.414 3.352 517 H ASP 70 H ASP 70 -2.262 20.179 3.544 518 HA ASP 70 HA ASP 70 0.520 19.521 3.564 519 1HB ASP 70 HB2 ASP 70 -0.958 19.665 5.580 520 2HB ASP 70 HB3 ASP 70 -1.736 18.164 5.061 521 H ILE 71 H ILE 71 -1.917 18.362 1.537 522 HA ILE 71 HA ILE 71 -0.215 15.992 0.885 523 HB ILE 71 HB ILE 71 -3.231 16.209 0.633 524 1HG1 ILE 71 HG12 ILE 71 -1.496 14.168 2.077 525 2HG1 ILE 71 HG13 ILE 71 -2.237 15.563 2.888 526 1HG2 ILE 71 HG21 ILE 71 -3.138 13.975 -0.420 527 2HG2 ILE 71 HG22 ILE 71 -2.187 15.097 -1.383 528 3HG2 ILE 71 HG23 ILE 71 -1.365 13.962 -0.304 529 1HD1 ILE 71 HD11 ILE 71 -3.614 13.646 3.320 530 2HD1 ILE 71 HD12 ILE 71 -4.500 14.721 2.219 531 3HD1 ILE 71 HD13 ILE 71 -3.725 13.240 1.605 532 H LEU 72 H LEU 72 -2.540 18.466 -0.423 533 HA LEU 72 HA LEU 72 -1.938 18.162 -3.074 534 1HB LEU 72 HB2 LEU 72 -3.715 19.506 -2.420 535 2HB LEU 72 HB3 LEU 72 -2.751 20.526 -1.395 536 HG LEU 72 HG LEU 72 -1.935 20.648 -4.253 537 1HD1 LEU 72 HD11 LEU 72 -4.347 20.368 -4.597 538 2HD1 LEU 72 HD12 LEU 72 -4.681 21.683 -3.452 539 3HD1 LEU 72 HD13 LEU 72 -3.835 22.017 -4.980 540 1HD2 LEU 72 HD21 LEU 72 -1.960 23.072 -3.737 541 2HD2 LEU 72 HD22 LEU 72 -2.720 22.731 -2.169 542 3HD2 LEU 72 HD23 LEU 72 -1.077 22.167 -2.499 543 H ASN 73 H ASN 73 0.042 20.149 -0.787 544 HA ASN 73 HA ASN 73 1.753 21.049 -2.873 545 1HB ASN 73 HB2 ASN 73 2.852 22.273 -1.331 546 2HB ASN 73 HB3 ASN 73 1.381 21.987 -0.417 547 1HD2 ASN 73 HD22 ASN 73 1.496 20.044 1.144 548 2HD2 ASN 73 HD21 ASN 73 3.024 19.842 1.987 549 H ASN 74 H ASN 74 1.580 17.903 -1.793 550 HA ASN 74 HA ASN 74 4.334 17.336 -2.727 551 1HB ASN 74 HB2 ASN 74 4.597 15.602 -0.991 552 2HB ASN 74 HB3 ASN 74 4.544 17.229 -0.323 553 1HD2 ASN 74 HD22 ASN 74 2.775 17.843 0.981 554 2HD2 ASN 74 HD21 ASN 74 1.680 16.663 1.666 555 H ALA 75 H ALA 75 1.247 17.014 -3.571 556 HA ALA 75 HA ALA 75 1.064 14.217 -4.122 557 1HB ALA 75 HB1 ALA 75 -0.892 15.694 -4.141 558 2HB ALA 75 HB2 ALA 75 -0.197 16.627 -5.491 559 3HB ALA 75 HB3 ALA 75 -0.677 14.934 -5.733 560 H ASP 76 H ASP 76 1.525 13.217 -6.374 561 HA ASP 76 HA ASP 76 3.979 14.327 -7.559 562 1HB ASP 76 HB2 ASP 76 3.514 11.864 -7.600 563 2HB ASP 76 HB3 ASP 76 2.138 12.173 -8.677 564 H LEU 77 H LEU 77 0.467 14.264 -8.141 565 HA LEU 77 HA LEU 77 0.811 16.719 -9.632 566 1HB LEU 77 HB2 LEU 77 -0.460 16.199 -11.516 567 2HB LEU 77 HB3 LEU 77 0.762 14.929 -11.389 568 HG LEU 77 HG LEU 77 -2.104 14.506 -10.463 569 1HD1 LEU 77 HD11 LEU 77 -2.492 13.496 -12.671 570 2HD1 LEU 77 HD12 LEU 77 -2.140 15.223 -12.797 571 3HD1 LEU 77 HD13 LEU 77 -0.880 14.049 -13.201 572 1HD2 LEU 77 HD21 LEU 77 0.245 12.697 -11.220 573 2HD2 LEU 77 HD22 LEU 77 -0.525 12.837 -9.630 574 3HD2 LEU 77 HD23 LEU 77 -1.414 12.126 -10.981 575 H VAL 78 H VAL 78 -0.985 17.966 -9.835 576 HA VAL 78 HA VAL 78 -3.349 17.306 -8.145 577 HB VAL 78 HB VAL 78 -1.944 19.934 -8.783 578 1HG1 VAL 78 HG11 VAL 78 -4.630 19.533 -7.372 579 2HG1 VAL 78 HG12 VAL 78 -3.714 21.059 -7.422 580 3HG1 VAL 78 HG13 VAL 78 -4.360 20.377 -8.915 581 1HG2 VAL 78 HG21 VAL 78 -2.661 18.755 -6.059 582 2HG2 VAL 78 HG22 VAL 78 -1.100 18.499 -6.839 583 3HG2 VAL 78 HG23 VAL 78 -1.589 20.140 -6.430 584 H VAL 79 H VAL 79 -5.274 17.391 -9.278 585 HA VAL 79 HA VAL 79 -5.265 18.484 -12.040 586 HB VAL 79 HB VAL 79 -7.024 16.476 -12.371 587 1HG1 VAL 79 HG11 VAL 79 -5.449 16.987 -13.944 588 2HG1 VAL 79 HG12 VAL 79 -4.064 16.525 -12.923 589 3HG1 VAL 79 HG13 VAL 79 -5.169 15.286 -13.581 590 1HG2 VAL 79 HG21 VAL 79 -4.748 15.165 -10.761 591 2HG2 VAL 79 HG22 VAL 79 -6.404 15.365 -10.151 592 3HG2 VAL 79 HG23 VAL 79 -6.086 14.347 -11.570 593 H THR 80 H THR 80 -6.425 20.244 -11.744 594 HA THR 80 HA THR 80 -8.636 20.142 -9.814 595 HB THR 80 HB THR 80 -9.016 22.427 -10.098 596 HG1 THR 80 HG1 THR 80 -8.795 22.941 -12.171 597 1HG2 THR 80 HG21 THR 80 -5.980 22.212 -10.223 598 2HG2 THR 80 HG22 THR 80 -6.980 23.357 -9.296 599 3HG2 THR 80 HG23 THR 80 -6.902 21.671 -8.817 600 H LEU 81 H LEU 81 -10.820 20.212 -10.508 601 HA LEU 81 HA LEU 81 -11.156 18.999 -13.198 602 1HB LEU 81 HB2 LEU 81 -12.714 18.674 -10.629 603 2HB LEU 81 HB3 LEU 81 -13.111 17.881 -12.150 604 HG LEU 81 HG LEU 81 -10.504 17.493 -10.597 605 1HD1 LEU 81 HD11 LEU 81 -11.420 15.273 -10.069 606 2HD1 LEU 81 HD12 LEU 81 -12.408 16.584 -9.407 607 3HD1 LEU 81 HD13 LEU 81 -12.948 15.706 -10.862 608 1HD2 LEU 81 HD21 LEU 81 -11.588 16.151 -13.108 609 2HD2 LEU 81 HD22 LEU 81 -10.072 17.072 -12.939 610 3HD2 LEU 81 HD23 LEU 81 -10.246 15.507 -12.148 611 H CYS 82 H CYS 82 -11.591 22.049 -12.055 612 HA CYS 82 HA CYS 82 -13.400 22.475 -14.204 613 1HB CYS 82 HB2 CYS 82 -15.227 23.504 -13.168 614 2HB CYS 82 HB3 CYS 82 -14.952 22.037 -12.226 615 HG CYS 82 HG CYS 82 -15.546 23.883 -10.471 616 H GLY 83 H GLY 83 -13.530 24.872 -14.693 617 1HA GLY 83 HA1 GLY 83 -10.872 25.793 -14.845 618 2HA GLY 83 HA2 GLY 83 -12.324 26.711 -15.288 619 H ASP 84 H ASP 84 -13.591 26.880 -12.720 620 HA ASP 84 HA ASP 84 -12.110 29.088 -11.614 621 1HB ASP 84 HB2 ASP 84 -14.574 28.961 -11.585 622 2HB ASP 84 HB3 ASP 84 -14.496 27.590 -10.475 623 H ALA 85 H ALA 85 -12.475 25.660 -10.686 624 HA ALA 85 HA ALA 85 -11.364 25.858 -8.086 625 1HB ALA 85 HB1 ALA 85 -12.603 23.880 -8.822 626 2HB ALA 85 HB2 ALA 85 -11.353 23.509 -10.034 627 3HB ALA 85 HB3 ALA 85 -10.989 23.422 -8.306 628 H ALA 86 H ALA 86 -9.816 25.915 -11.233 629 HA ALA 86 HA ALA 86 -7.259 24.986 -10.605 630 1HB ALA 86 HB1 ALA 86 -6.522 26.305 -12.525 631 2HB ALA 86 HB2 ALA 86 -8.084 25.521 -12.876 632 3HB ALA 86 HB3 ALA 86 -8.010 27.260 -12.471 633 H ASP 87 H ASP 87 -8.770 28.066 -9.722 634 HA ASP 87 HA ASP 87 -6.399 29.499 -9.067 635 1HB ASP 87 HB2 ASP 87 -8.600 30.566 -9.358 636 2HB ASP 87 HB3 ASP 87 -9.215 29.702 -7.942 637 H LYS 88 H LYS 88 -8.238 27.027 -7.320 638 HA LYS 88 HA LYS 88 -7.035 27.794 -4.750 639 1HB LYS 88 HB2 LYS 88 -9.486 27.161 -5.070 640 2HB LYS 88 HB3 LYS 88 -8.934 25.503 -5.298 641 1HG LYS 88 HG2 LYS 88 -9.645 25.707 -3.055 642 2HG LYS 88 HG3 LYS 88 -7.885 25.633 -2.986 643 1HD LYS 88 HD2 LYS 88 -7.743 28.052 -2.626 644 2HD LYS 88 HD3 LYS 88 -9.494 28.228 -2.905 645 1HE LYS 88 HE2 LYS 88 -9.951 26.765 -0.971 646 2HE LYS 88 HE3 LYS 88 -8.216 26.585 -0.677 647 1HZ LYS 88 HZ1 LYS 88 -8.111 28.979 -0.242 648 2HZ LYS 88 HZ2 LYS 88 -9.716 29.143 -0.512 649 3HZ LYS 88 HZ3 LYS 88 -9.186 28.275 0.759 650 H CYS 89 H CYS 89 -4.952 27.289 -6.072 651 HA CYS 89 HA CYS 89 -4.001 24.607 -5.137 652 1HB CYS 89 HB2 CYS 89 -2.932 26.237 -7.472 653 2HB CYS 89 HB3 CYS 89 -2.254 24.725 -6.846 654 HG CYS 89 HG CYS 89 -5.110 25.377 -8.347 655 HA PRO 90 HA PRO 90 -2.699 28.265 -2.670 656 1HB PRO 90 HB2 PRO 90 -2.159 26.922 -0.262 657 2HB PRO 90 HB3 PRO 90 -3.702 27.676 -0.758 658 1HG PRO 90 HG2 PRO 90 -2.864 24.789 -0.977 659 2HG PRO 90 HG3 PRO 90 -4.457 25.457 -0.494 660 1HD PRO 90 HD2 PRO 90 -4.043 24.495 -2.986 661 2HD PRO 90 HD3 PRO 90 -5.020 25.969 -2.730 662 H MET 91 H MET 91 -0.842 25.222 -2.822 663 HA MET 91 HA MET 91 1.431 26.689 -3.716 664 1HB MET 91 HB2 MET 91 3.041 25.682 -2.031 665 2HB MET 91 HB3 MET 91 2.102 27.063 -1.485 666 1HG MET 91 HG2 MET 91 0.647 25.677 -0.159 667 2HG MET 91 HG3 MET 91 1.333 24.200 -0.837 668 1HE MET 91 HE1 MET 91 0.974 24.777 2.327 669 2HE MET 91 HE2 MET 91 1.603 23.252 1.656 670 3HE MET 91 HE3 MET 91 2.500 24.101 2.933 671 H THR 92 H THR 92 2.224 25.457 -5.313 672 HA THR 92 HA THR 92 2.208 22.500 -5.085 673 HB THR 92 HB THR 92 1.395 22.418 -7.474 674 HG1 THR 92 HG1 THR 92 1.695 24.713 -7.820 675 1HG2 THR 92 HG21 THR 92 -0.924 22.462 -6.902 676 2HG2 THR 92 HG22 THR 92 -0.038 21.884 -5.487 677 3HG2 THR 92 HG23 THR 92 -0.635 23.558 -5.538 678 HA PRO 93 HA PRO 93 6.261 24.419 -6.283 679 1HB PRO 93 HB2 PRO 93 7.887 22.642 -4.925 680 2HB PRO 93 HB3 PRO 93 7.110 24.063 -4.167 681 1HG PRO 93 HG2 PRO 93 6.151 21.188 -4.175 682 2HG PRO 93 HG3 PRO 93 6.288 22.304 -2.779 683 1HD PRO 93 HD2 PRO 93 3.938 21.902 -4.063 684 2HD PRO 93 HD3 PRO 93 4.378 23.524 -3.455 685 HA PRO 94 HA PRO 94 7.271 21.899 -9.748 686 1HB PRO 94 HB2 PRO 94 10.078 21.502 -8.682 687 2HB PRO 94 HB3 PRO 94 9.557 21.939 -10.342 688 1HG PRO 94 HG2 PRO 94 10.439 23.865 -8.663 689 2HG PRO 94 HG3 PRO 94 8.970 24.155 -9.650 690 1HD PRO 94 HD2 PRO 94 9.159 23.368 -6.740 691 2HD PRO 94 HD3 PRO 94 8.084 24.564 -7.522 692 H HIS 95 H HIS 95 7.918 20.363 -6.654 693 HA HIS 95 HA HIS 95 8.250 17.666 -7.526 694 1HB HIS 95 HB2 HIS 95 6.870 18.694 -5.015 695 2HB HIS 95 HB3 HIS 95 7.567 17.096 -5.254 696 HD1 HIS 95 HD1 HIS 95 10.475 17.580 -6.099 697 HD2 HIS 95 HD2 HIS 95 8.377 20.055 -3.413 698 HE1 HIS 95 HE1 HIS 95 12.235 18.824 -4.750 699 H VAL 96 H VAL 96 5.552 19.769 -7.834 700 HA VAL 96 HA VAL 96 3.560 17.583 -8.063 701 HB VAL 96 HB VAL 96 3.066 20.475 -7.192 702 1HG1 VAL 96 HG11 VAL 96 0.978 19.584 -6.311 703 2HG1 VAL 96 HG12 VAL 96 1.123 19.279 -8.046 704 3HG1 VAL 96 HG13 VAL 96 1.400 17.961 -6.891 705 1HG2 VAL 96 HG21 VAL 96 4.500 19.727 -5.457 706 2HG2 VAL 96 HG22 VAL 96 2.837 19.726 -4.878 707 3HG2 VAL 96 HG23 VAL 96 3.629 18.196 -5.295 708 H LYS 97 H LYS 97 3.133 17.406 -10.321 709 HA LYS 97 HA LYS 97 3.265 19.916 -11.910 710 1HB LYS 97 HB2 LYS 97 2.986 18.763 -13.868 711 2HB LYS 97 HB3 LYS 97 4.198 17.898 -12.969 712 1HG LYS 97 HG2 LYS 97 1.435 16.798 -12.661 713 2HG LYS 97 HG3 LYS 97 2.003 16.850 -14.317 714 1HD LYS 97 HD2 LYS 97 4.123 15.677 -13.589 715 2HD LYS 97 HD3 LYS 97 3.383 15.451 -11.997 716 1HE LYS 97 HE2 LYS 97 1.519 14.185 -13.047 717 2HE LYS 97 HE3 LYS 97 2.231 14.452 -14.646 718 1HZ LYS 97 HZ1 LYS 97 2.821 12.284 -13.804 719 2HZ LYS 97 HZ2 LYS 97 4.182 13.182 -13.848 720 3HZ LYS 97 HZ3 LYS 97 3.425 12.899 -12.411 721 H ARG 98 H ARG 98 1.251 20.276 -13.345 722 HA ARG 98 HA ARG 98 -1.215 19.856 -11.761 723 1HB ARG 98 HB2 ARG 98 0.186 22.449 -12.335 724 2HB ARG 98 HB3 ARG 98 -1.567 22.430 -12.550 725 1HG ARG 98 HG2 ARG 98 -1.985 21.767 -10.308 726 2HG ARG 98 HG3 ARG 98 -0.290 21.346 -10.020 727 1HD ARG 98 HD2 ARG 98 -0.957 23.445 -8.931 728 2HD ARG 98 HD3 ARG 98 0.395 23.645 -10.061 729 HE ARG 98 HE ARG 98 -1.917 24.247 -11.515 730 1HH1 ARG 98 HH21 ARG 98 -0.270 25.527 -8.628 731 2HH1 ARG 98 HH22 ARG 98 -0.785 27.158 -8.904 732 1HH2 ARG 98 HH11 ARG 98 -2.697 26.311 -11.808 733 2HH2 ARG 98 HH12 ARG 98 -2.257 27.620 -10.754 734 H GLU 99 H GLU 99 -3.092 19.946 -12.886 735 HA GLU 99 HA GLU 99 -3.109 20.655 -15.714 736 1HB GLU 99 HB2 GLU 99 -3.169 17.896 -14.797 737 2HB GLU 99 HB3 GLU 99 -4.778 18.343 -15.392 738 1HG GLU 99 HG2 GLU 99 -2.240 18.708 -17.006 739 2HG GLU 99 HG3 GLU 99 -3.286 17.275 -17.048 740 H HIS 100 H HIS 100 -5.324 21.169 -16.328 741 HA HIS 100 HA HIS 100 -7.103 21.842 -14.028 742 1HB HIS 100 HB2 HIS 100 -5.923 23.805 -16.040 743 2HB HIS 100 HB3 HIS 100 -7.219 24.172 -14.901 744 HD1 HIS 100 HD1 HIS 100 -6.256 23.238 -12.211 745 HD2 HIS 100 HD2 HIS 100 -3.686 24.870 -15.105 746 HE1 HIS 100 HE1 HIS 100 -4.235 24.122 -10.942 747 H TRP 101 H TRP 101 -8.526 20.267 -14.765 748 HA TRP 101 HA TRP 101 -9.500 20.274 -17.528 749 1HB TRP 101 HB2 TRP 101 -10.267 18.571 -15.135 750 2HB TRP 101 HB3 TRP 101 -10.740 18.317 -16.808 751 HD1 TRP 101 HD1 TRP 101 -7.370 19.160 -17.368 752 HE1 TRP 101 HE1 TRP 101 -5.821 17.209 -17.566 753 HE3 TRP 101 HE3 TRP 101 -10.276 15.645 -15.042 754 HZ2 TRP 101 HZ2 TRP 101 -5.603 14.566 -16.402 755 HZ3 TRP 101 HZ3 TRP 101 -9.313 13.436 -14.495 756 HH2 TRP 101 HH2 TRP 101 -6.972 12.874 -15.156 757 H GLY 102 H GLY 102 -12.100 19.986 -17.549 758 1HA GLY 102 HA1 GLY 102 -13.228 22.418 -16.203 759 2HA GLY 102 HA2 GLY 102 -13.205 22.245 -17.936 760 H PHE 103 H PHE 103 -14.673 20.990 -14.931 761 HA PHE 103 HA PHE 103 -16.948 20.035 -16.570 762 1HB PHE 103 HB2 PHE 103 -15.740 18.728 -14.104 763 2HB PHE 103 HB3 PHE 103 -17.248 18.245 -14.873 764 HD1 PHE 103 HD1 PHE 103 -13.593 18.037 -15.065 765 HD2 PHE 103 HD2 PHE 103 -17.257 17.479 -17.272 766 HE1 PHE 103 HE1 PHE 103 -12.350 16.799 -16.821 767 HE2 PHE 103 HE2 PHE 103 -16.025 16.269 -19.021 768 HZ PHE 103 HZ PHE 103 -13.552 15.919 -18.811 769 H ASP 104 H ASP 104 -18.740 21.013 -16.206 770 HA ASP 104 HA ASP 104 -19.296 22.822 -14.032 771 1HB ASP 104 HB2 ASP 104 -20.352 22.950 -16.294 772 2HB ASP 104 HB3 ASP 104 -21.120 21.382 -15.993 773 H ASP 105 H ASP 105 -20.961 22.450 -12.377 774 HA ASP 105 HA ASP 105 -20.443 19.958 -11.047 775 1HB ASP 105 HB2 ASP 105 -20.757 22.182 -9.922 776 2HB ASP 105 HB3 ASP 105 -22.491 22.023 -10.223 777 HA PRO 106 HA PRO 106 -23.680 18.019 -13.342 778 1HB PRO 106 HB2 PRO 106 -23.583 15.444 -12.307 779 2HB PRO 106 HB3 PRO 106 -22.388 16.107 -13.463 780 1HG PRO 106 HG2 PRO 106 -22.198 15.948 -10.439 781 2HG PRO 106 HG3 PRO 106 -20.959 15.495 -11.655 782 1HD PRO 106 HD2 PRO 106 -20.895 17.902 -10.402 783 2HD PRO 106 HD3 PRO 106 -20.465 17.749 -12.131 784 H ALA 107 H ALA 107 -23.739 17.957 -9.785 785 HA ALA 107 HA ALA 107 -26.382 16.888 -9.584 786 1HB ALA 107 HB1 ALA 107 -24.788 18.556 -7.592 787 2HB ALA 107 HB2 ALA 107 -26.261 17.635 -7.236 788 3HB ALA 107 HB3 ALA 107 -24.780 16.786 -7.727 789 H ARG 108 H ARG 108 -25.255 19.987 -10.590 790 HA ARG 108 HA ARG 108 -27.952 21.210 -10.202 791 1HB ARG 108 HB2 ARG 108 -25.206 22.548 -10.414 792 2HB ARG 108 HB3 ARG 108 -26.758 23.380 -10.350 793 1HG ARG 108 HG2 ARG 108 -26.153 23.548 -8.181 794 2HG ARG 108 HG3 ARG 108 -27.152 22.085 -8.134 795 1HD ARG 108 HD2 ARG 108 -25.090 20.703 -8.153 796 2HD ARG 108 HD3 ARG 108 -24.104 22.169 -8.252 797 HE ARG 108 HE ARG 108 -25.770 22.441 -6.009 798 1HH1 ARG 108 HH11 ARG 108 -23.099 20.265 -7.019 799 2HH1 ARG 108 HH12 ARG 108 -22.506 20.106 -5.385 800 1HH2 ARG 108 HH21 ARG 108 -24.949 22.110 -3.869 801 2HH2 ARG 108 HH22 ARG 108 -23.546 21.105 -3.643 802 H ALA 109 H ALA 109 -26.780 19.401 -12.443 803 HA ALA 109 HA ALA 109 -26.495 20.995 -14.730 804 1HB ALA 109 HB1 ALA 109 -27.020 18.923 -15.992 805 2HB ALA 109 HB2 ALA 109 -25.901 18.621 -14.648 806 3HB ALA 109 HB3 ALA 109 -27.612 18.171 -14.495 807 H GLN 110 H GLN 110 -29.413 20.131 -13.029 808 HA GLN 110 HA GLN 110 -31.608 20.201 -13.441 809 1HB GLN 110 HB2 GLN 110 -30.981 22.935 -14.628 810 2HB GLN 110 HB3 GLN 110 -32.471 22.431 -13.829 811 1HG GLN 110 HG2 GLN 110 -29.783 22.929 -12.531 812 2HG GLN 110 HG3 GLN 110 -31.243 23.886 -12.383 813 1HE2 GLN 110 HE22 GLN 110 -32.979 23.112 -10.996 814 2HE2 GLN 110 HE21 GLN 110 -32.707 21.816 -9.863 815 H GLY 111 H GLY 111 -32.848 21.926 -15.633 816 1HA GLY 111 HA1 GLY 111 -33.476 21.709 -17.879 817 2HA GLY 111 HA2 GLY 111 -32.563 20.194 -18.014 818 H THR 112 H THR 112 -33.323 18.390 -16.599 819 HA THR 112 HA THR 112 -35.785 18.305 -15.266 820 HB THR 112 HB THR 112 -36.814 18.381 -17.458 821 HG1 THR 112 HG1 THR 112 -37.041 15.677 -16.851 822 1HG2 THR 112 HG21 THR 112 -36.498 16.552 -19.132 823 2HG2 THR 112 HG22 THR 112 -35.132 17.662 -18.976 824 3HG2 THR 112 HG23 THR 112 -35.045 16.053 -18.237 825 H GLU 113 H GLU 113 -36.076 15.864 -14.539 826 HA GLU 113 HA GLU 113 -33.622 15.245 -13.303 827 1HB GLU 113 HB2 GLU 113 -35.760 14.634 -12.337 828 2HB GLU 113 HB3 GLU 113 -36.122 13.551 -13.694 829 1HG GLU 113 HG2 GLU 113 -34.291 12.072 -13.094 830 2HG GLU 113 HG3 GLU 113 -33.718 13.195 -11.854 831 H GLU 114 H GLU 114 -35.105 13.857 -16.220 832 HA GLU 114 HA GLU 114 -33.048 11.850 -16.489 833 1HB GLU 114 HB2 GLU 114 -33.986 11.374 -18.683 834 2HB GLU 114 HB3 GLU 114 -35.196 11.333 -17.415 835 1HG GLU 114 HG2 GLU 114 -34.849 13.838 -19.096 836 2HG GLU 114 HG3 GLU 114 -35.684 12.443 -19.748 837 H GLU 115 H GLU 115 -33.304 15.216 -17.498 838 HA GLU 115 HA GLU 115 -31.157 15.041 -19.424 839 1HB GLU 115 HB2 GLU 115 -32.951 16.796 -19.481 840 2HB GLU 115 HB3 GLU 115 -32.287 17.471 -17.994 841 1HG GLU 115 HG2 GLU 115 -31.486 18.796 -19.798 842 2HG GLU 115 HG3 GLU 115 -30.116 17.876 -19.200 843 H LYS 116 H LYS 116 -31.579 15.904 -15.971 844 HA LYS 116 HA LYS 116 -28.892 16.575 -15.426 845 1HB LYS 116 HB2 LYS 116 -30.695 17.217 -13.973 846 2HB LYS 116 HB3 LYS 116 -31.203 15.542 -13.736 847 1HG LYS 116 HG2 LYS 116 -29.184 15.006 -12.567 848 2HG LYS 116 HG3 LYS 116 -28.523 16.640 -12.828 849 1HD LYS 116 HD2 LYS 116 -31.024 15.958 -11.232 850 2HD LYS 116 HD3 LYS 116 -29.402 16.221 -10.544 851 1HE LYS 116 HE2 LYS 116 -29.455 18.513 -11.715 852 2HE LYS 116 HE3 LYS 116 -31.195 18.239 -11.937 853 1HZ LYS 116 HZ1 LYS 116 -31.330 18.036 -9.475 854 2HZ LYS 116 HZ2 LYS 116 -29.718 18.419 -9.373 855 3HZ LYS 116 HZ3 LYS 116 -30.762 19.502 -9.976 856 H TRP 117 H TRP 117 -30.611 13.433 -15.159 857 HA TRP 117 HA TRP 117 -28.298 11.935 -14.428 858 1HB TRP 117 HB2 TRP 117 -30.591 11.023 -14.278 859 2HB TRP 117 HB3 TRP 117 -30.688 10.964 -16.039 860 HD1 TRP 117 HD1 TRP 117 -29.235 9.087 -17.286 861 HE1 TRP 117 HE1 TRP 117 -28.079 6.928 -16.514 862 HE3 TRP 117 HE3 TRP 117 -29.369 9.846 -12.225 863 HZ2 TRP 117 HZ2 TRP 117 -27.061 5.840 -14.075 864 HZ3 TRP 117 HZ3 TRP 117 -28.163 8.305 -10.707 865 HH2 TRP 117 HH2 TRP 117 -26.986 6.302 -11.618 866 H ALA 118 H ALA 118 -29.617 12.737 -17.696 867 HA ALA 118 HA ALA 118 -27.704 11.300 -19.173 868 1HB ALA 118 HB1 ALA 118 -28.336 12.810 -21.032 869 2HB ALA 118 HB2 ALA 118 -29.763 12.253 -20.138 870 3HB ALA 118 HB3 ALA 118 -29.137 13.894 -19.892 871 H PHE 119 H PHE 119 -27.454 14.532 -17.641 872 HA PHE 119 HA PHE 119 -24.865 15.061 -18.747 873 1HB PHE 119 HB2 PHE 119 -26.514 16.769 -17.898 874 2HB PHE 119 HB3 PHE 119 -26.098 16.278 -16.260 875 HD1 PHE 119 HD1 PHE 119 -24.094 17.099 -15.225 876 HD2 PHE 119 HD2 PHE 119 -24.707 17.680 -19.446 877 HE1 PHE 119 HE1 PHE 119 -22.180 18.698 -15.277 878 HE2 PHE 119 HE2 PHE 119 -22.754 19.210 -19.519 879 HZ PHE 119 HZ PHE 119 -21.485 19.712 -17.445 880 H PHE 120 H PHE 120 -25.956 13.482 -15.656 881 HA PHE 120 HA PHE 120 -23.429 13.136 -14.427 882 1HB PHE 120 HB2 PHE 120 -25.541 10.973 -14.593 883 2HB PHE 120 HB3 PHE 120 -24.226 11.100 -13.465 884 HD1 PHE 120 HD1 PHE 120 -25.252 14.410 -13.359 885 HD2 PHE 120 HD2 PHE 120 -26.678 10.450 -12.426 886 HE1 PHE 120 HE1 PHE 120 -26.748 15.343 -11.635 887 HE2 PHE 120 HE2 PHE 120 -28.260 11.413 -10.772 888 HZ PHE 120 HZ PHE 120 -28.281 13.864 -10.360 889 H GLN 121 H GLN 121 -25.072 11.211 -17.006 890 HA GLN 121 HA GLN 121 -23.048 9.296 -17.380 891 1HB GLN 121 HB2 GLN 121 -25.032 10.396 -19.406 892 2HB GLN 121 HB3 GLN 121 -24.008 9.007 -19.684 893 1HG GLN 121 HG2 GLN 121 -26.075 9.215 -17.446 894 2HG GLN 121 HG3 GLN 121 -26.323 8.402 -18.986 895 1HE2 GLN 121 HE22 GLN 121 -25.690 7.699 -15.829 896 2HE2 GLN 121 HE21 GLN 121 -24.729 6.252 -16.035 897 H ARG 122 H ARG 122 -23.406 12.471 -19.021 898 HA ARG 122 HA ARG 122 -21.110 12.127 -20.690 899 1HB ARG 122 HB2 ARG 122 -22.597 14.609 -19.748 900 2HB ARG 122 HB3 ARG 122 -21.031 14.762 -20.529 901 1HG ARG 122 HG2 ARG 122 -22.605 15.037 -22.254 902 2HG ARG 122 HG3 ARG 122 -21.872 13.441 -22.486 903 1HD ARG 122 HD2 ARG 122 -23.853 12.449 -21.284 904 2HD ARG 122 HD3 ARG 122 -24.582 14.073 -21.248 905 HE ARG 122 HE ARG 122 -24.034 13.619 -23.912 906 1HH1 ARG 122 HH11 ARG 122 -25.871 11.974 -21.381 907 2HH1 ARG 122 HH12 ARG 122 -26.930 11.131 -22.473 908 1HH2 ARG 122 HH21 ARG 122 -25.495 12.581 -25.389 909 2HH2 ARG 122 HH22 ARG 122 -26.742 11.546 -24.808 910 H VAL 123 H VAL 123 -21.415 13.749 -17.471 911 HA VAL 123 HA VAL 123 -18.651 14.415 -17.455 912 HB VAL 123 HB VAL 123 -20.621 14.229 -15.143 913 1HG1 VAL 123 HG11 VAL 123 -19.023 15.725 -13.943 914 2HG1 VAL 123 HG12 VAL 123 -18.310 14.139 -14.259 915 3HG1 VAL 123 HG13 VAL 123 -17.852 15.525 -15.268 916 1HG2 VAL 123 HG21 VAL 123 -20.630 16.731 -15.394 917 2HG2 VAL 123 HG22 VAL 123 -19.586 16.585 -16.815 918 3HG2 VAL 123 HG23 VAL 123 -21.234 15.932 -16.848 919 H ARG 124 H ARG 124 -20.309 11.456 -16.001 920 HA ARG 124 HA ARG 124 -17.827 10.569 -14.951 921 1HB ARG 124 HB2 ARG 124 -18.774 8.395 -14.617 922 2HB ARG 124 HB3 ARG 124 -20.010 9.590 -14.217 923 1HG ARG 124 HG2 ARG 124 -21.115 9.116 -16.391 924 2HG ARG 124 HG3 ARG 124 -19.844 7.953 -16.791 925 1HD ARG 124 HD2 ARG 124 -20.471 6.648 -14.736 926 2HD ARG 124 HD3 ARG 124 -21.886 7.708 -14.565 927 HE ARG 124 HE ARG 124 -21.960 6.833 -17.200 928 1HH1 ARG 124 HH21 ARG 124 -22.054 5.171 -14.047 929 2HH1 ARG 124 HH22 ARG 124 -22.819 3.761 -14.704 930 1HH2 ARG 124 HH11 ARG 124 -23.210 5.094 -17.934 931 2HH2 ARG 124 HH12 ARG 124 -23.386 3.662 -16.980 932 H ASP 125 H ASP 125 -19.321 9.978 -18.140 933 HA ASP 125 HA ASP 125 -17.420 8.102 -19.053 934 1HB ASP 125 HB2 ASP 125 -19.515 8.489 -20.235 935 2HB ASP 125 HB3 ASP 125 -19.040 10.150 -20.613 936 H GLU 126 H GLU 126 -17.412 11.706 -19.247 937 HA GLU 126 HA GLU 126 -14.942 11.844 -20.638 938 1HB GLU 126 HB2 GLU 126 -16.760 13.761 -19.240 939 2HB GLU 126 HB3 GLU 126 -15.074 14.235 -19.408 940 1HG GLU 126 HG2 GLU 126 -16.570 13.202 -21.824 941 2HG GLU 126 HG3 GLU 126 -16.741 14.874 -21.289 942 H ILE 127 H ILE 127 -15.725 12.031 -17.081 943 HA ILE 127 HA ILE 127 -13.041 12.637 -16.377 944 HB ILE 127 HB ILE 127 -15.474 12.430 -15.028 945 1HG1 ILE 127 HG12 ILE 127 -14.140 13.049 -12.964 946 2HG1 ILE 127 HG13 ILE 127 -12.684 12.926 -13.971 947 1HG2 ILE 127 HG21 ILE 127 -13.703 10.362 -13.781 948 2HG2 ILE 127 HG22 ILE 127 -15.210 11.040 -13.112 949 3HG2 ILE 127 HG23 ILE 127 -15.268 10.120 -14.619 950 1HD1 ILE 127 HD11 ILE 127 -13.641 14.638 -15.497 951 2HD1 ILE 127 HD12 ILE 127 -15.141 14.661 -14.542 952 3HD1 ILE 127 HD13 ILE 127 -13.626 15.251 -13.823 953 H GLY 128 H GLY 128 -14.722 9.515 -16.833 954 1HA GLY 128 HA1 GLY 128 -12.557 7.796 -16.186 955 2HA GLY 128 HA2 GLY 128 -13.909 7.434 -17.284 956 H ASN 129 H ASN 129 -13.588 9.214 -19.346 957 HA ASN 129 HA ASN 129 -11.518 8.183 -20.943 958 1HB ASN 129 HB2 ASN 129 -13.434 9.161 -21.971 959 2HB ASN 129 HB3 ASN 129 -13.203 10.678 -21.116 960 1HD2 ASN 129 HD22 ASN 129 -12.703 12.263 -22.530 961 2HD2 ASN 129 HD21 ASN 129 -11.520 12.086 -23.816 962 H ARG 130 H ARG 130 -11.519 11.193 -18.978 963 HA ARG 130 HA ARG 130 -8.924 12.002 -19.881 964 1HB ARG 130 HB2 ARG 130 -10.193 12.682 -17.194 965 2HB ARG 130 HB3 ARG 130 -8.816 13.472 -17.948 966 1HG ARG 130 HG2 ARG 130 -11.724 13.743 -18.601 967 2HG ARG 130 HG3 ARG 130 -10.524 14.973 -18.321 968 1HD ARG 130 HD2 ARG 130 -9.523 14.569 -20.543 969 2HD ARG 130 HD3 ARG 130 -10.617 13.209 -20.810 970 HE ARG 130 HE ARG 130 -12.354 14.555 -21.308 971 1HH1 ARG 130 HH21 ARG 130 -9.726 16.615 -20.046 972 2HH1 ARG 130 HH22 ARG 130 -10.450 18.089 -20.570 973 1HH2 ARG 130 HH11 ARG 130 -13.310 16.485 -21.981 974 2HH2 ARG 130 HH12 ARG 130 -12.552 18.022 -21.685 975 H LEU 131 H LEU 131 -9.929 9.928 -17.091 976 HA LEU 131 HA LEU 131 -7.197 9.614 -16.234 977 1HB LEU 131 HB2 LEU 131 -9.775 8.262 -15.521 978 2HB LEU 131 HB3 LEU 131 -8.273 7.411 -15.174 979 HG LEU 131 HG LEU 131 -8.978 8.636 -13.271 980 1HD1 LEU 131 HD11 LEU 131 -6.459 9.992 -14.317 981 2HD1 LEU 131 HD12 LEU 131 -6.866 9.601 -12.656 982 3HD1 LEU 131 HD13 LEU 131 -6.517 8.295 -13.785 983 1HD2 LEU 131 HD21 LEU 131 -10.179 10.488 -14.289 984 2HD2 LEU 131 HD22 LEU 131 -8.996 11.075 -13.131 985 3HD2 LEU 131 HD23 LEU 131 -8.654 11.190 -14.866 986 H LYS 132 H LYS 132 -9.231 7.746 -18.497 987 HA LYS 132 HA LYS 132 -7.348 5.708 -19.050 988 1HB LYS 132 HB2 LYS 132 -9.431 5.285 -19.885 989 2HB LYS 132 HB3 LYS 132 -9.732 6.909 -20.419 990 1HG LYS 132 HG2 LYS 132 -7.742 5.140 -21.885 991 2HG LYS 132 HG3 LYS 132 -9.481 4.997 -22.133 992 1HD LYS 132 HD2 LYS 132 -9.143 7.730 -22.400 993 2HD LYS 132 HD3 LYS 132 -7.631 7.118 -23.082 994 1HE LYS 132 HE2 LYS 132 -8.847 5.791 -24.712 995 2HE LYS 132 HE3 LYS 132 -10.382 6.090 -23.884 996 1HZ LYS 132 HZ1 LYS 132 -8.782 8.155 -25.276 997 2HZ LYS 132 HZ2 LYS 132 -10.187 7.514 -25.794 998 3HZ LYS 132 HZ3 LYS 132 -10.174 8.445 -24.446 999 H GLU 133 H GLU 133 -7.714 8.937 -20.644 1000 HA GLU 133 HA GLU 133 -5.402 8.586 -22.300 1001 1HB GLU 133 HB2 GLU 133 -6.952 10.984 -21.270 1002 2HB GLU 133 HB3 GLU 133 -5.349 11.211 -21.958 1003 1HG GLU 133 HG2 GLU 133 -6.201 9.822 -23.987 1004 2HG GLU 133 HG3 GLU 133 -7.816 10.140 -23.349 1005 H PHE 134 H PHE 134 -5.710 10.073 -19.017 1006 HA PHE 134 HA PHE 134 -3.018 10.809 -18.803 1007 1HB PHE 134 HB2 PHE 134 -4.721 11.565 -17.296 1008 2HB PHE 134 HB3 PHE 134 -5.061 9.920 -16.754 1009 HD1 PHE 134 HD1 PHE 134 -4.047 9.101 -14.803 1010 HD2 PHE 134 HD2 PHE 134 -2.286 12.446 -16.878 1011 HE1 PHE 134 HE1 PHE 134 -2.386 9.362 -12.973 1012 HE2 PHE 134 HE2 PHE 134 -0.630 12.703 -15.064 1013 HZ PHE 134 HZ PHE 134 -0.708 11.209 -13.088 1014 H ALA 135 H ALA 135 -4.532 7.655 -18.211 1015 HA ALA 135 HA ALA 135 -2.178 6.417 -17.146 1016 1HB ALA 135 HB1 ALA 135 -4.684 5.182 -18.361 1017 2HB ALA 135 HB2 ALA 135 -3.452 4.322 -17.415 1018 3HB ALA 135 HB3 ALA 135 -4.430 5.587 -16.648 1019 H GLU 136 H GLU 136 -3.709 6.450 -20.372 1020 HA GLU 136 HA GLU 136 -1.859 4.585 -21.524 1021 1HB GLU 136 HB2 GLU 136 -3.987 6.420 -22.677 1022 2HB GLU 136 HB3 GLU 136 -3.010 5.369 -23.694 1023 1HG GLU 136 HG2 GLU 136 -4.726 4.334 -21.395 1024 2HG GLU 136 HG3 GLU 136 -5.265 4.442 -23.065 1025 H THR 137 H THR 137 -2.124 8.120 -21.605 1026 HA THR 137 HA THR 137 0.039 8.323 -23.503 1027 HB THR 137 HB THR 137 -0.572 10.655 -23.644 1028 HG1 THR 137 HG1 THR 137 -2.469 10.134 -21.627 1029 1HG2 THR 137 HG21 THR 137 -1.886 8.985 -24.936 1030 2HG2 THR 137 HG22 THR 137 -3.069 8.907 -23.616 1031 3HG2 THR 137 HG23 THR 137 -2.839 10.422 -24.515 1032 H GLY 138 H GLY 138 -0.317 8.391 -20.072 1033 1HA GLY 138 HA1 GLY 138 1.071 8.932 -18.342 1034 2HA GLY 138 HA2 GLY 138 2.439 8.900 -19.476 1035 H LYS 139 H LYS 139 -0.508 10.896 -19.584 1036 HA LYS 139 HA LYS 139 0.654 13.101 -20.661 1037 1HB LYS 139 HB2 LYS 139 -1.847 12.425 -20.221 1038 2HB LYS 139 HB3 LYS 139 -1.707 13.460 -18.801 1039 1HG LYS 139 HG2 LYS 139 -1.055 15.358 -20.187 1040 2HG LYS 139 HG3 LYS 139 -1.010 14.345 -21.636 1041 1HD LYS 139 HD2 LYS 139 -3.466 15.053 -19.985 1042 2HD LYS 139 HD3 LYS 139 -3.061 15.690 -21.571 1043 1HE LYS 139 HE2 LYS 139 -3.838 12.806 -20.915 1044 2HE LYS 139 HE3 LYS 139 -4.832 14.019 -21.723 1045 1HZ LYS 139 HZ1 LYS 139 -4.046 12.791 -23.438 1046 2HZ LYS 139 HZ2 LYS 139 -2.942 13.995 -23.448 1047 3HZ LYS 139 HZ3 LYS 139 -2.554 12.526 -22.780 Start of MODEL 8 1 1H MET 1 H1 MET 1 2.201 -0.707 -1.961 2 2H MET 1 H2 MET 1 1.343 -1.884 -1.203 3 3H MET 1 H3 MET 1 0.605 -0.906 -2.293 4 HA MET 1 HA MET 1 -0.033 -0.288 -0.108 5 1HB MET 1 HB2 MET 1 1.990 -1.104 1.056 6 2HB MET 1 HB3 MET 1 2.926 0.243 0.401 7 1HG MET 1 HG2 MET 1 2.217 0.689 2.693 8 2HG MET 1 HG3 MET 1 1.476 1.845 1.592 9 1HE MET 1 HE1 MET 1 -1.199 1.525 4.423 10 2HE MET 1 HE2 MET 1 0.570 1.486 4.596 11 3HE MET 1 HE3 MET 1 -0.189 2.628 3.463 12 H GLU 2 H GLU 2 2.812 1.757 -1.190 13 HA GLU 2 HA GLU 2 1.043 3.498 -2.679 14 1HB GLU 2 HB2 GLU 2 1.613 5.527 -1.413 15 2HB GLU 2 HB3 GLU 2 0.681 4.400 -0.429 16 1HG GLU 2 HG2 GLU 2 2.738 3.669 0.729 17 2HG GLU 2 HG3 GLU 2 3.702 4.759 -0.269 18 H ASN 3 H ASN 3 2.408 5.183 -3.796 19 HA ASN 3 HA ASN 3 5.269 4.837 -3.891 20 1HB ASN 3 HB2 ASN 3 4.962 2.841 -5.066 21 2HB ASN 3 HB3 ASN 3 3.570 3.439 -5.939 22 1HD2 ASN 3 HD22 ASN 3 3.873 4.422 -7.923 23 2HD2 ASN 3 HD21 ASN 3 5.460 4.660 -8.657 24 H LYS 4 H LYS 4 2.353 5.978 -5.597 25 HA LYS 4 HA LYS 4 3.592 8.685 -5.782 26 1HB LYS 4 HB2 LYS 4 2.029 7.198 -7.935 27 2HB LYS 4 HB3 LYS 4 2.183 8.955 -7.934 28 1HG LYS 4 HG2 LYS 4 4.620 8.830 -8.044 29 2HG LYS 4 HG3 LYS 4 4.562 7.070 -8.003 30 1HD LYS 4 HD2 LYS 4 3.488 8.860 -10.223 31 2HD LYS 4 HD3 LYS 4 4.930 7.827 -10.267 32 1HE LYS 4 HE2 LYS 4 3.301 5.874 -9.720 33 2HE LYS 4 HE3 LYS 4 2.008 6.999 -10.144 34 1HZ LYS 4 HZ1 LYS 4 2.822 7.087 -12.364 35 2HZ LYS 4 HZ2 LYS 4 4.237 6.347 -11.992 36 3HZ LYS 4 HZ3 LYS 4 2.859 5.484 -11.960 37 H ILE 5 H ILE 5 1.732 10.320 -6.158 38 HA ILE 5 HA ILE 5 -0.818 9.526 -4.885 39 HB ILE 5 HB ILE 5 1.084 11.723 -3.997 40 1HG1 ILE 5 HG12 ILE 5 -0.382 9.643 -2.350 41 2HG1 ILE 5 HG13 ILE 5 1.286 9.503 -2.912 42 1HG2 ILE 5 HG21 ILE 5 -0.771 12.642 -2.553 43 2HG2 ILE 5 HG22 ILE 5 -1.113 12.822 -4.258 44 3HG2 ILE 5 HG23 ILE 5 -1.896 11.518 -3.365 45 1HD1 ILE 5 HD11 ILE 5 1.865 11.579 -1.639 46 2HD1 ILE 5 HD12 ILE 5 0.235 11.537 -0.919 47 3HD1 ILE 5 HD13 ILE 5 1.358 10.205 -0.638 48 H ILE 6 H ILE 6 -2.506 10.519 -5.901 49 HA ILE 6 HA ILE 6 -1.954 12.819 -7.697 50 HB ILE 6 HB ILE 6 -2.248 11.032 -9.202 51 1HG1 ILE 6 HG12 ILE 6 -4.999 12.339 -8.946 52 2HG1 ILE 6 HG13 ILE 6 -3.566 13.182 -9.529 53 1HG2 ILE 6 HG21 ILE 6 -4.168 9.457 -9.178 54 2HG2 ILE 6 HG22 ILE 6 -3.124 9.269 -7.775 55 3HG2 ILE 6 HG23 ILE 6 -4.672 10.124 -7.615 56 1HD1 ILE 6 HD11 ILE 6 -4.901 10.791 -10.855 57 2HD1 ILE 6 HD12 ILE 6 -4.866 12.468 -11.419 58 3HD1 ILE 6 HD13 ILE 6 -3.371 11.525 -11.396 59 H TYR 7 H TYR 7 -3.379 14.521 -7.226 60 HA TYR 7 HA TYR 7 -5.429 14.028 -5.120 61 1HB TYR 7 HB2 TYR 7 -3.235 14.861 -4.268 62 2HB TYR 7 HB3 TYR 7 -3.418 16.305 -5.255 63 HD1 TYR 7 HD1 TYR 7 -3.791 18.109 -3.866 64 HD2 TYR 7 HD2 TYR 7 -5.787 14.406 -2.968 65 HE1 TYR 7 HE1 TYR 7 -4.682 19.096 -1.769 66 HE2 TYR 7 HE2 TYR 7 -6.688 15.392 -0.876 67 HH TYR 7 HH TYR 7 -5.452 18.542 0.290 68 H PHE 8 H PHE 8 -7.382 14.513 -5.946 69 HA PHE 8 HA PHE 8 -7.614 16.368 -8.220 70 1HB PHE 8 HB2 PHE 8 -9.679 14.715 -6.708 71 2HB PHE 8 HB3 PHE 8 -10.034 15.742 -8.090 72 HD1 PHE 8 HD1 PHE 8 -8.984 12.443 -7.084 73 HD2 PHE 8 HD2 PHE 8 -8.711 15.332 -10.276 74 HE1 PHE 8 HE1 PHE 8 -8.278 10.656 -8.662 75 HE2 PHE 8 HE2 PHE 8 -7.985 13.541 -11.836 76 HZ PHE 8 HZ PHE 8 -7.766 11.203 -11.016 77 H LEU 9 H LEU 9 -8.555 18.353 -8.179 78 HA LEU 9 HA LEU 9 -9.568 19.521 -5.611 79 1HB LEU 9 HB2 LEU 9 -7.722 20.625 -7.761 80 2HB LEU 9 HB3 LEU 9 -8.782 21.709 -6.886 81 HG LEU 9 HG LEU 9 -7.611 21.435 -4.837 82 1HD1 LEU 9 HD11 LEU 9 -5.617 19.906 -4.645 83 2HD1 LEU 9 HD12 LEU 9 -7.180 19.101 -4.650 84 3HD1 LEU 9 HD13 LEU 9 -6.193 19.089 -6.121 85 1HD2 LEU 9 HD21 LEU 9 -5.685 21.671 -7.118 86 2HD2 LEU 9 HD22 LEU 9 -6.678 22.948 -6.379 87 3HD2 LEU 9 HD23 LEU 9 -5.395 22.177 -5.433 88 H CYS 10 H CYS 10 -11.585 20.573 -5.936 89 HA CYS 10 HA CYS 10 -12.345 21.450 -8.592 90 1HB CYS 10 HB2 CYS 10 -12.992 18.909 -8.290 91 2HB CYS 10 HB3 CYS 10 -14.289 19.534 -7.258 92 HG CYS 10 HG CYS 10 -13.464 20.466 -10.348 93 H THR 11 H THR 11 -14.662 22.602 -8.372 94 HA THR 11 HA THR 11 -14.347 24.401 -6.170 95 HB THR 11 HB THR 11 -16.604 25.281 -7.216 96 HG1 THR 11 HG1 THR 11 -16.823 24.673 -9.341 97 1HG2 THR 11 HG21 THR 11 -13.937 25.281 -8.692 98 2HG2 THR 11 HG22 THR 11 -15.241 26.476 -8.864 99 3HG2 THR 11 HG23 THR 11 -14.361 26.323 -7.330 100 H GLY 12 H GLY 12 -15.859 21.394 -6.160 101 1HA GLY 12 HA1 GLY 12 -16.652 21.818 -3.458 102 2HA GLY 12 HA2 GLY 12 -18.076 21.582 -4.497 103 H ASN 13 H ASN 13 -15.910 19.973 -2.614 104 HA ASN 13 HA ASN 13 -15.446 17.587 -4.237 105 1HB ASN 13 HB2 ASN 13 -13.859 18.392 -2.499 106 2HB ASN 13 HB3 ASN 13 -15.055 18.046 -1.256 107 1HD2 ASN 13 HD22 ASN 13 -12.855 16.802 -0.780 108 2HD2 ASN 13 HD21 ASN 13 -12.766 15.145 -1.365 109 H SER 14 H SER 14 -17.805 17.512 -4.765 110 HA SER 14 HA SER 14 -19.171 15.722 -2.813 111 1HB SER 14 HB2 SER 14 -21.330 16.839 -3.481 112 2HB SER 14 HB3 SER 14 -20.242 17.798 -2.467 113 HG SER 14 HG SER 14 -19.629 18.998 -4.222 114 H CYS 15 H CYS 15 -18.635 16.643 -6.224 115 HA CYS 15 HA CYS 15 -19.668 13.935 -6.964 116 1HB CYS 15 HB2 CYS 15 -20.061 16.484 -8.580 117 2HB CYS 15 HB3 CYS 15 -20.736 14.884 -8.907 118 HG CYS 15 HG CYS 15 -22.295 16.991 -7.964 119 H ARG 16 H ARG 16 -17.979 16.681 -8.605 120 HA ARG 16 HA ARG 16 -16.842 15.031 -10.558 121 1HB ARG 16 HB2 ARG 16 -16.087 17.790 -9.523 122 2HB ARG 16 HB3 ARG 16 -15.243 17.067 -10.890 123 1HG ARG 16 HG2 ARG 16 -17.164 16.990 -12.251 124 2HG ARG 16 HG3 ARG 16 -18.281 17.218 -10.905 125 1HD ARG 16 HD2 ARG 16 -16.295 19.342 -11.781 126 2HD ARG 16 HD3 ARG 16 -17.944 19.226 -12.402 127 HE ARG 16 HE ARG 16 -18.398 19.229 -9.714 128 1HH1 ARG 16 HH21 ARG 16 -16.892 21.521 -11.971 129 2HH1 ARG 16 HH22 ARG 16 -16.908 22.827 -10.818 130 1HH2 ARG 16 HH11 ARG 16 -18.342 20.925 -8.214 131 2HH2 ARG 16 HH12 ARG 16 -17.650 22.472 -8.651 132 H SER 17 H SER 17 -15.104 16.243 -7.596 133 HA SER 17 HA SER 17 -12.740 14.837 -8.160 134 1HB SER 17 HB2 SER 17 -13.733 15.452 -5.372 135 2HB SER 17 HB3 SER 17 -12.069 15.451 -5.999 136 HG SER 17 HG SER 17 -12.761 17.548 -5.786 137 H GLN 18 H GLN 18 -15.708 13.732 -6.509 138 HA GLN 18 HA GLN 18 -14.538 11.340 -5.400 139 1HB GLN 18 HB2 GLN 18 -17.428 12.201 -5.968 140 2HB GLN 18 HB3 GLN 18 -16.988 10.759 -5.071 141 1HG GLN 18 HG2 GLN 18 -16.204 13.590 -4.243 142 2HG GLN 18 HG3 GLN 18 -17.604 12.732 -3.639 143 1HE2 GLN 18 HE22 GLN 18 -15.013 13.703 -2.312 144 2HE2 GLN 18 HE21 GLN 18 -14.476 12.291 -1.409 145 H MET 19 H MET 19 -16.449 12.054 -8.379 146 HA MET 19 HA MET 19 -16.518 9.355 -9.362 147 1HB MET 19 HB2 MET 19 -16.540 12.032 -10.839 148 2HB MET 19 HB3 MET 19 -16.812 10.458 -11.594 149 1HG MET 19 HG2 MET 19 -18.804 10.093 -10.227 150 2HG MET 19 HG3 MET 19 -18.570 11.654 -9.432 151 1HE MET 19 HE1 MET 19 -21.258 10.712 -10.879 152 2HE MET 19 HE2 MET 19 -21.117 12.309 -10.105 153 3HE MET 19 HE3 MET 19 -21.737 12.171 -11.769 154 H ALA 20 H ALA 20 -14.239 12.111 -10.012 155 HA ALA 20 HA ALA 20 -12.554 10.753 -11.789 156 1HB ALA 20 HB1 ALA 20 -11.745 12.864 -9.743 157 2HB ALA 20 HB2 ALA 20 -10.898 12.457 -11.248 158 3HB ALA 20 HB3 ALA 20 -12.500 13.213 -11.314 159 H GLU 21 H GLU 21 -12.425 10.895 -8.220 160 HA GLU 21 HA GLU 21 -10.029 9.429 -7.879 161 1HB GLU 21 HB2 GLU 21 -11.003 10.722 -6.089 162 2HB GLU 21 HB3 GLU 21 -12.477 9.740 -6.089 163 1HG GLU 21 HG2 GLU 21 -11.218 7.779 -5.401 164 2HG GLU 21 HG3 GLU 21 -9.701 8.675 -5.446 165 H GLY 22 H GLY 22 -13.456 8.269 -8.018 166 1HA GLY 22 HA1 GLY 22 -12.920 5.537 -7.646 167 2HA GLY 22 HA2 GLY 22 -14.308 6.215 -8.503 168 H TRP 23 H TRP 23 -13.108 7.382 -10.799 169 HA TRP 23 HA TRP 23 -12.597 5.008 -12.368 170 1HB TRP 23 HB2 TRP 23 -12.195 7.946 -13.041 171 2HB TRP 23 HB3 TRP 23 -11.931 6.633 -14.172 172 HD1 TRP 23 HD1 TRP 23 -14.648 8.645 -12.570 173 HE1 TRP 23 HE1 TRP 23 -16.860 8.269 -13.718 174 HE3 TRP 23 HE3 TRP 23 -13.326 4.701 -15.550 175 HZ2 TRP 23 HZ2 TRP 23 -17.972 6.465 -15.659 176 HZ3 TRP 23 HZ3 TRP 23 -14.983 3.736 -17.124 177 HH2 TRP 23 HH2 TRP 23 -17.311 4.635 -17.196 178 H ALA 24 H ALA 24 -10.410 7.555 -11.017 179 HA ALA 24 HA ALA 24 -8.132 6.690 -12.421 180 1HB ALA 24 HB1 ALA 24 -8.320 8.865 -11.139 181 2HB ALA 24 HB2 ALA 24 -8.215 7.945 -9.638 182 3HB ALA 24 HB3 ALA 24 -6.840 7.969 -10.762 183 H LYS 25 H LYS 25 -9.493 5.522 -9.332 184 HA LYS 25 HA LYS 25 -7.329 3.862 -8.574 185 1HB LYS 25 HB2 LYS 25 -10.325 3.594 -8.148 186 2HB LYS 25 HB3 LYS 25 -9.168 2.458 -7.446 187 1HG LYS 25 HG2 LYS 25 -8.098 4.149 -6.134 188 2HG LYS 25 HG3 LYS 25 -8.931 5.454 -6.987 189 1HD LYS 25 HD2 LYS 25 -11.113 4.622 -6.129 190 2HD LYS 25 HD3 LYS 25 -10.257 3.374 -5.188 191 1HE LYS 25 HE2 LYS 25 -9.077 5.087 -3.898 192 2HE LYS 25 HE3 LYS 25 -9.681 6.354 -4.971 193 1HZ LYS 25 HZ1 LYS 25 -11.017 6.445 -3.096 194 2HZ LYS 25 HZ2 LYS 25 -11.957 5.736 -4.209 195 3HZ LYS 25 HZ3 LYS 25 -11.266 4.803 -3.026 196 H GLN 26 H GLN 26 -9.819 3.314 -11.048 197 HA GLN 26 HA GLN 26 -9.187 0.509 -11.433 198 1HB GLN 26 HB2 GLN 26 -10.349 2.433 -13.461 199 2HB GLN 26 HB3 GLN 26 -10.342 0.680 -13.529 200 1HG GLN 26 HG2 GLN 26 -11.834 0.652 -11.487 201 2HG GLN 26 HG3 GLN 26 -11.949 2.425 -11.618 202 1HE2 GLN 26 HE22 GLN 26 -12.145 3.013 -14.190 203 2HE2 GLN 26 HE21 GLN 26 -13.529 2.246 -14.952 204 H TYR 27 H TYR 27 -8.495 3.448 -13.327 205 HA TYR 27 HA TYR 27 -6.838 2.089 -15.192 206 1HB TYR 27 HB2 TYR 27 -7.099 5.063 -14.597 207 2HB TYR 27 HB3 TYR 27 -6.258 4.396 -15.986 208 HD1 TYR 27 HD1 TYR 27 -7.675 2.603 -17.414 209 HD2 TYR 27 HD2 TYR 27 -9.345 5.736 -14.962 210 HE1 TYR 27 HE1 TYR 27 -9.759 2.529 -18.745 211 HE2 TYR 27 HE2 TYR 27 -11.391 5.730 -16.341 212 HH TYR 27 HH TYR 27 -12.532 4.730 -18.127 213 H LEU 28 H LEU 28 -5.931 3.946 -12.280 214 HA LEU 28 HA LEU 28 -3.121 3.995 -13.118 215 1HB LEU 28 HB2 LEU 28 -4.486 5.098 -10.633 216 2HB LEU 28 HB3 LEU 28 -2.847 5.408 -11.137 217 HG LEU 28 HG LEU 28 -5.353 6.347 -12.548 218 1HD1 LEU 28 HD11 LEU 28 -4.572 7.583 -10.522 219 2HD1 LEU 28 HD12 LEU 28 -3.019 7.876 -11.325 220 3HD1 LEU 28 HD13 LEU 28 -4.511 8.561 -12.003 221 1HD2 LEU 28 HD21 LEU 28 -3.757 5.741 -14.308 222 2HD2 LEU 28 HD22 LEU 28 -3.874 7.486 -14.160 223 3HD2 LEU 28 HD23 LEU 28 -2.467 6.642 -13.479 224 H GLY 29 H GLY 29 -5.037 2.390 -10.593 225 1HA GLY 29 HA1 GLY 29 -4.597 0.423 -9.484 226 2HA GLY 29 HA2 GLY 29 -3.085 0.261 -10.381 227 H ASP 30 H ASP 30 -2.698 -0.561 -8.043 228 HA ASP 30 HA ASP 30 -2.593 1.256 -5.893 229 1HB ASP 30 HB2 ASP 30 -2.841 -1.252 -5.773 230 2HB ASP 30 HB3 ASP 30 -1.101 -1.383 -6.069 231 H GLU 31 H GLU 31 -0.406 1.003 -8.430 232 HA GLU 31 HA GLU 31 2.092 1.800 -7.311 233 1HB GLU 31 HB2 GLU 31 1.659 0.940 -9.619 234 2HB GLU 31 HB3 GLU 31 0.734 2.385 -9.989 235 1HG GLU 31 HG2 GLU 31 2.864 3.731 -9.631 236 2HG GLU 31 HG3 GLU 31 3.726 2.200 -9.477 237 H TRP 32 H TRP 32 -0.925 3.367 -7.229 238 HA TRP 32 HA TRP 32 0.303 5.976 -6.559 239 1HB TRP 32 HB2 TRP 32 -2.336 5.598 -8.013 240 2HB TRP 32 HB3 TRP 32 -1.504 7.103 -7.692 241 HD1 TRP 32 HD1 TRP 32 -0.880 3.893 -9.763 242 HE1 TRP 32 HE1 TRP 32 -0.157 4.553 -12.113 243 HE3 TRP 32 HE3 TRP 32 -0.620 8.953 -9.105 244 HZ2 TRP 32 HZ2 TRP 32 0.349 6.960 -13.572 245 HZ3 TRP 32 HZ3 TRP 32 -0.094 10.411 -11.014 246 HH2 TRP 32 HH2 TRP 32 0.357 9.435 -13.275 247 H LYS 33 H LYS 33 -1.190 7.236 -5.224 248 HA LYS 33 HA LYS 33 -3.429 5.767 -3.943 249 1HB LYS 33 HB2 LYS 33 -1.450 7.712 -2.698 250 2HB LYS 33 HB3 LYS 33 -3.006 7.349 -1.958 251 1HG LYS 33 HG2 LYS 33 -0.938 5.211 -2.590 252 2HG LYS 33 HG3 LYS 33 -0.984 6.129 -1.087 253 1HD LYS 33 HD2 LYS 33 -2.028 4.141 -0.529 254 2HD LYS 33 HD3 LYS 33 -3.339 5.288 -0.711 255 1HE LYS 33 HE2 LYS 33 -3.976 3.143 -1.614 256 2HE LYS 33 HE3 LYS 33 -3.890 4.287 -2.953 257 1HZ LYS 33 HZ1 LYS 33 -1.592 2.562 -2.286 258 2HZ LYS 33 HZ2 LYS 33 -2.786 1.962 -3.182 259 3HZ LYS 33 HZ3 LYS 33 -1.972 3.270 -3.742 260 H VAL 34 H VAL 34 -5.270 7.053 -3.652 261 HA VAL 34 HA VAL 34 -5.314 9.407 -5.477 262 HB VAL 34 HB VAL 34 -7.431 7.230 -5.386 263 1HG1 VAL 34 HG11 VAL 34 -7.817 9.533 -6.451 264 2HG1 VAL 34 HG12 VAL 34 -6.659 9.035 -7.700 265 3HG1 VAL 34 HG13 VAL 34 -8.148 8.102 -7.441 266 1HG2 VAL 34 HG21 VAL 34 -5.476 5.939 -6.025 267 2HG2 VAL 34 HG22 VAL 34 -6.464 6.232 -7.459 268 3HG2 VAL 34 HG23 VAL 34 -4.989 7.186 -7.204 269 H TYR 35 H TYR 35 -6.109 11.107 -4.384 270 HA TYR 35 HA TYR 35 -8.422 10.606 -2.594 271 1HB TYR 35 HB2 TYR 35 -6.686 12.814 -1.685 272 2HB TYR 35 HB3 TYR 35 -7.664 11.698 -0.778 273 HD1 TYR 35 HD1 TYR 35 -4.360 12.497 -2.046 274 HD2 TYR 35 HD2 TYR 35 -6.706 9.400 -0.175 275 HE1 TYR 35 HE1 TYR 35 -2.300 11.474 -1.189 276 HE2 TYR 35 HE2 TYR 35 -4.630 8.302 0.617 277 HH TYR 35 HH TYR 35 -2.296 8.434 0.745 278 H SER 36 H SER 36 -9.648 12.608 -2.176 279 HA SER 36 HA SER 36 -9.589 14.504 -4.457 280 1HB SER 36 HB2 SER 36 -12.145 14.294 -4.213 281 2HB SER 36 HB3 SER 36 -11.292 12.960 -5.017 282 HG SER 36 HG SER 36 -11.518 11.717 -3.249 283 H ALA 37 H ALA 37 -9.955 16.581 -3.937 284 HA ALA 37 HA ALA 37 -11.069 17.314 -1.314 285 1HB ALA 37 HB1 ALA 37 -8.602 17.304 -1.108 286 2HB ALA 37 HB2 ALA 37 -8.514 18.498 -2.438 287 3HB ALA 37 HB3 ALA 37 -9.355 18.879 -0.907 288 H GLY 38 H GLY 38 -11.138 19.993 -1.534 289 1HA GLY 38 HA1 GLY 38 -11.458 21.059 -4.134 290 2HA GLY 38 HA2 GLY 38 -13.051 20.617 -3.489 291 H ILE 39 H ILE 39 -12.858 23.117 -4.001 292 HA ILE 39 HA ILE 39 -11.704 24.943 -2.162 293 HB ILE 39 HB ILE 39 -14.028 24.960 -4.088 294 1HG1 ILE 39 HG12 ILE 39 -12.766 26.760 -5.167 295 2HG1 ILE 39 HG13 ILE 39 -11.594 26.762 -3.853 296 1HG2 ILE 39 HG21 ILE 39 -14.475 27.347 -3.690 297 2HG2 ILE 39 HG22 ILE 39 -14.964 26.342 -2.333 298 3HG2 ILE 39 HG23 ILE 39 -13.459 27.293 -2.230 299 1HD1 ILE 39 HD11 ILE 39 -10.711 25.673 -5.853 300 2HD1 ILE 39 HD12 ILE 39 -10.818 24.499 -4.555 301 3HD1 ILE 39 HD13 ILE 39 -12.043 24.511 -5.857 302 H GLU 40 H GLU 40 -14.795 23.181 -2.111 303 HA GLU 40 HA GLU 40 -14.697 23.251 0.812 304 1HB GLU 40 HB2 GLU 40 -16.971 23.937 1.140 305 2HB GLU 40 HB3 GLU 40 -16.093 25.198 0.287 306 1HG GLU 40 HG2 GLU 40 -17.111 24.440 -1.875 307 2HG GLU 40 HG3 GLU 40 -18.007 23.188 -1.014 308 H ALA 41 H ALA 41 -16.699 21.792 1.582 309 HA ALA 41 HA ALA 41 -17.256 19.512 -0.193 310 1HB ALA 41 HB1 ALA 41 -15.748 19.267 2.460 311 2HB ALA 41 HB2 ALA 41 -16.337 17.926 1.472 312 3HB ALA 41 HB3 ALA 41 -15.051 18.978 0.850 313 H HIS 42 H HIS 42 -18.733 18.017 0.971 314 HA HIS 42 HA HIS 42 -19.982 18.900 3.460 315 1HB HIS 42 HB2 HIS 42 -21.353 20.095 1.783 316 2HB HIS 42 HB3 HIS 42 -21.615 18.596 0.894 317 HD1 HIS 42 HD1 HIS 42 -22.521 20.134 4.353 318 HD2 HIS 42 HD2 HIS 42 -23.653 17.108 1.648 319 HE1 HIS 42 HE1 HIS 42 -24.680 19.137 5.257 320 H GLY 43 H GLY 43 -20.187 16.662 0.633 321 1HA GLY 43 HA1 GLY 43 -19.054 14.445 1.843 322 2HA GLY 43 HA2 GLY 43 -20.813 14.284 2.049 323 H LEU 44 H LEU 44 -19.369 12.525 0.382 324 HA LEU 44 HA LEU 44 -19.616 13.211 -2.384 325 1HB LEU 44 HB2 LEU 44 -19.246 11.039 -2.924 326 2HB LEU 44 HB3 LEU 44 -18.223 11.366 -1.529 327 HG LEU 44 HG LEU 44 -20.841 9.850 -1.539 328 1HD1 LEU 44 HD11 LEU 44 -19.415 7.854 -1.207 329 2HD1 LEU 44 HD12 LEU 44 -18.944 8.707 -2.687 330 3HD1 LEU 44 HD13 LEU 44 -17.974 8.887 -1.220 331 1HD2 LEU 44 HD21 LEU 44 -18.849 10.292 0.736 332 2HD2 LEU 44 HD22 LEU 44 -20.562 10.785 0.704 333 3HD2 LEU 44 HD23 LEU 44 -20.142 9.078 0.770 334 H ASN 45 H ASN 45 -21.344 13.510 -3.603 335 HA ASN 45 HA ASN 45 -23.894 13.611 -2.288 336 1HB ASN 45 HB2 ASN 45 -23.008 15.248 -4.005 337 2HB ASN 45 HB3 ASN 45 -23.224 14.002 -5.236 338 1HD2 ASN 45 HD22 ASN 45 -25.147 14.207 -6.318 339 2HD2 ASN 45 HD21 ASN 45 -26.639 14.839 -5.631 340 HA PRO 46 HA PRO 46 -25.225 9.472 -3.153 341 1HB PRO 46 HB2 PRO 46 -27.919 10.663 -3.838 342 2HB PRO 46 HB3 PRO 46 -27.540 9.251 -2.798 343 1HG PRO 46 HG2 PRO 46 -28.100 11.648 -1.672 344 2HG PRO 46 HG3 PRO 46 -26.729 10.670 -1.048 345 1HD PRO 46 HD2 PRO 46 -26.649 13.011 -2.961 346 2HD PRO 46 HD3 PRO 46 -25.609 12.678 -1.538 347 H ASN 47 H ASN 47 -26.152 11.933 -5.629 348 HA ASN 47 HA ASN 47 -26.617 10.056 -7.711 349 1HB ASN 47 HB2 ASN 47 -26.748 11.753 -9.148 350 2HB ASN 47 HB3 ASN 47 -26.994 12.698 -7.685 351 1HD2 ASN 47 HD22 ASN 47 -25.369 12.711 -10.638 352 2HD2 ASN 47 HD21 ASN 47 -23.977 13.661 -10.175 353 H ALA 48 H ALA 48 -23.568 11.401 -6.436 354 HA ALA 48 HA ALA 48 -21.991 10.530 -8.694 355 1HB ALA 48 HB1 ALA 48 -21.109 11.257 -5.857 356 2HB ALA 48 HB2 ALA 48 -20.073 11.133 -7.292 357 3HB ALA 48 HB3 ALA 48 -21.311 12.406 -7.198 358 H VAL 49 H VAL 49 -22.819 9.269 -5.444 359 HA VAL 49 HA VAL 49 -21.248 6.907 -5.600 360 HB VAL 49 HB VAL 49 -23.892 7.211 -4.136 361 1HG1 VAL 49 HG11 VAL 49 -23.102 4.884 -4.328 362 2HG1 VAL 49 HG12 VAL 49 -21.479 5.358 -3.810 363 3HG1 VAL 49 HG13 VAL 49 -22.849 5.457 -2.677 364 1HG2 VAL 49 HG21 VAL 49 -22.478 7.794 -2.168 365 2HG2 VAL 49 HG22 VAL 49 -21.056 7.851 -3.229 366 3HG2 VAL 49 HG23 VAL 49 -22.368 9.028 -3.421 367 H LYS 50 H LYS 50 -24.736 7.447 -6.452 368 HA LYS 50 HA LYS 50 -25.096 4.832 -7.407 369 1HB LYS 50 HB2 LYS 50 -26.838 6.493 -6.720 370 2HB LYS 50 HB3 LYS 50 -26.573 7.368 -8.238 371 1HG LYS 50 HG2 LYS 50 -27.268 5.388 -9.522 372 2HG LYS 50 HG3 LYS 50 -27.455 4.442 -8.041 373 1HD LYS 50 HD2 LYS 50 -28.979 7.025 -8.557 374 2HD LYS 50 HD3 LYS 50 -29.586 5.434 -9.064 375 1HE LYS 50 HE2 LYS 50 -29.473 4.649 -6.700 376 2HE LYS 50 HE3 LYS 50 -28.923 6.252 -6.197 377 1HZ LYS 50 HZ1 LYS 50 -31.296 5.991 -5.874 378 2HZ LYS 50 HZ2 LYS 50 -31.038 7.151 -6.986 379 3HZ LYS 50 HZ3 LYS 50 -31.545 5.665 -7.448 380 H ALA 51 H ALA 51 -24.173 7.797 -9.276 381 HA ALA 51 HA ALA 51 -24.293 6.625 -11.821 382 1HB ALA 51 HB1 ALA 51 -23.992 9.056 -11.446 383 2HB ALA 51 HB2 ALA 51 -22.368 8.752 -10.778 384 3HB ALA 51 HB3 ALA 51 -22.697 8.423 -12.489 385 H MET 52 H MET 52 -21.514 6.678 -9.484 386 HA MET 52 HA MET 52 -19.759 5.259 -11.264 387 1HB MET 52 HB2 MET 52 -19.782 5.824 -8.283 388 2HB MET 52 HB3 MET 52 -18.426 5.108 -9.151 389 1HG MET 52 HG2 MET 52 -19.621 7.859 -9.694 390 2HG MET 52 HG3 MET 52 -18.139 7.547 -8.808 391 1HE MET 52 HE1 MET 52 -15.678 6.271 -11.476 392 2HE MET 52 HE2 MET 52 -15.897 6.901 -9.825 393 3HE MET 52 HE3 MET 52 -16.686 5.395 -10.332 394 H LYS 53 H LYS 53 -21.927 4.303 -8.552 395 HA LYS 53 HA LYS 53 -21.102 1.611 -8.402 396 1HB LYS 53 HB2 LYS 53 -22.475 3.051 -6.757 397 2HB LYS 53 HB3 LYS 53 -23.888 2.624 -7.734 398 1HG LYS 53 HG2 LYS 53 -23.307 0.179 -7.223 399 2HG LYS 53 HG3 LYS 53 -22.022 0.792 -6.159 400 1HD LYS 53 HD2 LYS 53 -23.895 2.186 -4.994 401 2HD LYS 53 HD3 LYS 53 -25.028 1.210 -5.927 402 1HE LYS 53 HE2 LYS 53 -24.985 0.005 -3.978 403 2HE LYS 53 HE3 LYS 53 -23.731 -0.841 -4.887 404 1HZ LYS 53 HZ1 LYS 53 -23.024 -0.339 -2.631 405 2HZ LYS 53 HZ2 LYS 53 -22.074 0.523 -3.645 406 3HZ LYS 53 HZ3 LYS 53 -23.277 1.259 -2.830 407 H GLU 54 H GLU 54 -23.555 3.176 -10.454 408 HA GLU 54 HA GLU 54 -24.590 0.815 -11.650 409 1HB GLU 54 HB2 GLU 54 -24.470 3.733 -12.512 410 2HB GLU 54 HB3 GLU 54 -25.198 2.519 -13.548 411 1HG GLU 54 HG2 GLU 54 -26.061 2.946 -10.664 412 2HG GLU 54 HG3 GLU 54 -26.782 3.781 -12.036 413 H VAL 55 H VAL 55 -21.461 2.255 -12.000 414 HA VAL 55 HA VAL 55 -20.926 0.706 -14.485 415 HB VAL 55 HB VAL 55 -19.366 2.945 -13.123 416 1HG1 VAL 55 HG11 VAL 55 -17.764 1.604 -14.371 417 2HG1 VAL 55 HG12 VAL 55 -18.843 1.561 -15.787 418 3HG1 VAL 55 HG13 VAL 55 -18.084 3.078 -15.256 419 1HG2 VAL 55 HG21 VAL 55 -21.062 2.929 -15.665 420 2HG2 VAL 55 HG22 VAL 55 -21.453 3.785 -14.162 421 3HG2 VAL 55 HG23 VAL 55 -20.050 4.271 -15.099 422 H GLY 56 H GLY 56 -21.033 0.118 -11.242 423 1HA GLY 56 HA1 GLY 56 -20.205 -1.632 -10.037 424 2HA GLY 56 HA2 GLY 56 -19.128 -2.074 -11.370 425 H ILE 57 H ILE 57 -19.026 1.272 -10.253 426 HA ILE 57 HA ILE 57 -16.435 0.744 -8.875 427 HB ILE 57 HB ILE 57 -17.399 3.303 -10.189 428 1HG1 ILE 57 HG12 ILE 57 -15.389 1.246 -11.192 429 2HG1 ILE 57 HG13 ILE 57 -16.947 1.648 -11.920 430 1HG2 ILE 57 HG21 ILE 57 -14.691 2.469 -8.989 431 2HG2 ILE 57 HG22 ILE 57 -15.035 4.039 -9.722 432 3HG2 ILE 57 HG23 ILE 57 -15.840 3.586 -8.227 433 1HD1 ILE 57 HD11 ILE 57 -15.345 2.763 -13.234 434 2HD1 ILE 57 HD12 ILE 57 -16.090 4.020 -12.247 435 3HD1 ILE 57 HD13 ILE 57 -14.466 3.391 -11.832 436 H ASP 58 H ASP 58 -17.220 0.295 -6.894 437 HA ASP 58 HA ASP 58 -19.528 1.671 -5.787 438 1HB ASP 58 HB2 ASP 58 -19.211 -0.705 -5.403 439 2HB ASP 58 HB3 ASP 58 -17.654 -0.415 -4.612 440 H ILE 59 H ILE 59 -18.609 3.896 -5.877 441 HA ILE 59 HA ILE 59 -16.366 4.514 -4.172 442 HB ILE 59 HB ILE 59 -16.678 6.786 -4.704 443 1HG1 ILE 59 HG12 ILE 59 -19.269 6.279 -6.173 444 2HG1 ILE 59 HG13 ILE 59 -19.254 6.753 -4.478 445 1HG2 ILE 59 HG21 ILE 59 -17.319 5.237 -7.222 446 2HG2 ILE 59 HG22 ILE 59 -16.491 6.800 -7.107 447 3HG2 ILE 59 HG23 ILE 59 -15.713 5.349 -6.459 448 1HD1 ILE 59 HD11 ILE 59 -17.976 8.787 -5.009 449 2HD1 ILE 59 HD12 ILE 59 -18.090 8.416 -6.741 450 3HD1 ILE 59 HD13 ILE 59 -19.554 8.751 -5.798 451 H SER 60 H SER 60 -19.369 3.525 -3.180 452 HA SER 60 HA SER 60 -20.304 5.405 -1.405 453 1HB SER 60 HB2 SER 60 -20.221 2.427 -0.790 454 2HB SER 60 HB3 SER 60 -21.461 3.605 -0.335 455 HG SER 60 HG SER 60 -20.998 2.251 -2.734 456 H ASN 61 H ASN 61 -17.461 3.363 -1.054 457 HA ASN 61 HA ASN 61 -17.070 3.638 1.768 458 1HB ASN 61 HB2 ASN 61 -16.122 1.797 0.413 459 2HB ASN 61 HB3 ASN 61 -15.151 2.954 -0.505 460 1HD2 ASN 61 HD22 ASN 61 -15.706 1.777 2.875 461 2HD2 ASN 61 HD21 ASN 61 -14.059 2.023 3.390 462 H GLN 62 H GLN 62 -16.464 5.854 -0.886 463 HA GLN 62 HA GLN 62 -14.132 7.108 0.217 464 1HB GLN 62 HB2 GLN 62 -16.033 8.057 -1.964 465 2HB GLN 62 HB3 GLN 62 -14.465 8.772 -1.552 466 1HG GLN 62 HG2 GLN 62 -13.350 6.637 -2.100 467 2HG GLN 62 HG3 GLN 62 -14.897 5.947 -2.587 468 1HE2 GLN 62 HE22 GLN 62 -14.999 9.197 -3.678 469 2HE2 GLN 62 HE21 GLN 62 -14.486 8.835 -5.322 470 H THR 63 H THR 63 -14.224 9.554 0.573 471 HA THR 63 HA THR 63 -16.608 10.622 1.835 472 HB THR 63 HB THR 63 -15.050 11.331 3.821 473 HG1 THR 63 HG1 THR 63 -13.105 10.482 3.062 474 1HG2 THR 63 HG21 THR 63 -15.657 9.414 5.155 475 2HG2 THR 63 HG22 THR 63 -16.991 9.785 4.052 476 3HG2 THR 63 HG23 THR 63 -15.912 8.413 3.712 477 H SER 64 H SER 64 -16.197 13.026 2.337 478 HA SER 64 HA SER 64 -14.366 14.149 0.278 479 1HB SER 64 HB2 SER 64 -16.880 15.309 1.536 480 2HB SER 64 HB3 SER 64 -15.851 16.082 0.317 481 HG SER 64 HG SER 64 -17.244 15.204 -0.926 482 H ASP 65 H ASP 65 -13.334 16.128 0.775 483 HA ASP 65 HA ASP 65 -13.207 17.220 3.459 484 1HB ASP 65 HB2 ASP 65 -11.460 15.341 3.407 485 2HB ASP 65 HB3 ASP 65 -10.663 16.233 2.103 486 H ILE 66 H ILE 66 -11.968 19.327 3.329 487 HA ILE 66 HA ILE 66 -12.161 20.505 0.621 488 HB ILE 66 HB ILE 66 -12.203 22.599 1.622 489 1HG1 ILE 66 HG12 ILE 66 -11.375 21.327 4.251 490 2HG1 ILE 66 HG13 ILE 66 -10.445 22.474 3.260 491 1HG2 ILE 66 HG21 ILE 66 -14.224 22.513 2.900 492 2HG2 ILE 66 HG22 ILE 66 -14.223 21.078 1.862 493 3HG2 ILE 66 HG23 ILE 66 -13.829 20.923 3.576 494 1HD1 ILE 66 HD11 ILE 66 -12.970 23.021 4.841 495 2HD1 ILE 66 HD12 ILE 66 -11.356 23.714 5.083 496 3HD1 ILE 66 HD13 ILE 66 -12.306 24.155 3.637 497 H ILE 67 H ILE 67 -10.272 22.014 0.110 498 HA ILE 67 HA ILE 67 -8.091 20.337 -0.270 499 HB ILE 67 HB ILE 67 -8.880 22.041 -1.768 500 1HG1 ILE 67 HG12 ILE 67 -6.716 21.025 -2.132 501 2HG1 ILE 67 HG13 ILE 67 -6.861 22.646 -2.793 502 1HG2 ILE 67 HG21 ILE 67 -9.320 23.921 -0.293 503 2HG2 ILE 67 HG22 ILE 67 -7.572 24.171 -0.055 504 3HG2 ILE 67 HG23 ILE 67 -8.295 24.364 -1.659 505 1HD1 ILE 67 HD11 ILE 67 -5.534 23.522 -0.828 506 2HD1 ILE 67 HD12 ILE 67 -5.260 21.830 -0.348 507 3HD1 ILE 67 HD13 ILE 67 -4.670 22.413 -1.896 508 H ASP 68 H ASP 68 -6.853 19.506 1.186 509 HA ASP 68 HA ASP 68 -5.582 21.161 3.296 510 1HB ASP 68 HB2 ASP 68 -6.446 18.943 3.921 511 2HB ASP 68 HB3 ASP 68 -5.426 18.179 2.695 512 H SER 69 H SER 69 -3.843 22.274 2.634 513 HA SER 69 HA SER 69 -2.470 21.929 0.242 514 1HB SER 69 HB2 SER 69 -1.202 23.263 2.628 515 2HB SER 69 HB3 SER 69 -1.248 23.797 0.938 516 HG SER 69 HG SER 69 -2.613 25.012 2.375 517 H ASP 70 H ASP 70 -2.044 20.144 3.245 518 HA ASP 70 HA ASP 70 0.757 19.617 2.921 519 1HB ASP 70 HB2 ASP 70 -0.336 19.347 5.089 520 2HB ASP 70 HB3 ASP 70 -1.377 18.077 4.429 521 H ILE 71 H ILE 71 -2.194 17.794 1.998 522 HA ILE 71 HA ILE 71 -0.675 15.580 0.902 523 HB ILE 71 HB ILE 71 -3.573 16.416 0.501 524 1HG1 ILE 71 HG12 ILE 71 -2.244 14.142 2.046 525 2HG1 ILE 71 HG13 ILE 71 -2.876 15.623 2.778 526 1HG2 ILE 71 HG21 ILE 71 -2.126 13.891 -0.441 527 2HG2 ILE 71 HG22 ILE 71 -3.884 14.183 -0.543 528 3HG2 ILE 71 HG23 ILE 71 -2.790 15.154 -1.499 529 1HD1 ILE 71 HD11 ILE 71 -5.166 15.006 1.903 530 2HD1 ILE 71 HD12 ILE 71 -4.488 13.420 1.443 531 3HD1 ILE 71 HD13 ILE 71 -4.502 13.916 3.140 532 H LEU 72 H LEU 72 -2.180 18.519 -0.442 533 HA LEU 72 HA LEU 72 -1.642 18.273 -3.147 534 1HB LEU 72 HB2 LEU 72 -2.843 20.101 -1.867 535 2HB LEU 72 HB3 LEU 72 -1.292 20.660 -1.313 536 HG LEU 72 HG LEU 72 -0.801 20.919 -3.925 537 1HD1 LEU 72 HD11 LEU 72 -3.016 20.026 -4.646 538 2HD1 LEU 72 HD12 LEU 72 -3.851 21.252 -3.689 539 3HD1 LEU 72 HD13 LEU 72 -2.854 21.738 -5.068 540 1HD2 LEU 72 HD21 LEU 72 -2.475 22.758 -2.175 541 2HD2 LEU 72 HD22 LEU 72 -0.715 22.690 -2.233 542 3HD2 LEU 72 HD23 LEU 72 -1.607 23.275 -3.651 543 H ASN 73 H ASN 73 0.616 19.486 -0.582 544 HA ASN 73 HA ASN 73 2.753 19.824 -2.476 545 1HB ASN 73 HB2 ASN 73 2.493 20.152 0.520 546 2HB ASN 73 HB3 ASN 73 4.089 20.118 -0.224 547 1HD2 ASN 73 HD22 ASN 73 0.979 21.882 -0.263 548 2HD2 ASN 73 HD21 ASN 73 1.555 23.195 -1.290 549 H ASN 74 H ASN 74 1.607 16.980 -0.951 550 HA ASN 74 HA ASN 74 4.266 15.623 -1.090 551 1HB ASN 74 HB2 ASN 74 1.535 14.812 -0.002 552 2HB ASN 74 HB3 ASN 74 2.769 13.623 -0.367 553 1HD2 ASN 74 HD22 ASN 74 1.886 16.207 1.833 554 2HD2 ASN 74 HD21 ASN 74 3.113 15.840 3.025 555 H ALA 75 H ALA 75 1.386 16.260 -2.963 556 HA ALA 75 HA ALA 75 1.093 13.745 -4.123 557 1HB ALA 75 HB1 ALA 75 -0.638 15.524 -4.014 558 2HB ALA 75 HB2 ALA 75 0.252 16.422 -5.277 559 3HB ALA 75 HB3 ALA 75 -0.446 14.823 -5.629 560 H ASP 76 H ASP 76 1.598 12.942 -6.299 561 HA ASP 76 HA ASP 76 4.132 13.923 -7.432 562 1HB ASP 76 HB2 ASP 76 3.427 11.513 -7.664 563 2HB ASP 76 HB3 ASP 76 2.065 12.050 -8.671 564 H LEU 77 H LEU 77 0.620 14.167 -7.987 565 HA LEU 77 HA LEU 77 1.070 16.672 -9.346 566 1HB LEU 77 HB2 LEU 77 -0.163 16.277 -11.288 567 2HB LEU 77 HB3 LEU 77 1.012 14.963 -11.188 568 HG LEU 77 HG LEU 77 -1.915 14.658 -10.391 569 1HD1 LEU 77 HD11 LEU 77 -2.259 13.702 -12.608 570 2HD1 LEU 77 HD12 LEU 77 -1.735 15.385 -12.736 571 3HD1 LEU 77 HD13 LEU 77 -0.575 14.083 -13.050 572 1HD2 LEU 77 HD21 LEU 77 0.355 12.712 -11.020 573 2HD2 LEU 77 HD22 LEU 77 -0.502 12.892 -9.477 574 3HD2 LEU 77 HD23 LEU 77 -1.350 12.250 -10.887 575 H VAL 78 H VAL 78 -0.809 17.881 -9.718 576 HA VAL 78 HA VAL 78 -3.134 17.252 -7.972 577 HB VAL 78 HB VAL 78 -1.868 19.946 -8.673 578 1HG1 VAL 78 HG11 VAL 78 -4.325 20.064 -8.348 579 2HG1 VAL 78 HG12 VAL 78 -4.115 19.298 -6.755 580 3HG1 VAL 78 HG13 VAL 78 -3.424 20.908 -7.094 581 1HG2 VAL 78 HG21 VAL 78 -1.875 18.424 -6.022 582 2HG2 VAL 78 HG22 VAL 78 -0.469 18.687 -7.058 583 3HG2 VAL 78 HG23 VAL 78 -1.226 20.066 -6.296 584 H VAL 79 H VAL 79 -5.149 17.508 -9.033 585 HA VAL 79 HA VAL 79 -5.056 18.433 -11.867 586 HB VAL 79 HB VAL 79 -6.609 15.990 -10.935 587 1HG1 VAL 79 HG11 VAL 79 -7.575 17.207 -12.830 588 2HG1 VAL 79 HG12 VAL 79 -6.011 17.152 -13.676 589 3HG1 VAL 79 HG13 VAL 79 -6.921 15.647 -13.349 590 1HG2 VAL 79 HG21 VAL 79 -4.989 14.678 -12.320 591 2HG2 VAL 79 HG22 VAL 79 -3.969 16.127 -12.443 592 3HG2 VAL 79 HG23 VAL 79 -4.258 15.358 -10.865 593 H THR 80 H THR 80 -6.232 20.250 -11.910 594 HA THR 80 HA THR 80 -8.424 20.630 -9.969 595 HB THR 80 HB THR 80 -8.384 22.952 -10.870 596 HG1 THR 80 HG1 THR 80 -7.560 22.375 -12.905 597 1HG2 THR 80 HG21 THR 80 -5.925 23.442 -10.143 598 2HG2 THR 80 HG22 THR 80 -7.046 22.754 -8.949 599 3HG2 THR 80 HG23 THR 80 -5.827 21.735 -9.747 600 H LEU 81 H LEU 81 -10.195 19.558 -10.605 601 HA LEU 81 HA LEU 81 -10.627 18.750 -13.328 602 1HB LEU 81 HB2 LEU 81 -12.424 18.684 -10.879 603 2HB LEU 81 HB3 LEU 81 -12.821 17.901 -12.408 604 HG LEU 81 HG LEU 81 -10.362 17.240 -10.721 605 1HD1 LEU 81 HD11 LEU 81 -12.481 16.681 -9.597 606 2HD1 LEU 81 HD12 LEU 81 -12.983 15.734 -11.021 607 3HD1 LEU 81 HD13 LEU 81 -11.565 15.242 -10.067 608 1HD2 LEU 81 HD21 LEU 81 -11.551 15.907 -13.199 609 2HD2 LEU 81 HD22 LEU 81 -9.948 16.647 -13.047 610 3HD2 LEU 81 HD23 LEU 81 -10.317 15.167 -12.164 611 H CYS 82 H CYS 82 -11.204 21.833 -11.973 612 HA CYS 82 HA CYS 82 -12.762 22.467 -14.319 613 1HB CYS 82 HB2 CYS 82 -14.558 23.620 -13.152 614 2HB CYS 82 HB3 CYS 82 -14.525 21.916 -12.659 615 HG CYS 82 HG CYS 82 -15.073 23.620 -10.585 616 H GLY 83 H GLY 83 -12.574 24.770 -14.802 617 1HA GLY 83 HA1 GLY 83 -9.911 25.569 -14.429 618 2HA GLY 83 HA2 GLY 83 -11.200 26.555 -15.143 619 H ASP 84 H ASP 84 -12.922 26.799 -12.876 620 HA ASP 84 HA ASP 84 -11.676 29.014 -11.602 621 1HB ASP 84 HB2 ASP 84 -14.117 28.789 -11.941 622 2HB ASP 84 HB3 ASP 84 -14.160 27.493 -10.742 623 H ALA 85 H ALA 85 -11.928 25.586 -10.617 624 HA ALA 85 HA ALA 85 -11.211 26.009 -7.889 625 1HB ALA 85 HB1 ALA 85 -10.742 23.565 -9.660 626 2HB ALA 85 HB2 ALA 85 -10.553 23.606 -7.897 627 3HB ALA 85 HB3 ALA 85 -12.148 23.869 -8.612 628 H ALA 86 H ALA 86 -9.304 25.963 -10.858 629 HA ALA 86 HA ALA 86 -6.824 25.297 -9.623 630 1HB ALA 86 HB1 ALA 86 -5.841 25.852 -11.731 631 2HB ALA 86 HB2 ALA 86 -7.415 25.097 -12.072 632 3HB ALA 86 HB3 ALA 86 -7.230 26.862 -12.192 633 H ASP 87 H ASP 87 -8.632 28.265 -9.576 634 HA ASP 87 HA ASP 87 -6.482 30.094 -9.133 635 1HB ASP 87 HB2 ASP 87 -8.835 30.761 -9.612 636 2HB ASP 87 HB3 ASP 87 -9.322 30.085 -8.046 637 H LYS 88 H LYS 88 -8.111 27.703 -7.105 638 HA LYS 88 HA LYS 88 -7.447 28.978 -4.599 639 1HB LYS 88 HB2 LYS 88 -9.456 27.564 -5.013 640 2HB LYS 88 HB3 LYS 88 -8.406 26.155 -5.228 641 1HG LYS 88 HG2 LYS 88 -9.445 26.102 -3.085 642 2HG LYS 88 HG3 LYS 88 -7.707 26.289 -2.889 643 1HD LYS 88 HD2 LYS 88 -7.978 28.670 -2.350 644 2HD LYS 88 HD3 LYS 88 -9.721 28.583 -2.722 645 1HE LYS 88 HE2 LYS 88 -10.022 26.902 -0.942 646 2HE LYS 88 HE3 LYS 88 -8.294 26.951 -0.576 647 1HZ LYS 88 HZ1 LYS 88 -10.164 29.236 -0.254 648 2HZ LYS 88 HZ2 LYS 88 -9.559 28.332 0.958 649 3HZ LYS 88 HZ3 LYS 88 -8.565 29.279 0.083 650 H CYS 89 H CYS 89 -5.731 26.602 -6.565 651 HA CYS 89 HA CYS 89 -4.503 25.031 -4.756 652 1HB CYS 89 HB2 CYS 89 -2.925 26.129 -7.088 653 2HB CYS 89 HB3 CYS 89 -2.838 24.522 -6.332 654 HG CYS 89 HG CYS 89 -5.133 23.677 -7.040 655 HA PRO 90 HA PRO 90 -2.555 28.300 -2.442 656 1HB PRO 90 HB2 PRO 90 -1.726 26.941 -0.193 657 2HB PRO 90 HB3 PRO 90 -3.392 27.509 -0.544 658 1HG PRO 90 HG2 PRO 90 -2.239 24.751 -0.977 659 2HG PRO 90 HG3 PRO 90 -3.828 25.202 -0.264 660 1HD PRO 90 HD2 PRO 90 -3.630 24.441 -2.860 661 2HD PRO 90 HD3 PRO 90 -4.744 25.722 -2.339 662 H MET 91 H MET 91 -0.615 25.330 -2.968 663 HA MET 91 HA MET 91 1.485 26.874 -4.118 664 1HB MET 91 HB2 MET 91 2.122 27.293 -1.755 665 2HB MET 91 HB3 MET 91 2.058 25.564 -1.408 666 1HG MET 91 HG2 MET 91 4.357 26.404 -1.679 667 2HG MET 91 HG3 MET 91 3.966 25.150 -2.846 668 1HE MET 91 HE1 MET 91 6.544 26.916 -3.114 669 2HE MET 91 HE2 MET 91 6.055 25.675 -4.290 670 3HE MET 91 HE3 MET 91 6.515 27.298 -4.851 671 H THR 92 H THR 92 2.410 25.537 -5.662 672 HA THR 92 HA THR 92 2.599 22.629 -5.145 673 HB THR 92 HB THR 92 1.900 22.251 -7.557 674 HG1 THR 92 HG1 THR 92 1.918 24.482 -8.176 675 1HG2 THR 92 HG21 THR 92 -0.458 22.175 -7.070 676 2HG2 THR 92 HG22 THR 92 0.472 21.667 -5.649 677 3HG2 THR 92 HG23 THR 92 -0.265 23.287 -5.700 678 HA PRO 93 HA PRO 93 6.598 24.430 -6.519 679 1HB PRO 93 HB2 PRO 93 8.267 22.554 -5.377 680 2HB PRO 93 HB3 PRO 93 7.528 23.898 -4.464 681 1HG PRO 93 HG2 PRO 93 6.589 21.031 -4.671 682 2HG PRO 93 HG3 PRO 93 6.745 22.042 -3.201 683 1HD PRO 93 HD2 PRO 93 4.366 21.684 -4.486 684 2HD PRO 93 HD3 PRO 93 4.780 23.237 -3.701 685 HA PRO 94 HA PRO 94 7.446 22.161 -10.205 686 1HB PRO 94 HB2 PRO 94 10.284 21.720 -9.248 687 2HB PRO 94 HB3 PRO 94 9.714 22.235 -10.871 688 1HG PRO 94 HG2 PRO 94 10.639 24.083 -9.128 689 2HG PRO 94 HG3 PRO 94 9.134 24.413 -10.048 690 1HD PRO 94 HD2 PRO 94 9.428 23.488 -7.190 691 2HD PRO 94 HD3 PRO 94 8.312 24.703 -7.879 692 H HIS 95 H HIS 95 8.479 20.477 -7.251 693 HA HIS 95 HA HIS 95 8.750 17.856 -8.355 694 1HB HIS 95 HB2 HIS 95 7.930 18.667 -5.537 695 2HB HIS 95 HB3 HIS 95 8.631 17.129 -6.030 696 HD1 HIS 95 HD1 HIS 95 9.761 20.078 -4.322 697 HD2 HIS 95 HD2 HIS 95 11.217 17.720 -7.496 698 HE1 HIS 95 HE1 HIS 95 12.252 20.563 -4.489 699 H VAL 96 H VAL 96 5.963 19.768 -8.165 700 HA VAL 96 HA VAL 96 4.067 17.476 -8.064 701 HB VAL 96 HB VAL 96 3.738 20.266 -6.851 702 1HG1 VAL 96 HG11 VAL 96 2.032 17.766 -6.611 703 2HG1 VAL 96 HG12 VAL 96 1.739 19.331 -5.821 704 3HG1 VAL 96 HG13 VAL 96 1.660 19.206 -7.582 705 1HG2 VAL 96 HG21 VAL 96 4.472 17.697 -5.423 706 2HG2 VAL 96 HG22 VAL 96 5.381 19.213 -5.469 707 3HG2 VAL 96 HG23 VAL 96 3.832 19.148 -4.626 708 H LYS 97 H LYS 97 3.612 17.416 -10.352 709 HA LYS 97 HA LYS 97 3.402 19.984 -11.757 710 1HB LYS 97 HB2 LYS 97 3.004 18.922 -13.743 711 2HB LYS 97 HB3 LYS 97 4.307 18.049 -12.988 712 1HG LYS 97 HG2 LYS 97 1.533 16.916 -12.645 713 2HG LYS 97 HG3 LYS 97 2.187 16.951 -14.273 714 1HD LYS 97 HD2 LYS 97 4.234 15.754 -13.472 715 2HD LYS 97 HD3 LYS 97 3.457 15.559 -11.889 716 1HE LYS 97 HE2 LYS 97 1.586 14.321 -12.953 717 2HE LYS 97 HE3 LYS 97 2.276 14.608 -14.554 718 1HZ LYS 97 HZ1 LYS 97 3.439 12.952 -12.374 719 2HZ LYS 97 HZ2 LYS 97 2.843 12.415 -13.798 720 3HZ LYS 97 HZ3 LYS 97 4.225 13.281 -13.786 721 H ARG 98 H ARG 98 1.343 20.436 -12.987 722 HA ARG 98 HA ARG 98 -1.046 19.942 -11.297 723 1HB ARG 98 HB2 ARG 98 0.133 21.813 -10.301 724 2HB ARG 98 HB3 ARG 98 0.254 22.637 -11.857 725 1HG ARG 98 HG2 ARG 98 -2.087 23.095 -11.907 726 2HG ARG 98 HG3 ARG 98 -2.425 22.019 -10.534 727 1HD ARG 98 HD2 ARG 98 -1.449 23.459 -8.964 728 2HD ARG 98 HD3 ARG 98 -0.437 24.266 -10.143 729 HE ARG 98 HE ARG 98 -3.253 24.840 -9.493 730 1HH1 ARG 98 HH21 ARG 98 -0.501 25.567 -11.626 731 2HH1 ARG 98 HH22 ARG 98 -1.050 27.146 -12.036 732 1HH2 ARG 98 HH11 ARG 98 -3.969 27.013 -10.017 733 2HH2 ARG 98 HH12 ARG 98 -3.047 27.955 -11.122 734 H GLU 99 H GLU 99 -2.804 19.687 -12.559 735 HA GLU 99 HA GLU 99 -2.626 20.377 -15.449 736 1HB GLU 99 HB2 GLU 99 -2.013 18.000 -14.917 737 2HB GLU 99 HB3 GLU 99 -3.588 17.782 -14.149 738 1HG GLU 99 HG2 GLU 99 -3.452 16.817 -16.406 739 2HG GLU 99 HG3 GLU 99 -4.734 18.018 -16.250 740 H HIS 100 H HIS 100 -4.821 20.478 -16.482 741 HA HIS 100 HA HIS 100 -6.897 21.391 -14.545 742 1HB HIS 100 HB2 HIS 100 -6.040 22.982 -16.987 743 2HB HIS 100 HB3 HIS 100 -7.151 23.475 -15.720 744 HD1 HIS 100 HD1 HIS 100 -5.464 23.246 -13.132 745 HD2 HIS 100 HD2 HIS 100 -3.985 24.507 -16.870 746 HE1 HIS 100 HE1 HIS 100 -3.441 24.720 -12.655 747 H TRP 101 H TRP 101 -8.987 21.131 -15.211 748 HA TRP 101 HA TRP 101 -9.622 20.663 -18.054 749 1HB TRP 101 HB2 TRP 101 -10.765 18.944 -15.855 750 2HB TRP 101 HB3 TRP 101 -10.937 18.764 -17.606 751 HD1 TRP 101 HD1 TRP 101 -8.786 17.842 -14.709 752 HE1 TRP 101 HE1 TRP 101 -6.734 16.491 -15.393 753 HE3 TRP 101 HE3 TRP 101 -9.012 18.498 -19.784 754 HZ2 TRP 101 HZ2 TRP 101 -5.524 15.528 -17.826 755 HZ3 TRP 101 HZ3 TRP 101 -7.395 17.331 -21.261 756 HH2 TRP 101 HH2 TRP 101 -5.675 15.805 -20.288 757 H GLY 102 H GLY 102 -12.411 20.451 -17.767 758 1HA GLY 102 HA1 GLY 102 -13.156 23.008 -16.394 759 2HA GLY 102 HA2 GLY 102 -13.372 22.793 -18.125 760 H PHE 103 H PHE 103 -14.006 20.515 -15.362 761 HA PHE 103 HA PHE 103 -16.482 19.740 -16.659 762 1HB PHE 103 HB2 PHE 103 -15.072 18.811 -14.138 763 2HB PHE 103 HB3 PHE 103 -16.631 18.198 -14.651 764 HD1 PHE 103 HD1 PHE 103 -13.046 18.463 -15.739 765 HD2 PHE 103 HD2 PHE 103 -16.859 16.560 -16.352 766 HE1 PHE 103 HE1 PHE 103 -11.967 16.838 -17.235 767 HE2 PHE 103 HE2 PHE 103 -15.773 14.877 -17.781 768 HZ PHE 103 HZ PHE 103 -13.331 15.016 -18.269 769 H ASP 104 H ASP 104 -18.417 20.547 -16.327 770 HA ASP 104 HA ASP 104 -19.052 22.309 -14.056 771 1HB ASP 104 HB2 ASP 104 -19.999 22.746 -16.317 772 2HB ASP 104 HB3 ASP 104 -20.777 21.156 -16.280 773 H ASP 105 H ASP 105 -20.832 21.683 -12.542 774 HA ASP 105 HA ASP 105 -20.158 19.018 -11.621 775 1HB ASP 105 HB2 ASP 105 -20.397 21.066 -10.142 776 2HB ASP 105 HB3 ASP 105 -22.144 20.869 -10.309 777 HA PRO 106 HA PRO 106 -23.673 17.210 -13.566 778 1HB PRO 106 HB2 PRO 106 -23.615 14.651 -12.492 779 2HB PRO 106 HB3 PRO 106 -22.506 15.243 -13.762 780 1HG PRO 106 HG2 PRO 106 -22.055 15.073 -10.779 781 2HG PRO 106 HG3 PRO 106 -20.938 14.596 -12.097 782 1HD PRO 106 HD2 PRO 106 -20.721 16.980 -10.800 783 2HD PRO 106 HD3 PRO 106 -20.370 16.847 -12.546 784 H ALA 107 H ALA 107 -23.527 17.126 -9.990 785 HA ALA 107 HA ALA 107 -26.228 16.209 -9.683 786 1HB ALA 107 HB1 ALA 107 -25.990 16.967 -7.340 787 2HB ALA 107 HB2 ALA 107 -24.607 16.001 -7.874 788 3HB ALA 107 HB3 ALA 107 -24.458 17.762 -7.750 789 H ARG 108 H ARG 108 -24.883 19.287 -10.522 790 HA ARG 108 HA ARG 108 -27.347 20.759 -9.744 791 1HB ARG 108 HB2 ARG 108 -24.549 21.729 -10.504 792 2HB ARG 108 HB3 ARG 108 -25.939 22.773 -10.237 793 1HG ARG 108 HG2 ARG 108 -24.936 22.897 -8.199 794 2HG ARG 108 HG3 ARG 108 -26.155 21.650 -7.921 795 1HD ARG 108 HD2 ARG 108 -24.356 19.910 -8.201 796 2HD ARG 108 HD3 ARG 108 -23.180 21.212 -8.430 797 HE ARG 108 HE ARG 108 -24.453 21.722 -5.999 798 1HH1 ARG 108 HH11 ARG 108 -22.392 19.101 -7.340 799 2HH1 ARG 108 HH12 ARG 108 -21.618 18.800 -5.812 800 1HH2 ARG 108 HH21 ARG 108 -23.405 21.197 -3.981 801 2HH2 ARG 108 HH22 ARG 108 -22.209 19.943 -3.943 802 H ALA 109 H ALA 109 -26.309 19.023 -12.393 803 HA ALA 109 HA ALA 109 -27.030 20.750 -14.523 804 1HB ALA 109 HB1 ALA 109 -27.258 17.710 -14.270 805 2HB ALA 109 HB2 ALA 109 -27.314 18.632 -15.783 806 3HB ALA 109 HB3 ALA 109 -25.812 18.589 -14.828 807 H GLN 110 H GLN 110 -29.088 20.708 -15.671 808 HA GLN 110 HA GLN 110 -31.464 19.720 -14.318 809 1HB GLN 110 HB2 GLN 110 -32.396 21.960 -13.805 810 2HB GLN 110 HB3 GLN 110 -30.971 21.572 -12.861 811 1HG GLN 110 HG2 GLN 110 -29.645 22.957 -14.662 812 2HG GLN 110 HG3 GLN 110 -31.237 23.556 -15.134 813 1HE2 GLN 110 HE22 GLN 110 -28.983 23.180 -12.328 814 2HE2 GLN 110 HE21 GLN 110 -29.564 24.586 -11.463 815 H GLY 111 H GLY 111 -33.444 20.460 -15.443 816 1HA GLY 111 HA1 GLY 111 -34.031 21.773 -17.647 817 2HA GLY 111 HA2 GLY 111 -33.079 20.454 -18.373 818 H THR 112 H THR 112 -33.634 18.292 -16.876 819 HA THR 112 HA THR 112 -36.226 17.936 -15.904 820 HB THR 112 HB THR 112 -37.030 17.884 -18.164 821 HG1 THR 112 HG1 THR 112 -37.966 15.943 -18.143 822 1HG2 THR 112 HG21 THR 112 -34.843 15.875 -18.801 823 2HG2 THR 112 HG22 THR 112 -36.221 16.246 -19.857 824 3HG2 THR 112 HG23 THR 112 -35.040 17.504 -19.483 825 H GLU 113 H GLU 113 -36.373 15.487 -15.273 826 HA GLU 113 HA GLU 113 -34.036 14.925 -13.757 827 1HB GLU 113 HB2 GLU 113 -36.249 14.201 -13.061 828 2HB GLU 113 HB3 GLU 113 -36.429 13.191 -14.505 829 1HG GLU 113 HG2 GLU 113 -34.622 11.723 -13.777 830 2HG GLU 113 HG3 GLU 113 -34.256 12.778 -12.406 831 H GLU 114 H GLU 114 -35.198 13.623 -16.861 832 HA GLU 114 HA GLU 114 -33.091 11.696 -17.053 833 1HB GLU 114 HB2 GLU 114 -33.832 11.311 -19.330 834 2HB GLU 114 HB3 GLU 114 -35.194 11.351 -18.211 835 1HG GLU 114 HG2 GLU 114 -35.737 13.657 -18.938 836 2HG GLU 114 HG3 GLU 114 -34.361 13.639 -20.050 837 H GLU 115 H GLU 115 -33.274 15.119 -17.878 838 HA GLU 115 HA GLU 115 -30.954 15.092 -19.593 839 1HB GLU 115 HB2 GLU 115 -32.743 16.838 -19.716 840 2HB GLU 115 HB3 GLU 115 -32.263 17.410 -18.117 841 1HG GLU 115 HG2 GLU 115 -31.286 18.875 -19.701 842 2HG GLU 115 HG3 GLU 115 -29.971 17.913 -19.047 843 H LYS 116 H LYS 116 -31.690 15.891 -16.172 844 HA LYS 116 HA LYS 116 -29.055 16.459 -15.322 845 1HB LYS 116 HB2 LYS 116 -30.898 17.081 -13.947 846 2HB LYS 116 HB3 LYS 116 -31.548 15.437 -13.927 847 1HG LYS 116 HG2 LYS 116 -29.716 14.640 -12.605 848 2HG LYS 116 HG3 LYS 116 -28.895 16.213 -12.655 849 1HD LYS 116 HD2 LYS 116 -31.691 15.950 -11.509 850 2HD LYS 116 HD3 LYS 116 -30.280 15.433 -10.562 851 1HE LYS 116 HE2 LYS 116 -29.283 17.737 -10.939 852 2HE LYS 116 HE3 LYS 116 -30.839 18.214 -11.630 853 1HZ LYS 116 HZ1 LYS 116 -30.701 18.792 -9.306 854 2HZ LYS 116 HZ2 LYS 116 -31.872 17.670 -9.490 855 3HZ LYS 116 HZ3 LYS 116 -30.414 17.256 -8.859 856 H TRP 117 H TRP 117 -30.817 13.321 -15.354 857 HA TRP 117 HA TRP 117 -28.631 11.800 -14.370 858 1HB TRP 117 HB2 TRP 117 -30.933 10.922 -14.472 859 2HB TRP 117 HB3 TRP 117 -30.858 10.893 -16.234 860 HD1 TRP 117 HD1 TRP 117 -29.317 9.002 -17.367 861 HE1 TRP 117 HE1 TRP 117 -28.356 6.774 -16.526 862 HE3 TRP 117 HE3 TRP 117 -30.037 9.634 -12.336 863 HZ2 TRP 117 HZ2 TRP 117 -27.754 5.532 -14.017 864 HZ3 TRP 117 HZ3 TRP 117 -29.218 7.926 -10.739 865 HH2 TRP 117 HH2 TRP 117 -28.074 5.873 -11.567 866 H ALA 118 H ALA 118 -29.568 12.595 -17.778 867 HA ALA 118 HA ALA 118 -27.510 11.116 -19.015 868 1HB ALA 118 HB1 ALA 118 -28.787 13.741 -19.907 869 2HB ALA 118 HB2 ALA 118 -27.839 12.643 -20.931 870 3HB ALA 118 HB3 ALA 118 -29.391 12.108 -20.254 871 H PHE 119 H PHE 119 -27.463 14.450 -17.652 872 HA PHE 119 HA PHE 119 -24.814 15.048 -18.424 873 1HB PHE 119 HB2 PHE 119 -26.756 16.502 -17.348 874 2HB PHE 119 HB3 PHE 119 -25.952 16.090 -15.844 875 HD1 PHE 119 HD1 PHE 119 -23.425 16.694 -15.637 876 HD2 PHE 119 HD2 PHE 119 -25.964 18.206 -18.775 877 HE1 PHE 119 HE1 PHE 119 -21.869 18.601 -15.973 878 HE2 PHE 119 HE2 PHE 119 -24.379 20.076 -19.151 879 HZ PHE 119 HZ PHE 119 -22.336 20.281 -17.754 880 H PHE 120 H PHE 120 -26.064 13.260 -15.532 881 HA PHE 120 HA PHE 120 -23.591 12.950 -14.173 882 1HB PHE 120 HB2 PHE 120 -25.605 10.703 -14.439 883 2HB PHE 120 HB3 PHE 120 -24.400 10.936 -13.214 884 HD1 PHE 120 HD1 PHE 120 -25.624 14.161 -13.181 885 HD2 PHE 120 HD2 PHE 120 -26.964 10.119 -12.452 886 HE1 PHE 120 HE1 PHE 120 -27.271 14.990 -11.559 887 HE2 PHE 120 HE2 PHE 120 -28.685 10.984 -10.897 888 HZ PHE 120 HZ PHE 120 -28.831 13.418 -10.426 889 H GLN 121 H GLN 121 -25.119 10.991 -16.792 890 HA GLN 121 HA GLN 121 -23.047 9.070 -16.968 891 1HB GLN 121 HB2 GLN 121 -24.921 9.877 -19.217 892 2HB GLN 121 HB3 GLN 121 -23.995 8.389 -19.080 893 1HG GLN 121 HG2 GLN 121 -26.386 9.235 -17.420 894 2HG GLN 121 HG3 GLN 121 -26.262 7.883 -18.520 895 1HE2 GLN 121 HE22 GLN 121 -26.099 8.759 -15.232 896 2HE2 GLN 121 HE21 GLN 121 -25.295 7.320 -14.638 897 H ARG 122 H ARG 122 -23.544 12.079 -18.831 898 HA ARG 122 HA ARG 122 -21.267 11.785 -20.522 899 1HB ARG 122 HB2 ARG 122 -22.898 14.183 -19.612 900 2HB ARG 122 HB3 ARG 122 -21.355 14.436 -20.413 901 1HG ARG 122 HG2 ARG 122 -22.944 14.569 -22.118 902 2HG ARG 122 HG3 ARG 122 -22.117 13.025 -22.333 903 1HD ARG 122 HD2 ARG 122 -24.087 11.898 -21.196 904 2HD ARG 122 HD3 ARG 122 -24.864 13.482 -21.103 905 HE ARG 122 HE ARG 122 -25.308 13.468 -23.358 906 1HH1 ARG 122 HH21 ARG 122 -23.289 10.644 -22.596 907 2HH1 ARG 122 HH22 ARG 122 -23.563 9.865 -24.108 908 1HH2 ARG 122 HH11 ARG 122 -25.669 12.430 -25.371 909 2HH2 ARG 122 HH12 ARG 122 -24.945 10.906 -25.719 910 H VAL 123 H VAL 123 -21.560 13.491 -17.335 911 HA VAL 123 HA VAL 123 -18.828 14.280 -17.376 912 HB VAL 123 HB VAL 123 -20.826 13.981 -15.099 913 1HG1 VAL 123 HG11 VAL 123 -18.648 13.758 -14.040 914 2HG1 VAL 123 HG12 VAL 123 -17.990 15.104 -14.988 915 3HG1 VAL 123 HG13 VAL 123 -19.229 15.397 -13.756 916 1HG2 VAL 123 HG21 VAL 123 -19.631 16.428 -16.503 917 2HG2 VAL 123 HG22 VAL 123 -21.253 15.779 -16.796 918 3HG2 VAL 123 HG23 VAL 123 -20.843 16.454 -15.213 919 H ARG 124 H ARG 124 -20.325 11.300 -15.814 920 HA ARG 124 HA ARG 124 -17.785 10.514 -14.841 921 1HB ARG 124 HB2 ARG 124 -18.675 8.263 -14.540 922 2HB ARG 124 HB3 ARG 124 -19.845 9.457 -13.983 923 1HG ARG 124 HG2 ARG 124 -21.221 9.099 -15.926 924 2HG ARG 124 HG3 ARG 124 -19.993 8.122 -16.719 925 1HD ARG 124 HD2 ARG 124 -20.224 6.435 -14.859 926 2HD ARG 124 HD3 ARG 124 -21.605 7.361 -14.283 927 HE ARG 124 HE ARG 124 -22.897 6.487 -15.952 928 1HH1 ARG 124 HH21 ARG 124 -19.532 5.959 -17.042 929 2HH1 ARG 124 HH22 ARG 124 -20.019 5.044 -18.419 930 1HH2 ARG 124 HH11 ARG 124 -23.483 5.405 -17.755 931 2HH2 ARG 124 HH12 ARG 124 -22.322 4.680 -18.831 932 H ASP 125 H ASP 125 -19.316 9.853 -17.998 933 HA ASP 125 HA ASP 125 -17.361 8.022 -18.915 934 1HB ASP 125 HB2 ASP 125 -19.499 8.310 -20.055 935 2HB ASP 125 HB3 ASP 125 -19.091 9.977 -20.479 936 H GLU 126 H GLU 126 -17.507 11.617 -19.129 937 HA GLU 126 HA GLU 126 -15.072 11.748 -20.601 938 1HB GLU 126 HB2 GLU 126 -16.921 13.768 -19.349 939 2HB GLU 126 HB3 GLU 126 -15.345 14.269 -19.963 940 1HG GLU 126 HG2 GLU 126 -17.462 12.812 -21.586 941 2HG GLU 126 HG3 GLU 126 -17.148 14.548 -21.628 942 H ILE 127 H ILE 127 -15.791 11.972 -17.099 943 HA ILE 127 HA ILE 127 -13.128 12.794 -16.393 944 HB ILE 127 HB ILE 127 -15.520 12.415 -14.993 945 1HG1 ILE 127 HG12 ILE 127 -14.178 12.932 -12.903 946 2HG1 ILE 127 HG13 ILE 127 -12.723 12.906 -13.912 947 1HG2 ILE 127 HG21 ILE 127 -15.150 10.938 -13.161 948 2HG2 ILE 127 HG22 ILE 127 -15.195 10.075 -14.694 949 3HG2 ILE 127 HG23 ILE 127 -13.630 10.362 -13.879 950 1HD1 ILE 127 HD11 ILE 127 -13.783 15.180 -13.487 951 2HD1 ILE 127 HD12 ILE 127 -13.571 14.769 -15.199 952 3HD1 ILE 127 HD13 ILE 127 -15.181 14.636 -14.439 953 H GLY 128 H GLY 128 -14.711 9.612 -16.895 954 1HA GLY 128 HA1 GLY 128 -12.512 7.977 -16.191 955 2HA GLY 128 HA2 GLY 128 -13.873 7.534 -17.247 956 H ASN 129 H ASN 129 -13.629 9.179 -19.395 957 HA ASN 129 HA ASN 129 -11.539 8.271 -21.043 958 1HB ASN 129 HB2 ASN 129 -13.559 9.288 -21.934 959 2HB ASN 129 HB3 ASN 129 -13.226 10.784 -21.065 960 1HD2 ASN 129 HD22 ASN 129 -13.088 12.250 -22.744 961 2HD2 ASN 129 HD21 ASN 129 -11.848 12.132 -23.978 962 H ARG 130 H ARG 130 -11.679 11.253 -19.044 963 HA ARG 130 HA ARG 130 -9.148 12.212 -19.899 964 1HB ARG 130 HB2 ARG 130 -11.185 13.099 -18.081 965 2HB ARG 130 HB3 ARG 130 -9.751 12.940 -17.104 966 1HG ARG 130 HG2 ARG 130 -9.992 15.201 -17.999 967 2HG ARG 130 HG3 ARG 130 -8.515 14.429 -18.561 968 1HD ARG 130 HD2 ARG 130 -9.542 15.673 -20.395 969 2HD ARG 130 HD3 ARG 130 -9.540 13.981 -20.776 970 HE ARG 130 HE ARG 130 -11.895 13.839 -20.399 971 1HH1 ARG 130 HH11 ARG 130 -10.740 17.165 -20.079 972 2HH1 ARG 130 HH12 ARG 130 -12.177 17.887 -20.716 973 1HH2 ARG 130 HH22 ARG 130 -13.709 14.771 -21.482 974 2HH2 ARG 130 HH21 ARG 130 -13.943 16.489 -21.426 975 H LEU 131 H LEU 131 -9.985 10.180 -17.056 976 HA LEU 131 HA LEU 131 -7.242 10.003 -16.238 977 1HB LEU 131 HB2 LEU 131 -9.767 8.590 -15.479 978 2HB LEU 131 HB3 LEU 131 -8.256 7.755 -15.144 979 HG LEU 131 HG LEU 131 -9.006 9.041 -13.256 980 1HD1 LEU 131 HD11 LEU 131 -6.397 10.209 -14.327 981 2HD1 LEU 131 HD12 LEU 131 -6.865 10.006 -12.647 982 3HD1 LEU 131 HD13 LEU 131 -6.571 8.579 -13.643 983 1HD2 LEU 131 HD21 LEU 131 -10.080 10.947 -14.396 984 2HD2 LEU 131 HD22 LEU 131 -8.955 11.458 -13.135 985 3HD2 LEU 131 HD23 LEU 131 -8.479 11.582 -14.838 986 H LYS 132 H LYS 132 -9.206 7.983 -18.427 987 HA LYS 132 HA LYS 132 -7.269 5.981 -18.887 988 1HB LYS 132 HB2 LYS 132 -9.409 5.503 -19.597 989 2HB LYS 132 HB3 LYS 132 -9.669 7.051 -20.348 990 1HG LYS 132 HG2 LYS 132 -7.573 5.331 -21.642 991 2HG LYS 132 HG3 LYS 132 -9.240 4.744 -21.696 992 1HD LYS 132 HD2 LYS 132 -10.004 6.910 -22.651 993 2HD LYS 132 HD3 LYS 132 -8.351 7.512 -22.594 994 1HE LYS 132 HE2 LYS 132 -8.879 6.872 -24.830 995 2HE LYS 132 HE3 LYS 132 -7.628 5.792 -24.198 996 1HZ LYS 132 HZ1 LYS 132 -10.516 5.130 -24.424 997 2HZ LYS 132 HZ2 LYS 132 -9.346 4.596 -25.420 998 3HZ LYS 132 HZ3 LYS 132 -9.359 4.110 -23.867 999 H GLU 133 H GLU 133 -7.744 9.108 -20.640 1000 HA GLU 133 HA GLU 133 -5.483 8.657 -22.367 1001 1HB GLU 133 HB2 GLU 133 -6.838 11.225 -21.440 1002 2HB GLU 133 HB3 GLU 133 -5.509 11.169 -22.612 1003 1HG GLU 133 HG2 GLU 133 -6.859 9.703 -24.089 1004 2HG GLU 133 HG3 GLU 133 -8.227 9.844 -22.986 1005 H PHE 134 H PHE 134 -5.777 10.410 -19.217 1006 HA PHE 134 HA PHE 134 -3.091 11.226 -19.096 1007 1HB PHE 134 HB2 PHE 134 -4.671 12.113 -17.593 1008 2HB PHE 134 HB3 PHE 134 -5.163 10.515 -17.024 1009 HD1 PHE 134 HD1 PHE 134 -4.069 9.412 -15.229 1010 HD2 PHE 134 HD2 PHE 134 -2.399 13.010 -16.906 1011 HE1 PHE 134 HE1 PHE 134 -2.424 9.515 -13.360 1012 HE2 PHE 134 HE2 PHE 134 -0.747 13.102 -15.076 1013 HZ PHE 134 HZ PHE 134 -0.786 11.396 -13.269 1014 H ALA 135 H ALA 135 -4.528 8.072 -18.302 1015 HA ALA 135 HA ALA 135 -2.106 6.964 -17.224 1016 1HB ALA 135 HB1 ALA 135 -4.347 6.108 -16.627 1017 2HB ALA 135 HB2 ALA 135 -4.589 5.558 -18.297 1018 3HB ALA 135 HB3 ALA 135 -3.318 4.828 -17.298 1019 H GLU 136 H GLU 136 -3.773 6.659 -20.366 1020 HA GLU 136 HA GLU 136 -1.928 4.800 -21.486 1021 1HB GLU 136 HB2 GLU 136 -4.084 6.575 -22.677 1022 2HB GLU 136 HB3 GLU 136 -3.118 5.490 -23.668 1023 1HG GLU 136 HG2 GLU 136 -4.784 4.536 -21.298 1024 2HG GLU 136 HG3 GLU 136 -5.354 4.574 -22.962 1025 H THR 137 H THR 137 -2.196 8.332 -21.736 1026 HA THR 137 HA THR 137 -0.027 8.432 -23.620 1027 HB THR 137 HB THR 137 -0.509 10.755 -23.805 1028 HG1 THR 137 HG1 THR 137 -2.428 10.402 -21.764 1029 1HG2 THR 137 HG21 THR 137 -1.946 9.143 -25.019 1030 2HG2 THR 137 HG22 THR 137 -3.092 9.134 -23.672 1031 3HG2 THR 137 HG23 THR 137 -2.825 10.628 -24.597 1032 H GLY 138 H GLY 138 -0.382 8.489 -20.195 1033 1HA GLY 138 HA1 GLY 138 0.953 8.958 -18.437 1034 2HA GLY 138 HA2 GLY 138 2.366 8.820 -19.513 1035 H LYS 139 H LYS 139 -0.437 11.014 -19.649 1036 HA LYS 139 HA LYS 139 0.884 13.157 -20.691 1037 1HB LYS 139 HB2 LYS 139 -1.635 12.659 -20.363 1038 2HB LYS 139 HB3 LYS 139 -1.495 13.543 -18.847 1039 1HG LYS 139 HG2 LYS 139 -0.762 15.543 -19.984 1040 2HG LYS 139 HG3 LYS 139 -0.599 14.692 -21.522 1041 1HD LYS 139 HD2 LYS 139 -3.182 15.305 -20.038 1042 2HD LYS 139 HD3 LYS 139 -2.624 16.044 -21.532 1043 1HE LYS 139 HE2 LYS 139 -3.616 13.187 -21.129 1044 2HE LYS 139 HE3 LYS 139 -4.377 14.482 -22.055 1045 1HZ LYS 139 HZ1 LYS 139 -1.977 12.922 -22.752 1046 2HZ LYS 139 HZ2 LYS 139 -3.349 13.093 -23.598 1047 3HZ LYS 139 HZ3 LYS 139 -2.318 14.355 -23.514 Start of MODEL 9 1 1H MET 1 H1 MET 1 0.903 -1.090 -3.698 2 2H MET 1 H2 MET 1 2.541 -0.964 -3.680 3 3H MET 1 H3 MET 1 1.800 -2.185 -2.868 4 HA MET 1 HA MET 1 0.730 -0.647 -1.398 5 1HB MET 1 HB2 MET 1 2.895 -1.653 -0.733 6 2HB MET 1 HB3 MET 1 3.753 -0.270 -1.414 7 1HG MET 1 HG2 MET 1 2.539 1.225 0.195 8 2HG MET 1 HG3 MET 1 1.684 -0.180 0.822 9 1HE MET 1 HE1 MET 1 5.577 0.397 -0.089 10 2HE MET 1 HE2 MET 1 4.991 1.872 0.717 11 3HE MET 1 HE3 MET 1 6.159 0.814 1.533 12 H GLU 2 H GLU 2 3.465 1.490 -2.485 13 HA GLU 2 HA GLU 2 1.699 3.288 -3.862 14 1HB GLU 2 HB2 GLU 2 1.970 5.215 -2.427 15 2HB GLU 2 HB3 GLU 2 1.206 3.929 -1.502 16 1HG GLU 2 HG2 GLU 2 3.415 3.379 -0.457 17 2HG GLU 2 HG3 GLU 2 4.135 4.738 -1.322 18 H ASN 3 H ASN 3 2.966 5.099 -4.721 19 HA ASN 3 HA ASN 3 5.890 5.078 -4.571 20 1HB ASN 3 HB2 ASN 3 5.703 3.357 -6.211 21 2HB ASN 3 HB3 ASN 3 4.325 4.122 -6.986 22 1HD2 ASN 3 HD22 ASN 3 4.639 5.541 -8.659 23 2HD2 ASN 3 HD21 ASN 3 6.218 6.049 -9.221 24 H LYS 4 H LYS 4 2.883 6.349 -5.994 25 HA LYS 4 HA LYS 4 3.985 9.096 -5.933 26 1HB LYS 4 HB2 LYS 4 3.161 9.531 -8.224 27 2HB LYS 4 HB3 LYS 4 4.440 8.324 -8.186 28 1HG LYS 4 HG2 LYS 4 2.558 6.546 -8.256 29 2HG LYS 4 HG3 LYS 4 1.466 7.872 -8.639 30 1HD LYS 4 HD2 LYS 4 3.951 7.071 -10.230 31 2HD LYS 4 HD3 LYS 4 2.303 6.568 -10.607 32 1HE LYS 4 HE2 LYS 4 1.638 8.916 -10.942 33 2HE LYS 4 HE3 LYS 4 3.266 9.465 -10.517 34 1HZ LYS 4 HZ1 LYS 4 2.611 7.757 -12.853 35 2HZ LYS 4 HZ2 LYS 4 2.955 9.349 -12.915 36 3HZ LYS 4 HZ3 LYS 4 4.109 8.291 -12.465 37 H ILE 5 H ILE 5 2.034 10.677 -6.420 38 HA ILE 5 HA ILE 5 -0.437 9.635 -5.159 39 HB ILE 5 HB ILE 5 1.326 11.895 -4.122 40 1HG1 ILE 5 HG12 ILE 5 0.080 9.514 -2.686 41 2HG1 ILE 5 HG13 ILE 5 1.742 9.582 -3.282 42 1HG2 ILE 5 HG21 ILE 5 -0.513 12.515 -2.550 43 2HG2 ILE 5 HG22 ILE 5 -0.999 12.791 -4.200 44 3HG2 ILE 5 HG23 ILE 5 -1.584 11.344 -3.362 45 1HD1 ILE 5 HD11 ILE 5 2.147 11.592 -1.853 46 2HD1 ILE 5 HD12 ILE 5 0.566 11.302 -1.079 47 3HD1 ILE 5 HD13 ILE 5 1.841 10.081 -0.968 48 H ILE 6 H ILE 6 -2.307 10.780 -5.734 49 HA ILE 6 HA ILE 6 -1.988 13.134 -7.451 50 HB ILE 6 HB ILE 6 -2.232 11.418 -9.061 51 1HG1 ILE 6 HG12 ILE 6 -4.887 12.870 -8.722 52 2HG1 ILE 6 HG13 ILE 6 -3.426 13.494 -9.499 53 1HG2 ILE 6 HG21 ILE 6 -4.719 10.470 -7.611 54 2HG2 ILE 6 HG22 ILE 6 -4.068 9.791 -9.108 55 3HG2 ILE 6 HG23 ILE 6 -3.160 9.617 -7.618 56 1HD1 ILE 6 HD11 ILE 6 -5.263 11.276 -10.454 57 2HD1 ILE 6 HD12 ILE 6 -4.900 12.818 -11.238 58 3HD1 ILE 6 HD13 ILE 6 -3.654 11.550 -11.163 59 H TYR 7 H TYR 7 -3.584 14.668 -7.138 60 HA TYR 7 HA TYR 7 -5.613 14.087 -5.049 61 1HB TYR 7 HB2 TYR 7 -3.421 15.084 -4.209 62 2HB TYR 7 HB3 TYR 7 -3.793 16.526 -5.136 63 HD1 TYR 7 HD1 TYR 7 -4.019 18.141 -3.445 64 HD2 TYR 7 HD2 TYR 7 -6.086 14.379 -3.002 65 HE1 TYR 7 HE1 TYR 7 -4.976 18.914 -1.298 66 HE2 TYR 7 HE2 TYR 7 -7.088 15.168 -0.895 67 HH TYR 7 HH TYR 7 -7.159 16.876 0.683 68 H PHE 8 H PHE 8 -7.502 14.311 -6.124 69 HA PHE 8 HA PHE 8 -7.897 16.217 -8.270 70 1HB PHE 8 HB2 PHE 8 -9.830 14.546 -6.591 71 2HB PHE 8 HB3 PHE 8 -10.291 15.517 -7.977 72 HD1 PHE 8 HD1 PHE 8 -9.368 12.229 -6.986 73 HD2 PHE 8 HD2 PHE 8 -8.829 15.101 -10.141 74 HE1 PHE 8 HE1 PHE 8 -8.629 10.428 -8.529 75 HE2 PHE 8 HE2 PHE 8 -8.044 13.303 -11.665 76 HZ PHE 8 HZ PHE 8 -7.912 10.961 -10.829 77 H LEU 9 H LEU 9 -8.903 18.162 -8.193 78 HA LEU 9 HA LEU 9 -9.880 19.264 -5.601 79 1HB LEU 9 HB2 LEU 9 -7.728 20.200 -7.434 80 2HB LEU 9 HB3 LEU 9 -8.989 21.394 -7.260 81 HG LEU 9 HG LEU 9 -7.186 21.827 -5.738 82 1HD1 LEU 9 HD11 LEU 9 -9.621 22.296 -5.120 83 2HD1 LEU 9 HD12 LEU 9 -9.520 20.883 -4.035 84 3HD1 LEU 9 HD13 LEU 9 -8.460 22.288 -3.804 85 1HD2 LEU 9 HD21 LEU 9 -6.430 19.446 -5.468 86 2HD2 LEU 9 HD22 LEU 9 -6.503 20.351 -3.958 87 3HD2 LEU 9 HD23 LEU 9 -7.776 19.181 -4.348 88 H CYS 10 H CYS 10 -11.872 20.423 -5.880 89 HA CYS 10 HA CYS 10 -12.601 21.370 -8.493 90 1HB CYS 10 HB2 CYS 10 -13.326 18.795 -8.247 91 2HB CYS 10 HB3 CYS 10 -14.679 19.494 -7.340 92 HG CYS 10 HG CYS 10 -13.500 20.212 -10.362 93 H THR 11 H THR 11 -14.953 22.525 -8.260 94 HA THR 11 HA THR 11 -14.749 24.190 -5.938 95 HB THR 11 HB THR 11 -16.993 25.050 -6.889 96 HG1 THR 11 HG1 THR 11 -17.302 24.495 -9.043 97 1HG2 THR 11 HG21 THR 11 -15.780 26.315 -8.594 98 2HG2 THR 11 HG22 THR 11 -14.766 26.134 -7.152 99 3HG2 THR 11 HG23 THR 11 -14.452 25.139 -8.577 100 H GLY 12 H GLY 12 -16.087 21.106 -6.264 101 1HA GLY 12 HA1 GLY 12 -16.904 21.168 -3.519 102 2HA GLY 12 HA2 GLY 12 -18.257 20.822 -4.625 103 H ASN 13 H ASN 13 -15.885 19.366 -2.844 104 HA ASN 13 HA ASN 13 -14.637 17.448 -4.506 105 1HB ASN 13 HB2 ASN 13 -14.088 17.929 -2.120 106 2HB ASN 13 HB3 ASN 13 -15.595 17.194 -1.612 107 1HD2 ASN 13 HD22 ASN 13 -13.053 16.408 -0.690 108 2HD2 ASN 13 HD21 ASN 13 -12.673 14.801 -1.282 109 H SER 14 H SER 14 -17.660 17.342 -2.733 110 HA SER 14 HA SER 14 -18.496 14.886 -2.607 111 1HB SER 14 HB2 SER 14 -20.113 17.376 -3.262 112 2HB SER 14 HB3 SER 14 -20.755 15.918 -2.463 113 HG SER 14 HG SER 14 -19.421 16.209 -0.796 114 H CYS 15 H CYS 15 -18.408 16.418 -5.752 115 HA CYS 15 HA CYS 15 -19.955 14.109 -6.842 116 1HB CYS 15 HB2 CYS 15 -19.888 16.905 -8.039 117 2HB CYS 15 HB3 CYS 15 -20.823 15.510 -8.595 118 HG CYS 15 HG CYS 15 -22.184 17.502 -7.462 119 H ARG 16 H ARG 16 -17.947 16.702 -8.303 120 HA ARG 16 HA ARG 16 -16.985 14.928 -10.284 121 1HB ARG 16 HB2 ARG 16 -16.166 17.712 -9.383 122 2HB ARG 16 HB3 ARG 16 -15.334 16.908 -10.716 123 1HG ARG 16 HG2 ARG 16 -17.226 16.828 -12.088 124 2HG ARG 16 HG3 ARG 16 -18.364 17.031 -10.759 125 1HD ARG 16 HD2 ARG 16 -16.459 19.213 -11.665 126 2HD ARG 16 HD3 ARG 16 -18.107 19.025 -12.270 127 HE ARG 16 HE ARG 16 -18.568 19.073 -9.593 128 1HH1 ARG 16 HH21 ARG 16 -17.013 21.387 -11.793 129 2HH1 ARG 16 HH22 ARG 16 -16.938 22.638 -10.575 130 1HH2 ARG 16 HH11 ARG 16 -18.739 20.719 -8.192 131 2HH2 ARG 16 HH12 ARG 16 -17.942 22.271 -8.481 132 H SER 17 H SER 17 -15.226 16.082 -7.304 133 HA SER 17 HA SER 17 -12.863 14.665 -8.070 134 1HB SER 17 HB2 SER 17 -13.655 15.488 -5.276 135 2HB SER 17 HB3 SER 17 -12.024 15.263 -5.936 136 HG SER 17 HG SER 17 -12.542 17.434 -5.790 137 H GLN 18 H GLN 18 -15.677 13.757 -6.015 138 HA GLN 18 HA GLN 18 -14.617 11.248 -5.145 139 1HB GLN 18 HB2 GLN 18 -17.485 12.219 -5.618 140 2HB GLN 18 HB3 GLN 18 -17.097 10.676 -4.875 141 1HG GLN 18 HG2 GLN 18 -16.277 13.382 -3.770 142 2HG GLN 18 HG3 GLN 18 -17.637 12.435 -3.212 143 1HE2 GLN 18 HE22 GLN 18 -14.607 13.228 -2.327 144 2HE2 GLN 18 HE21 GLN 18 -14.207 11.801 -1.373 145 H MET 19 H MET 19 -16.565 12.078 -8.067 146 HA MET 19 HA MET 19 -16.753 9.374 -9.030 147 1HB MET 19 HB2 MET 19 -16.961 12.076 -10.438 148 2HB MET 19 HB3 MET 19 -17.310 10.526 -11.218 149 1HG MET 19 HG2 MET 19 -19.166 10.088 -9.787 150 2HG MET 19 HG3 MET 19 -18.697 11.354 -8.665 151 1HE MET 19 HE1 MET 19 -20.403 10.528 -12.078 152 2HE MET 19 HE2 MET 19 -20.718 12.137 -12.761 153 3HE MET 19 HE3 MET 19 -19.051 11.532 -12.660 154 H ALA 20 H ALA 20 -14.450 12.071 -9.816 155 HA ALA 20 HA ALA 20 -12.863 10.684 -11.668 156 1HB ALA 20 HB1 ALA 20 -11.118 12.304 -11.097 157 2HB ALA 20 HB2 ALA 20 -12.687 13.125 -11.163 158 3HB ALA 20 HB3 ALA 20 -11.955 12.732 -9.595 159 H GLU 21 H GLU 21 -12.568 10.791 -8.082 160 HA GLU 21 HA GLU 21 -10.249 9.224 -7.834 161 1HB GLU 21 HB2 GLU 21 -11.123 10.489 -5.993 162 2HB GLU 21 HB3 GLU 21 -12.633 9.565 -5.973 163 1HG GLU 21 HG2 GLU 21 -11.457 7.545 -5.359 164 2HG GLU 21 HG3 GLU 21 -9.893 8.345 -5.475 165 H GLY 22 H GLY 22 -13.694 8.165 -7.999 166 1HA GLY 22 HA1 GLY 22 -13.273 5.419 -7.653 167 2HA GLY 22 HA2 GLY 22 -14.607 6.155 -8.547 168 H TRP 23 H TRP 23 -13.276 7.289 -10.823 169 HA TRP 23 HA TRP 23 -12.748 4.853 -12.343 170 1HB TRP 23 HB2 TRP 23 -12.307 7.785 -13.030 171 2HB TRP 23 HB3 TRP 23 -12.068 6.459 -14.153 172 HD1 TRP 23 HD1 TRP 23 -14.708 8.600 -12.593 173 HE1 TRP 23 HE1 TRP 23 -16.911 8.318 -13.797 174 HE3 TRP 23 HE3 TRP 23 -13.543 4.509 -15.447 175 HZ2 TRP 23 HZ2 TRP 23 -18.028 6.606 -15.831 176 HZ3 TRP 23 HZ3 TRP 23 -15.192 3.621 -17.073 177 HH2 TRP 23 HH2 TRP 23 -17.436 4.688 -17.287 178 H ALA 24 H ALA 24 -10.711 7.420 -10.910 179 HA ALA 24 HA ALA 24 -8.382 6.772 -12.334 180 1HB ALA 24 HB1 ALA 24 -8.767 8.042 -9.588 181 2HB ALA 24 HB2 ALA 24 -7.254 8.106 -10.524 182 3HB ALA 24 HB3 ALA 24 -8.720 8.894 -11.138 183 H LYS 25 H LYS 25 -9.606 5.479 -9.252 184 HA LYS 25 HA LYS 25 -7.388 3.889 -8.529 185 1HB LYS 25 HB2 LYS 25 -10.384 3.468 -8.212 186 2HB LYS 25 HB3 LYS 25 -9.198 2.352 -7.521 187 1HG LYS 25 HG2 LYS 25 -8.241 4.027 -6.110 188 2HG LYS 25 HG3 LYS 25 -9.101 5.332 -6.939 189 1HD LYS 25 HD2 LYS 25 -11.267 4.429 -6.159 190 2HD LYS 25 HD3 LYS 25 -10.411 3.150 -5.258 191 1HE LYS 25 HE2 LYS 25 -9.270 4.813 -3.876 192 2HE LYS 25 HE3 LYS 25 -9.852 6.121 -4.909 193 1HZ LYS 25 HZ1 LYS 25 -11.470 4.508 -3.045 194 2HZ LYS 25 HZ2 LYS 25 -11.210 6.151 -3.061 195 3HZ LYS 25 HZ3 LYS 25 -12.142 5.484 -4.206 196 H GLN 26 H GLN 26 -9.782 3.349 -11.102 197 HA GLN 26 HA GLN 26 -8.917 0.601 -11.584 198 1HB GLN 26 HB2 GLN 26 -10.339 2.419 -13.533 199 2HB GLN 26 HB3 GLN 26 -10.200 0.673 -13.577 200 1HG GLN 26 HG2 GLN 26 -11.611 0.561 -11.484 201 2HG GLN 26 HG3 GLN 26 -11.852 2.321 -11.616 202 1HE2 GLN 26 HE22 GLN 26 -12.188 2.894 -14.163 203 2HE2 GLN 26 HE21 GLN 26 -13.535 2.028 -14.883 204 H TYR 27 H TYR 27 -8.604 3.695 -13.344 205 HA TYR 27 HA TYR 27 -6.917 2.542 -15.340 206 1HB TYR 27 HB2 TYR 27 -7.538 5.452 -14.714 207 2HB TYR 27 HB3 TYR 27 -6.660 4.911 -16.135 208 HD1 TYR 27 HD1 TYR 27 -9.795 5.973 -15.153 209 HD2 TYR 27 HD2 TYR 27 -7.917 2.808 -17.408 210 HE1 TYR 27 HE1 TYR 27 -11.863 5.681 -16.470 211 HE2 TYR 27 HE2 TYR 27 -10.009 2.463 -18.680 212 HH TYR 27 HH TYR 27 -12.944 4.471 -18.155 213 H LEU 28 H LEU 28 -6.037 4.665 -12.534 214 HA LEU 28 HA LEU 28 -3.409 5.117 -13.672 215 1HB LEU 28 HB2 LEU 28 -4.455 5.647 -10.867 216 2HB LEU 28 HB3 LEU 28 -2.946 6.240 -11.534 217 HG LEU 28 HG LEU 28 -5.719 6.995 -12.491 218 1HD1 LEU 28 HD11 LEU 28 -4.940 7.982 -10.334 219 2HD1 LEU 28 HD12 LEU 28 -3.537 8.660 -11.185 220 3HD1 LEU 28 HD13 LEU 28 -5.179 9.189 -11.615 221 1HD2 LEU 28 HD21 LEU 28 -4.281 7.025 -14.451 222 2HD2 LEU 28 HD22 LEU 28 -4.578 8.679 -13.933 223 3HD2 LEU 28 HD23 LEU 28 -3.020 7.909 -13.564 224 H GLY 29 H GLY 29 -4.691 2.894 -11.234 225 1HA GLY 29 HA1 GLY 29 -3.821 0.766 -10.780 226 2HA GLY 29 HA2 GLY 29 -2.275 1.208 -11.508 227 H ASP 30 H ASP 30 -2.209 -0.116 -9.172 228 HA ASP 30 HA ASP 30 -2.577 1.413 -6.828 229 1HB ASP 30 HB2 ASP 30 -2.657 -1.075 -7.033 230 2HB ASP 30 HB3 ASP 30 -0.890 -1.072 -7.193 231 H GLU 31 H GLU 31 0.086 1.504 -9.007 232 HA GLU 31 HA GLU 31 2.259 2.196 -7.338 233 1HB GLU 31 HB2 GLU 31 1.601 3.742 -9.881 234 2HB GLU 31 HB3 GLU 31 3.171 3.412 -9.172 235 1HG GLU 31 HG2 GLU 31 2.707 0.924 -9.683 236 2HG GLU 31 HG3 GLU 31 1.328 1.506 -10.639 237 H TRP 32 H TRP 32 -0.742 3.849 -8.056 238 HA TRP 32 HA TRP 32 0.331 6.412 -7.013 239 1HB TRP 32 HB2 TRP 32 -2.324 5.808 -8.380 240 2HB TRP 32 HB3 TRP 32 -1.720 7.390 -7.946 241 HD1 TRP 32 HD1 TRP 32 -0.653 4.500 -10.311 242 HE1 TRP 32 HE1 TRP 32 -0.154 5.489 -12.604 243 HE3 TRP 32 HE3 TRP 32 -1.043 9.469 -9.155 244 HZ2 TRP 32 HZ2 TRP 32 -0.149 8.055 -13.847 245 HZ3 TRP 32 HZ3 TRP 32 -0.877 11.172 -10.959 246 HH2 TRP 32 HH2 TRP 32 -0.517 10.462 -13.308 247 H LYS 33 H LYS 33 -0.703 7.398 -5.278 248 HA LYS 33 HA LYS 33 -2.988 5.960 -3.997 249 1HB LYS 33 HB2 LYS 33 -0.575 7.115 -2.795 250 2HB LYS 33 HB3 LYS 33 -2.019 7.945 -2.222 251 1HG LYS 33 HG2 LYS 33 -1.440 6.058 -0.775 252 2HG LYS 33 HG3 LYS 33 -3.033 5.827 -1.495 253 1HD LYS 33 HD2 LYS 33 -0.707 4.664 -2.982 254 2HD LYS 33 HD3 LYS 33 -1.068 3.935 -1.413 255 1HE LYS 33 HE2 LYS 33 -3.177 3.160 -2.064 256 2HE LYS 33 HE3 LYS 33 -3.272 4.213 -3.481 257 1HZ LYS 33 HZ1 LYS 33 -1.198 2.126 -3.247 258 2HZ LYS 33 HZ2 LYS 33 -2.629 1.798 -3.935 259 3HZ LYS 33 HZ3 LYS 33 -1.652 2.945 -4.590 260 H VAL 34 H VAL 34 -4.858 6.911 -4.124 261 HA VAL 34 HA VAL 34 -4.907 9.583 -5.431 262 HB VAL 34 HB VAL 34 -5.146 8.001 -7.135 263 1HG1 VAL 34 HG11 VAL 34 -7.259 6.491 -5.579 264 2HG1 VAL 34 HG12 VAL 34 -6.771 6.200 -7.268 265 3HG1 VAL 34 HG13 VAL 34 -5.618 5.918 -5.966 266 1HG2 VAL 34 HG21 VAL 34 -6.805 9.909 -7.083 267 2HG2 VAL 34 HG22 VAL 34 -7.230 8.511 -8.080 268 3HG2 VAL 34 HG23 VAL 34 -8.010 8.752 -6.505 269 H TYR 35 H TYR 35 -6.113 11.023 -4.533 270 HA TYR 35 HA TYR 35 -8.358 10.267 -2.779 271 1HB TYR 35 HB2 TYR 35 -6.799 12.545 -1.747 272 2HB TYR 35 HB3 TYR 35 -7.645 11.284 -0.900 273 HD1 TYR 35 HD1 TYR 35 -4.460 12.550 -2.043 274 HD2 TYR 35 HD2 TYR 35 -6.437 9.039 -0.501 275 HE1 TYR 35 HE1 TYR 35 -2.303 11.722 -1.193 276 HE2 TYR 35 HE2 TYR 35 -4.262 8.161 0.298 277 HH TYR 35 HH TYR 35 -1.977 8.596 0.560 278 H SER 36 H SER 36 -9.591 12.353 -2.206 279 HA SER 36 HA SER 36 -9.579 14.281 -4.458 280 1HB SER 36 HB2 SER 36 -12.128 13.977 -4.300 281 2HB SER 36 HB3 SER 36 -11.215 12.668 -5.073 282 HG SER 36 HG SER 36 -11.458 11.423 -3.286 283 H ALA 37 H ALA 37 -9.995 16.356 -3.904 284 HA ALA 37 HA ALA 37 -11.299 16.974 -1.329 285 1HB ALA 37 HB1 ALA 37 -9.724 18.714 -0.930 286 2HB ALA 37 HB2 ALA 37 -8.946 17.136 -0.912 287 3HB ALA 37 HB3 ALA 37 -8.729 18.217 -2.327 288 H GLY 38 H GLY 38 -11.502 19.610 -1.503 289 1HA GLY 38 HA1 GLY 38 -11.861 20.667 -4.128 290 2HA GLY 38 HA2 GLY 38 -13.419 20.294 -3.367 291 H ILE 39 H ILE 39 -13.084 22.808 -3.919 292 HA ILE 39 HA ILE 39 -11.951 24.573 -1.981 293 HB ILE 39 HB ILE 39 -14.319 24.675 -3.877 294 1HG1 ILE 39 HG12 ILE 39 -13.070 26.528 -4.927 295 2HG1 ILE 39 HG13 ILE 39 -11.793 26.369 -3.721 296 1HG2 ILE 39 HG21 ILE 39 -13.576 26.920 -1.973 297 2HG2 ILE 39 HG22 ILE 39 -14.666 27.065 -3.371 298 3HG2 ILE 39 HG23 ILE 39 -15.117 26.024 -2.031 299 1HD1 ILE 39 HD11 ILE 39 -11.169 24.174 -4.667 300 2HD1 ILE 39 HD12 ILE 39 -12.532 24.282 -5.814 301 3HD1 ILE 39 HD13 ILE 39 -11.199 25.419 -5.919 302 H GLU 40 H GLU 40 -15.017 22.732 -2.128 303 HA GLU 40 HA GLU 40 -15.043 22.665 0.791 304 1HB GLU 40 HB2 GLU 40 -17.362 23.317 1.023 305 2HB GLU 40 HB3 GLU 40 -16.422 24.627 0.328 306 1HG GLU 40 HG2 GLU 40 -17.291 24.091 -1.928 307 2HG GLU 40 HG3 GLU 40 -18.207 22.729 -1.275 308 H ALA 41 H ALA 41 -17.071 21.207 1.398 309 HA ALA 41 HA ALA 41 -17.755 19.122 -0.556 310 1HB ALA 41 HB1 ALA 41 -15.734 18.224 0.575 311 2HB ALA 41 HB2 ALA 41 -16.461 18.563 2.161 312 3HB ALA 41 HB3 ALA 41 -17.199 17.356 1.093 313 H HIS 42 H HIS 42 -19.779 18.210 0.024 314 HA HIS 42 HA HIS 42 -21.147 19.302 2.440 315 1HB HIS 42 HB2 HIS 42 -23.155 19.593 1.155 316 2HB HIS 42 HB3 HIS 42 -21.849 20.488 0.403 317 HD1 HIS 42 HD1 HIS 42 -23.997 17.343 -0.197 318 HD2 HIS 42 HD2 HIS 42 -21.298 19.917 -2.141 319 HE1 HIS 42 HE1 HIS 42 -24.149 16.795 -2.674 320 H GLY 43 H GLY 43 -19.808 16.597 1.425 321 1HA GLY 43 HA1 GLY 43 -20.397 14.602 2.868 322 2HA GLY 43 HA2 GLY 43 -22.009 14.723 2.137 323 H LEU 44 H LEU 44 -21.223 12.426 1.491 324 HA LEU 44 HA LEU 44 -19.725 12.477 -1.097 325 1HB LEU 44 HB2 LEU 44 -19.064 10.665 0.336 326 2HB LEU 44 HB3 LEU 44 -20.744 10.242 0.701 327 HG LEU 44 HG LEU 44 -21.144 9.414 -1.477 328 1HD1 LEU 44 HD11 LEU 44 -19.900 10.925 -2.949 329 2HD1 LEU 44 HD12 LEU 44 -18.367 10.383 -2.229 330 3HD1 LEU 44 HD13 LEU 44 -19.335 9.278 -3.220 331 1HD2 LEU 44 HD21 LEU 44 -19.572 7.528 -1.513 332 2HD2 LEU 44 HD22 LEU 44 -18.403 8.461 -0.573 333 3HD2 LEU 44 HD23 LEU 44 -19.933 7.960 0.168 334 H ASN 45 H ASN 45 -21.096 13.168 -2.748 335 HA ASN 45 HA ASN 45 -23.874 13.497 -2.280 336 1HB ASN 45 HB2 ASN 45 -22.455 14.819 -3.874 337 2HB ASN 45 HB3 ASN 45 -22.501 13.457 -4.996 338 1HD2 ASN 45 HD22 ASN 45 -23.648 16.282 -5.148 339 2HD2 ASN 45 HD21 ASN 45 -25.361 16.058 -5.434 340 HA PRO 46 HA PRO 46 -25.188 9.221 -3.122 341 1HB PRO 46 HB2 PRO 46 -27.772 10.675 -3.715 342 2HB PRO 46 HB3 PRO 46 -27.520 9.155 -2.799 343 1HG PRO 46 HG2 PRO 46 -27.915 11.489 -1.478 344 2HG PRO 46 HG3 PRO 46 -26.646 10.350 -0.919 345 1HD PRO 46 HD2 PRO 46 -26.317 12.853 -2.588 346 2HD PRO 46 HD3 PRO 46 -25.330 12.273 -1.214 347 H ASN 47 H ASN 47 -25.829 11.976 -5.356 348 HA ASN 47 HA ASN 47 -26.436 10.365 -7.639 349 1HB ASN 47 HB2 ASN 47 -26.691 12.296 -8.689 350 2HB ASN 47 HB3 ASN 47 -26.392 13.116 -7.177 351 1HD2 ASN 47 HD22 ASN 47 -25.339 12.720 -10.440 352 2HD2 ASN 47 HD21 ASN 47 -23.774 13.483 -10.280 353 H ALA 48 H ALA 48 -23.327 11.398 -6.196 354 HA ALA 48 HA ALA 48 -21.735 10.539 -8.442 355 1HB ALA 48 HB1 ALA 48 -20.957 10.968 -5.512 356 2HB ALA 48 HB2 ALA 48 -19.847 10.797 -6.873 357 3HB ALA 48 HB3 ALA 48 -20.932 12.198 -6.792 358 H VAL 49 H VAL 49 -22.799 9.100 -5.325 359 HA VAL 49 HA VAL 49 -21.342 6.678 -5.602 360 HB VAL 49 HB VAL 49 -23.986 7.034 -4.143 361 1HG1 VAL 49 HG11 VAL 49 -21.696 5.019 -3.899 362 2HG1 VAL 49 HG12 VAL 49 -23.063 5.144 -2.766 363 3HG1 VAL 49 HG13 VAL 49 -23.347 4.672 -4.443 364 1HG2 VAL 49 HG21 VAL 49 -22.519 7.387 -2.132 365 2HG2 VAL 49 HG22 VAL 49 -21.113 7.465 -3.217 366 3HG2 VAL 49 HG23 VAL 49 -22.386 8.693 -3.301 367 H LYS 50 H LYS 50 -24.768 7.462 -6.559 368 HA LYS 50 HA LYS 50 -25.119 4.864 -7.642 369 1HB LYS 50 HB2 LYS 50 -26.934 6.557 -6.988 370 2HB LYS 50 HB3 LYS 50 -26.678 7.297 -8.583 371 1HG LYS 50 HG2 LYS 50 -27.139 5.055 -9.637 372 2HG LYS 50 HG3 LYS 50 -27.396 4.369 -8.027 373 1HD LYS 50 HD2 LYS 50 -29.303 5.922 -7.677 374 2HD LYS 50 HD3 LYS 50 -29.046 6.584 -9.307 375 1HE LYS 50 HE2 LYS 50 -29.430 4.335 -10.285 376 2HE LYS 50 HE3 LYS 50 -29.683 3.670 -8.667 377 1HZ LYS 50 HZ1 LYS 50 -31.621 5.114 -8.447 378 2HZ LYS 50 HZ2 LYS 50 -31.390 5.729 -9.945 379 3HZ LYS 50 HZ3 LYS 50 -31.777 4.159 -9.754 380 H ALA 51 H ALA 51 -24.056 7.930 -9.235 381 HA ALA 51 HA ALA 51 -24.097 6.989 -11.869 382 1HB ALA 51 HB1 ALA 51 -22.091 8.907 -10.582 383 2HB ALA 51 HB2 ALA 51 -22.375 8.728 -12.323 384 3HB ALA 51 HB3 ALA 51 -23.668 9.359 -11.280 385 H MET 52 H MET 52 -21.427 6.713 -9.444 386 HA MET 52 HA MET 52 -19.734 5.257 -11.273 387 1HB MET 52 HB2 MET 52 -19.706 5.697 -8.269 388 2HB MET 52 HB3 MET 52 -18.403 4.939 -9.184 389 1HG MET 52 HG2 MET 52 -19.394 7.795 -9.452 390 2HG MET 52 HG3 MET 52 -17.852 7.265 -8.800 391 1HE MET 52 HE1 MET 52 -16.858 5.115 -10.648 392 2HE MET 52 HE2 MET 52 -15.996 5.904 -11.957 393 3HE MET 52 HE3 MET 52 -15.770 6.473 -10.294 394 H LYS 53 H LYS 53 -22.018 4.309 -8.647 395 HA LYS 53 HA LYS 53 -21.234 1.595 -8.585 396 1HB LYS 53 HB2 LYS 53 -22.497 2.741 -6.803 397 2HB LYS 53 HB3 LYS 53 -23.923 2.826 -7.855 398 1HG LYS 53 HG2 LYS 53 -24.078 0.369 -7.870 399 2HG LYS 53 HG3 LYS 53 -22.572 0.249 -6.933 400 1HD LYS 53 HD2 LYS 53 -23.648 1.391 -5.022 401 2HD LYS 53 HD3 LYS 53 -25.105 1.661 -5.982 402 1HE LYS 53 HE2 LYS 53 -25.538 -0.180 -4.516 403 2HE LYS 53 HE3 LYS 53 -25.458 -0.792 -6.167 404 1HZ LYS 53 HZ1 LYS 53 -23.216 -1.599 -5.686 405 2HZ LYS 53 HZ2 LYS 53 -23.279 -0.995 -4.162 406 3HZ LYS 53 HZ3 LYS 53 -24.269 -2.205 -4.608 407 H GLU 54 H GLU 54 -23.612 3.274 -10.636 408 HA GLU 54 HA GLU 54 -24.667 0.958 -11.894 409 1HB GLU 54 HB2 GLU 54 -24.454 3.886 -12.677 410 2HB GLU 54 HB3 GLU 54 -25.176 2.708 -13.772 411 1HG GLU 54 HG2 GLU 54 -26.116 3.125 -10.907 412 2HG GLU 54 HG3 GLU 54 -26.792 3.965 -12.298 413 H VAL 55 H VAL 55 -21.522 2.454 -12.257 414 HA VAL 55 HA VAL 55 -20.966 0.996 -14.773 415 HB VAL 55 HB VAL 55 -19.253 2.864 -13.071 416 1HG1 VAL 55 HG11 VAL 55 -17.793 3.053 -15.051 417 2HG1 VAL 55 HG12 VAL 55 -17.764 1.436 -14.381 418 3HG1 VAL 55 HG13 VAL 55 -18.709 1.757 -15.855 419 1HG2 VAL 55 HG21 VAL 55 -19.635 4.479 -14.901 420 2HG2 VAL 55 HG22 VAL 55 -20.746 3.338 -15.691 421 3HG2 VAL 55 HG23 VAL 55 -21.159 4.056 -14.126 422 H GLY 56 H GLY 56 -21.058 0.304 -11.442 423 1HA GLY 56 HA1 GLY 56 -20.501 -1.731 -10.469 424 2HA GLY 56 HA2 GLY 56 -19.310 -2.062 -11.734 425 H ILE 57 H ILE 57 -19.308 1.142 -10.247 426 HA ILE 57 HA ILE 57 -16.828 0.458 -8.739 427 HB ILE 57 HB ILE 57 -17.534 3.037 -10.175 428 1HG1 ILE 57 HG12 ILE 57 -15.581 0.833 -10.972 429 2HG1 ILE 57 HG13 ILE 57 -17.064 1.287 -11.817 430 1HG2 ILE 57 HG21 ILE 57 -15.254 3.738 -9.572 431 2HG2 ILE 57 HG22 ILE 57 -16.087 3.250 -8.105 432 3HG2 ILE 57 HG23 ILE 57 -14.917 2.151 -8.853 433 1HD1 ILE 57 HD11 ILE 57 -15.311 2.250 -13.051 434 2HD1 ILE 57 HD12 ILE 57 -16.073 3.581 -12.190 435 3HD1 ILE 57 HD13 ILE 57 -14.513 2.919 -11.615 436 H ASP 58 H ASP 58 -17.791 0.078 -6.813 437 HA ASP 58 HA ASP 58 -19.946 1.739 -5.777 438 1HB ASP 58 HB2 ASP 58 -20.015 0.231 -3.929 439 2HB ASP 58 HB3 ASP 58 -19.985 -0.671 -5.435 440 H ILE 59 H ILE 59 -18.708 3.762 -5.908 441 HA ILE 59 HA ILE 59 -16.499 4.227 -4.130 442 HB ILE 59 HB ILE 59 -16.714 6.529 -4.630 443 1HG1 ILE 59 HG12 ILE 59 -19.309 6.113 -6.124 444 2HG1 ILE 59 HG13 ILE 59 -19.259 6.639 -4.445 445 1HG2 ILE 59 HG21 ILE 59 -16.441 6.533 -7.021 446 2HG2 ILE 59 HG22 ILE 59 -15.768 5.034 -6.367 447 3HG2 ILE 59 HG23 ILE 59 -17.353 5.019 -7.177 448 1HD1 ILE 59 HD11 ILE 59 -17.811 8.564 -5.087 449 2HD1 ILE 59 HD12 ILE 59 -18.084 8.162 -6.793 450 3HD1 ILE 59 HD13 ILE 59 -19.449 8.611 -5.749 451 H SER 60 H SER 60 -19.550 3.389 -3.203 452 HA SER 60 HA SER 60 -20.490 5.193 -1.395 453 1HB SER 60 HB2 SER 60 -20.463 2.245 -0.756 454 2HB SER 60 HB3 SER 60 -21.799 3.400 -0.654 455 HG SER 60 HG SER 60 -22.045 1.961 -2.408 456 H ASN 61 H ASN 61 -17.672 3.103 -1.039 457 HA ASN 61 HA ASN 61 -17.414 3.360 1.820 458 1HB ASN 61 HB2 ASN 61 -16.601 1.398 0.519 459 2HB ASN 61 HB3 ASN 61 -15.429 2.436 -0.297 460 1HD2 ASN 61 HD22 ASN 61 -13.376 2.164 0.579 461 2HD2 ASN 61 HD21 ASN 61 -13.044 1.865 2.262 462 H GLN 62 H GLN 62 -16.626 5.508 -0.795 463 HA GLN 62 HA GLN 62 -14.261 6.691 0.347 464 1HB GLN 62 HB2 GLN 62 -16.165 7.743 -1.787 465 2HB GLN 62 HB3 GLN 62 -14.592 8.430 -1.350 466 1HG GLN 62 HG2 GLN 62 -13.465 6.352 -2.006 467 2HG GLN 62 HG3 GLN 62 -15.004 5.653 -2.505 468 1HE2 GLN 62 HE22 GLN 62 -15.119 8.964 -3.458 469 2HE2 GLN 62 HE21 GLN 62 -14.621 8.674 -5.122 470 H THR 63 H THR 63 -14.422 9.179 0.754 471 HA THR 63 HA THR 63 -16.931 10.209 1.696 472 HB THR 63 HB THR 63 -15.695 11.077 3.844 473 HG1 THR 63 HG1 THR 63 -13.668 10.141 3.427 474 1HG2 THR 63 HG21 THR 63 -17.679 9.504 3.783 475 2HG2 THR 63 HG22 THR 63 -16.530 8.155 3.875 476 3HG2 THR 63 HG23 THR 63 -16.615 9.340 5.192 477 H SER 64 H SER 64 -16.769 12.597 1.947 478 HA SER 64 HA SER 64 -14.707 13.695 0.147 479 1HB SER 64 HB2 SER 64 -17.289 14.880 1.218 480 2HB SER 64 HB3 SER 64 -16.268 15.546 -0.071 481 HG SER 64 HG SER 64 -18.245 14.132 -0.517 482 H ASP 65 H ASP 65 -13.687 15.658 0.691 483 HA ASP 65 HA ASP 65 -13.682 16.722 3.413 484 1HB ASP 65 HB2 ASP 65 -11.905 14.835 3.282 485 2HB ASP 65 HB3 ASP 65 -11.071 15.859 2.097 486 H ILE 66 H ILE 66 -12.357 18.808 3.391 487 HA ILE 66 HA ILE 66 -12.426 20.068 0.707 488 HB ILE 66 HB ILE 66 -12.601 22.123 1.759 489 1HG1 ILE 66 HG12 ILE 66 -11.927 20.787 4.407 490 2HG1 ILE 66 HG13 ILE 66 -10.950 21.974 3.518 491 1HG2 ILE 66 HG21 ILE 66 -14.315 20.358 3.559 492 2HG2 ILE 66 HG22 ILE 66 -14.712 21.943 2.880 493 3HG2 ILE 66 HG23 ILE 66 -14.608 20.516 1.825 494 1HD1 ILE 66 HD11 ILE 66 -13.600 22.435 4.917 495 2HD1 ILE 66 HD12 ILE 66 -12.023 23.152 5.296 496 3HD1 ILE 66 HD13 ILE 66 -12.874 23.612 3.795 497 H ILE 67 H ILE 67 -10.514 21.472 0.224 498 HA ILE 67 HA ILE 67 -8.324 19.798 0.070 499 HB ILE 67 HB ILE 67 -8.877 21.404 -1.560 500 1HG1 ILE 67 HG12 ILE 67 -6.530 20.542 -1.280 501 2HG1 ILE 67 HG13 ILE 67 -6.808 21.892 -2.353 502 1HG2 ILE 67 HG21 ILE 67 -8.085 23.625 0.348 503 2HG2 ILE 67 HG22 ILE 67 -8.380 23.809 -1.394 504 3HG2 ILE 67 HG23 ILE 67 -9.697 23.304 -0.334 505 1HD1 ILE 67 HD11 ILE 67 -5.703 22.305 0.443 506 2HD1 ILE 67 HD12 ILE 67 -4.729 22.125 -1.021 507 3HD1 ILE 67 HD13 ILE 67 -5.848 23.488 -0.864 508 H ASP 68 H ASP 68 -6.559 19.347 1.017 509 HA ASP 68 HA ASP 68 -5.681 20.840 3.439 510 1HB ASP 68 HB2 ASP 68 -6.452 18.616 4.040 511 2HB ASP 68 HB3 ASP 68 -5.460 17.885 2.773 512 H SER 69 H SER 69 -3.940 22.032 2.880 513 HA SER 69 HA SER 69 -2.626 21.779 0.401 514 1HB SER 69 HB2 SER 69 -1.044 23.487 1.614 515 2HB SER 69 HB3 SER 69 -2.710 23.923 1.202 516 HG SER 69 HG SER 69 -2.159 24.489 3.359 517 H ASP 70 H ASP 70 -2.022 20.068 3.416 518 HA ASP 70 HA ASP 70 0.783 19.654 3.009 519 1HB ASP 70 HB2 ASP 70 -0.271 19.253 5.181 520 2HB ASP 70 HB3 ASP 70 -1.255 17.958 4.485 521 H ILE 71 H ILE 71 -2.117 17.856 1.975 522 HA ILE 71 HA ILE 71 -0.623 15.692 0.737 523 HB ILE 71 HB ILE 71 -3.504 16.597 0.345 524 1HG1 ILE 71 HG12 ILE 71 -2.281 14.257 1.882 525 2HG1 ILE 71 HG13 ILE 71 -2.944 15.723 2.614 526 1HG2 ILE 71 HG21 ILE 71 -2.102 14.063 -0.651 527 2HG2 ILE 71 HG22 ILE 71 -3.837 14.431 -0.810 528 3HG2 ILE 71 HG23 ILE 71 -2.669 15.396 -1.677 529 1HD1 ILE 71 HD11 ILE 71 -4.591 14.014 2.842 530 2HD1 ILE 71 HD12 ILE 71 -5.188 15.144 1.609 531 3HD1 ILE 71 HD13 ILE 71 -4.496 13.569 1.134 532 H LEU 72 H LEU 72 -2.236 18.665 -0.419 533 HA LEU 72 HA LEU 72 -1.749 18.533 -3.129 534 1HB LEU 72 HB2 LEU 72 -3.036 20.282 -1.857 535 2HB LEU 72 HB3 LEU 72 -1.508 20.924 -1.272 536 HG LEU 72 HG LEU 72 -0.937 21.252 -3.825 537 1HD1 LEU 72 HD11 LEU 72 -3.006 20.079 -4.636 538 2HD1 LEU 72 HD12 LEU 72 -3.997 21.312 -3.839 539 3HD1 LEU 72 HD13 LEU 72 -2.920 21.769 -5.173 540 1HD2 LEU 72 HD21 LEU 72 -2.923 22.977 -2.284 541 2HD2 LEU 72 HD22 LEU 72 -1.156 23.056 -2.178 542 3HD2 LEU 72 HD23 LEU 72 -1.958 23.504 -3.692 543 H ASN 73 H ASN 73 0.479 19.919 -0.661 544 HA ASN 73 HA ASN 73 2.498 20.613 -2.538 545 1HB ASN 73 HB2 ASN 73 2.359 20.427 0.496 546 2HB ASN 73 HB3 ASN 73 3.913 20.657 -0.274 547 1HD2 ASN 73 HD22 ASN 73 0.738 22.179 0.194 548 2HD2 ASN 73 HD21 ASN 73 1.259 23.781 -0.312 549 H ASN 74 H ASN 74 1.757 17.441 -1.451 550 HA ASN 74 HA ASN 74 4.483 16.598 -2.279 551 1HB ASN 74 HB2 ASN 74 4.826 15.108 -0.635 552 2HB ASN 74 HB3 ASN 74 4.082 16.422 0.277 553 1HD2 ASN 74 HD22 ASN 74 1.686 16.095 0.864 554 2HD2 ASN 74 HD21 ASN 74 1.188 14.437 1.123 555 H ALA 75 H ALA 75 1.413 16.641 -3.321 556 HA ALA 75 HA ALA 75 1.128 13.941 -4.208 557 1HB ALA 75 HB1 ALA 75 0.054 16.525 -5.400 558 2HB ALA 75 HB2 ALA 75 -0.508 14.877 -5.770 559 3HB ALA 75 HB3 ALA 75 -0.751 15.548 -4.151 560 H ASP 76 H ASP 76 1.601 13.172 -6.464 561 HA ASP 76 HA ASP 76 4.061 14.375 -7.620 562 1HB ASP 76 HB2 ASP 76 3.755 11.904 -7.679 563 2HB ASP 76 HB3 ASP 76 2.294 12.121 -8.658 564 H LEU 77 H LEU 77 0.550 14.219 -8.069 565 HA LEU 77 HA LEU 77 0.636 16.384 -10.074 566 1HB LEU 77 HB2 LEU 77 0.630 14.395 -11.392 567 2HB LEU 77 HB3 LEU 77 -0.581 13.627 -10.357 568 HG LEU 77 HG LEU 77 -2.265 15.311 -11.155 569 1HD1 LEU 77 HD11 LEU 77 -1.840 16.553 -13.214 570 2HD1 LEU 77 HD12 LEU 77 -0.678 17.065 -11.998 571 3HD1 LEU 77 HD13 LEU 77 -0.183 15.947 -13.292 572 1HD2 LEU 77 HD21 LEU 77 -2.152 13.043 -12.080 573 2HD2 LEU 77 HD22 LEU 77 -2.610 14.201 -13.334 574 3HD2 LEU 77 HD23 LEU 77 -0.952 13.563 -13.272 575 H VAL 78 H VAL 78 -1.130 17.655 -10.034 576 HA VAL 78 HA VAL 78 -3.392 17.046 -8.190 577 HB VAL 78 HB VAL 78 -1.893 19.664 -8.685 578 1HG1 VAL 78 HG11 VAL 78 -3.475 20.751 -7.154 579 2HG1 VAL 78 HG12 VAL 78 -4.321 20.130 -8.561 580 3HG1 VAL 78 HG13 VAL 78 -4.415 19.244 -7.021 581 1HG2 VAL 78 HG21 VAL 78 -0.857 18.122 -6.995 582 2HG2 VAL 78 HG22 VAL 78 -1.336 19.688 -6.356 583 3HG2 VAL 78 HG23 VAL 78 -2.334 18.235 -6.037 584 H VAL 79 H VAL 79 -5.418 17.481 -9.283 585 HA VAL 79 HA VAL 79 -5.160 19.067 -11.731 586 HB VAL 79 HB VAL 79 -6.524 17.757 -13.141 587 1HG1 VAL 79 HG11 VAL 79 -4.415 15.856 -12.054 588 2HG1 VAL 79 HG12 VAL 79 -5.078 15.927 -13.703 589 3HG1 VAL 79 HG13 VAL 79 -4.077 17.254 -13.093 590 1HG2 VAL 79 HG21 VAL 79 -8.006 16.657 -11.580 591 2HG2 VAL 79 HG22 VAL 79 -7.253 15.467 -12.642 592 3HG2 VAL 79 HG23 VAL 79 -6.667 15.646 -10.966 593 H THR 80 H THR 80 -6.722 20.549 -11.960 594 HA THR 80 HA THR 80 -8.830 20.474 -9.862 595 HB THR 80 HB THR 80 -9.170 22.782 -10.163 596 HG1 THR 80 HG1 THR 80 -8.825 23.073 -12.330 597 1HG2 THR 80 HG21 THR 80 -7.110 21.905 -8.831 598 2HG2 THR 80 HG22 THR 80 -6.143 22.511 -10.182 599 3HG2 THR 80 HG23 THR 80 -7.162 23.612 -9.226 600 H LEU 81 H LEU 81 -10.682 19.657 -10.487 601 HA LEU 81 HA LEU 81 -10.956 18.766 -13.219 602 1HB LEU 81 HB2 LEU 81 -12.766 18.495 -10.792 603 2HB LEU 81 HB3 LEU 81 -13.014 17.651 -12.315 604 HG LEU 81 HG LEU 81 -10.507 17.355 -10.583 605 1HD1 LEU 81 HD11 LEU 81 -12.433 16.550 -9.357 606 2HD1 LEU 81 HD12 LEU 81 -12.956 15.570 -10.753 607 3HD1 LEU 81 HD13 LEU 81 -11.441 15.191 -9.902 608 1HD2 LEU 81 HD21 LEU 81 -11.540 15.767 -12.964 609 2HD2 LEU 81 HD22 LEU 81 -10.069 16.767 -12.906 610 3HD2 LEU 81 HD23 LEU 81 -10.176 15.286 -11.952 611 H CYS 82 H CYS 82 -11.539 21.842 -12.103 612 HA CYS 82 HA CYS 82 -13.271 22.306 -14.313 613 1HB CYS 82 HB2 CYS 82 -15.091 23.415 -13.213 614 2HB CYS 82 HB3 CYS 82 -14.926 21.796 -12.508 615 HG CYS 82 HG CYS 82 -13.559 22.504 -10.445 616 H GLY 83 H GLY 83 -13.447 24.710 -14.705 617 1HA GLY 83 HA1 GLY 83 -10.797 25.707 -14.664 618 2HA GLY 83 HA2 GLY 83 -12.239 26.559 -15.247 619 H ASP 84 H ASP 84 -13.725 26.660 -12.753 620 HA ASP 84 HA ASP 84 -12.463 28.968 -11.606 621 1HB ASP 84 HB2 ASP 84 -14.913 28.634 -11.664 622 2HB ASP 84 HB3 ASP 84 -14.759 27.316 -10.500 623 H ALA 85 H ALA 85 -12.584 25.532 -10.630 624 HA ALA 85 HA ALA 85 -11.425 25.918 -8.043 625 1HB ALA 85 HB1 ALA 85 -12.597 23.848 -8.593 626 2HB ALA 85 HB2 ALA 85 -11.396 23.464 -9.854 627 3HB ALA 85 HB3 ALA 85 -10.927 23.487 -8.141 628 H ALA 86 H ALA 86 -9.994 26.068 -11.227 629 HA ALA 86 HA ALA 86 -7.373 25.196 -10.613 630 1HB ALA 86 HB1 ALA 86 -8.184 27.328 -12.603 631 2HB ALA 86 HB2 ALA 86 -6.724 26.329 -12.628 632 3HB ALA 86 HB3 ALA 86 -8.316 25.566 -12.884 633 H ASP 87 H ASP 87 -9.032 28.178 -9.725 634 HA ASP 87 HA ASP 87 -6.740 29.745 -9.075 635 1HB ASP 87 HB2 ASP 87 -9.016 30.673 -9.226 636 2HB ASP 87 HB3 ASP 87 -9.522 29.680 -7.851 637 H LYS 88 H LYS 88 -8.390 27.086 -7.416 638 HA LYS 88 HA LYS 88 -7.051 27.671 -4.857 639 1HB LYS 88 HB2 LYS 88 -9.513 26.976 -5.109 640 2HB LYS 88 HB3 LYS 88 -8.915 25.360 -5.489 641 1HG LYS 88 HG2 LYS 88 -9.508 25.401 -3.194 642 2HG LYS 88 HG3 LYS 88 -7.743 25.366 -3.236 643 1HD LYS 88 HD2 LYS 88 -7.631 27.755 -2.709 644 2HD LYS 88 HD3 LYS 88 -9.393 27.918 -2.906 645 1HE LYS 88 HE2 LYS 88 -9.742 26.334 -1.042 646 2HE LYS 88 HE3 LYS 88 -7.992 26.189 -0.824 647 1HZ LYS 88 HZ1 LYS 88 -8.948 27.776 0.734 648 2HZ LYS 88 HZ2 LYS 88 -7.937 28.561 -0.271 649 3HZ LYS 88 HZ3 LYS 88 -9.554 28.690 -0.469 650 H CYS 89 H CYS 89 -5.022 27.400 -6.224 651 HA CYS 89 HA CYS 89 -3.982 24.668 -5.594 652 1HB CYS 89 HB2 CYS 89 -3.001 26.450 -7.864 653 2HB CYS 89 HB3 CYS 89 -2.360 24.870 -7.385 654 HG CYS 89 HG CYS 89 -5.222 25.752 -8.742 655 HA PRO 90 HA PRO 90 -2.641 28.182 -2.823 656 1HB PRO 90 HB2 PRO 90 -1.933 25.729 -1.200 657 2HB PRO 90 HB3 PRO 90 -2.521 27.325 -0.632 658 1HG PRO 90 HG2 PRO 90 -4.205 25.201 -0.929 659 2HG PRO 90 HG3 PRO 90 -4.720 26.864 -1.342 660 1HD PRO 90 HD2 PRO 90 -4.053 24.624 -3.190 661 2HD PRO 90 HD3 PRO 90 -5.093 26.048 -3.409 662 H MET 91 H MET 91 -0.663 25.208 -3.251 663 HA MET 91 HA MET 91 1.394 26.659 -4.562 664 1HB MET 91 HB2 MET 91 1.763 26.799 -1.828 665 2HB MET 91 HB3 MET 91 2.572 25.278 -2.164 666 1HG MET 91 HG2 MET 91 3.137 27.968 -3.470 667 2HG MET 91 HG3 MET 91 4.086 27.219 -2.192 668 1HE MET 91 HE1 MET 91 6.317 27.621 -3.503 669 2HE MET 91 HE2 MET 91 6.572 27.142 -5.195 670 3HE MET 91 HE3 MET 91 5.392 28.412 -4.802 671 H THR 92 H THR 92 2.440 25.165 -5.923 672 HA THR 92 HA THR 92 2.267 22.276 -5.265 673 HB THR 92 HB THR 92 1.741 21.810 -7.651 674 HG1 THR 92 HG1 THR 92 2.348 23.924 -8.409 675 1HG2 THR 92 HG21 THR 92 -0.609 22.179 -7.509 676 2HG2 THR 92 HG22 THR 92 -0.016 21.808 -5.889 677 3HG2 THR 92 HG23 THR 92 -0.411 23.487 -6.321 678 HA PRO 93 HA PRO 93 6.523 23.934 -6.032 679 1HB PRO 93 HB2 PRO 93 7.867 22.308 -4.239 680 2HB PRO 93 HB3 PRO 93 7.017 23.815 -3.784 681 1HG PRO 93 HG2 PRO 93 5.991 20.966 -3.631 682 2HG PRO 93 HG3 PRO 93 5.937 22.232 -2.362 683 1HD PRO 93 HD2 PRO 93 3.806 21.729 -3.946 684 2HD PRO 93 HD3 PRO 93 4.212 23.405 -3.485 685 HA PRO 94 HA PRO 94 7.976 21.392 -9.119 686 1HB PRO 94 HB2 PRO 94 10.542 20.755 -7.644 687 2HB PRO 94 HB3 PRO 94 10.324 21.215 -9.365 688 1HG PRO 94 HG2 PRO 94 11.040 23.097 -7.566 689 2HG PRO 94 HG3 PRO 94 9.757 23.465 -8.766 690 1HD PRO 94 HD2 PRO 94 9.461 22.710 -5.863 691 2HD PRO 94 HD3 PRO 94 8.565 23.928 -6.816 692 H HIS 95 H HIS 95 8.069 19.535 -6.090 693 HA HIS 95 HA HIS 95 8.367 16.912 -7.238 694 1HB HIS 95 HB2 HIS 95 8.484 17.392 -4.809 695 2HB HIS 95 HB3 HIS 95 6.786 17.870 -4.805 696 HD1 HIS 95 HD1 HIS 95 4.987 15.720 -5.382 697 HD2 HIS 95 HD2 HIS 95 9.024 14.850 -4.496 698 HE1 HIS 95 HE1 HIS 95 5.080 13.258 -4.793 699 H VAL 96 H VAL 96 5.674 19.159 -6.859 700 HA VAL 96 HA VAL 96 3.590 17.324 -7.775 701 HB VAL 96 HB VAL 96 3.346 20.284 -7.064 702 1HG1 VAL 96 HG11 VAL 96 1.481 17.901 -6.806 703 2HG1 VAL 96 HG12 VAL 96 1.110 19.546 -6.258 704 3HG1 VAL 96 HG13 VAL 96 1.337 19.234 -7.978 705 1HG2 VAL 96 HG21 VAL 96 2.860 19.776 -4.750 706 2HG2 VAL 96 HG22 VAL 96 3.364 18.101 -4.967 707 3HG2 VAL 96 HG23 VAL 96 4.538 19.422 -5.122 708 H LYS 97 H LYS 97 2.273 17.931 -9.598 709 HA LYS 97 HA LYS 97 3.155 20.096 -11.369 710 1HB LYS 97 HB2 LYS 97 3.345 18.792 -13.326 711 2HB LYS 97 HB3 LYS 97 4.281 17.943 -12.103 712 1HG LYS 97 HG2 LYS 97 1.910 16.620 -11.853 713 2HG LYS 97 HG3 LYS 97 1.789 17.133 -13.544 714 1HD LYS 97 HD2 LYS 97 4.107 16.130 -13.906 715 2HD LYS 97 HD3 LYS 97 4.054 15.565 -12.223 716 1HE LYS 97 HE2 LYS 97 1.822 14.405 -12.910 717 2HE LYS 97 HE3 LYS 97 2.345 14.689 -14.578 718 1HZ LYS 97 HZ1 LYS 97 3.095 12.537 -13.889 719 2HZ LYS 97 HZ2 LYS 97 4.438 13.465 -13.897 720 3HZ LYS 97 HZ3 LYS 97 3.688 13.084 -12.471 721 H ARG 98 H ARG 98 1.291 20.317 -13.159 722 HA ARG 98 HA ARG 98 -1.287 19.694 -11.852 723 1HB ARG 98 HB2 ARG 98 -0.156 22.422 -12.433 724 2HB ARG 98 HB3 ARG 98 -1.892 22.154 -12.624 725 1HG ARG 98 HG2 ARG 98 -2.054 21.250 -10.345 726 2HG ARG 98 HG3 ARG 98 -0.335 21.580 -10.071 727 1HD ARG 98 HD2 ARG 98 -2.424 23.695 -10.790 728 2HD ARG 98 HD3 ARG 98 -1.948 23.284 -9.147 729 HE ARG 98 HE ARG 98 0.185 24.158 -9.444 730 1HH1 ARG 98 HH21 ARG 98 -1.797 24.786 -12.389 731 2HH1 ARG 98 HH22 ARG 98 -0.775 26.067 -12.911 732 1HH2 ARG 98 HH11 ARG 98 1.475 25.840 -10.180 733 2HH2 ARG 98 HH12 ARG 98 1.127 26.675 -11.649 734 H GLU 99 H GLU 99 -3.130 19.895 -13.087 735 HA GLU 99 HA GLU 99 -3.000 20.383 -15.939 736 1HB GLU 99 HB2 GLU 99 -2.882 17.708 -15.013 737 2HB GLU 99 HB3 GLU 99 -4.595 17.961 -15.363 738 1HG GLU 99 HG2 GLU 99 -2.269 18.409 -17.288 739 2HG GLU 99 HG3 GLU 99 -3.282 16.965 -17.207 740 H HIS 100 H HIS 100 -5.350 20.728 -16.658 741 HA HIS 100 HA HIS 100 -7.162 21.449 -14.396 742 1HB HIS 100 HB2 HIS 100 -6.052 23.405 -16.458 743 2HB HIS 100 HB3 HIS 100 -7.336 23.748 -15.302 744 HD1 HIS 100 HD1 HIS 100 -6.497 23.567 -12.604 745 HD2 HIS 100 HD2 HIS 100 -3.582 23.905 -15.614 746 HE1 HIS 100 HE1 HIS 100 -4.396 24.398 -11.458 747 H TRP 101 H TRP 101 -9.106 20.657 -14.939 748 HA TRP 101 HA TRP 101 -9.927 20.532 -17.813 749 1HB TRP 101 HB2 TRP 101 -10.844 18.763 -15.546 750 2HB TRP 101 HB3 TRP 101 -11.287 18.657 -17.250 751 HD1 TRP 101 HD1 TRP 101 -8.149 19.146 -18.216 752 HE1 TRP 101 HE1 TRP 101 -6.454 17.295 -18.060 753 HE3 TRP 101 HE3 TRP 101 -10.756 15.988 -15.151 754 HZ2 TRP 101 HZ2 TRP 101 -6.134 14.811 -16.592 755 HZ3 TRP 101 HZ3 TRP 101 -9.723 13.864 -14.392 756 HH2 TRP 101 HH2 TRP 101 -7.403 13.280 -15.072 757 H GLY 102 H GLY 102 -12.661 20.307 -17.603 758 1HA GLY 102 HA1 GLY 102 -13.468 22.899 -16.335 759 2HA GLY 102 HA2 GLY 102 -13.624 22.615 -18.056 760 H PHE 103 H PHE 103 -14.384 20.367 -15.292 761 HA PHE 103 HA PHE 103 -16.927 19.772 -16.618 762 1HB PHE 103 HB2 PHE 103 -15.541 18.583 -14.183 763 2HB PHE 103 HB3 PHE 103 -17.084 18.033 -14.831 764 HD1 PHE 103 HD1 PHE 103 -13.453 17.861 -15.263 765 HD2 PHE 103 HD2 PHE 103 -17.241 17.310 -17.252 766 HE1 PHE 103 HE1 PHE 103 -12.310 16.676 -17.117 767 HE2 PHE 103 HE2 PHE 103 -16.113 16.146 -19.087 768 HZ PHE 103 HZ PHE 103 -13.628 15.803 -19.037 769 H ASP 104 H ASP 104 -18.776 20.722 -16.171 770 HA ASP 104 HA ASP 104 -19.223 22.410 -13.828 771 1HB ASP 104 HB2 ASP 104 -20.300 22.863 -16.029 772 2HB ASP 104 HB3 ASP 104 -21.117 21.296 -15.923 773 H ASP 105 H ASP 105 -20.973 21.866 -12.250 774 HA ASP 105 HA ASP 105 -20.317 19.256 -11.219 775 1HB ASP 105 HB2 ASP 105 -20.649 21.398 -9.878 776 2HB ASP 105 HB3 ASP 105 -22.382 21.115 -10.044 777 HA PRO 106 HA PRO 106 -23.620 17.397 -13.405 778 1HB PRO 106 HB2 PRO 106 -23.578 14.809 -12.371 779 2HB PRO 106 HB3 PRO 106 -22.432 15.447 -13.585 780 1HG PRO 106 HG2 PRO 106 -22.079 15.221 -10.592 781 2HG PRO 106 HG3 PRO 106 -20.906 14.814 -11.887 782 1HD PRO 106 HD2 PRO 106 -20.792 17.170 -10.524 783 2HD PRO 106 HD3 PRO 106 -20.400 17.084 -12.270 784 H ALA 107 H ALA 107 -23.676 17.214 -9.847 785 HA ALA 107 HA ALA 107 -26.397 16.369 -9.668 786 1HB ALA 107 HB1 ALA 107 -24.796 16.147 -7.820 787 2HB ALA 107 HB2 ALA 107 -24.705 17.914 -7.665 788 3HB ALA 107 HB3 ALA 107 -26.230 17.071 -7.321 789 H ARG 108 H ARG 108 -25.003 19.460 -10.487 790 HA ARG 108 HA ARG 108 -27.534 20.901 -9.878 791 1HB ARG 108 HB2 ARG 108 -24.687 21.885 -10.413 792 2HB ARG 108 HB3 ARG 108 -26.100 22.931 -10.335 793 1HG ARG 108 HG2 ARG 108 -25.357 23.130 -8.198 794 2HG ARG 108 HG3 ARG 108 -26.573 21.859 -8.035 795 1HD ARG 108 HD2 ARG 108 -24.672 20.172 -8.115 796 2HD ARG 108 HD3 ARG 108 -23.543 21.535 -8.085 797 HE ARG 108 HE ARG 108 -25.280 21.920 -5.938 798 1HH1 ARG 108 HH21 ARG 108 -22.892 19.424 -6.893 799 2HH1 ARG 108 HH22 ARG 108 -22.596 18.947 -5.241 800 1HH2 ARG 108 HH11 ARG 108 -24.877 21.185 -3.781 801 2HH2 ARG 108 HH12 ARG 108 -23.757 19.882 -3.514 802 H ALA 109 H ALA 109 -26.308 19.153 -12.426 803 HA ALA 109 HA ALA 109 -26.878 20.846 -14.628 804 1HB ALA 109 HB1 ALA 109 -25.684 18.664 -14.804 805 2HB ALA 109 HB2 ALA 109 -27.177 17.819 -14.321 806 3HB ALA 109 HB3 ALA 109 -27.120 18.710 -15.856 807 H GLN 110 H GLN 110 -28.854 20.886 -15.866 808 HA GLN 110 HA GLN 110 -31.332 19.943 -14.663 809 1HB GLN 110 HB2 GLN 110 -32.232 22.209 -14.210 810 2HB GLN 110 HB3 GLN 110 -30.876 21.785 -13.183 811 1HG GLN 110 HG2 GLN 110 -29.405 23.133 -14.886 812 2HG GLN 110 HG3 GLN 110 -30.943 23.763 -15.482 813 1HE2 GLN 110 HE22 GLN 110 -28.918 23.358 -12.516 814 2HE2 GLN 110 HE21 GLN 110 -29.525 24.787 -11.703 815 H GLY 111 H GLY 111 -33.221 20.753 -15.913 816 1HA GLY 111 HA1 GLY 111 -33.641 22.030 -18.173 817 2HA GLY 111 HA2 GLY 111 -32.662 20.685 -18.812 818 H THR 112 H THR 112 -33.353 18.566 -17.280 819 HA THR 112 HA THR 112 -36.032 18.293 -16.521 820 HB THR 112 HB THR 112 -36.617 18.135 -18.842 821 HG1 THR 112 HG1 THR 112 -37.581 16.208 -18.808 822 1HG2 THR 112 HG21 THR 112 -34.490 17.657 -19.928 823 2HG2 THR 112 HG22 THR 112 -34.436 16.046 -19.179 824 3HG2 THR 112 HG23 THR 112 -35.681 16.434 -20.382 825 H GLU 113 H GLU 113 -36.259 15.947 -15.670 826 HA GLU 113 HA GLU 113 -33.997 15.431 -14.029 827 1HB GLU 113 HB2 GLU 113 -36.254 14.843 -13.351 828 2HB GLU 113 HB3 GLU 113 -36.426 13.720 -14.709 829 1HG GLU 113 HG2 GLU 113 -34.692 12.262 -13.800 830 2HG GLU 113 HG3 GLU 113 -34.333 13.419 -12.512 831 H GLU 114 H GLU 114 -35.115 13.905 -17.046 832 HA GLU 114 HA GLU 114 -33.094 11.895 -17.031 833 1HB GLU 114 HB2 GLU 114 -33.734 11.438 -19.336 834 2HB GLU 114 HB3 GLU 114 -35.138 11.573 -18.281 835 1HG GLU 114 HG2 GLU 114 -35.571 13.861 -19.124 836 2HG GLU 114 HG3 GLU 114 -34.150 13.755 -20.170 837 H GLU 115 H GLU 115 -33.042 15.272 -18.060 838 HA GLU 115 HA GLU 115 -30.599 14.955 -19.576 839 1HB GLU 115 HB2 GLU 115 -32.079 16.685 -20.292 840 2HB GLU 115 HB3 GLU 115 -32.141 17.394 -18.680 841 1HG GLU 115 HG2 GLU 115 -30.749 18.692 -20.256 842 2HG GLU 115 HG3 GLU 115 -29.895 18.182 -18.810 843 H LYS 116 H LYS 116 -31.564 16.055 -16.295 844 HA LYS 116 HA LYS 116 -28.970 16.692 -15.348 845 1HB LYS 116 HB2 LYS 116 -30.881 17.357 -14.075 846 2HB LYS 116 HB3 LYS 116 -31.500 15.706 -13.995 847 1HG LYS 116 HG2 LYS 116 -29.675 15.013 -12.562 848 2HG LYS 116 HG3 LYS 116 -28.923 16.615 -12.643 849 1HD LYS 116 HD2 LYS 116 -31.772 16.313 -11.664 850 2HD LYS 116 HD3 LYS 116 -30.420 15.846 -10.607 851 1HE LYS 116 HE2 LYS 116 -29.449 18.159 -10.977 852 2HE LYS 116 HE3 LYS 116 -30.957 18.588 -11.791 853 1HZ LYS 116 HZ1 LYS 116 -30.710 17.715 -8.970 854 2HZ LYS 116 HZ2 LYS 116 -31.011 19.229 -9.480 855 3HZ LYS 116 HZ3 LYS 116 -32.130 18.067 -9.711 856 H TRP 117 H TRP 117 -30.755 13.576 -15.255 857 HA TRP 117 HA TRP 117 -28.609 12.059 -14.158 858 1HB TRP 117 HB2 TRP 117 -30.887 11.170 -14.271 859 2HB TRP 117 HB3 TRP 117 -30.839 11.176 -16.035 860 HD1 TRP 117 HD1 TRP 117 -29.390 9.289 -17.241 861 HE1 TRP 117 HE1 TRP 117 -28.408 7.050 -16.475 862 HE3 TRP 117 HE3 TRP 117 -29.675 9.971 -12.182 863 HZ2 TRP 117 HZ2 TRP 117 -27.577 5.843 -14.018 864 HZ3 TRP 117 HZ3 TRP 117 -28.612 8.342 -10.652 865 HH2 TRP 117 HH2 TRP 117 -27.558 6.267 -11.553 866 H ALA 118 H ALA 118 -29.472 12.741 -17.614 867 HA ALA 118 HA ALA 118 -27.434 11.178 -18.756 868 1HB ALA 118 HB1 ALA 118 -27.685 12.597 -20.740 869 2HB ALA 118 HB2 ALA 118 -29.270 12.185 -20.066 870 3HB ALA 118 HB3 ALA 118 -28.583 13.805 -19.799 871 H PHE 119 H PHE 119 -27.311 14.555 -17.504 872 HA PHE 119 HA PHE 119 -24.655 15.090 -18.293 873 1HB PHE 119 HB2 PHE 119 -26.566 16.592 -17.252 874 2HB PHE 119 HB3 PHE 119 -25.777 16.191 -15.737 875 HD1 PHE 119 HD1 PHE 119 -23.327 16.859 -15.426 876 HD2 PHE 119 HD2 PHE 119 -25.675 18.170 -18.794 877 HE1 PHE 119 HE1 PHE 119 -21.794 18.788 -15.734 878 HE2 PHE 119 HE2 PHE 119 -24.072 20.022 -19.183 879 HZ PHE 119 HZ PHE 119 -22.135 20.336 -17.667 880 H PHE 120 H PHE 120 -25.892 13.318 -15.407 881 HA PHE 120 HA PHE 120 -23.385 13.013 -14.075 882 1HB PHE 120 HB2 PHE 120 -25.444 10.804 -14.269 883 2HB PHE 120 HB3 PHE 120 -24.210 11.032 -13.072 884 HD1 PHE 120 HD1 PHE 120 -26.577 10.245 -12.055 885 HD2 PHE 120 HD2 PHE 120 -25.587 14.289 -13.213 886 HE1 PHE 120 HE1 PHE 120 -28.297 11.126 -10.508 887 HE2 PHE 120 HE2 PHE 120 -27.279 15.140 -11.657 888 HZ PHE 120 HZ PHE 120 -28.663 13.578 -10.310 889 H GLN 121 H GLN 121 -25.012 11.107 -16.678 890 HA GLN 121 HA GLN 121 -22.963 9.186 -16.986 891 1HB GLN 121 HB2 GLN 121 -24.866 10.035 -19.180 892 2HB GLN 121 HB3 GLN 121 -23.988 8.526 -19.033 893 1HG GLN 121 HG2 GLN 121 -26.291 9.470 -17.288 894 2HG GLN 121 HG3 GLN 121 -26.299 8.156 -18.443 895 1HE2 GLN 121 HE22 GLN 121 -25.917 8.884 -15.128 896 2HE2 GLN 121 HE21 GLN 121 -25.169 7.379 -14.638 897 H ARG 122 H ARG 122 -23.436 12.290 -18.723 898 HA ARG 122 HA ARG 122 -21.198 11.969 -20.474 899 1HB ARG 122 HB2 ARG 122 -22.479 14.530 -19.409 900 2HB ARG 122 HB3 ARG 122 -21.064 14.533 -20.436 901 1HG ARG 122 HG2 ARG 122 -22.793 14.943 -21.903 902 2HG ARG 122 HG3 ARG 122 -22.351 13.248 -22.188 903 1HD ARG 122 HD2 ARG 122 -24.313 12.455 -21.093 904 2HD ARG 122 HD3 ARG 122 -24.515 13.972 -20.224 905 HE ARG 122 HE ARG 122 -25.339 13.426 -23.003 906 1HH1 ARG 122 HH21 ARG 122 -25.166 15.890 -20.451 907 2HH1 ARG 122 HH22 ARG 122 -26.772 16.505 -20.742 908 1HH2 ARG 122 HH11 ARG 122 -27.482 14.333 -23.400 909 2HH2 ARG 122 HH12 ARG 122 -28.096 15.570 -22.335 910 H VAL 123 H VAL 123 -21.390 13.654 -17.256 911 HA VAL 123 HA VAL 123 -18.640 14.345 -17.376 912 HB VAL 123 HB VAL 123 -20.544 14.193 -15.006 913 1HG1 VAL 123 HG11 VAL 123 -18.256 14.069 -14.114 914 2HG1 VAL 123 HG12 VAL 123 -17.743 15.408 -15.165 915 3HG1 VAL 123 HG13 VAL 123 -18.904 15.691 -13.847 916 1HG2 VAL 123 HG21 VAL 123 -19.470 16.533 -16.670 917 2HG2 VAL 123 HG22 VAL 123 -21.115 15.888 -16.757 918 3HG2 VAL 123 HG23 VAL 123 -20.556 16.674 -15.275 919 H ARG 124 H ARG 124 -20.213 11.405 -15.833 920 HA ARG 124 HA ARG 124 -17.709 10.512 -14.843 921 1HB ARG 124 HB2 ARG 124 -18.674 8.316 -14.556 922 2HB ARG 124 HB3 ARG 124 -19.873 9.514 -14.098 923 1HG ARG 124 HG2 ARG 124 -21.056 9.169 -16.187 924 2HG ARG 124 HG3 ARG 124 -19.822 8.057 -16.771 925 1HD ARG 124 HD2 ARG 124 -20.352 6.537 -14.840 926 2HD ARG 124 HD3 ARG 124 -21.684 7.609 -14.427 927 HE ARG 124 HE ARG 124 -22.947 6.658 -16.055 928 1HH1 ARG 124 HH21 ARG 124 -19.588 5.922 -17.030 929 2HH1 ARG 124 HH22 ARG 124 -20.088 4.987 -18.390 930 1HH2 ARG 124 HH11 ARG 124 -23.544 5.516 -17.812 931 2HH2 ARG 124 HH12 ARG 124 -22.393 4.706 -18.838 932 H ASP 125 H ASP 125 -19.228 9.964 -18.034 933 HA ASP 125 HA ASP 125 -17.298 8.101 -18.950 934 1HB ASP 125 HB2 ASP 125 -19.426 8.393 -20.091 935 2HB ASP 125 HB3 ASP 125 -19.031 10.068 -20.491 936 H GLU 126 H GLU 126 -17.442 11.695 -19.222 937 HA GLU 126 HA GLU 126 -15.020 11.833 -20.723 938 1HB GLU 126 HB2 GLU 126 -16.604 13.898 -19.178 939 2HB GLU 126 HB3 GLU 126 -15.129 14.268 -20.097 940 1HG GLU 126 HG2 GLU 126 -16.163 13.341 -22.151 941 2HG GLU 126 HG3 GLU 126 -17.666 13.066 -21.278 942 H ILE 127 H ILE 127 -15.655 12.099 -17.160 943 HA ILE 127 HA ILE 127 -12.977 12.774 -16.478 944 HB ILE 127 HB ILE 127 -15.365 12.371 -15.063 945 1HG1 ILE 127 HG12 ILE 127 -14.014 12.919 -13.005 946 2HG1 ILE 127 HG13 ILE 127 -12.570 12.902 -14.028 947 1HG2 ILE 127 HG21 ILE 127 -15.027 10.032 -14.761 948 2HG2 ILE 127 HG22 ILE 127 -13.461 10.326 -13.955 949 3HG2 ILE 127 HG23 ILE 127 -14.978 10.901 -13.230 950 1HD1 ILE 127 HD11 ILE 127 -13.611 15.187 -13.712 951 2HD1 ILE 127 HD12 ILE 127 -13.561 14.692 -15.422 952 3HD1 ILE 127 HD13 ILE 127 -15.081 14.594 -14.506 953 H GLY 128 H GLY 128 -14.603 9.614 -16.951 954 1HA GLY 128 HA1 GLY 128 -12.435 7.962 -16.277 955 2HA GLY 128 HA2 GLY 128 -13.779 7.540 -17.365 956 H ASN 129 H ASN 129 -13.419 9.318 -19.483 957 HA ASN 129 HA ASN 129 -11.309 8.107 -20.960 958 1HB ASN 129 HB2 ASN 129 -13.081 10.504 -21.482 959 2HB ASN 129 HB3 ASN 129 -11.689 10.178 -22.511 960 1HD2 ASN 129 HD22 ASN 129 -14.700 8.676 -21.301 961 2HD2 ASN 129 HD21 ASN 129 -14.887 7.583 -22.655 962 H ARG 130 H ARG 130 -11.375 11.204 -19.156 963 HA ARG 130 HA ARG 130 -8.814 12.053 -20.191 964 1HB ARG 130 HB2 ARG 130 -10.667 12.972 -18.014 965 2HB ARG 130 HB3 ARG 130 -8.967 13.330 -17.788 966 1HG ARG 130 HG2 ARG 130 -9.950 15.211 -18.797 967 2HG ARG 130 HG3 ARG 130 -8.850 14.492 -19.963 968 1HD ARG 130 HD2 ARG 130 -11.852 13.990 -19.982 969 2HD ARG 130 HD3 ARG 130 -11.117 15.379 -20.784 970 HE ARG 130 HE ARG 130 -9.688 13.303 -21.854 971 1HH1 ARG 130 HH21 ARG 130 -13.165 14.008 -21.673 972 2HH1 ARG 130 HH22 ARG 130 -13.513 13.301 -23.211 973 1HH2 ARG 130 HH11 ARG 130 -10.097 12.413 -23.766 974 2HH2 ARG 130 HH12 ARG 130 -11.701 12.329 -24.472 975 H LEU 131 H LEU 131 -9.796 10.170 -17.331 976 HA LEU 131 HA LEU 131 -7.099 10.001 -16.266 977 1HB LEU 131 HB2 LEU 131 -9.665 8.438 -15.765 978 2HB LEU 131 HB3 LEU 131 -8.187 8.190 -14.829 979 HG LEU 131 HG LEU 131 -9.435 10.967 -15.102 980 1HD1 LEU 131 HD11 LEU 131 -10.094 8.875 -13.016 981 2HD1 LEU 131 HD12 LEU 131 -10.566 10.590 -12.963 982 3HD1 LEU 131 HD13 LEU 131 -11.177 9.545 -14.255 983 1HD2 LEU 131 HD21 LEU 131 -7.111 10.884 -14.294 984 2HD2 LEU 131 HD22 LEU 131 -8.231 11.418 -13.049 985 3HD2 LEU 131 HD23 LEU 131 -7.587 9.754 -13.014 986 H LYS 132 H LYS 132 -9.086 7.869 -18.334 987 HA LYS 132 HA LYS 132 -7.171 5.833 -18.726 988 1HB LYS 132 HB2 LYS 132 -9.395 5.499 -19.425 989 2HB LYS 132 HB3 LYS 132 -9.460 6.977 -20.346 990 1HG LYS 132 HG2 LYS 132 -7.557 4.809 -21.250 991 2HG LYS 132 HG3 LYS 132 -9.296 4.618 -21.497 992 1HD LYS 132 HD2 LYS 132 -9.296 6.929 -22.613 993 2HD LYS 132 HD3 LYS 132 -7.521 6.810 -22.633 994 1HE LYS 132 HE2 LYS 132 -7.714 4.635 -23.851 995 2HE LYS 132 HE3 LYS 132 -9.475 4.816 -23.847 996 1HZ LYS 132 HZ1 LYS 132 -9.212 6.821 -25.188 997 2HZ LYS 132 HZ2 LYS 132 -7.582 6.657 -25.198 998 3HZ LYS 132 HZ3 LYS 132 -8.522 5.550 -25.934 999 H GLU 133 H GLU 133 -7.614 8.931 -20.522 1000 HA GLU 133 HA GLU 133 -5.363 8.594 -22.227 1001 1HB GLU 133 HB2 GLU 133 -6.704 11.070 -21.073 1002 2HB GLU 133 HB3 GLU 133 -5.226 11.176 -22.026 1003 1HG GLU 133 HG2 GLU 133 -6.325 10.110 -23.938 1004 2HG GLU 133 HG3 GLU 133 -7.835 9.979 -23.024 1005 H PHE 134 H PHE 134 -5.443 10.198 -18.930 1006 HA PHE 134 HA PHE 134 -2.699 10.755 -19.048 1007 1HB PHE 134 HB2 PHE 134 -4.379 11.542 -17.298 1008 2HB PHE 134 HB3 PHE 134 -4.098 10.012 -16.460 1009 HD1 PHE 134 HD1 PHE 134 -2.959 13.388 -16.896 1010 HD2 PHE 134 HD2 PHE 134 -1.541 9.416 -15.972 1011 HE1 PHE 134 HE1 PHE 134 -0.785 14.320 -16.159 1012 HE2 PHE 134 HE2 PHE 134 0.649 10.329 -15.344 1013 HZ PHE 134 HZ PHE 134 1.046 12.802 -15.445 1014 H ALA 135 H ALA 135 -4.330 7.796 -17.972 1015 HA ALA 135 HA ALA 135 -2.013 6.522 -16.953 1016 1HB ALA 135 HB1 ALA 135 -4.596 5.294 -18.042 1017 2HB ALA 135 HB2 ALA 135 -3.432 4.497 -16.962 1018 3HB ALA 135 HB3 ALA 135 -4.371 5.899 -16.394 1019 H GLU 136 H GLU 136 -3.546 6.471 -20.168 1020 HA GLU 136 HA GLU 136 -1.791 4.404 -21.172 1021 1HB GLU 136 HB2 GLU 136 -3.939 6.137 -22.443 1022 2HB GLU 136 HB3 GLU 136 -3.005 4.966 -23.363 1023 1HG GLU 136 HG2 GLU 136 -4.675 4.219 -20.923 1024 2HG GLU 136 HG3 GLU 136 -5.252 4.144 -22.583 1025 H THR 137 H THR 137 -2.034 7.926 -21.504 1026 HA THR 137 HA THR 137 -0.017 7.924 -23.552 1027 HB THR 137 HB THR 137 -0.559 10.250 -23.828 1028 HG1 THR 137 HG1 THR 137 -2.370 9.947 -21.694 1029 1HG2 THR 137 HG21 THR 137 -2.932 10.040 -24.470 1030 2HG2 THR 137 HG22 THR 137 -2.002 8.604 -24.941 1031 3HG2 THR 137 HG23 THR 137 -3.071 8.536 -23.533 1032 H GLY 138 H GLY 138 -0.177 8.502 -20.098 1033 1HA GLY 138 HA1 GLY 138 1.374 9.240 -18.578 1034 2HA GLY 138 HA2 GLY 138 2.659 8.996 -19.786 1035 H LYS 139 H LYS 139 -0.290 10.949 -19.896 1036 HA LYS 139 HA LYS 139 0.311 12.915 -21.520 1037 1HB LYS 139 HB2 LYS 139 -1.860 12.504 -20.289 1038 2HB LYS 139 HB3 LYS 139 -1.190 13.410 -18.939 1039 1HG LYS 139 HG2 LYS 139 -2.528 14.958 -20.066 1040 2HG LYS 139 HG3 LYS 139 -0.882 15.376 -20.515 1041 1HD LYS 139 HD2 LYS 139 -2.263 15.547 -22.467 1042 2HD LYS 139 HD3 LYS 139 -1.219 14.141 -22.703 1043 1HE LYS 139 HE2 LYS 139 -3.060 12.621 -22.108 1044 2HE LYS 139 HE3 LYS 139 -4.084 13.994 -21.657 1045 1HZ LYS 139 HZ1 LYS 139 -3.969 14.708 -24.005 1046 2HZ LYS 139 HZ2 LYS 139 -3.169 13.334 -24.389 1047 3HZ LYS 139 HZ3 LYS 139 -4.714 13.273 -23.826 Start of MODEL 10 1 1H MET 1 H1 MET 1 2.373 -0.597 -2.149 2 2H MET 1 H2 MET 1 1.528 -1.700 -1.270 3 3H MET 1 H3 MET 1 0.746 -0.697 -2.306 4 HA MET 1 HA MET 1 0.402 -0.006 -0.050 5 1HB MET 1 HB2 MET 1 3.432 0.316 -0.013 6 2HB MET 1 HB3 MET 1 2.340 1.077 1.141 7 1HG MET 1 HG2 MET 1 2.707 -1.907 0.706 8 2HG MET 1 HG3 MET 1 3.278 -0.966 2.072 9 1HE MET 1 HE1 MET 1 1.838 -0.126 4.060 10 2HE MET 1 HE2 MET 1 0.845 0.877 2.973 11 3HE MET 1 HE3 MET 1 0.065 -0.217 4.134 12 H GLU 2 H GLU 2 3.113 1.868 -1.621 13 HA GLU 2 HA GLU 2 1.306 3.571 -3.048 14 1HB GLU 2 HB2 GLU 2 1.919 5.665 -1.913 15 2HB GLU 2 HB3 GLU 2 1.041 4.603 -0.822 16 1HG GLU 2 HG2 GLU 2 3.196 3.915 0.242 17 2HG GLU 2 HG3 GLU 2 4.066 4.998 -0.845 18 H ASN 3 H ASN 3 2.804 5.375 -4.095 19 HA ASN 3 HA ASN 3 5.640 4.918 -4.044 20 1HB ASN 3 HB2 ASN 3 5.606 3.227 -5.575 21 2HB ASN 3 HB3 ASN 3 4.069 3.685 -6.260 22 1HD2 ASN 3 HD21 ASN 3 3.988 5.094 -8.039 23 2HD2 ASN 3 HD22 ASN 3 5.439 5.625 -8.884 24 H LYS 4 H LYS 4 2.854 6.382 -5.737 25 HA LYS 4 HA LYS 4 4.037 9.004 -5.158 26 1HB LYS 4 HB2 LYS 4 3.764 9.910 -7.369 27 2HB LYS 4 HB3 LYS 4 4.863 8.546 -7.401 28 1HG LYS 4 HG2 LYS 4 2.926 7.125 -8.270 29 2HG LYS 4 HG3 LYS 4 1.988 8.623 -8.412 30 1HD LYS 4 HD2 LYS 4 3.735 9.571 -9.906 31 2HD LYS 4 HD3 LYS 4 4.700 8.091 -9.721 32 1HE LYS 4 HE2 LYS 4 2.768 6.785 -10.690 33 2HE LYS 4 HE3 LYS 4 1.945 8.323 -10.985 34 1HZ LYS 4 HZ1 LYS 4 4.539 7.527 -12.183 35 2HZ LYS 4 HZ2 LYS 4 3.106 7.563 -12.954 36 3HZ LYS 4 HZ3 LYS 4 3.785 8.954 -12.443 37 H ILE 5 H ILE 5 2.192 10.734 -5.964 38 HA ILE 5 HA ILE 5 -0.377 9.713 -4.844 39 HB ILE 5 HB ILE 5 1.339 12.034 -3.888 40 1HG1 ILE 5 HG12 ILE 5 0.182 9.667 -2.362 41 2HG1 ILE 5 HG13 ILE 5 1.844 9.790 -2.934 42 1HG2 ILE 5 HG21 ILE 5 -0.991 12.861 -4.028 43 2HG2 ILE 5 HG22 ILE 5 -1.558 11.440 -3.139 44 3HG2 ILE 5 HG23 ILE 5 -0.528 12.670 -2.356 45 1HD1 ILE 5 HD11 ILE 5 1.877 10.355 -0.633 46 2HD1 ILE 5 HD12 ILE 5 2.138 11.860 -1.539 47 3HD1 ILE 5 HD13 ILE 5 0.553 11.512 -0.799 48 H ILE 6 H ILE 6 -2.170 10.647 -5.727 49 HA ILE 6 HA ILE 6 -1.855 12.984 -7.524 50 HB ILE 6 HB ILE 6 -2.051 11.192 -9.024 51 1HG1 ILE 6 HG12 ILE 6 -4.811 12.445 -8.699 52 2HG1 ILE 6 HG13 ILE 6 -3.414 13.180 -9.491 53 1HG2 ILE 6 HG21 ILE 6 -3.789 9.451 -8.982 54 2HG2 ILE 6 HG22 ILE 6 -2.833 9.386 -7.518 55 3HG2 ILE 6 HG23 ILE 6 -4.443 10.131 -7.478 56 1HD1 ILE 6 HD11 ILE 6 -3.439 11.214 -11.125 57 2HD1 ILE 6 HD12 ILE 6 -4.997 10.748 -10.406 58 3HD1 ILE 6 HD13 ILE 6 -4.832 12.312 -11.211 59 H TYR 7 H TYR 7 -3.274 14.593 -7.003 60 HA TYR 7 HA TYR 7 -5.311 14.049 -4.891 61 1HB TYR 7 HB2 TYR 7 -3.154 15.017 -4.085 62 2HB TYR 7 HB3 TYR 7 -3.413 16.416 -5.114 63 HD1 TYR 7 HD1 TYR 7 -5.428 14.426 -2.615 64 HD2 TYR 7 HD2 TYR 7 -4.082 18.306 -3.901 65 HE1 TYR 7 HE1 TYR 7 -6.441 15.435 -0.592 66 HE2 TYR 7 HE2 TYR 7 -5.080 19.322 -1.859 67 HH TYR 7 HH TYR 7 -6.704 17.392 0.660 68 H PHE 8 H PHE 8 -7.214 14.193 -5.973 69 HA PHE 8 HA PHE 8 -7.606 16.078 -8.186 70 1HB PHE 8 HB2 PHE 8 -9.528 14.289 -6.620 71 2HB PHE 8 HB3 PHE 8 -9.998 15.299 -7.981 72 HD1 PHE 8 HD1 PHE 8 -8.668 12.086 -7.021 73 HD2 PHE 8 HD2 PHE 8 -8.805 14.959 -10.231 74 HE1 PHE 8 HE1 PHE 8 -7.898 10.353 -8.629 75 HE2 PHE 8 HE2 PHE 8 -8.005 13.227 -11.821 76 HZ PHE 8 HZ PHE 8 -7.528 10.924 -11.000 77 H LEU 9 H LEU 9 -8.794 17.964 -8.154 78 HA LEU 9 HA LEU 9 -9.780 18.992 -5.568 79 1HB LEU 9 HB2 LEU 9 -7.392 19.642 -5.875 80 2HB LEU 9 HB3 LEU 9 -7.763 20.351 -7.433 81 HG LEU 9 HG LEU 9 -7.411 21.942 -5.541 82 1HD1 LEU 9 HD11 LEU 9 -10.235 22.335 -6.530 83 2HD1 LEU 9 HD12 LEU 9 -9.001 23.538 -6.154 84 3HD1 LEU 9 HD13 LEU 9 -8.825 22.532 -7.597 85 1HD2 LEU 9 HD21 LEU 9 -8.505 20.685 -3.744 86 2HD2 LEU 9 HD22 LEU 9 -9.255 22.295 -3.909 87 3HD2 LEU 9 HD23 LEU 9 -10.075 20.879 -4.536 88 H CYS 10 H CYS 10 -11.750 20.053 -5.891 89 HA CYS 10 HA CYS 10 -12.174 21.437 -8.404 90 1HB CYS 10 HB2 CYS 10 -12.965 18.887 -8.591 91 2HB CYS 10 HB3 CYS 10 -14.410 19.521 -7.779 92 HG CYS 10 HG CYS 10 -14.609 19.449 -10.471 93 H THR 11 H THR 11 -14.767 22.292 -8.257 94 HA THR 11 HA THR 11 -14.581 24.046 -6.016 95 HB THR 11 HB THR 11 -16.884 24.789 -6.982 96 HG1 THR 11 HG1 THR 11 -17.157 24.111 -9.117 97 1HG2 THR 11 HG21 THR 11 -14.424 24.882 -8.777 98 2HG2 THR 11 HG22 THR 11 -15.711 26.090 -8.634 99 3HG2 THR 11 HG23 THR 11 -14.578 25.839 -7.293 100 H GLY 12 H GLY 12 -15.800 20.890 -6.001 101 1HA GLY 12 HA1 GLY 12 -16.521 21.251 -3.275 102 2HA GLY 12 HA2 GLY 12 -17.962 20.880 -4.244 103 H ASN 13 H ASN 13 -15.933 19.385 -2.296 104 HA ASN 13 HA ASN 13 -14.928 17.207 -3.938 105 1HB ASN 13 HB2 ASN 13 -13.788 18.174 -1.887 106 2HB ASN 13 HB3 ASN 13 -15.021 17.399 -0.907 107 1HD2 ASN 13 HD22 ASN 13 -12.697 16.547 -0.221 108 2HD2 ASN 13 HD21 ASN 13 -12.262 14.996 -0.893 109 H SER 14 H SER 14 -17.740 17.384 -4.171 110 HA SER 14 HA SER 14 -18.760 15.038 -2.638 111 1HB SER 14 HB2 SER 14 -20.949 16.299 -2.951 112 2HB SER 14 HB3 SER 14 -19.760 17.007 -1.853 113 HG SER 14 HG SER 14 -20.658 18.543 -3.207 114 H CYS 15 H CYS 15 -18.243 16.366 -5.827 115 HA CYS 15 HA CYS 15 -19.596 13.992 -7.012 116 1HB CYS 15 HB2 CYS 15 -19.750 16.841 -8.085 117 2HB CYS 15 HB3 CYS 15 -20.462 15.398 -8.818 118 HG CYS 15 HG CYS 15 -22.121 17.195 -7.634 119 H ARG 16 H ARG 16 -17.654 16.797 -8.284 120 HA ARG 16 HA ARG 16 -16.619 15.306 -10.430 121 1HB ARG 16 HB2 ARG 16 -15.762 17.894 -9.083 122 2HB ARG 16 HB3 ARG 16 -14.684 17.145 -10.241 123 1HG ARG 16 HG2 ARG 16 -15.907 18.752 -11.438 124 2HG ARG 16 HG3 ARG 16 -16.422 17.170 -11.975 125 1HD ARG 16 HD2 ARG 16 -18.278 18.766 -11.795 126 2HD ARG 16 HD3 ARG 16 -18.499 17.347 -10.776 127 HE ARG 16 HE ARG 16 -18.815 18.781 -9.033 128 1HH1 ARG 16 HH21 ARG 16 -16.967 20.749 -11.387 129 2HH1 ARG 16 HH22 ARG 16 -16.800 22.042 -10.234 130 1HH2 ARG 16 HH11 ARG 16 -18.744 20.503 -7.753 131 2HH2 ARG 16 HH12 ARG 16 -17.802 21.930 -8.178 132 H SER 17 H SER 17 -14.724 16.241 -7.490 133 HA SER 17 HA SER 17 -12.506 14.698 -8.173 134 1HB SER 17 HB2 SER 17 -13.362 15.367 -5.351 135 2HB SER 17 HB3 SER 17 -11.715 15.234 -6.010 136 HG SER 17 HG SER 17 -12.403 17.398 -5.728 137 H GLN 18 H GLN 18 -15.357 13.805 -6.189 138 HA GLN 18 HA GLN 18 -14.358 11.334 -5.237 139 1HB GLN 18 HB2 GLN 18 -17.230 12.225 -5.819 140 2HB GLN 18 HB3 GLN 18 -16.789 10.802 -4.885 141 1HG GLN 18 HG2 GLN 18 -16.052 13.649 -4.108 142 2HG GLN 18 HG3 GLN 18 -17.437 12.761 -3.490 143 1HE2 GLN 18 HE22 GLN 18 -15.387 13.830 -1.856 144 2HE2 GLN 18 HE21 GLN 18 -14.601 12.469 -1.037 145 H MET 19 H MET 19 -16.296 12.045 -8.220 146 HA MET 19 HA MET 19 -16.387 9.275 -9.044 147 1HB MET 19 HB2 MET 19 -16.696 11.839 -10.673 148 2HB MET 19 HB3 MET 19 -16.987 10.198 -11.265 149 1HG MET 19 HG2 MET 19 -18.603 9.994 -9.217 150 2HG MET 19 HG3 MET 19 -18.553 11.747 -9.206 151 1HE MET 19 HE1 MET 19 -19.240 13.241 -11.343 152 2HE MET 19 HE2 MET 19 -18.345 12.248 -12.519 153 3HE MET 19 HE3 MET 19 -20.069 12.588 -12.778 154 H ALA 20 H ALA 20 -14.178 12.031 -9.883 155 HA ALA 20 HA ALA 20 -12.617 10.660 -11.771 156 1HB ALA 20 HB1 ALA 20 -10.905 12.330 -11.315 157 2HB ALA 20 HB2 ALA 20 -12.495 13.113 -11.299 158 3HB ALA 20 HB3 ALA 20 -11.664 12.751 -9.771 159 H GLU 21 H GLU 21 -12.230 10.825 -8.218 160 HA GLU 21 HA GLU 21 -9.873 9.259 -8.021 161 1HB GLU 21 HB2 GLU 21 -10.545 10.563 -6.201 162 2HB GLU 21 HB3 GLU 21 -12.167 9.845 -6.121 163 1HG GLU 21 HG2 GLU 21 -11.207 7.720 -5.403 164 2HG GLU 21 HG3 GLU 21 -9.577 8.380 -5.502 165 H GLY 22 H GLY 22 -13.344 8.274 -7.986 166 1HA GLY 22 HA1 GLY 22 -12.967 5.528 -7.565 167 2HA GLY 22 HA2 GLY 22 -14.322 6.265 -8.423 168 H TRP 23 H TRP 23 -13.054 7.315 -10.783 169 HA TRP 23 HA TRP 23 -12.592 4.832 -12.243 170 1HB TRP 23 HB2 TRP 23 -12.149 7.727 -13.040 171 2HB TRP 23 HB3 TRP 23 -11.928 6.363 -14.118 172 HD1 TRP 23 HD1 TRP 23 -14.543 8.550 -12.572 173 HE1 TRP 23 HE1 TRP 23 -16.765 8.270 -13.734 174 HE3 TRP 23 HE3 TRP 23 -13.426 4.480 -15.487 175 HZ2 TRP 23 HZ2 TRP 23 -17.909 6.615 -15.758 176 HZ3 TRP 23 HZ3 TRP 23 -15.105 3.643 -17.110 177 HH2 TRP 23 HH2 TRP 23 -17.356 4.732 -17.261 178 H ALA 24 H ALA 24 -10.448 7.417 -10.940 179 HA ALA 24 HA ALA 24 -8.171 6.616 -12.374 180 1HB ALA 24 HB1 ALA 24 -6.903 7.968 -10.740 181 2HB ALA 24 HB2 ALA 24 -8.397 8.800 -11.190 182 3HB ALA 24 HB3 ALA 24 -8.291 7.964 -9.631 183 H LYS 25 H LYS 25 -9.437 5.467 -9.240 184 HA LYS 25 HA LYS 25 -7.228 3.868 -8.480 185 1HB LYS 25 HB2 LYS 25 -10.216 3.558 -8.045 186 2HB LYS 25 HB3 LYS 25 -9.048 2.429 -7.346 187 1HG LYS 25 HG2 LYS 25 -7.993 4.120 -6.023 188 2HG LYS 25 HG3 LYS 25 -8.811 5.428 -6.884 189 1HD LYS 25 HD2 LYS 25 -11.005 4.628 -6.047 190 2HD LYS 25 HD3 LYS 25 -10.183 3.350 -5.115 191 1HE LYS 25 HE2 LYS 25 -8.984 5.017 -3.788 192 2HE LYS 25 HE3 LYS 25 -9.544 6.311 -4.851 193 1HZ LYS 25 HZ1 LYS 25 -10.904 6.428 -3.012 194 2HZ LYS 25 HZ2 LYS 25 -11.850 5.714 -4.119 195 3HZ LYS 25 HZ3 LYS 25 -11.173 4.789 -2.923 196 H GLN 26 H GLN 26 -9.687 3.264 -10.972 197 HA GLN 26 HA GLN 26 -8.933 0.476 -11.355 198 1HB GLN 26 HB2 GLN 26 -10.247 2.298 -13.381 199 2HB GLN 26 HB3 GLN 26 -10.191 0.544 -13.370 200 1HG GLN 26 HG2 GLN 26 -11.609 0.571 -11.272 201 2HG GLN 26 HG3 GLN 26 -11.778 2.332 -11.476 202 1HE2 GLN 26 HE22 GLN 26 -12.100 2.815 -14.043 203 2HE2 GLN 26 HE21 GLN 26 -13.485 1.976 -14.724 204 H TYR 27 H TYR 27 -8.449 3.474 -13.223 205 HA TYR 27 HA TYR 27 -6.784 2.238 -15.164 206 1HB TYR 27 HB2 TYR 27 -7.191 5.176 -14.476 207 2HB TYR 27 HB3 TYR 27 -6.287 4.617 -15.873 208 HD1 TYR 27 HD1 TYR 27 -7.551 2.794 -17.392 209 HD2 TYR 27 HD2 TYR 27 -9.461 5.736 -14.879 210 HE1 TYR 27 HE1 TYR 27 -9.593 2.650 -18.784 211 HE2 TYR 27 HE2 TYR 27 -11.481 5.641 -16.302 212 HH TYR 27 HH TYR 27 -12.514 4.642 -18.147 213 H LEU 28 H LEU 28 -5.857 4.081 -12.251 214 HA LEU 28 HA LEU 28 -3.075 4.265 -13.183 215 1HB LEU 28 HB2 LEU 28 -4.364 5.293 -10.627 216 2HB LEU 28 HB3 LEU 28 -2.785 5.707 -11.251 217 HG LEU 28 HG LEU 28 -5.456 6.487 -12.443 218 1HD1 LEU 28 HD11 LEU 28 -4.699 8.751 -11.987 219 2HD1 LEU 28 HD12 LEU 28 -4.588 7.787 -10.501 220 3HD1 LEU 28 HD13 LEU 28 -3.121 8.155 -11.426 221 1HD2 LEU 28 HD21 LEU 28 -3.981 5.961 -14.338 222 2HD2 LEU 28 HD22 LEU 28 -4.239 7.689 -14.184 223 3HD2 LEU 28 HD23 LEU 28 -2.700 6.978 -13.638 224 H GLY 29 H GLY 29 -4.857 2.688 -10.558 225 1HA GLY 29 HA1 GLY 29 -4.387 0.688 -9.493 226 2HA GLY 29 HA2 GLY 29 -2.861 0.567 -10.373 227 H ASP 30 H ASP 30 -2.597 -0.209 -7.938 228 HA ASP 30 HA ASP 30 -2.522 1.676 -5.848 229 1HB ASP 30 HB2 ASP 30 -2.801 -0.815 -5.666 230 2HB ASP 30 HB3 ASP 30 -1.069 -0.989 -5.981 231 H GLU 31 H GLU 31 -0.249 1.272 -8.326 232 HA GLU 31 HA GLU 31 2.182 2.096 -7.083 233 1HB GLU 31 HB2 GLU 31 1.929 1.053 -9.325 234 2HB GLU 31 HB3 GLU 31 1.127 2.510 -9.918 235 1HG GLU 31 HG2 GLU 31 3.161 3.807 -9.663 236 2HG GLU 31 HG3 GLU 31 3.956 2.487 -8.792 237 H TRP 32 H TRP 32 -0.792 3.710 -7.394 238 HA TRP 32 HA TRP 32 0.463 6.315 -6.734 239 1HB TRP 32 HB2 TRP 32 -2.197 5.941 -8.150 240 2HB TRP 32 HB3 TRP 32 -1.358 7.440 -7.823 241 HD1 TRP 32 HD1 TRP 32 -0.656 4.239 -9.913 242 HE1 TRP 32 HE1 TRP 32 -0.075 4.934 -12.288 243 HE3 TRP 32 HE3 TRP 32 -0.691 9.319 -9.302 244 HZ2 TRP 32 HZ2 TRP 32 0.237 7.347 -13.781 245 HZ3 TRP 32 HZ3 TRP 32 -0.348 10.805 -11.240 246 HH2 TRP 32 HH2 TRP 32 0.106 9.812 -13.521 247 H LYS 33 H LYS 33 -0.592 7.337 -4.977 248 HA LYS 33 HA LYS 33 -2.901 5.877 -3.787 249 1HB LYS 33 HB2 LYS 33 -0.693 6.571 -2.370 250 2HB LYS 33 HB3 LYS 33 -1.542 8.121 -2.331 251 1HG LYS 33 HG2 LYS 33 -2.286 7.078 -0.400 252 2HG LYS 33 HG3 LYS 33 -3.610 6.769 -1.511 253 1HD LYS 33 HD2 LYS 33 -1.399 4.842 -0.667 254 2HD LYS 33 HD3 LYS 33 -3.069 4.830 -0.109 255 1HE LYS 33 HE2 LYS 33 -3.822 4.268 -2.447 256 2HE LYS 33 HE3 LYS 33 -2.125 4.214 -2.942 257 1HZ LYS 33 HZ1 LYS 33 -1.769 2.463 -1.302 258 2HZ LYS 33 HZ2 LYS 33 -3.380 2.426 -0.945 259 3HZ LYS 33 HZ3 LYS 33 -2.817 2.001 -2.435 260 H VAL 34 H VAL 34 -4.832 6.956 -3.630 261 HA VAL 34 HA VAL 34 -4.986 9.379 -5.356 262 HB VAL 34 HB VAL 34 -7.022 7.125 -5.206 263 1HG1 VAL 34 HG11 VAL 34 -6.398 9.026 -7.491 264 2HG1 VAL 34 HG12 VAL 34 -7.802 7.959 -7.303 265 3HG1 VAL 34 HG13 VAL 34 -7.615 9.369 -6.244 266 1HG2 VAL 34 HG21 VAL 34 -5.025 5.941 -5.935 267 2HG2 VAL 34 HG22 VAL 34 -6.077 6.195 -7.328 268 3HG2 VAL 34 HG23 VAL 34 -4.646 7.225 -7.111 269 H TYR 35 H TYR 35 -6.034 11.075 -4.403 270 HA TYR 35 HA TYR 35 -8.181 10.500 -2.497 271 1HB TYR 35 HB2 TYR 35 -6.519 12.770 -1.602 272 2HB TYR 35 HB3 TYR 35 -7.441 11.624 -0.685 273 HD1 TYR 35 HD1 TYR 35 -6.373 9.398 -0.028 274 HD2 TYR 35 HD2 TYR 35 -4.169 12.585 -1.924 275 HE1 TYR 35 HE1 TYR 35 -4.263 8.493 0.904 276 HE2 TYR 35 HE2 TYR 35 -2.083 11.744 -0.934 277 HH TYR 35 HH TYR 35 -1.955 8.835 1.166 278 H SER 36 H SER 36 -9.375 12.548 -2.018 279 HA SER 36 HA SER 36 -9.385 14.468 -4.296 280 1HB SER 36 HB2 SER 36 -11.703 13.042 -2.894 281 2HB SER 36 HB3 SER 36 -11.857 14.303 -4.115 282 HG SER 36 HG SER 36 -10.886 11.678 -4.327 283 H ALA 37 H ALA 37 -9.779 16.563 -3.734 284 HA ALA 37 HA ALA 37 -11.020 17.194 -1.138 285 1HB ALA 37 HB1 ALA 37 -8.562 18.611 -2.145 286 2HB ALA 37 HB2 ALA 37 -9.512 18.876 -0.645 287 3HB ALA 37 HB3 ALA 37 -8.621 17.379 -0.841 288 H GLY 38 H GLY 38 -11.322 19.829 -1.346 289 1HA GLY 38 HA1 GLY 38 -12.080 20.667 -3.986 290 2HA GLY 38 HA2 GLY 38 -13.464 20.285 -2.961 291 H ILE 39 H ILE 39 -13.119 22.844 -3.892 292 HA ILE 39 HA ILE 39 -11.950 24.711 -2.092 293 HB ILE 39 HB ILE 39 -14.314 24.680 -3.975 294 1HG1 ILE 39 HG12 ILE 39 -13.160 26.501 -5.094 295 2HG1 ILE 39 HG13 ILE 39 -11.979 26.607 -3.791 296 1HG2 ILE 39 HG21 ILE 39 -13.806 27.033 -2.132 297 2HG2 ILE 39 HG22 ILE 39 -14.842 27.044 -3.579 298 3HG2 ILE 39 HG23 ILE 39 -15.275 26.028 -2.213 299 1HD1 ILE 39 HD11 ILE 39 -12.307 24.258 -5.698 300 2HD1 ILE 39 HD12 ILE 39 -11.091 25.528 -5.822 301 3HD1 ILE 39 HD13 ILE 39 -11.035 24.418 -4.451 302 H GLU 40 H GLU 40 -15.003 22.889 -1.994 303 HA GLU 40 HA GLU 40 -14.917 23.024 0.931 304 1HB GLU 40 HB2 GLU 40 -17.230 23.618 1.209 305 2HB GLU 40 HB3 GLU 40 -16.389 24.888 0.333 306 1HG GLU 40 HG2 GLU 40 -17.344 24.035 -1.818 307 2HG GLU 40 HG3 GLU 40 -18.195 22.767 -0.935 308 H ALA 41 H ALA 41 -16.894 21.524 1.706 309 HA ALA 41 HA ALA 41 -17.344 19.175 -0.021 310 1HB ALA 41 HB1 ALA 41 -16.634 17.696 1.876 311 2HB ALA 41 HB2 ALA 41 -15.276 18.622 1.199 312 3HB ALA 41 HB3 ALA 41 -16.023 19.111 2.739 313 H HIS 42 H HIS 42 -19.100 17.865 0.910 314 HA HIS 42 HA HIS 42 -20.498 18.881 3.259 315 1HB HIS 42 HB2 HIS 42 -22.692 19.057 2.166 316 2HB HIS 42 HB3 HIS 42 -21.558 20.280 1.630 317 HD1 HIS 42 HD1 HIS 42 -23.361 17.148 0.272 318 HD2 HIS 42 HD2 HIS 42 -21.055 20.449 -0.953 319 HE1 HIS 42 HE1 HIS 42 -23.538 17.246 -2.260 320 H GLY 43 H GLY 43 -20.227 16.402 0.659 321 1HA GLY 43 HA1 GLY 43 -20.012 14.268 2.382 322 2HA GLY 43 HA2 GLY 43 -21.745 14.405 2.049 323 H LEU 44 H LEU 44 -20.635 12.152 1.191 324 HA LEU 44 HA LEU 44 -19.833 12.184 -1.621 325 1HB LEU 44 HB2 LEU 44 -20.555 10.157 0.453 326 2HB LEU 44 HB3 LEU 44 -21.018 9.740 -1.182 327 HG LEU 44 HG LEU 44 -18.802 8.922 -0.432 328 1HD1 LEU 44 HD11 LEU 44 -19.321 8.810 -2.706 329 2HD1 LEU 44 HD12 LEU 44 -18.961 10.540 -2.983 330 3HD1 LEU 44 HD13 LEU 44 -17.664 9.384 -2.600 331 1HD2 LEU 44 HD21 LEU 44 -17.975 10.911 0.753 332 2HD2 LEU 44 HD22 LEU 44 -16.841 10.366 -0.494 333 3HD2 LEU 44 HD23 LEU 44 -17.840 11.791 -0.785 334 H ASN 45 H ASN 45 -21.266 13.138 -3.087 335 HA ASN 45 HA ASN 45 -24.004 13.510 -2.277 336 1HB ASN 45 HB2 ASN 45 -22.608 15.098 -3.709 337 2HB ASN 45 HB3 ASN 45 -22.847 13.972 -5.052 338 1HD2 ASN 45 HD22 ASN 45 -24.750 14.245 -6.209 339 2HD2 ASN 45 HD21 ASN 45 -26.174 15.080 -5.608 340 HA PRO 46 HA PRO 46 -25.130 9.481 -3.454 341 1HB PRO 46 HB2 PRO 46 -27.884 9.610 -3.777 342 2HB PRO 46 HB3 PRO 46 -27.027 9.610 -2.206 343 1HG PRO 46 HG2 PRO 46 -28.050 11.985 -3.776 344 2HG PRO 46 HG3 PRO 46 -28.215 11.657 -2.022 345 1HD PRO 46 HD2 PRO 46 -26.302 13.317 -3.005 346 2HD PRO 46 HD3 PRO 46 -25.954 12.243 -1.613 347 H ASN 47 H ASN 47 -26.128 12.080 -5.700 348 HA ASN 47 HA ASN 47 -26.728 10.335 -7.879 349 1HB ASN 47 HB2 ASN 47 -26.900 12.143 -9.173 350 2HB ASN 47 HB3 ASN 47 -27.001 13.006 -7.653 351 1HD2 ASN 47 HD22 ASN 47 -25.567 13.090 -10.693 352 2HD2 ASN 47 HD21 ASN 47 -24.082 13.924 -10.281 353 H ALA 48 H ALA 48 -23.610 11.606 -6.651 354 HA ALA 48 HA ALA 48 -22.116 10.710 -8.960 355 1HB ALA 48 HB1 ALA 48 -20.162 11.330 -7.555 356 2HB ALA 48 HB2 ALA 48 -21.376 12.625 -7.615 357 3HB ALA 48 HB3 ALA 48 -21.230 11.594 -6.168 358 H VAL 49 H VAL 49 -22.928 9.504 -5.726 359 HA VAL 49 HA VAL 49 -21.335 7.138 -5.735 360 HB VAL 49 HB VAL 49 -23.985 7.739 -4.377 361 1HG1 VAL 49 HG11 VAL 49 -23.817 5.335 -4.579 362 2HG1 VAL 49 HG12 VAL 49 -22.094 5.375 -4.156 363 3HG1 VAL 49 HG13 VAL 49 -23.341 5.766 -2.937 364 1HG2 VAL 49 HG21 VAL 49 -22.015 9.122 -3.630 365 2HG2 VAL 49 HG22 VAL 49 -22.628 8.034 -2.377 366 3HG2 VAL 49 HG23 VAL 49 -21.157 7.607 -3.270 367 H LYS 50 H LYS 50 -24.816 7.614 -6.712 368 HA LYS 50 HA LYS 50 -24.985 4.952 -7.650 369 1HB LYS 50 HB2 LYS 50 -26.911 6.520 -7.065 370 2HB LYS 50 HB3 LYS 50 -26.684 7.280 -8.652 371 1HG LYS 50 HG2 LYS 50 -27.044 5.027 -9.723 372 2HG LYS 50 HG3 LYS 50 -27.297 4.330 -8.116 373 1HD LYS 50 HD2 LYS 50 -29.254 5.828 -7.784 374 2HD LYS 50 HD3 LYS 50 -28.993 6.510 -9.405 375 1HE LYS 50 HE2 LYS 50 -29.308 4.260 -10.407 376 2HE LYS 50 HE3 LYS 50 -29.562 3.575 -8.797 377 1HZ LYS 50 HZ1 LYS 50 -31.539 4.969 -8.589 378 2HZ LYS 50 HZ2 LYS 50 -31.306 5.600 -10.081 379 3HZ LYS 50 HZ3 LYS 50 -31.655 4.019 -9.905 380 H ALA 51 H ALA 51 -24.137 7.979 -9.411 381 HA ALA 51 HA ALA 51 -24.089 6.991 -12.009 382 1HB ALA 51 HB1 ALA 51 -22.344 8.764 -12.408 383 2HB ALA 51 HB2 ALA 51 -23.732 9.364 -11.473 384 3HB ALA 51 HB3 ALA 51 -22.204 8.978 -10.651 385 H MET 52 H MET 52 -21.384 6.888 -9.593 386 HA MET 52 HA MET 52 -19.646 5.397 -11.330 387 1HB MET 52 HB2 MET 52 -19.736 5.954 -8.345 388 2HB MET 52 HB3 MET 52 -18.388 5.161 -9.157 389 1HG MET 52 HG2 MET 52 -19.420 7.966 -9.728 390 2HG MET 52 HG3 MET 52 -17.952 7.562 -8.849 391 1HE MET 52 HE1 MET 52 -16.671 5.276 -10.405 392 2HE MET 52 HE2 MET 52 -15.614 6.085 -11.554 393 3HE MET 52 HE3 MET 52 -15.760 6.712 -9.897 394 H LYS 53 H LYS 53 -21.925 4.511 -8.706 395 HA LYS 53 HA LYS 53 -21.084 1.823 -8.529 396 1HB LYS 53 HB2 LYS 53 -22.324 3.271 -6.880 397 2HB LYS 53 HB3 LYS 53 -23.817 2.922 -7.765 398 1HG LYS 53 HG2 LYS 53 -23.708 0.599 -7.133 399 2HG LYS 53 HG3 LYS 53 -21.998 0.740 -6.656 400 1HD LYS 53 HD2 LYS 53 -22.613 2.325 -4.859 401 2HD LYS 53 HD3 LYS 53 -24.328 2.152 -5.271 402 1HE LYS 53 HE2 LYS 53 -24.387 -0.108 -4.511 403 2HE LYS 53 HE3 LYS 53 -22.631 -0.287 -4.633 404 1HZ LYS 53 HZ1 LYS 53 -23.961 1.431 -2.628 405 2HZ LYS 53 HZ2 LYS 53 -23.354 -0.059 -2.335 406 3HZ LYS 53 HZ3 LYS 53 -22.343 1.157 -2.773 407 H GLU 54 H GLU 54 -23.477 3.354 -10.651 408 HA GLU 54 HA GLU 54 -24.505 0.952 -11.789 409 1HB GLU 54 HB2 GLU 54 -24.345 3.847 -12.707 410 2HB GLU 54 HB3 GLU 54 -25.023 2.606 -13.754 411 1HG GLU 54 HG2 GLU 54 -26.011 3.112 -10.922 412 2HG GLU 54 HG3 GLU 54 -26.680 3.896 -12.349 413 H VAL 55 H VAL 55 -21.372 2.462 -12.121 414 HA VAL 55 HA VAL 55 -20.725 0.840 -14.519 415 HB VAL 55 HB VAL 55 -19.076 2.919 -13.013 416 1HG1 VAL 55 HG11 VAL 55 -17.701 3.012 -15.075 417 2HG1 VAL 55 HG12 VAL 55 -17.571 1.467 -14.266 418 3HG1 VAL 55 HG13 VAL 55 -18.588 1.613 -15.720 419 1HG2 VAL 55 HG21 VAL 55 -20.668 3.165 -15.608 420 2HG2 VAL 55 HG22 VAL 55 -21.041 3.986 -14.082 421 3HG2 VAL 55 HG23 VAL 55 -19.563 4.388 -14.944 422 H GLY 56 H GLY 56 -21.013 0.327 -11.228 423 1HA GLY 56 HA1 GLY 56 -20.406 -1.542 -10.041 424 2HA GLY 56 HA2 GLY 56 -19.191 -1.968 -11.254 425 H ILE 57 H ILE 57 -19.169 1.345 -10.041 426 HA ILE 57 HA ILE 57 -16.729 0.738 -8.439 427 HB ILE 57 HB ILE 57 -17.424 3.256 -9.974 428 1HG1 ILE 57 HG12 ILE 57 -15.482 1.025 -10.707 429 2HG1 ILE 57 HG13 ILE 57 -16.962 1.465 -11.563 430 1HG2 ILE 57 HG21 ILE 57 -15.101 3.929 -9.392 431 2HG2 ILE 57 HG22 ILE 57 -15.972 3.543 -7.914 432 3HG2 ILE 57 HG23 ILE 57 -14.828 2.373 -8.593 433 1HD1 ILE 57 HD11 ILE 57 -14.394 3.075 -11.421 434 2HD1 ILE 57 HD12 ILE 57 -15.214 2.389 -12.831 435 3HD1 ILE 57 HD13 ILE 57 -15.948 3.750 -11.994 436 H ASP 58 H ASP 58 -17.620 0.488 -6.479 437 HA ASP 58 HA ASP 58 -19.843 2.104 -5.499 438 1HB ASP 58 HB2 ASP 58 -19.737 -0.232 -4.913 439 2HB ASP 58 HB3 ASP 58 -18.116 -0.051 -4.232 440 H ILE 59 H ILE 59 -18.768 4.241 -5.751 441 HA ILE 59 HA ILE 59 -16.457 4.833 -4.131 442 HB ILE 59 HB ILE 59 -16.733 7.123 -4.765 443 1HG1 ILE 59 HG12 ILE 59 -19.293 6.507 -6.259 444 2HG1 ILE 59 HG13 ILE 59 -19.314 7.091 -4.602 445 1HG2 ILE 59 HG21 ILE 59 -17.306 5.376 -7.175 446 2HG2 ILE 59 HG22 ILE 59 -16.464 6.940 -7.155 447 3HG2 ILE 59 HG23 ILE 59 -15.727 5.538 -6.371 448 1HD1 ILE 59 HD11 ILE 59 -18.049 9.090 -5.226 449 2HD1 ILE 59 HD12 ILE 59 -18.085 8.609 -6.931 450 3HD1 ILE 59 HD13 ILE 59 -19.591 8.988 -6.067 451 H SER 60 H SER 60 -19.595 4.198 -3.076 452 HA SER 60 HA SER 60 -20.198 6.303 -1.402 453 1HB SER 60 HB2 SER 60 -20.648 3.447 -0.458 454 2HB SER 60 HB3 SER 60 -21.745 4.830 -0.383 455 HG SER 60 HG SER 60 -21.195 3.006 -2.452 456 H ASN 61 H ASN 61 -17.801 3.763 -0.948 457 HA ASN 61 HA ASN 61 -17.414 4.045 1.875 458 1HB ASN 61 HB2 ASN 61 -16.868 1.997 0.566 459 2HB ASN 61 HB3 ASN 61 -15.603 2.887 -0.285 460 1HD2 ASN 61 HD22 ASN 61 -13.573 2.390 0.541 461 2HD2 ASN 61 HD21 ASN 61 -13.236 2.051 2.215 462 H GLN 62 H GLN 62 -16.450 6.075 -0.763 463 HA GLN 62 HA GLN 62 -13.968 7.028 0.341 464 1HB GLN 62 HB2 GLN 62 -15.791 8.261 -1.761 465 2HB GLN 62 HB3 GLN 62 -14.140 8.768 -1.373 466 1HG GLN 62 HG2 GLN 62 -13.302 6.519 -1.998 467 2HG GLN 62 HG3 GLN 62 -14.932 6.035 -2.464 468 1HE2 GLN 62 HE22 GLN 62 -14.752 9.247 -3.557 469 2HE2 GLN 62 HE21 GLN 62 -14.283 8.836 -5.202 470 H THR 63 H THR 63 -13.923 9.539 0.790 471 HA THR 63 HA THR 63 -16.260 10.494 2.256 472 HB THR 63 HB THR 63 -14.590 11.188 4.129 473 HG1 THR 63 HG1 THR 63 -12.665 10.495 3.194 474 1HG2 THR 63 HG21 THR 63 -15.021 9.158 5.378 475 2HG2 THR 63 HG22 THR 63 -16.437 9.527 4.375 476 3HG2 THR 63 HG23 THR 63 -15.319 8.239 3.885 477 H SER 64 H SER 64 -16.014 12.861 2.805 478 HA SER 64 HA SER 64 -14.513 14.206 0.635 479 1HB SER 64 HB2 SER 64 -16.441 15.826 0.761 480 2HB SER 64 HB3 SER 64 -16.831 14.208 0.181 481 HG SER 64 HG SER 64 -17.316 15.199 2.802 482 H ASP 65 H ASP 65 -13.506 16.095 1.071 483 HA ASP 65 HA ASP 65 -13.304 17.298 3.729 484 1HB ASP 65 HB2 ASP 65 -11.623 15.341 3.642 485 2HB ASP 65 HB3 ASP 65 -10.833 16.212 2.314 486 H ILE 66 H ILE 66 -12.109 19.368 3.554 487 HA ILE 66 HA ILE 66 -12.305 20.473 0.822 488 HB ILE 66 HB ILE 66 -12.447 22.578 1.775 489 1HG1 ILE 66 HG12 ILE 66 -11.557 21.406 4.433 490 2HG1 ILE 66 HG13 ILE 66 -10.667 22.554 3.408 491 1HG2 ILE 66 HG21 ILE 66 -14.459 22.430 3.059 492 2HG2 ILE 66 HG22 ILE 66 -14.401 20.941 2.097 493 3HG2 ILE 66 HG23 ILE 66 -13.977 20.899 3.807 494 1HD1 ILE 66 HD11 ILE 66 -13.209 23.058 4.977 495 2HD1 ILE 66 HD12 ILE 66 -11.623 23.820 5.191 496 3HD1 ILE 66 HD13 ILE 66 -12.594 24.177 3.735 497 H ILE 67 H ILE 67 -10.481 21.963 0.220 498 HA ILE 67 HA ILE 67 -8.272 20.415 -0.176 499 HB ILE 67 HB ILE 67 -9.072 22.260 -1.573 500 1HG1 ILE 67 HG12 ILE 67 -6.129 22.276 -0.848 501 2HG1 ILE 67 HG13 ILE 67 -6.956 21.280 -2.054 502 1HG2 ILE 67 HG21 ILE 67 -8.634 24.557 -1.179 503 2HG2 ILE 67 HG22 ILE 67 -9.439 23.946 0.254 504 3HG2 ILE 67 HG23 ILE 67 -7.673 24.215 0.277 505 1HD1 ILE 67 HD11 ILE 67 -5.732 23.047 -3.169 506 2HD1 ILE 67 HD12 ILE 67 -7.458 23.404 -3.348 507 3HD1 ILE 67 HD13 ILE 67 -6.497 24.289 -2.161 508 H ASP 68 H ASP 68 -6.373 19.997 0.677 509 HA ASP 68 HA ASP 68 -5.559 21.408 3.171 510 1HB ASP 68 HB2 ASP 68 -6.584 19.188 3.614 511 2HB ASP 68 HB3 ASP 68 -5.348 18.431 2.594 512 H SER 69 H SER 69 -3.719 22.462 2.774 513 HA SER 69 HA SER 69 -2.044 22.080 0.551 514 1HB SER 69 HB2 SER 69 -0.445 23.473 2.066 515 2HB SER 69 HB3 SER 69 -1.934 24.187 1.434 516 HG SER 69 HG SER 69 -1.661 24.589 3.678 517 H ASP 70 H ASP 70 -2.178 20.413 3.660 518 HA ASP 70 HA ASP 70 0.529 19.516 3.687 519 1HB ASP 70 HB2 ASP 70 -0.955 19.825 5.684 520 2HB ASP 70 HB3 ASP 70 -1.836 18.374 5.191 521 H ILE 71 H ILE 71 -1.906 18.540 1.583 522 HA ILE 71 HA ILE 71 -0.417 15.975 1.085 523 HB ILE 71 HB ILE 71 -3.381 16.575 0.663 524 1HG1 ILE 71 HG12 ILE 71 -1.962 14.369 2.224 525 2HG1 ILE 71 HG13 ILE 71 -2.655 15.830 2.953 526 1HG2 ILE 71 HG21 ILE 71 -2.496 15.392 -1.333 527 2HG2 ILE 71 HG22 ILE 71 -1.774 14.152 -0.284 528 3HG2 ILE 71 HG23 ILE 71 -3.539 14.344 -0.399 529 1HD1 ILE 71 HD11 ILE 71 -4.189 13.586 1.589 530 2HD1 ILE 71 HD12 ILE 71 -4.217 14.057 3.292 531 3HD1 ILE 71 HD13 ILE 71 -4.912 15.144 2.072 532 H LEU 72 H LEU 72 -2.304 18.682 -0.292 533 HA LEU 72 HA LEU 72 -1.744 18.549 -2.954 534 1HB LEU 72 HB2 LEU 72 -3.114 20.226 -1.732 535 2HB LEU 72 HB3 LEU 72 -1.644 20.872 -1.036 536 HG LEU 72 HG LEU 72 -0.991 21.379 -3.567 537 1HD1 LEU 72 HD11 LEU 72 -3.016 20.258 -4.512 538 2HD1 LEU 72 HD12 LEU 72 -4.051 21.385 -3.625 539 3HD1 LEU 72 HD13 LEU 72 -2.968 21.987 -4.899 540 1HD2 LEU 72 HD21 LEU 72 -2.995 22.879 -1.833 541 2HD2 LEU 72 HD22 LEU 72 -1.221 23.016 -1.789 542 3HD2 LEU 72 HD23 LEU 72 -2.109 23.594 -3.216 543 H ASN 73 H ASN 73 0.402 20.177 -0.530 544 HA ASN 73 HA ASN 73 2.311 20.894 -2.484 545 1HB ASN 73 HB2 ASN 73 3.438 22.001 -0.851 546 2HB ASN 73 HB3 ASN 73 1.850 21.909 -0.102 547 1HD2 ASN 73 HD22 ASN 73 1.535 20.082 1.478 548 2HD2 ASN 73 HD21 ASN 73 2.910 19.669 2.495 549 H ASN 74 H ASN 74 1.817 17.766 -1.464 550 HA ASN 74 HA ASN 74 4.607 17.002 -2.122 551 1HB ASN 74 HB2 ASN 74 4.565 15.246 -0.394 552 2HB ASN 74 HB3 ASN 74 4.516 16.865 0.284 553 1HD2 ASN 74 HD22 ASN 74 2.741 17.524 1.471 554 2HD2 ASN 74 HD21 ASN 74 1.470 16.438 1.972 555 H ALA 75 H ALA 75 1.479 16.822 -3.154 556 HA ALA 75 HA ALA 75 1.366 14.075 -3.946 557 1HB ALA 75 HB1 ALA 75 0.060 16.548 -5.158 558 2HB ALA 75 HB2 ALA 75 -0.388 14.857 -5.475 559 3HB ALA 75 HB3 ALA 75 -0.632 15.547 -3.859 560 H ASP 76 H ASP 76 1.890 13.275 -6.183 561 HA ASP 76 HA ASP 76 4.221 14.583 -7.423 562 1HB ASP 76 HB2 ASP 76 3.914 12.124 -7.605 563 2HB ASP 76 HB3 ASP 76 2.387 12.372 -8.468 564 H LEU 77 H LEU 77 0.725 14.420 -7.749 565 HA LEU 77 HA LEU 77 0.686 16.515 -9.828 566 1HB LEU 77 HB2 LEU 77 0.684 14.444 -11.017 567 2HB LEU 77 HB3 LEU 77 -0.467 13.720 -9.892 568 HG LEU 77 HG LEU 77 -2.241 15.262 -10.707 569 1HD1 LEU 77 HD11 LEU 77 -0.734 17.069 -11.682 570 2HD1 LEU 77 HD12 LEU 77 -0.342 15.939 -12.995 571 3HD1 LEU 77 HD13 LEU 77 -2.000 16.503 -12.765 572 1HD2 LEU 77 HD21 LEU 77 -2.578 14.026 -12.809 573 2HD2 LEU 77 HD22 LEU 77 -0.856 13.578 -12.816 574 3HD2 LEU 77 HD23 LEU 77 -1.932 12.955 -11.556 575 H VAL 78 H VAL 78 -1.026 17.777 -9.740 576 HA VAL 78 HA VAL 78 -3.287 17.176 -7.898 577 HB VAL 78 HB VAL 78 -1.934 19.827 -8.544 578 1HG1 VAL 78 HG11 VAL 78 -4.397 19.329 -6.799 579 2HG1 VAL 78 HG12 VAL 78 -3.553 20.882 -7.004 580 3HG1 VAL 78 HG13 VAL 78 -4.391 20.157 -8.372 581 1HG2 VAL 78 HG21 VAL 78 -1.379 19.949 -6.190 582 2HG2 VAL 78 HG22 VAL 78 -2.243 18.420 -5.858 583 3HG2 VAL 78 HG23 VAL 78 -0.766 18.431 -6.826 584 H VAL 79 H VAL 79 -5.314 17.366 -8.960 585 HA VAL 79 HA VAL 79 -5.196 18.242 -11.819 586 HB VAL 79 HB VAL 79 -6.892 15.955 -10.794 587 1HG1 VAL 79 HG11 VAL 79 -7.288 15.561 -13.196 588 2HG1 VAL 79 HG12 VAL 79 -7.787 17.198 -12.745 589 3HG1 VAL 79 HG13 VAL 79 -6.253 16.954 -13.606 590 1HG2 VAL 79 HG21 VAL 79 -4.597 15.171 -10.733 591 2HG2 VAL 79 HG22 VAL 79 -5.393 14.487 -12.150 592 3HG2 VAL 79 HG23 VAL 79 -4.279 15.858 -12.346 593 H THR 80 H THR 80 -6.257 20.109 -11.942 594 HA THR 80 HA THR 80 -8.386 20.707 -9.977 595 HB THR 80 HB THR 80 -8.167 23.007 -10.937 596 HG1 THR 80 HG1 THR 80 -7.199 22.304 -12.928 597 1HG2 THR 80 HG21 THR 80 -5.983 23.462 -9.864 598 2HG2 THR 80 HG22 THR 80 -6.930 22.319 -8.897 599 3HG2 THR 80 HG23 THR 80 -5.589 21.732 -9.891 600 H LEU 81 H LEU 81 -10.048 19.456 -10.635 601 HA LEU 81 HA LEU 81 -10.539 18.712 -13.338 602 1HB LEU 81 HB2 LEU 81 -12.274 18.559 -10.857 603 2HB LEU 81 HB3 LEU 81 -12.713 17.802 -12.385 604 HG LEU 81 HG LEU 81 -10.151 17.151 -10.856 605 1HD1 LEU 81 HD11 LEU 81 -12.803 15.664 -10.892 606 2HD1 LEU 81 HD12 LEU 81 -11.307 15.142 -10.094 607 3HD1 LEU 81 HD13 LEU 81 -12.139 16.595 -9.523 608 1HD2 LEU 81 HD21 LEU 81 -10.023 16.544 -13.246 609 2HD2 LEU 81 HD22 LEU 81 -10.168 15.091 -12.259 610 3HD2 LEU 81 HD23 LEU 81 -11.576 15.707 -13.140 611 H CYS 82 H CYS 82 -11.236 21.739 -11.955 612 HA CYS 82 HA CYS 82 -12.672 22.396 -14.363 613 1HB CYS 82 HB2 CYS 82 -14.532 21.857 -12.786 614 2HB CYS 82 HB3 CYS 82 -13.902 23.081 -11.657 615 HG CYS 82 HG CYS 82 -16.024 23.983 -12.941 616 H GLY 83 H GLY 83 -11.771 24.300 -15.060 617 1HA GLY 83 HA1 GLY 83 -9.449 25.280 -13.975 618 2HA GLY 83 HA2 GLY 83 -10.462 26.166 -15.129 619 H ASP 84 H ASP 84 -12.764 26.475 -13.289 620 HA ASP 84 HA ASP 84 -12.005 28.872 -11.947 621 1HB ASP 84 HB2 ASP 84 -14.304 28.364 -12.699 622 2HB ASP 84 HB3 ASP 84 -14.424 27.086 -11.484 623 H ALA 85 H ALA 85 -12.000 25.490 -10.883 624 HA ALA 85 HA ALA 85 -11.852 26.037 -8.045 625 1HB ALA 85 HB1 ALA 85 -10.820 23.554 -9.480 626 2HB ALA 85 HB2 ALA 85 -11.420 23.713 -7.826 627 3HB ALA 85 HB3 ALA 85 -12.549 23.816 -9.188 628 H ALA 86 H ALA 86 -9.532 25.873 -10.720 629 HA ALA 86 HA ALA 86 -7.225 25.227 -9.220 630 1HB ALA 86 HB1 ALA 86 -7.365 26.861 -11.786 631 2HB ALA 86 HB2 ALA 86 -5.998 25.908 -11.189 632 3HB ALA 86 HB3 ALA 86 -7.487 25.086 -11.725 633 H ASP 87 H ASP 87 -8.952 28.239 -9.446 634 HA ASP 87 HA ASP 87 -6.972 30.132 -8.781 635 1HB ASP 87 HB2 ASP 87 -9.326 30.668 -9.369 636 2HB ASP 87 HB3 ASP 87 -9.860 29.927 -7.850 637 H LYS 88 H LYS 88 -8.631 27.706 -6.790 638 HA LYS 88 HA LYS 88 -8.018 28.996 -4.281 639 1HB LYS 88 HB2 LYS 88 -9.978 27.502 -4.739 640 2HB LYS 88 HB3 LYS 88 -8.870 26.130 -4.888 641 1HG LYS 88 HG2 LYS 88 -9.935 26.090 -2.755 642 2HG LYS 88 HG3 LYS 88 -8.218 26.409 -2.523 643 1HD LYS 88 HD2 LYS 88 -8.656 28.775 -2.086 644 2HD LYS 88 HD3 LYS 88 -10.370 28.577 -2.534 645 1HE LYS 88 HE2 LYS 88 -10.678 26.975 -0.688 646 2HE LYS 88 HE3 LYS 88 -8.974 27.133 -0.241 647 1HZ LYS 88 HZ1 LYS 88 -9.393 29.471 0.280 648 2HZ LYS 88 HZ2 LYS 88 -10.969 29.329 -0.135 649 3HZ LYS 88 HZ3 LYS 88 -10.385 28.521 1.152 650 H CYS 89 H CYS 89 -6.314 26.562 -6.191 651 HA CYS 89 HA CYS 89 -5.005 25.106 -4.322 652 1HB CYS 89 HB2 CYS 89 -3.911 26.060 -6.985 653 2HB CYS 89 HB3 CYS 89 -3.266 24.703 -6.044 654 HG CYS 89 HG CYS 89 -5.438 23.286 -5.972 655 HA PRO 90 HA PRO 90 -2.821 28.493 -2.396 656 1HB PRO 90 HB2 PRO 90 -1.991 27.325 -0.063 657 2HB PRO 90 HB3 PRO 90 -3.670 27.851 -0.418 658 1HG PRO 90 HG2 PRO 90 -2.506 25.067 -0.706 659 2HG PRO 90 HG3 PRO 90 -4.037 25.548 0.107 660 1HD PRO 90 HD2 PRO 90 -4.080 24.652 -2.437 661 2HD PRO 90 HD3 PRO 90 -5.097 26.019 -1.933 662 H MET 91 H MET 91 -1.157 25.420 -3.073 663 HA MET 91 HA MET 91 1.141 26.841 -4.003 664 1HB MET 91 HB2 MET 91 2.810 25.752 -2.494 665 2HB MET 91 HB3 MET 91 1.807 26.941 -1.684 666 1HG MET 91 HG2 MET 91 0.380 25.043 -0.791 667 2HG MET 91 HG3 MET 91 1.528 23.919 -1.513 668 1HE MET 91 HE1 MET 91 2.009 27.326 0.588 669 2HE MET 91 HE2 MET 91 0.721 26.374 1.362 670 3HE MET 91 HE3 MET 91 2.281 26.596 2.183 671 H THR 92 H THR 92 1.947 25.650 -5.710 672 HA THR 92 HA THR 92 2.019 22.711 -5.473 673 HB THR 92 HB THR 92 1.228 22.441 -7.825 674 HG1 THR 92 HG1 THR 92 1.372 24.659 -8.443 675 1HG2 THR 92 HG21 THR 92 -0.930 23.612 -6.044 676 2HG2 THR 92 HG22 THR 92 -1.101 22.408 -7.338 677 3HG2 THR 92 HG23 THR 92 -0.239 21.989 -5.849 678 HA PRO 93 HA PRO 93 6.088 24.674 -6.572 679 1HB PRO 93 HB2 PRO 93 6.869 22.084 -5.221 680 2HB PRO 93 HB3 PRO 93 7.639 23.695 -5.086 681 1HG PRO 93 HG2 PRO 93 6.032 22.787 -3.111 682 2HG PRO 93 HG3 PRO 93 5.901 24.492 -3.660 683 1HD PRO 93 HD2 PRO 93 4.151 22.139 -4.402 684 2HD PRO 93 HD3 PRO 93 3.684 23.803 -3.951 685 HA PRO 94 HA PRO 94 7.069 22.231 -10.218 686 1HB PRO 94 HB2 PRO 94 9.862 21.838 -9.125 687 2HB PRO 94 HB3 PRO 94 9.359 22.323 -10.776 688 1HG PRO 94 HG2 PRO 94 10.243 24.191 -9.029 689 2HG PRO 94 HG3 PRO 94 8.794 24.527 -10.032 690 1HD PRO 94 HD2 PRO 94 8.917 23.648 -7.142 691 2HD PRO 94 HD3 PRO 94 7.882 24.894 -7.903 692 H HIS 95 H HIS 95 8.019 20.779 -7.109 693 HA HIS 95 HA HIS 95 8.226 18.069 -8.019 694 1HB HIS 95 HB2 HIS 95 7.497 19.131 -5.259 695 2HB HIS 95 HB3 HIS 95 8.106 17.523 -5.635 696 HD1 HIS 95 HD1 HIS 95 10.736 17.763 -7.001 697 HD2 HIS 95 HD2 HIS 95 9.335 20.710 -4.334 698 HE1 HIS 95 HE1 HIS 95 12.780 19.080 -6.252 699 H VAL 96 H VAL 96 5.519 20.064 -7.947 700 HA VAL 96 HA VAL 96 3.516 17.897 -7.608 701 HB VAL 96 HB VAL 96 3.338 20.787 -6.626 702 1HG1 VAL 96 HG11 VAL 96 1.551 18.413 -6.038 703 2HG1 VAL 96 HG12 VAL 96 1.312 20.105 -5.542 704 3HG1 VAL 96 HG13 VAL 96 1.202 19.669 -7.247 705 1HG2 VAL 96 HG21 VAL 96 4.963 19.775 -5.174 706 2HG2 VAL 96 HG22 VAL 96 3.421 19.914 -4.333 707 3HG2 VAL 96 HG23 VAL 96 3.944 18.339 -4.949 708 H LYS 97 H LYS 97 3.500 17.711 -9.923 709 HA LYS 97 HA LYS 97 3.265 20.084 -11.586 710 1HB LYS 97 HB2 LYS 97 3.299 18.648 -13.410 711 2HB LYS 97 HB3 LYS 97 4.287 17.813 -12.221 712 1HG LYS 97 HG2 LYS 97 1.952 16.605 -11.664 713 2HG LYS 97 HG3 LYS 97 1.576 17.133 -13.317 714 1HD LYS 97 HD2 LYS 97 3.735 16.002 -14.055 715 2HD LYS 97 HD3 LYS 97 3.909 15.420 -12.387 716 1HE LYS 97 HE2 LYS 97 1.455 14.500 -12.754 717 2HE LYS 97 HE3 LYS 97 1.815 14.668 -14.472 718 1HZ LYS 97 HZ1 LYS 97 3.269 13.040 -12.441 719 2HZ LYS 97 HZ2 LYS 97 2.393 12.464 -13.702 720 3HZ LYS 97 HZ3 LYS 97 3.807 13.227 -13.994 721 H ARG 98 H ARG 98 1.289 20.257 -13.050 722 HA ARG 98 HA ARG 98 -1.197 19.541 -11.625 723 1HB ARG 98 HB2 ARG 98 -0.186 22.299 -12.087 724 2HB ARG 98 HB3 ARG 98 -1.803 22.015 -12.720 725 1HG ARG 98 HG2 ARG 98 -2.447 21.033 -10.470 726 2HG ARG 98 HG3 ARG 98 -0.872 21.569 -9.858 727 1HD ARG 98 HD2 ARG 98 -2.610 23.179 -9.270 728 2HD ARG 98 HD3 ARG 98 -1.488 23.915 -10.409 729 HE ARG 98 HE ARG 98 -4.216 22.820 -11.067 730 1HH1 ARG 98 HH21 ARG 98 -1.647 25.170 -11.826 731 2HH1 ARG 98 HH22 ARG 98 -2.510 25.869 -13.142 732 1HH2 ARG 98 HH11 ARG 98 -5.336 23.731 -12.751 733 2HH2 ARG 98 HH12 ARG 98 -4.673 25.041 -13.684 734 H GLU 99 H GLU 99 -3.054 19.471 -12.881 735 HA GLU 99 HA GLU 99 -2.859 19.923 -15.734 736 1HB GLU 99 HB2 GLU 99 -2.245 17.503 -15.409 737 2HB GLU 99 HB3 GLU 99 -3.803 17.233 -14.624 738 1HG GLU 99 HG2 GLU 99 -3.647 16.516 -17.011 739 2HG GLU 99 HG3 GLU 99 -4.992 17.604 -16.655 740 H HIS 100 H HIS 100 -5.181 19.979 -16.607 741 HA HIS 100 HA HIS 100 -7.123 20.744 -14.534 742 1HB HIS 100 HB2 HIS 100 -7.295 23.016 -15.373 743 2HB HIS 100 HB3 HIS 100 -5.655 22.700 -14.830 744 HD1 HIS 100 HD1 HIS 100 -4.720 21.329 -17.799 745 HD2 HIS 100 HD2 HIS 100 -6.630 25.005 -16.959 746 HE1 HIS 100 HE1 HIS 100 -4.185 22.875 -19.727 747 H TRP 101 H TRP 101 -9.230 20.976 -15.240 748 HA TRP 101 HA TRP 101 -9.901 20.535 -18.080 749 1HB TRP 101 HB2 TRP 101 -11.062 18.796 -15.895 750 2HB TRP 101 HB3 TRP 101 -11.282 18.675 -17.644 751 HD1 TRP 101 HD1 TRP 101 -8.980 17.672 -14.847 752 HE1 TRP 101 HE1 TRP 101 -7.081 16.181 -15.663 753 HE3 TRP 101 HE3 TRP 101 -9.677 18.188 -19.895 754 HZ2 TRP 101 HZ2 TRP 101 -5.976 15.321 -18.192 755 HZ3 TRP 101 HZ3 TRP 101 -8.158 17.043 -21.485 756 HH2 TRP 101 HH2 TRP 101 -6.313 15.591 -20.641 757 H GLY 102 H GLY 102 -12.785 20.222 -17.464 758 1HA GLY 102 HA1 GLY 102 -13.428 22.885 -16.275 759 2HA GLY 102 HA2 GLY 102 -13.743 22.574 -17.975 760 H PHE 103 H PHE 103 -14.215 20.340 -15.146 761 HA PHE 103 HA PHE 103 -16.823 19.686 -16.281 762 1HB PHE 103 HB2 PHE 103 -15.213 18.483 -14.014 763 2HB PHE 103 HB3 PHE 103 -16.817 17.917 -14.502 764 HD1 PHE 103 HD1 PHE 103 -17.218 17.232 -16.928 765 HD2 PHE 103 HD2 PHE 103 -13.269 17.819 -15.293 766 HE1 PHE 103 HE1 PHE 103 -16.233 16.149 -18.921 767 HE2 PHE 103 HE2 PHE 103 -12.282 16.742 -17.280 768 HZ PHE 103 HZ PHE 103 -13.769 15.936 -19.133 769 H ASP 104 H ASP 104 -18.458 20.943 -15.894 770 HA ASP 104 HA ASP 104 -19.024 22.407 -13.483 771 1HB ASP 104 HB2 ASP 104 -19.987 22.931 -15.723 772 2HB ASP 104 HB3 ASP 104 -20.838 21.377 -15.696 773 H ASP 105 H ASP 105 -20.832 21.883 -11.987 774 HA ASP 105 HA ASP 105 -20.346 19.224 -11.010 775 1HB ASP 105 HB2 ASP 105 -20.609 21.292 -9.581 776 2HB ASP 105 HB3 ASP 105 -22.351 21.148 -9.846 777 HA PRO 106 HA PRO 106 -23.707 17.527 -13.305 778 1HB PRO 106 HB2 PRO 106 -23.690 14.912 -12.403 779 2HB PRO 106 HB3 PRO 106 -22.481 15.586 -13.535 780 1HG PRO 106 HG2 PRO 106 -22.254 15.257 -10.529 781 2HG PRO 106 HG3 PRO 106 -21.057 14.821 -11.791 782 1HD PRO 106 HD2 PRO 106 -20.892 17.157 -10.405 783 2HD PRO 106 HD3 PRO 106 -20.464 17.078 -12.144 784 H ALA 107 H ALA 107 -23.683 17.318 -9.720 785 HA ALA 107 HA ALA 107 -26.336 16.285 -9.503 786 1HB ALA 107 HB1 ALA 107 -24.766 17.948 -7.490 787 2HB ALA 107 HB2 ALA 107 -26.164 16.917 -7.154 788 3HB ALA 107 HB3 ALA 107 -24.629 16.200 -7.691 789 H ARG 108 H ARG 108 -25.152 19.429 -10.322 790 HA ARG 108 HA ARG 108 -27.715 20.753 -9.607 791 1HB ARG 108 HB2 ARG 108 -24.943 21.886 -10.218 792 2HB ARG 108 HB3 ARG 108 -26.398 22.850 -10.006 793 1HG ARG 108 HG2 ARG 108 -25.506 22.995 -7.911 794 2HG ARG 108 HG3 ARG 108 -26.659 21.673 -7.711 795 1HD ARG 108 HD2 ARG 108 -24.736 20.057 -7.954 796 2HD ARG 108 HD3 ARG 108 -23.638 21.440 -8.047 797 HE ARG 108 HE ARG 108 -25.106 21.828 -5.730 798 1HH1 ARG 108 HH21 ARG 108 -22.891 19.260 -6.894 799 2HH1 ARG 108 HH22 ARG 108 -22.324 18.882 -5.306 800 1HH2 ARG 108 HH11 ARG 108 -24.363 21.257 -3.644 801 2HH2 ARG 108 HH12 ARG 108 -23.201 19.996 -3.427 802 H ALA 109 H ALA 109 -26.559 19.085 -12.230 803 HA ALA 109 HA ALA 109 -27.244 20.780 -14.416 804 1HB ALA 109 HB1 ALA 109 -26.035 18.616 -14.668 805 2HB ALA 109 HB2 ALA 109 -27.483 17.745 -14.105 806 3HB ALA 109 HB3 ALA 109 -27.536 18.641 -15.630 807 H GLN 110 H GLN 110 -29.286 21.134 -15.319 808 HA GLN 110 HA GLN 110 -31.691 19.996 -14.006 809 1HB GLN 110 HB2 GLN 110 -30.855 22.929 -14.070 810 2HB GLN 110 HB3 GLN 110 -32.547 22.466 -13.926 811 1HG GLN 110 HG2 GLN 110 -32.262 21.475 -11.803 812 2HG GLN 110 HG3 GLN 110 -30.514 21.382 -11.957 813 1HE2 GLN 110 HE22 GLN 110 -29.199 23.188 -11.612 814 2HE2 GLN 110 HE21 GLN 110 -29.811 24.664 -10.878 815 H GLY 111 H GLY 111 -33.594 20.353 -15.301 816 1HA GLY 111 HA1 GLY 111 -34.191 21.922 -17.368 817 2HA GLY 111 HA2 GLY 111 -33.190 20.709 -18.198 818 H THR 112 H THR 112 -33.708 18.370 -17.178 819 HA THR 112 HA THR 112 -36.370 17.880 -16.301 820 HB THR 112 HB THR 112 -36.947 18.021 -18.633 821 HG1 THR 112 HG1 THR 112 -37.903 16.089 -18.802 822 1HG2 THR 112 HG21 THR 112 -36.015 16.524 -20.356 823 2HG2 THR 112 HG22 THR 112 -34.805 17.657 -19.747 824 3HG2 THR 112 HG23 THR 112 -34.787 15.960 -19.207 825 H GLU 113 H GLU 113 -36.492 15.518 -15.635 826 HA GLU 113 HA GLU 113 -34.157 15.029 -14.110 827 1HB GLU 113 HB2 GLU 113 -36.354 14.335 -13.353 828 2HB GLU 113 HB3 GLU 113 -36.562 13.264 -14.748 829 1HG GLU 113 HG2 GLU 113 -34.765 11.810 -13.984 830 2HG GLU 113 HG3 GLU 113 -34.362 12.920 -12.667 831 H GLU 114 H GLU 114 -35.288 13.580 -17.157 832 HA GLU 114 HA GLU 114 -33.208 11.626 -17.264 833 1HB GLU 114 HB2 GLU 114 -33.877 11.268 -19.580 834 2HB GLU 114 HB3 GLU 114 -35.274 11.327 -18.507 835 1HG GLU 114 HG2 GLU 114 -35.727 13.669 -19.233 836 2HG GLU 114 HG3 GLU 114 -34.334 13.598 -20.317 837 H GLU 115 H GLU 115 -33.332 15.041 -18.144 838 HA GLU 115 HA GLU 115 -30.922 14.946 -19.734 839 1HB GLU 115 HB2 GLU 115 -32.549 16.583 -20.286 840 2HB GLU 115 HB3 GLU 115 -32.571 17.241 -18.644 841 1HG GLU 115 HG2 GLU 115 -30.485 18.263 -18.863 842 2HG GLU 115 HG3 GLU 115 -29.997 17.231 -20.219 843 H LYS 116 H LYS 116 -31.840 15.905 -16.406 844 HA LYS 116 HA LYS 116 -29.307 16.566 -15.399 845 1HB LYS 116 HB2 LYS 116 -31.408 17.023 -14.266 846 2HB LYS 116 HB3 LYS 116 -31.765 15.299 -14.113 847 1HG LYS 116 HG2 LYS 116 -29.904 14.974 -12.621 848 2HG LYS 116 HG3 LYS 116 -29.367 16.644 -12.844 849 1HD LYS 116 HD2 LYS 116 -32.017 16.950 -11.980 850 2HD LYS 116 HD3 LYS 116 -31.493 15.492 -11.115 851 1HE LYS 116 HE2 LYS 116 -29.356 16.910 -10.534 852 2HE LYS 116 HE3 LYS 116 -30.309 18.286 -11.098 853 1HZ LYS 116 HZ1 LYS 116 -31.936 17.814 -9.379 854 2HZ LYS 116 HZ2 LYS 116 -31.095 16.507 -8.862 855 3HZ LYS 116 HZ3 LYS 116 -30.457 17.998 -8.710 856 H TRP 117 H TRP 117 -30.940 13.357 -15.445 857 HA TRP 117 HA TRP 117 -28.741 11.916 -14.366 858 1HB TRP 117 HB2 TRP 117 -30.997 10.956 -14.539 859 2HB TRP 117 HB3 TRP 117 -30.882 10.945 -16.299 860 HD1 TRP 117 HD1 TRP 117 -29.393 9.052 -17.421 861 HE1 TRP 117 HE1 TRP 117 -28.324 6.877 -16.574 862 HE3 TRP 117 HE3 TRP 117 -29.803 9.845 -12.385 863 HZ2 TRP 117 HZ2 TRP 117 -27.469 5.778 -14.072 864 HZ3 TRP 117 HZ3 TRP 117 -28.710 8.297 -10.792 865 HH2 TRP 117 HH2 TRP 117 -27.534 6.258 -11.620 866 H ALA 118 H ALA 118 -29.603 12.628 -17.818 867 HA ALA 118 HA ALA 118 -27.470 11.177 -18.950 868 1HB ALA 118 HB1 ALA 118 -28.786 13.724 -19.988 869 2HB ALA 118 HB2 ALA 118 -27.798 12.596 -20.937 870 3HB ALA 118 HB3 ALA 118 -29.352 12.062 -20.268 871 H PHE 119 H PHE 119 -27.535 14.538 -17.663 872 HA PHE 119 HA PHE 119 -24.902 15.221 -18.438 873 1HB PHE 119 HB2 PHE 119 -26.831 16.665 -17.460 874 2HB PHE 119 HB3 PHE 119 -26.211 16.189 -15.890 875 HD1 PHE 119 HD1 PHE 119 -25.885 18.445 -18.683 876 HD2 PHE 119 HD2 PHE 119 -23.725 16.749 -15.359 877 HE1 PHE 119 HE1 PHE 119 -24.289 20.342 -18.747 878 HE2 PHE 119 HE2 PHE 119 -22.159 18.683 -15.390 879 HZ PHE 119 HZ PHE 119 -22.431 20.467 -17.104 880 H PHE 120 H PHE 120 -26.121 13.467 -15.505 881 HA PHE 120 HA PHE 120 -23.633 13.219 -14.161 882 1HB PHE 120 HB2 PHE 120 -25.629 10.951 -14.305 883 2HB PHE 120 HB3 PHE 120 -24.447 11.282 -13.076 884 HD1 PHE 120 HD1 PHE 120 -26.995 10.453 -12.322 885 HD2 PHE 120 HD2 PHE 120 -25.740 14.484 -13.238 886 HE1 PHE 120 HE1 PHE 120 -28.800 11.354 -10.879 887 HE2 PHE 120 HE2 PHE 120 -27.500 15.354 -11.754 888 HZ PHE 120 HZ PHE 120 -29.040 13.805 -10.572 889 H GLN 121 H GLN 121 -25.196 11.133 -16.665 890 HA GLN 121 HA GLN 121 -23.126 9.220 -16.802 891 1HB GLN 121 HB2 GLN 121 -25.044 9.980 -19.027 892 2HB GLN 121 HB3 GLN 121 -24.078 8.512 -18.925 893 1HG GLN 121 HG2 GLN 121 -26.392 9.298 -17.121 894 2HG GLN 121 HG3 GLN 121 -26.344 7.997 -18.289 895 1HE2 GLN 121 HE22 GLN 121 -25.746 8.837 -14.980 896 2HE2 GLN 121 HE21 GLN 121 -25.029 7.317 -14.506 897 H ARG 122 H ARG 122 -23.586 12.178 -18.758 898 HA ARG 122 HA ARG 122 -21.317 11.793 -20.433 899 1HB ARG 122 HB2 ARG 122 -22.948 14.217 -19.623 900 2HB ARG 122 HB3 ARG 122 -21.386 14.465 -20.390 901 1HG ARG 122 HG2 ARG 122 -22.972 14.540 -22.122 902 2HG ARG 122 HG3 ARG 122 -22.068 13.035 -22.303 903 1HD ARG 122 HD2 ARG 122 -23.976 11.809 -21.225 904 2HD ARG 122 HD3 ARG 122 -24.862 13.334 -21.121 905 HE ARG 122 HE ARG 122 -24.303 11.711 -23.510 906 1HH1 ARG 122 HH21 ARG 122 -25.598 14.792 -22.297 907 2HH1 ARG 122 HH22 ARG 122 -26.520 15.122 -23.715 908 1HH2 ARG 122 HH11 ARG 122 -25.519 12.163 -25.400 909 2HH2 ARG 122 HH12 ARG 122 -26.465 13.596 -25.519 910 H VAL 123 H VAL 123 -21.579 13.590 -17.299 911 HA VAL 123 HA VAL 123 -18.816 14.314 -17.388 912 HB VAL 123 HB VAL 123 -20.775 14.205 -15.054 913 1HG1 VAL 123 HG11 VAL 123 -18.469 14.152 -14.148 914 2HG1 VAL 123 HG12 VAL 123 -18.016 15.517 -15.182 915 3HG1 VAL 123 HG13 VAL 123 -19.204 15.737 -13.879 916 1HG2 VAL 123 HG21 VAL 123 -19.718 16.542 -16.736 917 2HG2 VAL 123 HG22 VAL 123 -21.344 15.857 -16.857 918 3HG2 VAL 123 HG23 VAL 123 -20.839 16.671 -15.372 919 H ARG 124 H ARG 124 -20.399 11.414 -15.733 920 HA ARG 124 HA ARG 124 -17.871 10.577 -14.734 921 1HB ARG 124 HB2 ARG 124 -18.745 8.310 -14.510 922 2HB ARG 124 HB3 ARG 124 -19.870 9.494 -13.842 923 1HG ARG 124 HG2 ARG 124 -21.379 9.203 -15.665 924 2HG ARG 124 HG3 ARG 124 -20.203 8.313 -16.627 925 1HD ARG 124 HD2 ARG 124 -20.242 6.516 -14.821 926 2HD ARG 124 HD3 ARG 124 -21.642 7.355 -14.161 927 HE ARG 124 HE ARG 124 -22.953 6.535 -15.854 928 1HH1 ARG 124 HH21 ARG 124 -19.584 6.035 -16.922 929 2HH1 ARG 124 HH22 ARG 124 -20.051 5.142 -18.322 930 1HH2 ARG 124 HH11 ARG 124 -23.523 5.458 -17.680 931 2HH2 ARG 124 HH12 ARG 124 -22.346 4.757 -18.754 932 H ASP 125 H ASP 125 -19.415 9.957 -17.890 933 HA ASP 125 HA ASP 125 -17.534 8.053 -18.789 934 1HB ASP 125 HB2 ASP 125 -19.651 8.407 -19.942 935 2HB ASP 125 HB3 ASP 125 -19.186 10.056 -20.376 936 H GLU 126 H GLU 126 -17.549 11.660 -19.115 937 HA GLU 126 HA GLU 126 -15.083 11.611 -20.530 938 1HB GLU 126 HB2 GLU 126 -16.838 13.767 -19.424 939 2HB GLU 126 HB3 GLU 126 -15.172 14.172 -19.849 940 1HG GLU 126 HG2 GLU 126 -16.949 12.691 -21.796 941 2HG GLU 126 HG3 GLU 126 -16.970 14.448 -21.658 942 H ILE 127 H ILE 127 -15.834 11.900 -17.053 943 HA ILE 127 HA ILE 127 -13.148 12.651 -16.355 944 HB ILE 127 HB ILE 127 -15.546 12.349 -14.944 945 1HG1 ILE 127 HG12 ILE 127 -14.197 12.999 -12.918 946 2HG1 ILE 127 HG13 ILE 127 -12.745 12.879 -13.919 947 1HG2 ILE 127 HG21 ILE 127 -15.234 10.039 -14.550 948 2HG2 ILE 127 HG22 ILE 127 -13.651 10.337 -13.774 949 3HG2 ILE 127 HG23 ILE 127 -15.150 10.951 -13.041 950 1HD1 ILE 127 HD11 ILE 127 -13.651 14.627 -15.427 951 2HD1 ILE 127 HD12 ILE 127 -15.191 14.622 -14.541 952 3HD1 ILE 127 HD13 ILE 127 -13.720 15.213 -13.749 953 H GLY 128 H GLY 128 -14.771 9.469 -16.775 954 1HA GLY 128 HA1 GLY 128 -12.522 7.861 -16.108 955 2HA GLY 128 HA2 GLY 128 -13.903 7.389 -17.127 956 H ASN 129 H ASN 129 -13.735 9.071 -19.265 957 HA ASN 129 HA ASN 129 -11.706 8.054 -20.941 958 1HB ASN 129 HB2 ASN 129 -13.935 9.049 -21.576 959 2HB ASN 129 HB3 ASN 129 -13.262 10.639 -21.198 960 1HD2 ASN 129 HD22 ASN 129 -13.601 11.394 -23.284 961 2HD2 ASN 129 HD21 ASN 129 -12.703 10.791 -24.678 962 H ARG 130 H ARG 130 -11.769 11.034 -18.961 963 HA ARG 130 HA ARG 130 -9.353 12.191 -19.937 964 1HB ARG 130 HB2 ARG 130 -11.172 12.632 -17.654 965 2HB ARG 130 HB3 ARG 130 -9.521 12.636 -17.099 966 1HG ARG 130 HG2 ARG 130 -9.837 14.823 -17.535 967 2HG ARG 130 HG3 ARG 130 -9.038 14.304 -19.011 968 1HD ARG 130 HD2 ARG 130 -11.989 14.815 -18.523 969 2HD ARG 130 HD3 ARG 130 -10.929 15.821 -19.513 970 HE ARG 130 HE ARG 130 -12.460 13.545 -20.277 971 1HH1 ARG 130 HH21 ARG 130 -9.162 14.797 -20.991 972 2HH1 ARG 130 HH22 ARG 130 -9.075 13.799 -22.441 973 1HH2 ARG 130 HH11 ARG 130 -12.390 12.803 -22.444 974 2HH2 ARG 130 HH12 ARG 130 -10.783 12.669 -23.191 975 H LEU 131 H LEU 131 -9.991 9.943 -17.252 976 HA LEU 131 HA LEU 131 -7.220 9.806 -16.539 977 1HB LEU 131 HB2 LEU 131 -9.660 8.188 -15.750 978 2HB LEU 131 HB3 LEU 131 -8.073 7.928 -15.008 979 HG LEU 131 HG LEU 131 -9.250 10.745 -15.133 980 1HD1 LEU 131 HD11 LEU 131 -9.867 8.671 -13.037 981 2HD1 LEU 131 HD12 LEU 131 -10.201 10.414 -12.908 982 3HD1 LEU 131 HD13 LEU 131 -11.001 9.453 -14.160 983 1HD2 LEU 131 HD21 LEU 131 -7.846 11.128 -13.208 984 2HD2 LEU 131 HD22 LEU 131 -7.316 9.425 -13.193 985 3HD2 LEU 131 HD23 LEU 131 -6.865 10.506 -14.524 986 H LYS 132 H LYS 132 -9.283 7.801 -18.631 987 HA LYS 132 HA LYS 132 -7.342 5.829 -19.235 988 1HB LYS 132 HB2 LYS 132 -9.469 5.316 -19.930 989 2HB LYS 132 HB3 LYS 132 -9.830 6.912 -20.526 990 1HG LYS 132 HG2 LYS 132 -7.849 5.137 -21.999 991 2HG LYS 132 HG3 LYS 132 -9.594 4.927 -22.168 992 1HD LYS 132 HD2 LYS 132 -9.426 7.629 -22.613 993 2HD LYS 132 HD3 LYS 132 -7.835 7.111 -23.178 994 1HE LYS 132 HE2 LYS 132 -9.155 7.076 -25.084 995 2HE LYS 132 HE3 LYS 132 -9.038 5.373 -24.615 996 1HZ LYS 132 HZ1 LYS 132 -11.270 5.595 -23.646 997 2HZ LYS 132 HZ2 LYS 132 -11.321 7.192 -24.055 998 3HZ LYS 132 HZ3 LYS 132 -11.299 6.038 -25.215 999 H GLU 133 H GLU 133 -7.929 8.992 -20.916 1000 HA GLU 133 HA GLU 133 -5.692 8.599 -22.691 1001 1HB GLU 133 HB2 GLU 133 -7.032 11.150 -21.681 1002 2HB GLU 133 HB3 GLU 133 -5.738 11.110 -22.889 1003 1HG GLU 133 HG2 GLU 133 -7.150 9.702 -24.365 1004 2HG GLU 133 HG3 GLU 133 -8.481 9.822 -23.216 1005 H PHE 134 H PHE 134 -5.940 10.317 -19.543 1006 HA PHE 134 HA PHE 134 -3.277 11.184 -19.441 1007 1HB PHE 134 HB2 PHE 134 -4.923 12.038 -17.971 1008 2HB PHE 134 HB3 PHE 134 -5.354 10.429 -17.397 1009 HD1 PHE 134 HD1 PHE 134 -4.233 9.333 -15.648 1010 HD2 PHE 134 HD2 PHE 134 -2.800 13.111 -17.147 1011 HE1 PHE 134 HE1 PHE 134 -2.726 9.548 -13.674 1012 HE2 PHE 134 HE2 PHE 134 -1.270 13.302 -15.210 1013 HZ PHE 134 HZ PHE 134 -1.250 11.518 -13.472 1014 H ALA 135 H ALA 135 -4.646 8.008 -18.585 1015 HA ALA 135 HA ALA 135 -2.189 6.965 -17.530 1016 1HB ALA 135 HB1 ALA 135 -4.352 6.039 -16.856 1017 2HB ALA 135 HB2 ALA 135 -4.675 5.517 -18.526 1018 3HB ALA 135 HB3 ALA 135 -3.346 4.785 -17.602 1019 H GLU 136 H GLU 136 -3.880 6.597 -20.653 1020 HA GLU 136 HA GLU 136 -2.006 4.756 -21.766 1021 1HB GLU 136 HB2 GLU 136 -4.202 6.479 -22.966 1022 2HB GLU 136 HB3 GLU 136 -3.225 5.392 -23.946 1023 1HG GLU 136 HG2 GLU 136 -4.864 4.450 -21.551 1024 2HG GLU 136 HG3 GLU 136 -5.446 4.457 -23.210 1025 H THR 137 H THR 137 -2.362 8.274 -22.027 1026 HA THR 137 HA THR 137 -0.227 8.437 -23.936 1027 HB THR 137 HB THR 137 -0.781 10.733 -24.138 1028 HG1 THR 137 HG1 THR 137 -2.658 10.351 -22.069 1029 1HG2 THR 137 HG21 THR 137 -3.122 10.535 -24.868 1030 2HG2 THR 137 HG22 THR 137 -2.190 9.095 -25.325 1031 3HG2 THR 137 HG23 THR 137 -3.308 9.022 -23.957 1032 H GLY 138 H GLY 138 -0.577 8.599 -20.470 1033 1HA GLY 138 HA1 GLY 138 0.823 9.053 -18.766 1034 2HA GLY 138 HA2 GLY 138 2.208 8.954 -19.885 1035 H LYS 139 H LYS 139 -0.653 11.045 -19.989 1036 HA LYS 139 HA LYS 139 0.563 13.271 -20.995 1037 1HB LYS 139 HB2 LYS 139 -1.926 12.634 -20.661 1038 2HB LYS 139 HB3 LYS 139 -1.819 13.494 -19.127 1039 1HG LYS 139 HG2 LYS 139 -1.222 15.555 -20.234 1040 2HG LYS 139 HG3 LYS 139 -1.010 14.743 -21.786 1041 1HD LYS 139 HD2 LYS 139 -3.625 15.169 -20.292 1042 2HD LYS 139 HD3 LYS 139 -3.113 15.967 -21.771 1043 1HE LYS 139 HE2 LYS 139 -3.937 13.051 -21.424 1044 2HE LYS 139 HE3 LYS 139 -4.765 14.317 -22.332 1045 1HZ LYS 139 HZ1 LYS 139 -3.654 13.017 -23.894 1046 2HZ LYS 139 HZ2 LYS 139 -2.694 14.331 -23.781 1047 3HZ LYS 139 HZ3 LYS 139 -2.279 12.905 -23.043 Start of MODEL 11 1 1H MET 1 H1 MET 1 0.475 -0.941 -2.275 2 2H MET 1 H2 MET 1 2.106 -0.864 -2.160 3 3H MET 1 H3 MET 1 1.280 -2.034 -1.356 4 HA MET 1 HA MET 1 0.200 -0.432 0.034 5 1HB MET 1 HB2 MET 1 3.235 -0.173 0.036 6 2HB MET 1 HB3 MET 1 2.175 0.500 1.277 7 1HG MET 1 HG2 MET 1 1.266 -1.778 1.716 8 2HG MET 1 HG3 MET 1 2.442 -2.451 0.587 9 1HE MET 1 HE1 MET 1 5.010 -2.646 1.013 10 2HE MET 1 HE2 MET 1 5.172 -0.883 1.195 11 3HE MET 1 HE3 MET 1 5.852 -1.968 2.422 12 H GLU 2 H GLU 2 2.933 1.534 -1.371 13 HA GLU 2 HA GLU 2 1.128 3.431 -2.570 14 1HB GLU 2 HB2 GLU 2 1.876 5.358 -1.241 15 2HB GLU 2 HB3 GLU 2 1.008 4.208 -0.231 16 1HG GLU 2 HG2 GLU 2 3.187 3.338 0.636 17 2HG GLU 2 HG3 GLU 2 4.040 4.522 -0.356 18 H ASN 3 H ASN 3 2.602 5.218 -3.608 19 HA ASN 3 HA ASN 3 5.425 4.740 -3.709 20 1HB ASN 3 HB2 ASN 3 5.254 3.019 -5.225 21 2HB ASN 3 HB3 ASN 3 3.746 3.579 -5.900 22 1HD2 ASN 3 HD22 ASN 3 3.763 4.896 -7.725 23 2HD2 ASN 3 HD21 ASN 3 5.245 5.397 -8.532 24 H LYS 4 H LYS 4 2.610 6.209 -5.381 25 HA LYS 4 HA LYS 4 3.791 8.824 -4.775 26 1HB LYS 4 HB2 LYS 4 3.631 9.738 -6.993 27 2HB LYS 4 HB3 LYS 4 4.718 8.365 -6.976 28 1HG LYS 4 HG2 LYS 4 2.835 6.961 -7.956 29 2HG LYS 4 HG3 LYS 4 1.891 8.454 -8.115 30 1HD LYS 4 HD2 LYS 4 3.680 9.447 -9.513 31 2HD LYS 4 HD3 LYS 4 4.669 7.984 -9.310 32 1HE LYS 4 HE2 LYS 4 2.872 6.646 -10.421 33 2HE LYS 4 HE3 LYS 4 1.947 8.132 -10.657 34 1HZ LYS 4 HZ1 LYS 4 3.754 8.973 -12.039 35 2HZ LYS 4 HZ2 LYS 4 4.615 7.597 -11.831 36 3HZ LYS 4 HZ3 LYS 4 3.197 7.560 -12.635 37 H ILE 5 H ILE 5 2.053 10.600 -5.643 38 HA ILE 5 HA ILE 5 -0.597 9.665 -4.630 39 HB ILE 5 HB ILE 5 1.081 12.041 -3.747 40 1HG1 ILE 5 HG12 ILE 5 0.031 9.743 -2.055 41 2HG1 ILE 5 HG13 ILE 5 1.670 9.839 -2.691 42 1HG2 ILE 5 HG21 ILE 5 -1.786 11.355 -2.965 43 2HG2 ILE 5 HG22 ILE 5 -0.815 12.646 -2.216 44 3HG2 ILE 5 HG23 ILE 5 -1.271 12.770 -3.898 45 1HD1 ILE 5 HD11 ILE 5 2.005 11.987 -1.441 46 2HD1 ILE 5 HD12 ILE 5 0.434 11.713 -0.648 47 3HD1 ILE 5 HD13 ILE 5 1.749 10.554 -0.426 48 H ILE 6 H ILE 6 -2.299 10.508 -5.702 49 HA ILE 6 HA ILE 6 -1.935 12.854 -7.475 50 HB ILE 6 HB ILE 6 -2.044 11.062 -8.990 51 1HG1 ILE 6 HG12 ILE 6 -4.852 12.227 -8.758 52 2HG1 ILE 6 HG13 ILE 6 -3.456 13.006 -9.505 53 1HG2 ILE 6 HG21 ILE 6 -4.456 9.929 -7.527 54 2HG2 ILE 6 HG22 ILE 6 -3.726 9.270 -9.007 55 3HG2 ILE 6 HG23 ILE 6 -2.823 9.239 -7.509 56 1HD1 ILE 6 HD11 ILE 6 -4.793 12.099 -11.266 57 2HD1 ILE 6 HD12 ILE 6 -3.372 11.042 -11.141 58 3HD1 ILE 6 HD13 ILE 6 -4.938 10.531 -10.468 59 H TYR 7 H TYR 7 -3.449 14.419 -7.081 60 HA TYR 7 HA TYR 7 -5.529 13.832 -5.036 61 1HB TYR 7 HB2 TYR 7 -3.387 14.810 -4.190 62 2HB TYR 7 HB3 TYR 7 -3.663 16.220 -5.196 63 HD1 TYR 7 HD1 TYR 7 -6.227 14.368 -3.092 64 HD2 TYR 7 HD2 TYR 7 -3.766 17.877 -3.541 65 HE1 TYR 7 HE1 TYR 7 -7.165 15.289 -0.993 66 HE2 TYR 7 HE2 TYR 7 -4.664 18.761 -1.396 67 HH TYR 7 HH TYR 7 -5.772 18.278 0.451 68 H PHE 8 H PHE 8 -7.452 14.076 -6.130 69 HA PHE 8 HA PHE 8 -7.703 15.950 -8.369 70 1HB PHE 8 HB2 PHE 8 -9.733 14.228 -6.877 71 2HB PHE 8 HB3 PHE 8 -10.132 15.266 -8.242 72 HD1 PHE 8 HD1 PHE 8 -8.798 12.027 -7.271 73 HD2 PHE 8 HD2 PHE 8 -8.902 14.943 -10.450 74 HE1 PHE 8 HE1 PHE 8 -7.929 10.337 -8.871 75 HE2 PHE 8 HE2 PHE 8 -8.012 13.250 -12.033 76 HZ PHE 8 HZ PHE 8 -7.506 10.957 -11.229 77 H LEU 9 H LEU 9 -8.881 17.860 -8.433 78 HA LEU 9 HA LEU 9 -9.783 19.078 -5.889 79 1HB LEU 9 HB2 LEU 9 -7.327 19.488 -6.307 80 2HB LEU 9 HB3 LEU 9 -7.718 20.218 -7.846 81 HG LEU 9 HG LEU 9 -7.133 21.805 -6.054 82 1HD1 LEU 9 HD11 LEU 9 -10.027 22.320 -6.772 83 2HD1 LEU 9 HD12 LEU 9 -8.730 23.480 -6.480 84 3HD1 LEU 9 HD13 LEU 9 -8.689 22.486 -7.942 85 1HD2 LEU 9 HD21 LEU 9 -9.727 21.002 -4.702 86 2HD2 LEU 9 HD22 LEU 9 -8.096 20.588 -4.147 87 3HD2 LEU 9 HD23 LEU 9 -8.618 22.288 -4.204 88 H CYS 10 H CYS 10 -11.718 20.213 -6.307 89 HA CYS 10 HA CYS 10 -12.139 21.389 -8.945 90 1HB CYS 10 HB2 CYS 10 -12.980 18.857 -8.840 91 2HB CYS 10 HB3 CYS 10 -14.349 19.560 -7.967 92 HG CYS 10 HG CYS 10 -13.034 20.434 -10.897 93 H THR 11 H THR 11 -14.516 22.577 -8.848 94 HA THR 11 HA THR 11 -14.369 24.256 -6.535 95 HB THR 11 HB THR 11 -16.603 25.122 -7.585 96 HG1 THR 11 HG1 THR 11 -16.672 24.663 -9.802 97 1HG2 THR 11 HG21 THR 11 -14.329 26.197 -7.658 98 2HG2 THR 11 HG22 THR 11 -13.994 25.288 -9.146 99 3HG2 THR 11 HG23 THR 11 -15.304 26.481 -9.110 100 H GLY 12 H GLY 12 -15.719 21.186 -6.821 101 1HA GLY 12 HA1 GLY 12 -16.614 21.347 -4.114 102 2HA GLY 12 HA2 GLY 12 -17.952 20.993 -5.237 103 H ASN 13 H ASN 13 -15.825 19.496 -3.291 104 HA ASN 13 HA ASN 13 -14.464 17.555 -4.871 105 1HB ASN 13 HB2 ASN 13 -13.999 18.102 -2.481 106 2HB ASN 13 HB3 ASN 13 -15.522 17.390 -2.002 107 1HD2 ASN 13 HD22 ASN 13 -13.017 16.622 -0.971 108 2HD2 ASN 13 HD21 ASN 13 -12.638 14.990 -1.494 109 H SER 14 H SER 14 -17.514 17.458 -3.147 110 HA SER 14 HA SER 14 -18.296 14.972 -2.970 111 1HB SER 14 HB2 SER 14 -20.040 17.367 -3.649 112 2HB SER 14 HB3 SER 14 -20.530 15.929 -2.724 113 HG SER 14 HG SER 14 -18.890 16.422 -1.229 114 H CYS 15 H CYS 15 -18.234 16.417 -6.164 115 HA CYS 15 HA CYS 15 -19.625 13.986 -7.179 116 1HB CYS 15 HB2 CYS 15 -20.451 15.447 -9.074 117 2HB CYS 15 HB3 CYS 15 -21.228 15.697 -7.505 118 HG CYS 15 HG CYS 15 -20.998 18.059 -8.619 119 H ARG 16 H ARG 16 -17.790 16.699 -8.634 120 HA ARG 16 HA ARG 16 -16.744 15.020 -10.646 121 1HB ARG 16 HB2 ARG 16 -15.959 17.796 -9.661 122 2HB ARG 16 HB3 ARG 16 -15.157 17.044 -11.042 123 1HG ARG 16 HG2 ARG 16 -17.128 16.920 -12.332 124 2HG ARG 16 HG3 ARG 16 -18.199 17.189 -10.959 125 1HD ARG 16 HD2 ARG 16 -16.255 19.282 -11.980 126 2HD ARG 16 HD3 ARG 16 -17.919 19.135 -12.549 127 HE ARG 16 HE ARG 16 -18.243 19.258 -9.826 128 1HH1 ARG 16 HH21 ARG 16 -16.641 21.407 -12.184 129 2HH1 ARG 16 HH22 ARG 16 -16.593 22.743 -11.058 130 1HH2 ARG 16 HH11 ARG 16 -18.670 21.210 -8.691 131 2HH2 ARG 16 HH12 ARG 16 -17.635 22.589 -9.023 132 H SER 17 H SER 17 -15.028 16.164 -7.644 133 HA SER 17 HA SER 17 -12.657 14.736 -8.369 134 1HB SER 17 HB2 SER 17 -13.475 15.607 -5.595 135 2HB SER 17 HB3 SER 17 -11.840 15.366 -6.236 136 HG SER 17 HG SER 17 -12.378 17.546 -6.125 137 H GLN 18 H GLN 18 -15.488 13.872 -6.307 138 HA GLN 18 HA GLN 18 -14.460 11.389 -5.358 139 1HB GLN 18 HB2 GLN 18 -17.315 12.333 -5.965 140 2HB GLN 18 HB3 GLN 18 -16.958 10.792 -5.203 141 1HG GLN 18 HG2 GLN 18 -16.232 13.511 -4.062 142 2HG GLN 18 HG3 GLN 18 -17.592 12.520 -3.564 143 1HE2 GLN 18 HE22 GLN 18 -14.576 13.376 -2.603 144 2HE2 GLN 18 HE21 GLN 18 -14.215 11.981 -1.594 145 H MET 19 H MET 19 -16.351 12.093 -8.363 146 HA MET 19 HA MET 19 -16.454 9.350 -9.217 147 1HB MET 19 HB2 MET 19 -16.593 11.967 -10.793 148 2HB MET 19 HB3 MET 19 -16.892 10.371 -11.487 149 1HG MET 19 HG2 MET 19 -18.836 10.033 -10.110 150 2HG MET 19 HG3 MET 19 -18.524 11.514 -9.204 151 1HE MET 19 HE1 MET 19 -20.902 12.548 -9.585 152 2HE MET 19 HE2 MET 19 -21.707 12.637 -11.168 153 3HE MET 19 HE3 MET 19 -21.402 11.058 -10.423 154 H ALA 20 H ALA 20 -14.193 12.068 -10.035 155 HA ALA 20 HA ALA 20 -12.600 10.665 -11.862 156 1HB ALA 20 HB1 ALA 20 -12.481 13.125 -11.426 157 2HB ALA 20 HB2 ALA 20 -11.685 12.785 -9.874 158 3HB ALA 20 HB3 ALA 20 -10.895 12.339 -11.400 159 H GLU 21 H GLU 21 -12.310 10.863 -8.298 160 HA GLU 21 HA GLU 21 -9.949 9.363 -8.001 161 1HB GLU 21 HB2 GLU 21 -10.836 10.643 -6.182 162 2HB GLU 21 HB3 GLU 21 -12.365 9.750 -6.185 163 1HG GLU 21 HG2 GLU 21 -11.244 7.717 -5.507 164 2HG GLU 21 HG3 GLU 21 -9.667 8.504 -5.554 165 H GLY 22 H GLY 22 -13.394 8.183 -7.969 166 1HA GLY 22 HA1 GLY 22 -12.825 5.472 -7.669 167 2HA GLY 22 HA2 GLY 22 -14.245 6.132 -8.474 168 H TRP 23 H TRP 23 -13.105 7.287 -10.851 169 HA TRP 23 HA TRP 23 -12.600 4.873 -12.385 170 1HB TRP 23 HB2 TRP 23 -12.227 7.796 -13.149 171 2HB TRP 23 HB3 TRP 23 -12.005 6.448 -14.243 172 HD1 TRP 23 HD1 TRP 23 -14.671 8.514 -12.593 173 HE1 TRP 23 HE1 TRP 23 -16.906 8.175 -13.715 174 HE3 TRP 23 HE3 TRP 23 -13.454 4.582 -15.658 175 HZ2 TRP 23 HZ2 TRP 23 -18.049 6.484 -15.741 176 HZ3 TRP 23 HZ3 TRP 23 -15.144 3.695 -17.238 177 HH2 TRP 23 HH2 TRP 23 -17.463 4.668 -17.276 178 H ALA 24 H ALA 24 -10.429 7.475 -11.128 179 HA ALA 24 HA ALA 24 -8.160 6.630 -12.559 180 1HB ALA 24 HB1 ALA 24 -8.378 8.808 -11.290 181 2HB ALA 24 HB2 ALA 24 -8.227 7.908 -9.779 182 3HB ALA 24 HB3 ALA 24 -6.872 7.948 -10.926 183 H LYS 25 H LYS 25 -9.466 5.447 -9.448 184 HA LYS 25 HA LYS 25 -7.252 3.852 -8.695 185 1HB LYS 25 HB2 LYS 25 -10.235 3.496 -8.253 186 2HB LYS 25 HB3 LYS 25 -9.041 2.397 -7.556 187 1HG LYS 25 HG2 LYS 25 -8.016 4.117 -6.246 188 2HG LYS 25 HG3 LYS 25 -8.880 5.399 -7.101 189 1HD LYS 25 HD2 LYS 25 -11.043 4.517 -6.239 190 2HD LYS 25 HD3 LYS 25 -10.156 3.294 -5.295 191 1HE LYS 25 HE2 LYS 25 -9.017 5.037 -4.012 192 2HE LYS 25 HE3 LYS 25 -9.645 6.287 -5.090 193 1HZ LYS 25 HZ1 LYS 25 -11.211 4.707 -3.149 194 2HZ LYS 25 HZ2 LYS 25 -10.969 6.350 -3.199 195 3HZ LYS 25 HZ3 LYS 25 -11.908 5.655 -4.318 196 H GLN 26 H GLN 26 -9.725 3.234 -11.170 197 HA GLN 26 HA GLN 26 -8.967 0.455 -11.579 198 1HB GLN 26 HB2 GLN 26 -10.242 2.334 -13.583 199 2HB GLN 26 HB3 GLN 26 -10.164 0.581 -13.651 200 1HG GLN 26 HG2 GLN 26 -11.620 0.487 -11.591 201 2HG GLN 26 HG3 GLN 26 -11.802 2.254 -11.701 202 1HE2 GLN 26 HE22 GLN 26 -12.083 2.854 -14.269 203 2HE2 GLN 26 HE21 GLN 26 -13.452 2.037 -15.004 204 H TYR 27 H TYR 27 -8.417 3.470 -13.400 205 HA TYR 27 HA TYR 27 -6.735 2.242 -15.329 206 1HB TYR 27 HB2 TYR 27 -7.110 5.172 -14.603 207 2HB TYR 27 HB3 TYR 27 -6.199 4.616 -15.996 208 HD1 TYR 27 HD1 TYR 27 -9.441 5.617 -14.913 209 HD2 TYR 27 HD2 TYR 27 -7.415 2.972 -17.653 210 HE1 TYR 27 HE1 TYR 27 -11.449 5.576 -16.357 211 HE2 TYR 27 HE2 TYR 27 -9.444 2.867 -19.061 212 HH TYR 27 HH TYR 27 -11.643 3.609 -19.350 213 H LEU 28 H LEU 28 -5.854 3.948 -12.333 214 HA LEU 28 HA LEU 28 -3.024 4.048 -13.155 215 1HB LEU 28 HB2 LEU 28 -4.425 5.156 -10.691 216 2HB LEU 28 HB3 LEU 28 -2.790 5.492 -11.203 217 HG LEU 28 HG LEU 28 -5.323 6.366 -12.612 218 1HD1 LEU 28 HD11 LEU 28 -4.520 8.604 -12.099 219 2HD1 LEU 28 HD12 LEU 28 -4.580 7.648 -10.604 220 3HD1 LEU 28 HD13 LEU 28 -3.024 7.953 -11.398 221 1HD2 LEU 28 HD21 LEU 28 -3.709 5.764 -14.366 222 2HD2 LEU 28 HD22 LEU 28 -3.888 7.499 -14.244 223 3HD2 LEU 28 HD23 LEU 28 -2.447 6.720 -13.554 224 H GLY 29 H GLY 29 -4.967 2.539 -10.601 225 1HA GLY 29 HA1 GLY 29 -4.581 0.542 -9.502 226 2HA GLY 29 HA2 GLY 29 -3.016 0.393 -10.305 227 H ASP 30 H ASP 30 -2.844 -0.392 -7.893 228 HA ASP 30 HA ASP 30 -2.867 1.435 -5.755 229 1HB ASP 30 HB2 ASP 30 -3.116 -1.047 -5.620 230 2HB ASP 30 HB3 ASP 30 -1.386 -1.214 -5.942 231 H GLU 31 H GLU 31 -0.460 1.062 -8.134 232 HA GLU 31 HA GLU 31 1.893 1.922 -6.774 233 1HB GLU 31 HB2 GLU 31 1.738 0.843 -9.015 234 2HB GLU 31 HB3 GLU 31 0.986 2.300 -9.666 235 1HG GLU 31 HG2 GLU 31 3.019 3.571 -9.346 236 2HG GLU 31 HG3 GLU 31 3.751 2.269 -8.394 237 H TRP 32 H TRP 32 -1.053 3.528 -7.142 238 HA TRP 32 HA TRP 32 0.203 6.147 -6.539 239 1HB TRP 32 HB2 TRP 32 -2.391 5.708 -8.063 240 2HB TRP 32 HB3 TRP 32 -1.606 7.231 -7.715 241 HD1 TRP 32 HD1 TRP 32 -0.788 4.024 -9.737 242 HE1 TRP 32 HE1 TRP 32 -0.046 4.709 -12.070 243 HE3 TRP 32 HE3 TRP 32 -0.734 9.099 -9.097 244 HZ2 TRP 32 HZ2 TRP 32 0.420 7.132 -13.526 245 HZ3 TRP 32 HZ3 TRP 32 -0.214 10.587 -11.005 246 HH2 TRP 32 HH2 TRP 32 0.337 9.610 -13.237 247 H LYS 33 H LYS 33 -0.852 7.234 -4.879 248 HA LYS 33 HA LYS 33 -3.217 5.925 -3.603 249 1HB LYS 33 HB2 LYS 33 -1.307 8.048 -2.560 250 2HB LYS 33 HB3 LYS 33 -2.766 7.515 -1.724 251 1HG LYS 33 HG2 LYS 33 -0.391 5.731 -2.403 252 2HG LYS 33 HG3 LYS 33 -0.699 6.503 -0.851 253 1HD LYS 33 HD2 LYS 33 -1.398 4.337 -0.514 254 2HD LYS 33 HD3 LYS 33 -2.908 5.207 -0.751 255 1HE LYS 33 HE2 LYS 33 -3.214 4.229 -2.962 256 2HE LYS 33 HE3 LYS 33 -1.524 3.723 -3.030 257 1HZ LYS 33 HZ1 LYS 33 -1.960 2.181 -1.241 258 2HZ LYS 33 HZ2 LYS 33 -3.563 2.583 -1.208 259 3HZ LYS 33 HZ3 LYS 33 -2.888 1.838 -2.517 260 H VAL 34 H VAL 34 -5.090 6.950 -3.623 261 HA VAL 34 HA VAL 34 -5.234 9.306 -5.442 262 HB VAL 34 HB VAL 34 -7.190 6.981 -5.411 263 1HG1 VAL 34 HG11 VAL 34 -7.737 9.234 -6.510 264 2HG1 VAL 34 HG12 VAL 34 -6.472 8.852 -7.694 265 3HG1 VAL 34 HG13 VAL 34 -7.886 7.791 -7.525 266 1HG2 VAL 34 HG21 VAL 34 -4.690 7.141 -7.146 267 2HG2 VAL 34 HG22 VAL 34 -5.090 5.866 -5.967 268 3HG2 VAL 34 HG23 VAL 34 -6.062 6.052 -7.430 269 H TYR 35 H TYR 35 -6.082 10.954 -4.345 270 HA TYR 35 HA TYR 35 -8.433 10.428 -2.627 271 1HB TYR 35 HB2 TYR 35 -6.838 12.705 -1.686 272 2HB TYR 35 HB3 TYR 35 -7.747 11.519 -0.800 273 HD1 TYR 35 HD1 TYR 35 -4.523 12.752 -1.606 274 HD2 TYR 35 HD2 TYR 35 -6.603 9.131 -0.520 275 HE1 TYR 35 HE1 TYR 35 -2.429 11.835 -0.726 276 HE2 TYR 35 HE2 TYR 35 -4.481 8.172 0.338 277 HH TYR 35 HH TYR 35 -1.389 10.005 0.323 278 H SER 36 H SER 36 -9.596 12.572 -2.231 279 HA SER 36 HA SER 36 -9.438 14.393 -4.560 280 1HB SER 36 HB2 SER 36 -12.001 14.168 -4.523 281 2HB SER 36 HB3 SER 36 -11.087 12.826 -5.237 282 HG SER 36 HG SER 36 -11.438 11.613 -3.457 283 H ALA 37 H ALA 37 -9.957 16.466 -4.098 284 HA ALA 37 HA ALA 37 -11.254 17.180 -1.556 285 1HB ALA 37 HB1 ALA 37 -9.673 18.907 -1.160 286 2HB ALA 37 HB2 ALA 37 -8.895 17.333 -1.088 287 3HB ALA 37 HB3 ALA 37 -8.653 18.379 -2.527 288 H GLY 38 H GLY 38 -11.449 19.810 -1.817 289 1HA GLY 38 HA1 GLY 38 -11.858 20.747 -4.487 290 2HA GLY 38 HA2 GLY 38 -13.390 20.386 -3.680 291 H ILE 39 H ILE 39 -13.019 22.910 -4.372 292 HA ILE 39 HA ILE 39 -11.945 24.707 -2.426 293 HB ILE 39 HB ILE 39 -14.193 24.777 -4.451 294 1HG1 ILE 39 HG12 ILE 39 -12.920 26.595 -5.457 295 2HG1 ILE 39 HG13 ILE 39 -11.781 26.590 -4.114 296 1HG2 ILE 39 HG21 ILE 39 -14.642 27.155 -4.002 297 2HG2 ILE 39 HG22 ILE 39 -15.176 26.114 -2.691 298 3HG2 ILE 39 HG23 ILE 39 -13.672 27.053 -2.515 299 1HD1 ILE 39 HD11 ILE 39 -10.890 25.554 -6.180 300 2HD1 ILE 39 HD12 ILE 39 -10.902 24.402 -4.842 301 3HD1 ILE 39 HD13 ILE 39 -12.152 24.328 -6.117 302 H GLU 40 H GLU 40 -15.010 22.882 -2.635 303 HA GLU 40 HA GLU 40 -15.130 22.894 0.290 304 1HB GLU 40 HB2 GLU 40 -17.455 23.526 0.426 305 2HB GLU 40 HB3 GLU 40 -16.515 24.820 -0.301 306 1HG GLU 40 HG2 GLU 40 -17.313 24.150 -2.561 307 2HG GLU 40 HG3 GLU 40 -18.246 22.831 -1.850 308 H ALA 41 H ALA 41 -17.109 21.391 0.916 309 HA ALA 41 HA ALA 41 -17.645 19.201 -0.985 310 1HB ALA 41 HB1 ALA 41 -15.614 18.445 0.183 311 2HB ALA 41 HB2 ALA 41 -16.340 18.839 1.758 312 3HB ALA 41 HB3 ALA 41 -17.032 17.542 0.770 313 H HIS 42 H HIS 42 -19.780 18.777 -0.803 314 HA HIS 42 HA HIS 42 -21.407 19.863 1.407 315 1HB HIS 42 HB2 HIS 42 -22.255 19.906 -0.902 316 2HB HIS 42 HB3 HIS 42 -22.071 18.158 -1.038 317 HD1 HIS 42 HD1 HIS 42 -24.198 20.704 1.009 318 HD2 HIS 42 HD2 HIS 42 -24.112 16.694 -0.283 319 HE1 HIS 42 HE1 HIS 42 -26.439 19.694 1.663 320 H GLY 43 H GLY 43 -20.427 16.685 0.056 321 1HA GLY 43 HA1 GLY 43 -19.933 15.248 2.381 322 2HA GLY 43 HA2 GLY 43 -21.663 15.041 2.017 323 H LEU 44 H LEU 44 -20.882 12.706 1.606 324 HA LEU 44 HA LEU 44 -19.592 12.302 -1.027 325 1HB LEU 44 HB2 LEU 44 -19.226 10.645 0.804 326 2HB LEU 44 HB3 LEU 44 -20.968 10.356 0.885 327 HG LEU 44 HG LEU 44 -20.903 9.596 -1.510 328 1HD1 LEU 44 HD11 LEU 44 -18.833 10.635 -2.304 329 2HD1 LEU 44 HD12 LEU 44 -17.888 9.708 -1.118 330 3HD1 LEU 44 HD13 LEU 44 -18.718 8.882 -2.452 331 1HD2 LEU 44 HD21 LEU 44 -19.833 7.389 -0.956 332 2HD2 LEU 44 HD22 LEU 44 -19.229 8.107 0.544 333 3HD2 LEU 44 HD23 LEU 44 -20.975 7.965 0.273 334 H ASN 45 H ASN 45 -20.915 13.205 -2.604 335 HA ASN 45 HA ASN 45 -23.695 13.591 -2.297 336 1HB ASN 45 HB2 ASN 45 -22.131 14.840 -3.823 337 2HB ASN 45 HB3 ASN 45 -22.143 13.451 -4.913 338 1HD2 ASN 45 HD22 ASN 45 -23.286 16.432 -4.873 339 2HD2 ASN 45 HD21 ASN 45 -24.878 16.185 -5.550 340 HA PRO 46 HA PRO 46 -25.026 9.401 -3.199 341 1HB PRO 46 HB2 PRO 46 -27.705 9.803 -3.791 342 2HB PRO 46 HB3 PRO 46 -27.009 9.750 -2.143 343 1HG PRO 46 HG2 PRO 46 -27.612 12.188 -3.838 344 2HG PRO 46 HG3 PRO 46 -28.003 11.913 -2.108 345 1HD PRO 46 HD2 PRO 46 -25.840 13.358 -2.850 346 2HD PRO 46 HD3 PRO 46 -25.741 12.235 -1.460 347 H ASN 47 H ASN 47 -25.550 12.043 -5.571 348 HA ASN 47 HA ASN 47 -25.996 10.360 -7.872 349 1HB ASN 47 HB2 ASN 47 -26.323 12.756 -8.140 350 2HB ASN 47 HB3 ASN 47 -24.681 13.092 -7.571 351 1HD2 ASN 47 HD22 ASN 47 -24.288 14.331 -9.518 352 2HD2 ASN 47 HD21 ASN 47 -24.041 13.494 -11.035 353 H ALA 48 H ALA 48 -22.977 11.567 -6.256 354 HA ALA 48 HA ALA 48 -21.231 10.479 -8.231 355 1HB ALA 48 HB1 ALA 48 -19.470 10.880 -6.630 356 2HB ALA 48 HB2 ALA 48 -20.629 12.219 -6.519 357 3HB ALA 48 HB3 ALA 48 -20.621 10.952 -5.280 358 H VAL 49 H VAL 49 -22.600 9.113 -5.192 359 HA VAL 49 HA VAL 49 -21.132 6.670 -5.398 360 HB VAL 49 HB VAL 49 -23.812 7.028 -4.017 361 1HG1 VAL 49 HG11 VAL 49 -21.502 5.049 -3.689 362 2HG1 VAL 49 HG12 VAL 49 -22.934 5.145 -2.634 363 3HG1 VAL 49 HG13 VAL 49 -23.112 4.682 -4.331 364 1HG2 VAL 49 HG21 VAL 49 -22.290 8.705 -3.123 365 2HG2 VAL 49 HG22 VAL 49 -22.390 7.382 -1.970 366 3HG2 VAL 49 HG23 VAL 49 -20.970 7.525 -3.035 367 H LYS 50 H LYS 50 -24.534 7.472 -6.473 368 HA LYS 50 HA LYS 50 -24.923 4.837 -7.459 369 1HB LYS 50 HB2 LYS 50 -26.720 6.547 -6.915 370 2HB LYS 50 HB3 LYS 50 -26.376 7.312 -8.475 371 1HG LYS 50 HG2 LYS 50 -26.916 5.140 -9.621 372 2HG LYS 50 HG3 LYS 50 -27.231 4.403 -8.042 373 1HD LYS 50 HD2 LYS 50 -29.011 6.122 -7.647 374 2HD LYS 50 HD3 LYS 50 -28.774 6.725 -9.283 375 1HE LYS 50 HE2 LYS 50 -29.579 3.853 -8.604 376 2HE LYS 50 HE3 LYS 50 -30.727 5.155 -8.901 377 1HZ LYS 50 HZ1 LYS 50 -28.895 3.940 -10.886 378 2HZ LYS 50 HZ2 LYS 50 -30.505 4.019 -10.895 379 3HZ LYS 50 HZ3 LYS 50 -29.664 5.387 -11.145 380 H ALA 51 H ALA 51 -23.893 7.834 -9.177 381 HA ALA 51 HA ALA 51 -23.889 6.848 -11.772 382 1HB ALA 51 HB1 ALA 51 -22.195 8.635 -12.214 383 2HB ALA 51 HB2 ALA 51 -23.501 9.229 -11.170 384 3HB ALA 51 HB3 ALA 51 -21.920 8.795 -10.470 385 H MET 52 H MET 52 -21.256 6.609 -9.323 386 HA MET 52 HA MET 52 -19.502 5.194 -11.139 387 1HB MET 52 HB2 MET 52 -19.504 5.741 -8.148 388 2HB MET 52 HB3 MET 52 -18.162 5.006 -9.023 389 1HG MET 52 HG2 MET 52 -19.290 7.801 -9.450 390 2HG MET 52 HG3 MET 52 -17.760 7.400 -8.686 391 1HE MET 52 HE1 MET 52 -16.574 5.198 -10.399 392 2HE MET 52 HE2 MET 52 -15.651 6.008 -11.652 393 3HE MET 52 HE3 MET 52 -15.606 6.629 -9.988 394 H LYS 53 H LYS 53 -21.785 4.222 -8.507 395 HA LYS 53 HA LYS 53 -20.951 1.515 -8.399 396 1HB LYS 53 HB2 LYS 53 -22.339 2.791 -6.730 397 2HB LYS 53 HB3 LYS 53 -23.694 2.723 -7.867 398 1HG LYS 53 HG2 LYS 53 -23.494 0.169 -7.725 399 2HG LYS 53 HG3 LYS 53 -22.338 0.409 -6.405 400 1HD LYS 53 HD2 LYS 53 -25.185 1.477 -6.533 401 2HD LYS 53 HD3 LYS 53 -24.723 0.022 -5.653 402 1HE LYS 53 HE2 LYS 53 -23.661 2.821 -5.039 403 2HE LYS 53 HE3 LYS 53 -25.084 2.119 -4.273 404 1HZ LYS 53 HZ1 LYS 53 -22.313 1.065 -4.017 405 2HZ LYS 53 HZ2 LYS 53 -23.168 1.828 -2.888 406 3HZ LYS 53 HZ3 LYS 53 -23.661 0.352 -3.391 407 H GLU 54 H GLU 54 -23.168 3.276 -10.524 408 HA GLU 54 HA GLU 54 -24.110 1.036 -12.025 409 1HB GLU 54 HB2 GLU 54 -24.038 4.032 -12.513 410 2HB GLU 54 HB3 GLU 54 -24.855 2.935 -13.614 411 1HG GLU 54 HG2 GLU 54 -25.554 2.954 -10.657 412 2HG GLU 54 HG3 GLU 54 -26.171 4.183 -11.755 413 H VAL 55 H VAL 55 -20.992 2.000 -11.796 414 HA VAL 55 HA VAL 55 -20.305 0.986 -14.524 415 HB VAL 55 HB VAL 55 -18.439 2.524 -12.668 416 1HG1 VAL 55 HG11 VAL 55 -18.278 1.969 -15.663 417 2HG1 VAL 55 HG12 VAL 55 -17.144 2.970 -14.731 418 3HG1 VAL 55 HG13 VAL 55 -17.244 1.254 -14.407 419 1HG2 VAL 55 HG21 VAL 55 -18.732 4.525 -14.024 420 2HG2 VAL 55 HG22 VAL 55 -19.973 3.715 -15.004 421 3HG2 VAL 55 HG23 VAL 55 -20.246 4.065 -13.277 422 H GLY 56 H GLY 56 -20.703 0.075 -11.290 423 1HA GLY 56 HA1 GLY 56 -20.004 -1.771 -10.128 424 2HA GLY 56 HA2 GLY 56 -18.889 -2.212 -11.433 425 H ILE 57 H ILE 57 -18.892 1.079 -10.040 426 HA ILE 57 HA ILE 57 -16.309 0.518 -8.658 427 HB ILE 57 HB ILE 57 -17.174 3.068 -10.059 428 1HG1 ILE 57 HG12 ILE 57 -15.045 1.056 -10.916 429 2HG1 ILE 57 HG13 ILE 57 -16.616 1.268 -11.690 430 1HG2 ILE 57 HG21 ILE 57 -14.510 2.302 -8.763 431 2HG2 ILE 57 HG22 ILE 57 -14.901 3.860 -9.516 432 3HG2 ILE 57 HG23 ILE 57 -15.720 3.379 -8.039 433 1HD1 ILE 57 HD11 ILE 57 -16.000 3.692 -12.110 434 2HD1 ILE 57 HD12 ILE 57 -14.329 3.250 -11.647 435 3HD1 ILE 57 HD13 ILE 57 -15.121 2.478 -13.031 436 H ASP 58 H ASP 58 -17.262 0.073 -6.737 437 HA ASP 58 HA ASP 58 -19.546 1.594 -5.755 438 1HB ASP 58 HB2 ASP 58 -19.419 -0.798 -5.361 439 2HB ASP 58 HB3 ASP 58 -17.907 -0.610 -4.458 440 H ILE 59 H ILE 59 -18.564 3.743 -5.747 441 HA ILE 59 HA ILE 59 -16.367 4.245 -3.972 442 HB ILE 59 HB ILE 59 -16.526 6.520 -4.490 443 1HG1 ILE 59 HG12 ILE 59 -19.102 6.249 -6.030 444 2HG1 ILE 59 HG13 ILE 59 -19.108 6.647 -4.316 445 1HG2 ILE 59 HG21 ILE 59 -16.308 6.542 -6.897 446 2HG2 ILE 59 HG22 ILE 59 -15.596 5.069 -6.225 447 3HG2 ILE 59 HG23 ILE 59 -17.185 5.006 -7.019 448 1HD1 ILE 59 HD11 ILE 59 -17.830 8.303 -6.509 449 2HD1 ILE 59 HD12 ILE 59 -19.188 8.717 -5.436 450 3HD1 ILE 59 HD13 ILE 59 -17.565 8.572 -4.769 451 H SER 60 H SER 60 -19.312 3.277 -2.958 452 HA SER 60 HA SER 60 -20.260 5.189 -1.187 453 1HB SER 60 HB2 SER 60 -20.130 2.202 -0.613 454 2HB SER 60 HB3 SER 60 -21.304 3.372 0.009 455 HG SER 60 HG SER 60 -21.065 2.177 -2.519 456 H ASN 61 H ASN 61 -17.370 3.197 -0.919 457 HA ASN 61 HA ASN 61 -16.931 3.559 1.902 458 1HB ASN 61 HB2 ASN 61 -16.083 1.619 0.594 459 2HB ASN 61 HB3 ASN 61 -15.033 2.705 -0.321 460 1HD2 ASN 61 HD22 ASN 61 -12.915 2.607 0.424 461 2HD2 ASN 61 HD21 ASN 61 -12.456 2.365 2.087 462 H GLN 62 H GLN 62 -16.404 5.695 -0.810 463 HA GLN 62 HA GLN 62 -14.031 6.995 0.203 464 1HB GLN 62 HB2 GLN 62 -16.029 7.904 -1.915 465 2HB GLN 62 HB3 GLN 62 -14.461 8.646 -1.553 466 1HG GLN 62 HG2 GLN 62 -13.334 6.505 -2.139 467 2HG GLN 62 HG3 GLN 62 -14.893 5.849 -2.647 468 1HE2 GLN 62 HE22 GLN 62 -15.017 9.107 -3.653 469 2HE2 GLN 62 HE21 GLN 62 -14.451 8.814 -5.293 470 H THR 63 H THR 63 -14.232 9.469 0.527 471 HA THR 63 HA THR 63 -16.695 10.436 1.688 472 HB THR 63 HB THR 63 -15.226 11.380 3.657 473 HG1 THR 63 HG1 THR 63 -13.237 10.519 2.988 474 1HG2 THR 63 HG21 THR 63 -15.990 8.435 3.767 475 2HG2 THR 63 HG22 THR 63 -15.826 9.565 5.125 476 3HG2 THR 63 HG23 THR 63 -17.127 9.791 3.947 477 H SER 64 H SER 64 -16.648 12.809 1.806 478 HA SER 64 HA SER 64 -14.702 13.974 -0.101 479 1HB SER 64 HB2 SER 64 -17.369 15.034 0.890 480 2HB SER 64 HB3 SER 64 -16.376 15.690 -0.429 481 HG SER 64 HG SER 64 -18.254 14.156 -0.858 482 H ASP 65 H ASP 65 -13.733 15.951 0.401 483 HA ASP 65 HA ASP 65 -13.806 17.119 3.084 484 1HB ASP 65 HB2 ASP 65 -12.080 15.203 3.099 485 2HB ASP 65 HB3 ASP 65 -11.192 16.122 1.869 486 H ILE 66 H ILE 66 -12.482 19.196 3.034 487 HA ILE 66 HA ILE 66 -12.480 20.370 0.314 488 HB ILE 66 HB ILE 66 -12.696 22.450 1.291 489 1HG1 ILE 66 HG12 ILE 66 -11.988 21.234 3.986 490 2HG1 ILE 66 HG13 ILE 66 -11.043 22.407 3.045 491 1HG2 ILE 66 HG21 ILE 66 -14.800 22.298 2.423 492 2HG2 ILE 66 HG22 ILE 66 -14.686 20.828 1.434 493 3HG2 ILE 66 HG23 ILE 66 -14.386 20.748 3.170 494 1HD1 ILE 66 HD11 ILE 66 -13.688 22.861 4.449 495 2HD1 ILE 66 HD12 ILE 66 -12.127 23.635 4.779 496 3HD1 ILE 66 HD13 ILE 66 -13.007 24.007 3.269 497 H ILE 67 H ILE 67 -10.542 21.804 -0.130 498 HA ILE 67 HA ILE 67 -8.360 20.103 -0.193 499 HB ILE 67 HB ILE 67 -8.865 21.696 -1.866 500 1HG1 ILE 67 HG12 ILE 67 -6.572 20.672 -1.582 501 2HG1 ILE 67 HG13 ILE 67 -6.754 22.036 -2.668 502 1HG2 ILE 67 HG21 ILE 67 -9.532 23.670 -0.635 503 2HG2 ILE 67 HG22 ILE 67 -7.849 23.935 -0.091 504 3HG2 ILE 67 HG23 ILE 67 -8.262 24.036 -1.809 505 1HD1 ILE 67 HD11 ILE 67 -5.610 22.305 0.134 506 2HD1 ILE 67 HD12 ILE 67 -4.671 22.159 -1.351 507 3HD1 ILE 67 HD13 ILE 67 -5.718 23.564 -1.103 508 H ASP 68 H ASP 68 -7.142 19.329 1.244 509 HA ASP 68 HA ASP 68 -6.078 20.945 3.489 510 1HB ASP 68 HB2 ASP 68 -6.701 18.643 4.019 511 2HB ASP 68 HB3 ASP 68 -5.700 18.020 2.702 512 H SER 69 H SER 69 -4.349 22.187 3.034 513 HA SER 69 HA SER 69 -3.108 22.124 0.525 514 1HB SER 69 HB2 SER 69 -2.032 23.544 2.982 515 2HB SER 69 HB3 SER 69 -1.971 24.078 1.291 516 HG SER 69 HG SER 69 -3.591 25.147 2.568 517 H ASP 70 H ASP 70 -2.233 20.314 3.406 518 HA ASP 70 HA ASP 70 0.601 20.319 2.795 519 1HB ASP 70 HB2 ASP 70 -0.216 20.120 5.133 520 2HB ASP 70 HB3 ASP 70 -0.906 18.542 4.737 521 H ILE 71 H ILE 71 -2.186 18.111 2.426 522 HA ILE 71 HA ILE 71 -0.703 15.982 1.172 523 HB ILE 71 HB ILE 71 -3.635 16.777 1.029 524 1HG1 ILE 71 HG12 ILE 71 -2.118 14.451 2.312 525 2HG1 ILE 71 HG13 ILE 71 -2.763 15.854 3.172 526 1HG2 ILE 71 HG21 ILE 71 -3.050 15.648 -1.127 527 2HG2 ILE 71 HG22 ILE 71 -2.350 14.296 -0.218 528 3HG2 ILE 71 HG23 ILE 71 -4.093 14.656 -0.143 529 1HD1 ILE 71 HD11 ILE 71 -4.341 13.632 1.827 530 2HD1 ILE 71 HD12 ILE 71 -4.270 14.043 3.545 531 3HD1 ILE 71 HD13 ILE 71 -5.082 15.147 2.414 532 H LEU 72 H LEU 72 -2.354 18.897 -0.170 533 HA LEU 72 HA LEU 72 -1.761 18.408 -2.878 534 1HB LEU 72 HB2 LEU 72 -3.307 20.126 -2.144 535 2HB LEU 72 HB3 LEU 72 -2.061 20.968 -1.271 536 HG LEU 72 HG LEU 72 -1.300 20.668 -4.083 537 1HD1 LEU 72 HD11 LEU 72 -3.734 20.575 -4.496 538 2HD1 LEU 72 HD12 LEU 72 -3.957 22.076 -3.583 539 3HD1 LEU 72 HD13 LEU 72 -3.026 22.084 -5.098 540 1HD2 LEU 72 HD21 LEU 72 -1.931 23.043 -2.294 541 2HD2 LEU 72 HD22 LEU 72 -0.354 22.286 -2.533 542 3HD2 LEU 72 HD23 LEU 72 -1.133 23.142 -3.881 543 H ASN 73 H ASN 73 0.242 20.136 -0.419 544 HA ASN 73 HA ASN 73 2.415 20.634 -2.202 545 1HB ASN 73 HB2 ASN 73 2.059 20.660 0.815 546 2HB ASN 73 HB3 ASN 73 3.678 20.722 0.152 547 1HD2 ASN 73 HD21 ASN 73 0.544 22.466 0.115 548 2HD2 ASN 73 HD22 ASN 73 1.227 23.969 -0.484 549 H ASN 74 H ASN 74 1.456 17.630 -0.708 550 HA ASN 74 HA ASN 74 4.226 16.543 -0.760 551 1HB ASN 74 HB2 ASN 74 1.609 15.349 0.240 552 2HB ASN 74 HB3 ASN 74 3.174 14.557 0.319 553 1HD2 ASN 74 HD21 ASN 74 1.435 15.093 2.548 554 2HD2 ASN 74 HD22 ASN 74 2.131 16.316 3.571 555 H ALA 75 H ALA 75 1.364 16.727 -2.731 556 HA ALA 75 HA ALA 75 1.336 14.056 -3.585 557 1HB ALA 75 HB1 ALA 75 0.168 16.518 -4.942 558 2HB ALA 75 HB2 ALA 75 -0.283 14.830 -5.273 559 3HB ALA 75 HB3 ALA 75 -0.630 15.538 -3.692 560 H ASP 76 H ASP 76 1.708 13.292 -5.917 561 HA ASP 76 HA ASP 76 4.223 14.413 -7.047 562 1HB ASP 76 HB2 ASP 76 3.794 11.935 -7.085 563 2HB ASP 76 HB3 ASP 76 2.382 12.225 -8.119 564 H LEU 77 H LEU 77 0.725 14.358 -7.427 565 HA LEU 77 HA LEU 77 0.744 16.394 -9.555 566 1HB LEU 77 HB2 LEU 77 0.821 14.317 -10.750 567 2HB LEU 77 HB3 LEU 77 -0.318 13.557 -9.630 568 HG LEU 77 HG LEU 77 -2.142 15.023 -10.495 569 1HD1 LEU 77 HD11 LEU 77 -0.163 15.752 -12.697 570 2HD1 LEU 77 HD12 LEU 77 -1.852 16.243 -12.577 571 3HD1 LEU 77 HD13 LEU 77 -0.678 16.883 -11.435 572 1HD2 LEU 77 HD21 LEU 77 -1.723 12.726 -11.308 573 2HD2 LEU 77 HD22 LEU 77 -2.390 13.767 -12.574 574 3HD2 LEU 77 HD23 LEU 77 -0.648 13.383 -12.552 575 H VAL 78 H VAL 78 -1.057 17.587 -9.592 576 HA VAL 78 HA VAL 78 -3.366 16.930 -7.844 577 HB VAL 78 HB VAL 78 -2.074 19.618 -8.428 578 1HG1 VAL 78 HG11 VAL 78 -4.531 19.890 -8.423 579 2HG1 VAL 78 HG12 VAL 78 -4.622 19.078 -6.844 580 3HG1 VAL 78 HG13 VAL 78 -3.804 20.651 -7.012 581 1HG2 VAL 78 HG21 VAL 78 -1.568 19.841 -6.148 582 2HG2 VAL 78 HG22 VAL 78 -2.507 18.387 -5.695 583 3HG2 VAL 78 HG23 VAL 78 -0.993 18.249 -6.601 584 H VAL 79 H VAL 79 -5.360 17.119 -9.047 585 HA VAL 79 HA VAL 79 -5.050 17.988 -11.901 586 HB VAL 79 HB VAL 79 -6.779 15.681 -10.959 587 1HG1 VAL 79 HG11 VAL 79 -7.667 16.892 -12.903 588 2HG1 VAL 79 HG12 VAL 79 -6.094 16.753 -13.724 589 3HG1 VAL 79 HG13 VAL 79 -7.071 15.299 -13.385 590 1HG2 VAL 79 HG21 VAL 79 -4.134 15.642 -12.465 591 2HG2 VAL 79 HG22 VAL 79 -4.455 14.953 -10.853 592 3HG2 VAL 79 HG23 VAL 79 -5.219 14.250 -12.278 593 H THR 80 H THR 80 -6.085 19.860 -12.100 594 HA THR 80 HA THR 80 -8.258 20.500 -10.216 595 HB THR 80 HB THR 80 -7.977 22.784 -11.045 596 HG1 THR 80 HG1 THR 80 -7.256 22.174 -13.138 597 1HG2 THR 80 HG21 THR 80 -6.544 22.005 -9.168 598 2HG2 THR 80 HG22 THR 80 -5.307 21.470 -10.324 599 3HG2 THR 80 HG23 THR 80 -5.698 23.187 -10.190 600 H LEU 81 H LEU 81 -9.980 19.361 -10.896 601 HA LEU 81 HA LEU 81 -10.434 18.600 -13.602 602 1HB LEU 81 HB2 LEU 81 -12.231 18.574 -11.160 603 2HB LEU 81 HB3 LEU 81 -12.679 17.826 -12.690 604 HG LEU 81 HG LEU 81 -10.195 17.057 -11.092 605 1HD1 LEU 81 HD11 LEU 81 -11.472 15.139 -10.315 606 2HD1 LEU 81 HD12 LEU 81 -12.254 16.639 -9.806 607 3HD1 LEU 81 HD13 LEU 81 -12.918 15.711 -11.174 608 1HD2 LEU 81 HD21 LEU 81 -10.013 16.404 -13.454 609 2HD2 LEU 81 HD22 LEU 81 -10.320 14.970 -12.475 610 3HD2 LEU 81 HD23 LEU 81 -11.634 15.696 -13.419 611 H CYS 82 H CYS 82 -11.034 21.698 -12.239 612 HA CYS 82 HA CYS 82 -12.358 22.357 -14.711 613 1HB CYS 82 HB2 CYS 82 -14.293 21.822 -13.266 614 2HB CYS 82 HB3 CYS 82 -13.747 23.035 -12.083 615 HG CYS 82 HG CYS 82 -15.803 23.892 -13.560 616 H GLY 83 H GLY 83 -11.510 24.280 -15.387 617 1HA GLY 83 HA1 GLY 83 -9.139 25.144 -14.336 618 2HA GLY 83 HA2 GLY 83 -10.120 26.080 -15.476 619 H ASP 84 H ASP 84 -12.372 26.547 -13.630 620 HA ASP 84 HA ASP 84 -11.431 28.889 -12.304 621 1HB ASP 84 HB2 ASP 84 -13.767 28.541 -13.055 622 2HB ASP 84 HB3 ASP 84 -13.981 27.311 -11.806 623 H ALA 85 H ALA 85 -11.642 25.524 -11.241 624 HA ALA 85 HA ALA 85 -11.442 26.061 -8.403 625 1HB ALA 85 HB1 ALA 85 -10.593 23.511 -9.839 626 2HB ALA 85 HB2 ALA 85 -11.169 23.709 -8.182 627 3HB ALA 85 HB3 ALA 85 -12.298 23.896 -9.536 628 H ALA 86 H ALA 86 -9.154 25.798 -11.099 629 HA ALA 86 HA ALA 86 -6.882 24.994 -9.608 630 1HB ALA 86 HB1 ALA 86 -5.625 25.553 -11.595 631 2HB ALA 86 HB2 ALA 86 -7.186 24.884 -12.121 632 3HB ALA 86 HB3 ALA 86 -6.903 26.639 -12.170 633 H ASP 87 H ASP 87 -8.435 28.097 -9.804 634 HA ASP 87 HA ASP 87 -6.334 29.856 -9.101 635 1HB ASP 87 HB2 ASP 87 -8.642 30.542 -9.749 636 2HB ASP 87 HB3 ASP 87 -9.252 29.838 -8.239 637 H LYS 88 H LYS 88 -8.194 27.523 -7.197 638 HA LYS 88 HA LYS 88 -7.635 28.744 -4.633 639 1HB LYS 88 HB2 LYS 88 -9.661 27.391 -5.131 640 2HB LYS 88 HB3 LYS 88 -8.641 25.964 -5.381 641 1HG LYS 88 HG2 LYS 88 -9.709 25.838 -3.259 642 2HG LYS 88 HG3 LYS 88 -7.973 26.002 -3.028 643 1HD LYS 88 HD2 LYS 88 -8.233 28.364 -2.402 644 2HD LYS 88 HD3 LYS 88 -9.970 28.305 -2.801 645 1HE LYS 88 HE2 LYS 88 -10.309 26.558 -1.094 646 2HE LYS 88 HE3 LYS 88 -8.586 26.576 -0.704 647 1HZ LYS 88 HZ1 LYS 88 -10.440 28.864 -0.314 648 2HZ LYS 88 HZ2 LYS 88 -9.860 27.907 0.869 649 3HZ LYS 88 HZ3 LYS 88 -8.846 28.878 0.045 650 H CYS 89 H CYS 89 -5.996 26.273 -6.552 651 HA CYS 89 HA CYS 89 -4.704 24.754 -4.704 652 1HB CYS 89 HB2 CYS 89 -3.565 25.832 -7.300 653 2HB CYS 89 HB3 CYS 89 -2.927 24.439 -6.404 654 HG CYS 89 HG CYS 89 -5.133 23.035 -6.423 655 HA PRO 90 HA PRO 90 -2.850 28.197 -2.621 656 1HB PRO 90 HB2 PRO 90 -1.739 26.885 -0.422 657 2HB PRO 90 HB3 PRO 90 -3.400 27.541 -0.611 658 1HG PRO 90 HG2 PRO 90 -2.471 24.707 -0.886 659 2HG PRO 90 HG3 PRO 90 -4.046 25.321 -0.284 660 1HD PRO 90 HD2 PRO 90 -3.699 24.287 -2.803 661 2HD PRO 90 HD3 PRO 90 -4.915 25.515 -2.396 662 H MET 91 H MET 91 -0.709 25.337 -2.994 663 HA MET 91 HA MET 91 1.088 26.843 -4.601 664 1HB MET 91 HB2 MET 91 1.863 27.641 -2.300 665 2HB MET 91 HB3 MET 91 2.229 25.963 -1.894 666 1HG MET 91 HG2 MET 91 3.810 25.895 -3.838 667 2HG MET 91 HG3 MET 91 3.425 27.587 -4.171 668 1HE MET 91 HE1 MET 91 5.978 28.229 -4.193 669 2HE MET 91 HE2 MET 91 7.122 27.761 -2.916 670 3HE MET 91 HE3 MET 91 6.362 26.514 -3.928 671 H THR 92 H THR 92 1.637 25.233 -6.117 672 HA THR 92 HA THR 92 2.062 22.463 -5.099 673 HB THR 92 HB THR 92 1.631 21.787 -7.451 674 HG1 THR 92 HG1 THR 92 2.076 23.812 -8.429 675 1HG2 THR 92 HG21 THR 92 -0.646 23.399 -6.267 676 2HG2 THR 92 HG22 THR 92 -0.743 21.996 -7.354 677 3HG2 THR 92 HG23 THR 92 -0.135 21.786 -5.713 678 HA PRO 93 HA PRO 93 6.268 24.220 -5.930 679 1HB PRO 93 HB2 PRO 93 7.667 22.675 -4.120 680 2HB PRO 93 HB3 PRO 93 6.772 24.157 -3.670 681 1HG PRO 93 HG2 PRO 93 5.828 21.279 -3.488 682 2HG PRO 93 HG3 PRO 93 5.767 22.547 -2.221 683 1HD PRO 93 HD2 PRO 93 3.614 21.998 -3.763 684 2HD PRO 93 HD3 PRO 93 4.007 23.683 -3.318 685 HA PRO 94 HA PRO 94 7.663 21.494 -8.943 686 1HB PRO 94 HB2 PRO 94 10.334 21.136 -7.564 687 2HB PRO 94 HB3 PRO 94 10.002 21.470 -9.295 688 1HG PRO 94 HG2 PRO 94 10.700 23.498 -7.653 689 2HG PRO 94 HG3 PRO 94 9.343 23.721 -8.806 690 1HD PRO 94 HD2 PRO 94 9.225 23.125 -5.850 691 2HD PRO 94 HD3 PRO 94 8.231 24.247 -6.824 692 H HIS 95 H HIS 95 7.964 19.945 -5.771 693 HA HIS 95 HA HIS 95 8.429 17.251 -6.680 694 1HB HIS 95 HB2 HIS 95 8.534 17.966 -4.303 695 2HB HIS 95 HB3 HIS 95 6.805 18.308 -4.317 696 HD1 HIS 95 HD1 HIS 95 5.178 15.973 -4.681 697 HD2 HIS 95 HD2 HIS 95 9.276 15.520 -3.756 698 HE1 HIS 95 HE1 HIS 95 5.474 13.594 -3.869 699 H VAL 96 H VAL 96 5.625 19.363 -6.475 700 HA VAL 96 HA VAL 96 3.654 17.364 -7.300 701 HB VAL 96 HB VAL 96 3.213 20.327 -6.725 702 1HG1 VAL 96 HG11 VAL 96 1.019 19.484 -5.890 703 2HG1 VAL 96 HG12 VAL 96 1.273 19.133 -7.594 704 3HG1 VAL 96 HG13 VAL 96 1.490 17.847 -6.381 705 1HG2 VAL 96 HG21 VAL 96 2.750 19.911 -4.395 706 2HG2 VAL 96 HG22 VAL 96 3.336 18.251 -4.528 707 3HG2 VAL 96 HG23 VAL 96 4.444 19.622 -4.742 708 H LYS 97 H LYS 97 2.235 18.010 -9.144 709 HA LYS 97 HA LYS 97 3.165 20.091 -10.972 710 1HB LYS 97 HB2 LYS 97 3.403 18.752 -12.883 711 2HB LYS 97 HB3 LYS 97 4.255 17.852 -11.637 712 1HG LYS 97 HG2 LYS 97 1.933 16.569 -11.400 713 2HG LYS 97 HG3 LYS 97 1.639 17.240 -13.014 714 1HD LYS 97 HD2 LYS 97 3.927 16.215 -13.664 715 2HD LYS 97 HD3 LYS 97 3.893 15.426 -12.085 716 1HE LYS 97 HE2 LYS 97 3.107 13.796 -13.591 717 2HE LYS 97 HE3 LYS 97 1.677 14.357 -12.740 718 1HZ LYS 97 HZ1 LYS 97 1.084 15.670 -14.723 719 2HZ LYS 97 HZ2 LYS 97 2.518 15.317 -15.431 720 3HZ LYS 97 HZ3 LYS 97 1.421 14.151 -15.235 721 H ARG 98 H ARG 98 1.294 20.342 -12.732 722 HA ARG 98 HA ARG 98 -1.266 19.432 -11.590 723 1HB ARG 98 HB2 ARG 98 -0.428 22.300 -11.884 724 2HB ARG 98 HB3 ARG 98 -2.063 21.871 -12.408 725 1HG ARG 98 HG2 ARG 98 -2.543 20.809 -10.272 726 2HG ARG 98 HG3 ARG 98 -0.936 21.242 -9.658 727 1HD ARG 98 HD2 ARG 98 -3.030 23.257 -10.588 728 2HD ARG 98 HD3 ARG 98 -2.883 22.691 -8.916 729 HE ARG 98 HE ARG 98 -0.398 23.515 -9.236 730 1HH1 ARG 98 HH21 ARG 98 -3.420 25.216 -10.058 731 2HH1 ARG 98 HH22 ARG 98 -2.761 26.777 -9.764 732 1HH2 ARG 98 HH11 ARG 98 0.405 25.482 -8.752 733 2HH2 ARG 98 HH12 ARG 98 -0.485 26.954 -9.014 734 H GLU 99 H GLU 99 -2.888 19.119 -12.931 735 HA GLU 99 HA GLU 99 -2.583 19.564 -15.848 736 1HB GLU 99 HB2 GLU 99 -3.059 17.009 -14.362 737 2HB GLU 99 HB3 GLU 99 -4.284 17.370 -15.562 738 1HG GLU 99 HG2 GLU 99 -2.547 15.958 -16.492 739 2HG GLU 99 HG3 GLU 99 -2.674 17.496 -17.338 740 H HIS 100 H HIS 100 -4.752 20.016 -16.791 741 HA HIS 100 HA HIS 100 -6.698 21.028 -14.784 742 1HB HIS 100 HB2 HIS 100 -5.753 22.647 -17.171 743 2HB HIS 100 HB3 HIS 100 -6.743 23.183 -15.825 744 HD1 HIS 100 HD1 HIS 100 -5.089 22.928 -13.329 745 HD2 HIS 100 HD2 HIS 100 -3.413 23.661 -17.121 746 HE1 HIS 100 HE1 HIS 100 -2.843 24.092 -12.922 747 H TRP 101 H TRP 101 -8.823 20.922 -15.455 748 HA TRP 101 HA TRP 101 -9.476 20.378 -18.299 749 1HB TRP 101 HB2 TRP 101 -10.613 18.824 -15.976 750 2HB TRP 101 HB3 TRP 101 -10.878 18.569 -17.704 751 HD1 TRP 101 HD1 TRP 101 -8.674 17.583 -14.889 752 HE1 TRP 101 HE1 TRP 101 -6.738 16.104 -15.639 753 HE3 TRP 101 HE3 TRP 101 -9.051 18.277 -19.945 754 HZ2 TRP 101 HZ2 TRP 101 -5.559 15.221 -18.128 755 HZ3 TRP 101 HZ3 TRP 101 -7.508 17.094 -21.484 756 HH2 TRP 101 HH2 TRP 101 -5.787 15.538 -20.586 757 H GLY 102 H GLY 102 -12.294 20.199 -17.898 758 1HA GLY 102 HA1 GLY 102 -13.012 22.853 -16.732 759 2HA GLY 102 HA2 GLY 102 -13.221 22.541 -18.453 760 H PHE 103 H PHE 103 -13.817 20.323 -15.656 761 HA PHE 103 HA PHE 103 -16.324 19.512 -16.855 762 1HB PHE 103 HB2 PHE 103 -14.871 18.705 -14.318 763 2HB PHE 103 HB3 PHE 103 -16.450 18.078 -14.766 764 HD1 PHE 103 HD1 PHE 103 -16.757 16.485 -16.547 765 HD2 PHE 103 HD2 PHE 103 -12.866 18.178 -15.821 766 HE1 PHE 103 HE1 PHE 103 -15.723 14.794 -18.011 767 HE2 PHE 103 HE2 PHE 103 -11.837 16.569 -17.344 768 HZ PHE 103 HZ PHE 103 -13.280 14.815 -18.440 769 H ASP 104 H ASP 104 -18.105 20.673 -16.709 770 HA ASP 104 HA ASP 104 -18.725 22.499 -14.544 771 1HB ASP 104 HB2 ASP 104 -19.609 22.736 -16.877 772 2HB ASP 104 HB3 ASP 104 -20.529 21.239 -16.643 773 H ASP 105 H ASP 105 -20.561 22.168 -13.072 774 HA ASP 105 HA ASP 105 -20.102 19.683 -11.692 775 1HB ASP 105 HB2 ASP 105 -20.376 22.000 -10.684 776 2HB ASP 105 HB3 ASP 105 -22.114 21.808 -10.911 777 HA PRO 106 HA PRO 106 -23.607 17.774 -13.750 778 1HB PRO 106 HB2 PRO 106 -23.502 15.252 -12.639 779 2HB PRO 106 HB3 PRO 106 -22.350 15.818 -13.879 780 1HG PRO 106 HG2 PRO 106 -22.001 15.765 -10.870 781 2HG PRO 106 HG3 PRO 106 -20.853 15.200 -12.121 782 1HD PRO 106 HD2 PRO 106 -20.637 17.661 -10.958 783 2HD PRO 106 HD3 PRO 106 -20.246 17.418 -12.687 784 H ALA 107 H ALA 107 -23.280 17.836 -10.192 785 HA ALA 107 HA ALA 107 -25.891 16.742 -9.708 786 1HB ALA 107 HB1 ALA 107 -24.085 18.380 -7.888 787 2HB ALA 107 HB2 ALA 107 -25.498 17.437 -7.381 788 3HB ALA 107 HB3 ALA 107 -24.074 16.611 -8.048 789 H ARG 108 H ARG 108 -24.812 19.872 -10.665 790 HA ARG 108 HA ARG 108 -27.306 21.193 -9.747 791 1HB ARG 108 HB2 ARG 108 -24.638 22.341 -10.691 792 2HB ARG 108 HB3 ARG 108 -26.091 23.294 -10.407 793 1HG ARG 108 HG2 ARG 108 -25.034 23.563 -8.395 794 2HG ARG 108 HG3 ARG 108 -26.133 22.227 -8.041 795 1HD ARG 108 HD2 ARG 108 -24.181 20.649 -8.437 796 2HD ARG 108 HD3 ARG 108 -23.144 22.080 -8.595 797 HE ARG 108 HE ARG 108 -24.457 22.415 -6.188 798 1HH1 ARG 108 HH21 ARG 108 -22.231 19.959 -7.541 799 2HH1 ARG 108 HH22 ARG 108 -21.704 19.417 -5.994 800 1HH2 ARG 108 HH11 ARG 108 -23.710 21.694 -4.148 801 2HH2 ARG 108 HH12 ARG 108 -22.556 20.424 -4.026 802 H ALA 109 H ALA 109 -26.337 19.475 -12.454 803 HA ALA 109 HA ALA 109 -27.433 21.081 -14.558 804 1HB ALA 109 HB1 ALA 109 -27.610 18.924 -15.731 805 2HB ALA 109 HB2 ALA 109 -26.033 19.017 -14.904 806 3HB ALA 109 HB3 ALA 109 -27.346 18.041 -14.213 807 H GLN 110 H GLN 110 -29.684 21.277 -15.035 808 HA GLN 110 HA GLN 110 -31.611 19.925 -13.228 809 1HB GLN 110 HB2 GLN 110 -32.401 22.017 -12.228 810 2HB GLN 110 HB3 GLN 110 -30.719 21.694 -11.865 811 1HG GLN 110 HG2 GLN 110 -30.090 23.323 -13.745 812 2HG GLN 110 HG3 GLN 110 -31.802 23.749 -13.839 813 1HE2 GLN 110 HE22 GLN 110 -29.021 23.511 -11.590 814 2HE2 GLN 110 HE21 GLN 110 -29.512 24.831 -10.536 815 H GLY 111 H GLY 111 -31.200 20.147 -16.191 816 1HA GLY 111 HA1 GLY 111 -33.076 22.025 -17.317 817 2HA GLY 111 HA2 GLY 111 -32.370 20.631 -18.147 818 H THR 112 H THR 112 -33.235 18.486 -16.877 819 HA THR 112 HA THR 112 -35.872 18.440 -15.857 820 HB THR 112 HB THR 112 -36.588 18.628 -18.170 821 HG1 THR 112 HG1 THR 112 -37.861 17.253 -17.128 822 1HG2 THR 112 HG21 THR 112 -36.022 16.915 -19.874 823 2HG2 THR 112 HG22 THR 112 -34.656 17.945 -19.440 824 3HG2 THR 112 HG23 THR 112 -34.758 16.289 -18.798 825 H GLU 113 H GLU 113 -36.276 16.007 -15.211 826 HA GLU 113 HA GLU 113 -33.954 15.249 -13.799 827 1HB GLU 113 HB2 GLU 113 -36.181 14.684 -13.026 828 2HB GLU 113 HB3 GLU 113 -36.472 13.664 -14.446 829 1HG GLU 113 HG2 GLU 113 -34.737 12.102 -13.762 830 2HG GLU 113 HG3 GLU 113 -34.232 13.160 -12.438 831 H GLU 114 H GLU 114 -35.257 14.019 -16.863 832 HA GLU 114 HA GLU 114 -33.303 11.931 -17.094 833 1HB GLU 114 HB2 GLU 114 -34.065 11.661 -19.389 834 2HB GLU 114 HB3 GLU 114 -35.419 11.762 -18.264 835 1HG GLU 114 HG2 GLU 114 -35.796 14.128 -18.923 836 2HG GLU 114 HG3 GLU 114 -34.438 14.032 -20.052 837 H GLU 115 H GLU 115 -33.267 15.355 -17.953 838 HA GLU 115 HA GLU 115 -30.887 15.117 -19.573 839 1HB GLU 115 HB2 GLU 115 -32.483 16.840 -20.077 840 2HB GLU 115 HB3 GLU 115 -32.329 17.543 -18.459 841 1HG GLU 115 HG2 GLU 115 -30.162 18.334 -18.849 842 2HG GLU 115 HG3 GLU 115 -29.891 17.259 -20.229 843 H LYS 116 H LYS 116 -31.703 15.965 -16.196 844 HA LYS 116 HA LYS 116 -29.142 16.682 -15.285 845 1HB LYS 116 HB2 LYS 116 -31.204 17.128 -14.096 846 2HB LYS 116 HB3 LYS 116 -31.556 15.403 -13.922 847 1HG LYS 116 HG2 LYS 116 -29.692 15.066 -12.467 848 2HG LYS 116 HG3 LYS 116 -29.073 16.700 -12.789 849 1HD LYS 116 HD2 LYS 116 -31.511 17.378 -11.813 850 2HD LYS 116 HD3 LYS 116 -31.349 15.785 -11.029 851 1HE LYS 116 HE2 LYS 116 -29.016 16.554 -10.294 852 2HE LYS 116 HE3 LYS 116 -29.414 18.128 -10.972 853 1HZ LYS 116 HZ1 LYS 116 -31.223 18.312 -9.367 854 2HZ LYS 116 HZ2 LYS 116 -30.852 16.858 -8.713 855 3HZ LYS 116 HZ3 LYS 116 -29.796 18.101 -8.607 856 H TRP 117 H TRP 117 -30.815 13.487 -15.300 857 HA TRP 117 HA TRP 117 -28.555 12.011 -14.367 858 1HB TRP 117 HB2 TRP 117 -30.851 11.099 -14.377 859 2HB TRP 117 HB3 TRP 117 -30.830 11.045 -16.142 860 HD1 TRP 117 HD1 TRP 117 -29.393 9.135 -17.290 861 HE1 TRP 117 HE1 TRP 117 -28.279 6.968 -16.450 862 HE3 TRP 117 HE3 TRP 117 -29.598 10.003 -12.251 863 HZ2 TRP 117 HZ2 TRP 117 -27.294 5.932 -13.970 864 HZ3 TRP 117 HZ3 TRP 117 -28.409 8.502 -10.685 865 HH2 TRP 117 HH2 TRP 117 -27.223 6.477 -11.531 866 H ALA 118 H ALA 118 -29.610 12.826 -17.747 867 HA ALA 118 HA ALA 118 -27.553 11.406 -19.039 868 1HB ALA 118 HB1 ALA 118 -28.853 14.026 -19.894 869 2HB ALA 118 HB2 ALA 118 -27.972 12.905 -20.942 870 3HB ALA 118 HB3 ALA 118 -29.502 12.400 -20.193 871 H PHE 119 H PHE 119 -27.484 14.635 -17.499 872 HA PHE 119 HA PHE 119 -24.863 15.330 -18.355 873 1HB PHE 119 HB2 PHE 119 -26.829 16.683 -17.126 874 2HB PHE 119 HB3 PHE 119 -25.911 16.264 -15.694 875 HD1 PHE 119 HD1 PHE 119 -23.273 16.811 -15.861 876 HD2 PHE 119 HD2 PHE 119 -26.347 18.634 -18.278 877 HE1 PHE 119 HE1 PHE 119 -21.810 18.780 -16.237 878 HE2 PHE 119 HE2 PHE 119 -24.887 20.598 -18.648 879 HZ PHE 119 HZ PHE 119 -22.611 20.669 -17.648 880 H PHE 120 H PHE 120 -26.079 13.582 -15.430 881 HA PHE 120 HA PHE 120 -23.602 13.165 -14.122 882 1HB PHE 120 HB2 PHE 120 -25.818 11.103 -14.304 883 2HB PHE 120 HB3 PHE 120 -24.570 11.230 -13.107 884 HD1 PHE 120 HD1 PHE 120 -27.061 10.698 -12.164 885 HD2 PHE 120 HD2 PHE 120 -25.548 14.597 -13.204 886 HE1 PHE 120 HE1 PHE 120 -28.606 11.735 -10.524 887 HE2 PHE 120 HE2 PHE 120 -27.059 15.613 -11.552 888 HZ PHE 120 HZ PHE 120 -28.580 14.197 -10.186 889 H GLN 121 H GLN 121 -25.261 11.233 -16.676 890 HA GLN 121 HA GLN 121 -23.294 9.230 -16.974 891 1HB GLN 121 HB2 GLN 121 -25.321 10.349 -18.952 892 2HB GLN 121 HB3 GLN 121 -24.306 8.962 -19.297 893 1HG GLN 121 HG2 GLN 121 -26.258 9.133 -16.957 894 2HG GLN 121 HG3 GLN 121 -26.598 8.356 -18.501 895 1HE2 GLN 121 HE22 GLN 121 -25.861 7.547 -15.417 896 2HE2 GLN 121 HE21 GLN 121 -24.892 6.120 -15.693 897 H ARG 122 H ARG 122 -23.640 12.308 -18.790 898 HA ARG 122 HA ARG 122 -21.377 11.888 -20.467 899 1HB ARG 122 HB2 ARG 122 -22.929 14.342 -19.604 900 2HB ARG 122 HB3 ARG 122 -21.331 14.575 -20.296 901 1HG ARG 122 HG2 ARG 122 -22.852 14.770 -22.089 902 2HG ARG 122 HG3 ARG 122 -21.977 13.247 -22.298 903 1HD ARG 122 HD2 ARG 122 -23.952 12.059 -21.266 904 2HD ARG 122 HD3 ARG 122 -24.804 13.622 -21.244 905 HE ARG 122 HE ARG 122 -23.993 13.330 -23.860 906 1HH1 ARG 122 HH21 ARG 122 -25.941 11.390 -21.631 907 2HH1 ARG 122 HH22 ARG 122 -26.940 10.696 -22.861 908 1HH2 ARG 122 HH11 ARG 122 -25.318 12.416 -25.517 909 2HH2 ARG 122 HH12 ARG 122 -26.574 11.307 -25.123 910 H VAL 123 H VAL 123 -21.594 13.581 -17.280 911 HA VAL 123 HA VAL 123 -18.812 14.197 -17.326 912 HB VAL 123 HB VAL 123 -20.840 14.147 -15.058 913 1HG1 VAL 123 HG11 VAL 123 -17.948 15.127 -15.013 914 2HG1 VAL 123 HG12 VAL 123 -19.169 15.554 -13.801 915 3HG1 VAL 123 HG13 VAL 123 -18.667 13.870 -13.986 916 1HG2 VAL 123 HG21 VAL 123 -21.189 15.862 -16.842 917 2HG2 VAL 123 HG22 VAL 123 -20.672 16.631 -15.334 918 3HG2 VAL 123 HG23 VAL 123 -19.517 16.410 -16.653 919 H ARG 124 H ARG 124 -20.491 11.301 -15.749 920 HA ARG 124 HA ARG 124 -17.990 10.412 -14.751 921 1HB ARG 124 HB2 ARG 124 -18.914 8.194 -14.462 922 2HB ARG 124 HB3 ARG 124 -20.103 9.394 -13.941 923 1HG ARG 124 HG2 ARG 124 -21.353 9.028 -16.042 924 2HG ARG 124 HG3 ARG 124 -20.127 7.874 -16.588 925 1HD ARG 124 HD2 ARG 124 -20.652 6.481 -14.548 926 2HD ARG 124 HD3 ARG 124 -22.060 7.530 -14.283 927 HE ARG 124 HE ARG 124 -22.290 6.801 -16.927 928 1HH1 ARG 124 HH21 ARG 124 -22.114 4.900 -13.917 929 2HH1 ARG 124 HH22 ARG 124 -22.683 3.445 -14.699 930 1HH2 ARG 124 HH11 ARG 124 -23.415 5.022 -17.750 931 2HH2 ARG 124 HH12 ARG 124 -23.454 3.517 -16.893 932 H ASP 125 H ASP 125 -19.533 9.813 -17.915 933 HA ASP 125 HA ASP 125 -17.650 7.904 -18.816 934 1HB ASP 125 HB2 ASP 125 -19.770 8.271 -19.969 935 2HB ASP 125 HB3 ASP 125 -19.290 9.917 -20.402 936 H GLU 126 H GLU 126 -17.670 11.496 -19.122 937 HA GLU 126 HA GLU 126 -15.224 11.455 -20.582 938 1HB GLU 126 HB2 GLU 126 -16.931 13.675 -19.465 939 2HB GLU 126 HB3 GLU 126 -15.413 13.993 -20.307 940 1HG GLU 126 HG2 GLU 126 -17.759 12.462 -21.505 941 2HG GLU 126 HG3 GLU 126 -17.460 14.181 -21.723 942 H ILE 127 H ILE 127 -15.938 11.765 -17.093 943 HA ILE 127 HA ILE 127 -13.280 12.686 -16.442 944 HB ILE 127 HB ILE 127 -15.619 12.306 -14.984 945 1HG1 ILE 127 HG12 ILE 127 -14.218 12.826 -12.925 946 2HG1 ILE 127 HG13 ILE 127 -12.807 12.843 -13.996 947 1HG2 ILE 127 HG21 ILE 127 -13.718 10.257 -13.892 948 2HG2 ILE 127 HG22 ILE 127 -15.229 10.837 -13.156 949 3HG2 ILE 127 HG23 ILE 127 -15.294 9.971 -14.687 950 1HD1 ILE 127 HD11 ILE 127 -13.904 15.090 -13.540 951 2HD1 ILE 127 HD12 ILE 127 -13.790 14.670 -15.261 952 3HD1 ILE 127 HD13 ILE 127 -15.343 14.502 -14.401 953 H GLY 128 H GLY 128 -14.812 9.463 -16.869 954 1HA GLY 128 HA1 GLY 128 -12.540 7.881 -16.242 955 2HA GLY 128 HA2 GLY 128 -13.920 7.405 -17.257 956 H ASN 129 H ASN 129 -13.788 9.094 -19.390 957 HA ASN 129 HA ASN 129 -11.758 8.151 -21.076 958 1HB ASN 129 HB2 ASN 129 -13.950 9.202 -21.723 959 2HB ASN 129 HB3 ASN 129 -13.278 10.767 -21.261 960 1HD2 ASN 129 HD22 ASN 129 -13.852 11.413 -23.417 961 2HD2 ASN 129 HD21 ASN 129 -12.882 10.908 -24.801 962 H ARG 130 H ARG 130 -11.854 11.168 -19.140 963 HA ARG 130 HA ARG 130 -9.335 12.142 -20.039 964 1HB ARG 130 HB2 ARG 130 -11.307 13.033 -18.162 965 2HB ARG 130 HB3 ARG 130 -9.853 12.804 -17.225 966 1HG ARG 130 HG2 ARG 130 -9.741 15.009 -17.909 967 2HG ARG 130 HG3 ARG 130 -8.627 14.197 -19.003 968 1HD ARG 130 HD2 ARG 130 -11.505 15.015 -19.633 969 2HD ARG 130 HD3 ARG 130 -10.085 15.894 -20.126 970 HE ARG 130 HE ARG 130 -9.433 14.067 -21.594 971 1HH1 ARG 130 HH21 ARG 130 -12.773 13.656 -20.389 972 2HH1 ARG 130 HH22 ARG 130 -13.402 13.203 -21.935 973 1HH2 ARG 130 HH11 ARG 130 -10.143 13.061 -23.378 974 2HH2 ARG 130 HH12 ARG 130 -11.825 12.606 -23.607 975 H LEU 131 H LEU 131 -10.134 10.038 -17.218 976 HA LEU 131 HA LEU 131 -7.387 9.872 -16.444 977 1HB LEU 131 HB2 LEU 131 -9.867 8.419 -15.654 978 2HB LEU 131 HB3 LEU 131 -8.348 7.569 -15.393 979 HG LEU 131 HG LEU 131 -9.031 8.797 -13.449 980 1HD1 LEU 131 HD11 LEU 131 -6.619 8.303 -13.937 981 2HD1 LEU 131 HD12 LEU 131 -6.438 9.950 -14.577 982 3HD1 LEU 131 HD13 LEU 131 -6.847 9.703 -12.890 983 1HD2 LEU 131 HD21 LEU 131 -10.107 10.756 -14.503 984 2HD2 LEU 131 HD22 LEU 131 -8.947 11.201 -13.250 985 3HD2 LEU 131 HD23 LEU 131 -8.507 11.383 -14.959 986 H LYS 132 H LYS 132 -9.302 7.933 -18.735 987 HA LYS 132 HA LYS 132 -7.286 6.035 -19.318 988 1HB LYS 132 HB2 LYS 132 -9.291 5.426 -20.158 989 2HB LYS 132 HB3 LYS 132 -9.768 7.023 -20.644 990 1HG LYS 132 HG2 LYS 132 -7.574 5.578 -22.183 991 2HG LYS 132 HG3 LYS 132 -9.272 5.147 -22.398 992 1HD LYS 132 HD2 LYS 132 -9.511 7.828 -22.673 993 2HD LYS 132 HD3 LYS 132 -7.845 7.645 -23.240 994 1HE LYS 132 HE2 LYS 132 -8.547 6.111 -24.982 995 2HE LYS 132 HE3 LYS 132 -10.164 5.973 -24.274 996 1HZ LYS 132 HZ1 LYS 132 -10.506 8.336 -24.747 997 2HZ LYS 132 HZ2 LYS 132 -9.056 8.416 -25.518 998 3HZ LYS 132 HZ3 LYS 132 -10.244 7.471 -26.117 999 H GLU 133 H GLU 133 -7.828 9.249 -20.886 1000 HA GLU 133 HA GLU 133 -5.487 8.993 -22.550 1001 1HB GLU 133 HB2 GLU 133 -6.817 11.484 -21.394 1002 2HB GLU 133 HB3 GLU 133 -5.474 11.500 -22.546 1003 1HG GLU 133 HG2 GLU 133 -6.871 10.251 -24.185 1004 2HG GLU 133 HG3 GLU 133 -8.244 10.338 -23.077 1005 H PHE 134 H PHE 134 -5.920 10.466 -19.295 1006 HA PHE 134 HA PHE 134 -3.275 11.358 -19.039 1007 1HB PHE 134 HB2 PHE 134 -4.991 12.090 -17.570 1008 2HB PHE 134 HB3 PHE 134 -5.368 10.436 -17.068 1009 HD1 PHE 134 HD1 PHE 134 -4.096 9.261 -15.447 1010 HD2 PHE 134 HD2 PHE 134 -2.969 13.227 -16.681 1011 HE1 PHE 134 HE1 PHE 134 -2.418 9.353 -13.602 1012 HE2 PHE 134 HE2 PHE 134 -1.264 13.302 -14.887 1013 HZ PHE 134 HZ PHE 134 -0.981 11.355 -13.362 1014 H ALA 135 H ALA 135 -4.635 8.133 -18.400 1015 HA ALA 135 HA ALA 135 -2.208 7.027 -17.354 1016 1HB ALA 135 HB1 ALA 135 -4.408 6.080 -16.823 1017 2HB ALA 135 HB2 ALA 135 -4.655 5.648 -18.531 1018 3HB ALA 135 HB3 ALA 135 -3.368 4.865 -17.591 1019 H GLU 136 H GLU 136 -3.790 6.872 -20.554 1020 HA GLU 136 HA GLU 136 -1.888 5.107 -21.732 1021 1HB GLU 136 HB2 GLU 136 -4.014 6.944 -22.880 1022 2HB GLU 136 HB3 GLU 136 -2.996 5.943 -23.907 1023 1HG GLU 136 HG2 GLU 136 -4.735 4.796 -21.680 1024 2HG GLU 136 HG3 GLU 136 -5.250 4.958 -23.354 1025 H THR 137 H THR 137 -2.198 8.635 -21.761 1026 HA THR 137 HA THR 137 0.053 8.930 -23.513 1027 HB THR 137 HB THR 137 -0.424 11.258 -23.463 1028 HG1 THR 137 HG1 THR 137 -2.429 10.706 -21.550 1029 1HG2 THR 137 HG21 THR 137 -1.819 9.847 -24.905 1030 2HG2 THR 137 HG22 THR 137 -2.987 9.594 -23.605 1031 3HG2 THR 137 HG23 THR 137 -2.761 11.221 -24.281 1032 H GLY 138 H GLY 138 -0.500 8.671 -20.128 1033 1HA GLY 138 HA1 GLY 138 0.729 8.882 -18.254 1034 2HA GLY 138 HA2 GLY 138 2.206 8.805 -19.248 1035 H LYS 139 H LYS 139 -0.515 11.144 -19.277 1036 HA LYS 139 HA LYS 139 1.017 13.316 -19.939 1037 1HB LYS 139 HB2 LYS 139 -1.563 12.927 -19.838 1038 2HB LYS 139 HB3 LYS 139 -1.462 13.682 -18.246 1039 1HG LYS 139 HG2 LYS 139 -0.534 15.708 -19.170 1040 2HG LYS 139 HG3 LYS 139 -0.296 14.964 -20.752 1041 1HD LYS 139 HD2 LYS 139 -2.951 15.658 -19.442 1042 2HD LYS 139 HD3 LYS 139 -2.207 16.454 -20.821 1043 1HE LYS 139 HE2 LYS 139 -3.480 13.690 -20.719 1044 2HE LYS 139 HE3 LYS 139 -3.986 15.101 -21.648 1045 1HZ LYS 139 HZ1 LYS 139 -1.697 13.326 -22.175 1046 2HZ LYS 139 HZ2 LYS 139 -2.940 13.687 -23.146 1047 3HZ LYS 139 HZ3 LYS 139 -1.804 14.825 -22.878 Start of MODEL 12 1 1H MET 1 H1 MET 1 0.600 -0.896 -0.605 2 2H MET 1 H2 MET 1 -0.040 0.592 -0.855 3 3H MET 1 H3 MET 1 0.747 -0.164 -2.074 4 HA MET 1 HA MET 1 1.962 0.791 0.435 5 1HB MET 1 HB2 MET 1 3.239 -0.541 -1.997 6 2HB MET 1 HB3 MET 1 4.134 0.334 -0.752 7 1HG MET 1 HG2 MET 1 3.310 -1.233 0.977 8 2HG MET 1 HG3 MET 1 2.402 -2.113 -0.252 9 1HE MET 1 HE1 MET 1 5.878 -1.352 1.329 10 2HE MET 1 HE2 MET 1 7.016 -2.157 0.227 11 3HE MET 1 HE3 MET 1 6.183 -0.677 -0.289 12 H GLU 2 H GLU 2 2.709 2.894 0.411 13 HA GLU 2 HA GLU 2 1.872 4.726 -1.590 14 1HB GLU 2 HB2 GLU 2 4.086 4.901 0.522 15 2HB GLU 2 HB3 GLU 2 3.532 6.253 -0.450 16 1HG GLU 2 HG2 GLU 2 2.555 6.405 1.734 17 2HG GLU 2 HG3 GLU 2 1.307 6.146 0.529 18 H ASN 3 H ASN 3 3.079 5.824 -3.234 19 HA ASN 3 HA ASN 3 5.854 5.161 -3.728 20 1HB ASN 3 HB2 ASN 3 5.125 3.266 -4.888 21 2HB ASN 3 HB3 ASN 3 3.736 4.085 -5.572 22 1HD2 ASN 3 HD21 ASN 3 3.977 5.168 -7.545 23 2HD2 ASN 3 HD22 ASN 3 5.518 5.325 -8.383 24 H LYS 4 H LYS 4 2.908 6.523 -5.271 25 HA LYS 4 HA LYS 4 4.051 9.191 -5.010 26 1HB LYS 4 HB2 LYS 4 3.915 9.889 -7.268 27 2HB LYS 4 HB3 LYS 4 4.871 8.423 -7.230 28 1HG LYS 4 HG2 LYS 4 2.563 7.256 -7.853 29 2HG LYS 4 HG3 LYS 4 2.107 8.884 -8.359 30 1HD LYS 4 HD2 LYS 4 4.172 8.944 -9.815 31 2HD LYS 4 HD3 LYS 4 4.524 7.273 -9.322 32 1HE LYS 4 HE2 LYS 4 2.160 6.691 -10.168 33 2HE LYS 4 HE3 LYS 4 2.136 8.308 -10.884 34 1HZ LYS 4 HZ1 LYS 4 4.285 7.530 -12.035 35 2HZ LYS 4 HZ2 LYS 4 3.807 5.995 -11.623 36 3HZ LYS 4 HZ3 LYS 4 2.868 6.918 -12.566 37 H ILE 5 H ILE 5 2.149 10.814 -5.890 38 HA ILE 5 HA ILE 5 -0.411 9.742 -4.807 39 HB ILE 5 HB ILE 5 1.121 12.167 -3.813 40 1HG1 ILE 5 HG12 ILE 5 0.775 9.459 -2.537 41 2HG1 ILE 5 HG13 ILE 5 2.242 10.347 -2.895 42 1HG2 ILE 5 HG21 ILE 5 -1.331 12.578 -3.770 43 2HG2 ILE 5 HG22 ILE 5 -1.555 11.088 -2.836 44 3HG2 ILE 5 HG23 ILE 5 -0.692 12.491 -2.152 45 1HD1 ILE 5 HD11 ILE 5 1.925 10.435 -0.544 46 2HD1 ILE 5 HD12 ILE 5 1.567 12.059 -1.184 47 3HD1 ILE 5 HD13 ILE 5 0.244 10.958 -0.700 48 H ILE 6 H ILE 6 -2.225 10.751 -5.661 49 HA ILE 6 HA ILE 6 -1.851 13.113 -7.407 50 HB ILE 6 HB ILE 6 -1.964 11.333 -8.933 51 1HG1 ILE 6 HG12 ILE 6 -4.718 12.624 -8.764 52 2HG1 ILE 6 HG13 ILE 6 -3.265 13.329 -9.482 53 1HG2 ILE 6 HG21 ILE 6 -2.863 9.530 -7.489 54 2HG2 ILE 6 HG22 ILE 6 -4.468 10.285 -7.569 55 3HG2 ILE 6 HG23 ILE 6 -3.701 9.607 -9.021 56 1HD1 ILE 6 HD11 ILE 6 -4.848 10.925 -10.469 57 2HD1 ILE 6 HD12 ILE 6 -4.603 12.476 -11.275 58 3HD1 ILE 6 HD13 ILE 6 -3.243 11.346 -11.104 59 H TYR 7 H TYR 7 -3.373 14.687 -7.001 60 HA TYR 7 HA TYR 7 -5.519 14.073 -5.032 61 1HB TYR 7 HB2 TYR 7 -3.415 15.112 -4.087 62 2HB TYR 7 HB3 TYR 7 -3.730 16.542 -5.059 63 HD1 TYR 7 HD1 TYR 7 -4.216 18.233 -3.520 64 HD2 TYR 7 HD2 TYR 7 -6.023 14.360 -2.952 65 HE1 TYR 7 HE1 TYR 7 -5.329 19.052 -1.460 66 HE2 TYR 7 HE2 TYR 7 -7.180 15.188 -0.936 67 HH TYR 7 HH TYR 7 -7.451 16.977 0.536 68 H PHE 8 H PHE 8 -7.354 14.194 -6.195 69 HA PHE 8 HA PHE 8 -7.666 16.076 -8.416 70 1HB PHE 8 HB2 PHE 8 -9.628 14.233 -6.982 71 2HB PHE 8 HB3 PHE 8 -10.038 15.247 -8.366 72 HD1 PHE 8 HD1 PHE 8 -8.684 12.050 -7.369 73 HD2 PHE 8 HD2 PHE 8 -8.739 14.985 -10.526 74 HE1 PHE 8 HE1 PHE 8 -7.782 10.375 -8.965 75 HE2 PHE 8 HE2 PHE 8 -7.766 13.326 -12.093 76 HZ PHE 8 HZ PHE 8 -7.264 11.019 -11.295 77 H LEU 9 H LEU 9 -8.933 17.938 -8.446 78 HA LEU 9 HA LEU 9 -9.977 18.993 -5.878 79 1HB LEU 9 HB2 LEU 9 -7.545 19.544 -6.215 80 2HB LEU 9 HB3 LEU 9 -7.927 20.305 -7.740 81 HG LEU 9 HG LEU 9 -7.453 21.853 -5.877 82 1HD1 LEU 9 HD11 LEU 9 -9.000 22.499 -7.813 83 2HD1 LEU 9 HD12 LEU 9 -10.343 22.305 -6.654 84 3HD1 LEU 9 HD13 LEU 9 -9.062 23.480 -6.348 85 1HD2 LEU 9 HD21 LEU 9 -10.033 20.805 -4.654 86 2HD2 LEU 9 HD22 LEU 9 -8.397 20.614 -4.011 87 3HD2 LEU 9 HD23 LEU 9 -9.149 22.226 -4.108 88 H CYS 10 H CYS 10 -11.917 20.127 -6.238 89 HA CYS 10 HA CYS 10 -12.415 21.327 -8.863 90 1HB CYS 10 HB2 CYS 10 -13.239 18.792 -8.742 91 2HB CYS 10 HB3 CYS 10 -14.586 19.487 -7.824 92 HG CYS 10 HG CYS 10 -13.381 20.317 -10.812 93 H THR 11 H THR 11 -14.818 22.512 -8.676 94 HA THR 11 HA THR 11 -14.520 24.192 -6.375 95 HB THR 11 HB THR 11 -16.723 25.167 -7.308 96 HG1 THR 11 HG1 THR 11 -17.122 24.662 -9.411 97 1HG2 THR 11 HG21 THR 11 -14.245 25.144 -9.073 98 2HG2 THR 11 HG22 THR 11 -15.465 26.420 -8.946 99 3HG2 THR 11 HG23 THR 11 -14.392 26.084 -7.575 100 H GLY 12 H GLY 12 -16.002 21.173 -6.581 101 1HA GLY 12 HA1 GLY 12 -16.819 21.409 -3.834 102 2HA GLY 12 HA2 GLY 12 -18.181 21.070 -4.930 103 H ASN 13 H ASN 13 -15.998 19.546 -3.013 104 HA ASN 13 HA ASN 13 -14.767 17.625 -4.672 105 1HB ASN 13 HB2 ASN 13 -14.111 18.059 -2.307 106 2HB ASN 13 HB3 ASN 13 -15.632 17.402 -1.759 107 1HD2 ASN 13 HD22 ASN 13 -13.912 15.684 -4.435 108 2HD2 ASN 13 HD21 ASN 13 -13.373 14.370 -3.411 109 H SER 14 H SER 14 -17.820 17.631 -2.969 110 HA SER 14 HA SER 14 -18.642 15.220 -2.580 111 1HB SER 14 HB2 SER 14 -20.404 17.376 -3.775 112 2HB SER 14 HB3 SER 14 -20.864 16.161 -2.561 113 HG SER 14 HG SER 14 -20.248 18.447 -1.932 114 H CYS 15 H CYS 15 -18.484 16.386 -5.925 115 HA CYS 15 HA CYS 15 -19.585 13.770 -6.774 116 1HB CYS 15 HB2 CYS 15 -20.663 14.982 -8.722 117 2HB CYS 15 HB3 CYS 15 -21.422 15.199 -7.143 118 HG CYS 15 HG CYS 15 -21.580 17.492 -8.365 119 H ARG 16 H ARG 16 -18.172 16.569 -8.555 120 HA ARG 16 HA ARG 16 -17.141 14.933 -10.530 121 1HB ARG 16 HB2 ARG 16 -15.972 17.630 -9.707 122 2HB ARG 16 HB3 ARG 16 -15.674 16.805 -11.226 123 1HG ARG 16 HG2 ARG 16 -17.503 17.728 -12.129 124 2HG ARG 16 HG3 ARG 16 -18.497 16.833 -11.003 125 1HD ARG 16 HD2 ARG 16 -19.198 18.847 -10.267 126 2HD ARG 16 HD3 ARG 16 -17.690 18.922 -9.386 127 HE ARG 16 HE ARG 16 -17.374 19.869 -12.111 128 1HH1 ARG 16 HH21 ARG 16 -18.902 20.990 -9.098 129 2HH1 ARG 16 HH22 ARG 16 -17.989 22.490 -9.082 130 1HH2 ARG 16 HH11 ARG 16 -16.674 21.963 -12.333 131 2HH2 ARG 16 HH12 ARG 16 -16.834 23.117 -11.024 132 H SER 17 H SER 17 -15.148 16.043 -7.674 133 HA SER 17 HA SER 17 -12.958 14.492 -8.802 134 1HB SER 17 HB2 SER 17 -11.730 15.307 -6.793 135 2HB SER 17 HB3 SER 17 -12.352 16.539 -7.871 136 HG SER 17 HG SER 17 -12.751 17.076 -5.718 137 H GLN 18 H GLN 18 -15.473 13.863 -6.366 138 HA GLN 18 HA GLN 18 -14.299 11.439 -5.338 139 1HB GLN 18 HB2 GLN 18 -17.193 12.358 -5.723 140 2HB GLN 18 HB3 GLN 18 -16.781 10.825 -4.978 141 1HG GLN 18 HG2 GLN 18 -15.849 13.522 -3.939 142 2HG GLN 18 HG3 GLN 18 -17.272 12.676 -3.354 143 1HE2 GLN 18 HE22 GLN 18 -14.714 13.476 -1.943 144 2HE2 GLN 18 HE21 GLN 18 -14.185 11.982 -1.213 145 H MET 19 H MET 19 -16.334 12.114 -8.233 146 HA MET 19 HA MET 19 -16.513 9.380 -9.105 147 1HB MET 19 HB2 MET 19 -16.733 12.028 -10.611 148 2HB MET 19 HB3 MET 19 -17.100 10.452 -11.320 149 1HG MET 19 HG2 MET 19 -18.961 10.103 -9.883 150 2HG MET 19 HG3 MET 19 -18.454 11.365 -8.779 151 1HE MET 19 HE1 MET 19 -18.915 11.405 -12.758 152 2HE MET 19 HE2 MET 19 -20.301 10.511 -12.084 153 3HE MET 19 HE3 MET 19 -20.549 12.102 -12.838 154 H ALA 20 H ALA 20 -14.278 12.084 -10.042 155 HA ALA 20 HA ALA 20 -12.687 10.657 -11.844 156 1HB ALA 20 HB1 ALA 20 -10.953 12.313 -11.386 157 2HB ALA 20 HB2 ALA 20 -12.532 13.121 -11.399 158 3HB ALA 20 HB3 ALA 20 -11.723 12.761 -9.857 159 H GLU 21 H GLU 21 -12.338 10.882 -8.286 160 HA GLU 21 HA GLU 21 -9.981 9.439 -7.986 161 1HB GLU 21 HB2 GLU 21 -11.015 10.718 -6.205 162 2HB GLU 21 HB3 GLU 21 -12.434 9.666 -6.189 163 1HG GLU 21 HG2 GLU 21 -10.993 7.771 -5.480 164 2HG GLU 21 HG3 GLU 21 -9.614 8.870 -5.398 165 H GLY 22 H GLY 22 -13.385 8.162 -8.034 166 1HA GLY 22 HA1 GLY 22 -12.705 5.459 -7.631 167 2HA GLY 22 HA2 GLY 22 -14.176 6.050 -8.405 168 H TRP 23 H TRP 23 -13.013 7.282 -10.765 169 HA TRP 23 HA TRP 23 -12.554 4.892 -12.378 170 1HB TRP 23 HB2 TRP 23 -12.259 7.842 -13.002 171 2HB TRP 23 HB3 TRP 23 -11.930 6.576 -14.170 172 HD1 TRP 23 HD1 TRP 23 -14.697 8.491 -12.555 173 HE1 TRP 23 HE1 TRP 23 -16.883 8.127 -13.755 174 HE3 TRP 23 HE3 TRP 23 -13.286 4.641 -15.634 175 HZ2 TRP 23 HZ2 TRP 23 -17.900 6.486 -15.878 176 HZ3 TRP 23 HZ3 TRP 23 -14.894 3.770 -17.315 177 HH2 TRP 23 HH2 TRP 23 -17.222 4.719 -17.432 178 H ALA 24 H ALA 24 -10.436 7.536 -11.127 179 HA ALA 24 HA ALA 24 -8.126 6.693 -12.506 180 1HB ALA 24 HB1 ALA 24 -6.909 8.113 -10.885 181 2HB ALA 24 HB2 ALA 24 -8.382 8.920 -11.444 182 3HB ALA 24 HB3 ALA 24 -8.349 8.166 -9.844 183 H LYS 25 H LYS 25 -9.460 5.715 -9.338 184 HA LYS 25 HA LYS 25 -7.285 4.101 -8.507 185 1HB LYS 25 HB2 LYS 25 -10.257 4.097 -7.903 186 2HB LYS 25 HB3 LYS 25 -9.207 2.833 -7.247 187 1HG LYS 25 HG2 LYS 25 -7.800 4.414 -6.125 188 2HG LYS 25 HG3 LYS 25 -8.585 5.791 -6.902 189 1HD LYS 25 HD2 LYS 25 -10.636 5.442 -5.680 190 2HD LYS 25 HD3 LYS 25 -10.047 3.893 -5.029 191 1HE LYS 25 HE2 LYS 25 -8.200 5.041 -3.865 192 2HE LYS 25 HE3 LYS 25 -8.727 6.603 -4.502 193 1HZ LYS 25 HZ1 LYS 25 -10.463 4.956 -2.765 194 2HZ LYS 25 HZ2 LYS 25 -9.414 6.065 -2.185 195 3HZ LYS 25 HZ3 LYS 25 -10.620 6.569 -3.139 196 H GLN 26 H GLN 26 -9.658 3.464 -11.040 197 HA GLN 26 HA GLN 26 -8.993 0.617 -11.213 198 1HB GLN 26 HB2 GLN 26 -10.161 2.374 -13.381 199 2HB GLN 26 HB3 GLN 26 -10.076 0.624 -13.343 200 1HG GLN 26 HG2 GLN 26 -11.634 0.634 -11.364 201 2HG GLN 26 HG3 GLN 26 -11.811 2.390 -11.576 202 1HE2 GLN 26 HE22 GLN 26 -11.956 2.838 -14.203 203 2HE2 GLN 26 HE21 GLN 26 -13.286 1.976 -14.954 204 H TYR 27 H TYR 27 -8.340 3.490 -13.228 205 HA TYR 27 HA TYR 27 -6.610 2.113 -15.002 206 1HB TYR 27 HB2 TYR 27 -6.912 5.102 -14.507 207 2HB TYR 27 HB3 TYR 27 -6.082 4.388 -15.878 208 HD1 TYR 27 HD1 TYR 27 -7.544 2.515 -17.197 209 HD2 TYR 27 HD2 TYR 27 -9.114 5.839 -14.938 210 HE1 TYR 27 HE1 TYR 27 -9.626 2.435 -18.532 211 HE2 TYR 27 HE2 TYR 27 -11.170 5.802 -16.306 212 HH TYR 27 HH TYR 27 -12.327 4.750 -18.048 213 H LEU 28 H LEU 28 -5.802 4.131 -12.176 214 HA LEU 28 HA LEU 28 -2.998 4.309 -12.983 215 1HB LEU 28 HB2 LEU 28 -4.427 5.332 -10.496 216 2HB LEU 28 HB3 LEU 28 -2.811 5.744 -11.006 217 HG LEU 28 HG LEU 28 -5.387 6.532 -12.379 218 1HD1 LEU 28 HD11 LEU 28 -4.628 7.842 -10.398 219 2HD1 LEU 28 HD12 LEU 28 -3.104 8.189 -11.236 220 3HD1 LEU 28 HD13 LEU 28 -4.637 8.794 -11.896 221 1HD2 LEU 28 HD21 LEU 28 -2.558 6.977 -13.409 222 2HD2 LEU 28 HD22 LEU 28 -3.819 5.988 -14.182 223 3HD2 LEU 28 HD23 LEU 28 -4.043 7.722 -14.046 224 H GLY 29 H GLY 29 -4.808 2.687 -10.398 225 1HA GLY 29 HA1 GLY 29 -4.305 0.723 -9.296 226 2HA GLY 29 HA2 GLY 29 -2.794 0.604 -10.201 227 H ASP 30 H ASP 30 -2.384 -0.185 -7.859 228 HA ASP 30 HA ASP 30 -2.341 1.541 -5.646 229 1HB ASP 30 HB2 ASP 30 -2.364 -0.940 -5.581 230 2HB ASP 30 HB3 ASP 30 -0.683 -0.952 -6.134 231 H GLU 31 H GLU 31 -0.068 1.376 -8.231 232 HA GLU 31 HA GLU 31 2.309 2.390 -7.042 233 1HB GLU 31 HB2 GLU 31 2.021 1.479 -9.365 234 2HB GLU 31 HB3 GLU 31 1.095 2.915 -9.803 235 1HG GLU 31 HG2 GLU 31 3.098 4.320 -9.312 236 2HG GLU 31 HG3 GLU 31 4.013 2.855 -8.927 237 H TRP 32 H TRP 32 -0.824 3.846 -7.262 238 HA TRP 32 HA TRP 32 0.341 6.506 -6.598 239 1HB TRP 32 HB2 TRP 32 -2.267 6.025 -8.066 240 2HB TRP 32 HB3 TRP 32 -1.490 7.555 -7.735 241 HD1 TRP 32 HD1 TRP 32 -0.677 4.358 -9.764 242 HE1 TRP 32 HE1 TRP 32 -0.077 5.037 -12.140 243 HE3 TRP 32 HE3 TRP 32 -0.671 9.434 -9.162 244 HZ2 TRP 32 HZ2 TRP 32 0.291 7.453 -13.630 245 HZ3 TRP 32 HZ3 TRP 32 -0.247 10.919 -11.091 246 HH2 TRP 32 HH2 TRP 32 0.224 9.921 -13.358 247 H LYS 33 H LYS 33 -0.576 7.475 -4.844 248 HA LYS 33 HA LYS 33 -2.844 6.159 -3.416 249 1HB LYS 33 HB2 LYS 33 -1.169 8.625 -2.779 250 2HB LYS 33 HB3 LYS 33 -2.459 8.018 -1.762 251 1HG LYS 33 HG2 LYS 33 -0.150 6.207 -2.520 252 2HG LYS 33 HG3 LYS 33 0.063 7.408 -1.251 253 1HD LYS 33 HD2 LYS 33 -2.163 5.323 -1.197 254 2HD LYS 33 HD3 LYS 33 -0.563 5.078 -0.486 255 1HE LYS 33 HE2 LYS 33 -0.929 7.282 0.793 256 2HE LYS 33 HE3 LYS 33 -2.612 7.201 0.279 257 1HZ LYS 33 HZ1 LYS 33 -2.760 5.033 1.418 258 2HZ LYS 33 HZ2 LYS 33 -1.190 5.163 1.903 259 3HZ LYS 33 HZ3 LYS 33 -2.318 6.213 2.457 260 H VAL 34 H VAL 34 -4.870 7.039 -3.697 261 HA VAL 34 HA VAL 34 -5.077 9.414 -5.510 262 HB VAL 34 HB VAL 34 -6.869 6.964 -5.602 263 1HG1 VAL 34 HG11 VAL 34 -6.438 9.123 -7.700 264 2HG1 VAL 34 HG12 VAL 34 -7.709 7.886 -7.654 265 3HG1 VAL 34 HG13 VAL 34 -7.729 9.214 -6.494 266 1HG2 VAL 34 HG21 VAL 34 -5.744 6.362 -7.746 267 2HG2 VAL 34 HG22 VAL 34 -4.479 7.557 -7.392 268 3HG2 VAL 34 HG23 VAL 34 -4.708 6.146 -6.337 269 H TYR 35 H TYR 35 -6.099 11.024 -4.495 270 HA TYR 35 HA TYR 35 -8.511 10.347 -2.933 271 1HB TYR 35 HB2 TYR 35 -7.053 12.628 -1.779 272 2HB TYR 35 HB3 TYR 35 -7.980 11.377 -1.008 273 HD1 TYR 35 HD1 TYR 35 -6.838 9.231 -0.294 274 HD2 TYR 35 HD2 TYR 35 -4.675 12.556 -1.989 275 HE1 TYR 35 HE1 TYR 35 -4.749 8.412 0.765 276 HE2 TYR 35 HE2 TYR 35 -2.612 11.791 -0.895 277 HH TYR 35 HH TYR 35 -1.642 10.212 0.525 278 H SER 36 H SER 36 -9.775 12.417 -2.528 279 HA SER 36 HA SER 36 -9.355 14.464 -4.618 280 1HB SER 36 HB2 SER 36 -11.800 14.378 -5.014 281 2HB SER 36 HB3 SER 36 -10.964 12.909 -5.541 282 HG SER 36 HG SER 36 -11.742 11.847 -3.741 283 H ALA 37 H ALA 37 -10.155 16.496 -4.084 284 HA ALA 37 HA ALA 37 -11.680 16.870 -1.610 285 1HB ALA 37 HB1 ALA 37 -9.095 18.380 -2.195 286 2HB ALA 37 HB2 ALA 37 -10.210 18.602 -0.818 287 3HB ALA 37 HB3 ALA 37 -9.298 17.104 -0.959 288 H GLY 38 H GLY 38 -11.762 19.639 -1.721 289 1HA GLY 38 HA1 GLY 38 -12.122 20.616 -4.403 290 2HA GLY 38 HA2 GLY 38 -13.647 20.321 -3.563 291 H ILE 39 H ILE 39 -13.136 22.848 -4.275 292 HA ILE 39 HA ILE 39 -11.953 24.582 -2.357 293 HB ILE 39 HB ILE 39 -14.262 24.731 -4.309 294 1HG1 ILE 39 HG12 ILE 39 -12.985 26.566 -5.310 295 2HG1 ILE 39 HG13 ILE 39 -11.793 26.478 -4.014 296 1HG2 ILE 39 HG21 ILE 39 -13.692 26.975 -2.356 297 2HG2 ILE 39 HG22 ILE 39 -14.677 27.107 -3.831 298 3HG2 ILE 39 HG23 ILE 39 -15.207 26.048 -2.534 299 1HD1 ILE 39 HD11 ILE 39 -11.047 25.462 -6.157 300 2HD1 ILE 39 HD12 ILE 39 -11.030 24.291 -4.829 301 3HD1 ILE 39 HD13 ILE 39 -12.335 24.269 -6.042 302 H GLU 40 H GLU 40 -15.073 22.877 -2.453 303 HA GLU 40 HA GLU 40 -15.113 22.888 0.486 304 1HB GLU 40 HB2 GLU 40 -17.453 23.475 0.639 305 2HB GLU 40 HB3 GLU 40 -16.553 24.783 -0.115 306 1HG GLU 40 HG2 GLU 40 -17.356 24.079 -2.354 307 2HG GLU 40 HG3 GLU 40 -18.233 22.721 -1.639 308 H ALA 41 H ALA 41 -17.131 21.389 1.087 309 HA ALA 41 HA ALA 41 -17.648 19.140 -0.721 310 1HB ALA 41 HB1 ALA 41 -15.557 18.463 0.412 311 2HB ALA 41 HB2 ALA 41 -16.291 18.810 1.997 312 3HB ALA 41 HB3 ALA 41 -16.939 17.509 0.985 313 H HIS 42 H HIS 42 -19.474 17.986 0.092 314 HA HIS 42 HA HIS 42 -20.945 19.185 2.402 315 1HB HIS 42 HB2 HIS 42 -21.803 20.043 0.219 316 2HB HIS 42 HB3 HIS 42 -22.106 18.384 -0.299 317 HD1 HIS 42 HD1 HIS 42 -23.359 20.872 2.419 318 HD2 HIS 42 HD2 HIS 42 -24.413 17.326 0.402 319 HE1 HIS 42 HE1 HIS 42 -25.750 20.341 3.108 320 H GLY 43 H GLY 43 -20.150 16.322 0.387 321 1HA GLY 43 HA1 GLY 43 -20.074 14.475 2.407 322 2HA GLY 43 HA2 GLY 43 -21.777 14.481 1.890 323 H LEU 44 H LEU 44 -20.765 12.171 1.350 324 HA LEU 44 HA LEU 44 -19.552 12.057 -1.335 325 1HB LEU 44 HB2 LEU 44 -19.129 10.291 0.410 326 2HB LEU 44 HB3 LEU 44 -20.853 9.922 0.423 327 HG LEU 44 HG LEU 44 -20.624 9.447 -2.108 328 1HD1 LEU 44 HD11 LEU 44 -18.328 8.767 -2.828 329 2HD1 LEU 44 HD12 LEU 44 -18.479 10.508 -2.570 330 3HD1 LEU 44 HD13 LEU 44 -17.675 9.496 -1.351 331 1HD2 LEU 44 HD21 LEU 44 -19.213 7.720 -0.043 332 2HD2 LEU 44 HD22 LEU 44 -20.920 7.658 -0.508 333 3HD2 LEU 44 HD23 LEU 44 -19.663 7.184 -1.668 334 H ASN 45 H ASN 45 -20.957 13.000 -2.860 335 HA ASN 45 HA ASN 45 -23.719 13.313 -2.395 336 1HB ASN 45 HB2 ASN 45 -22.301 14.678 -3.924 337 2HB ASN 45 HB3 ASN 45 -22.322 13.358 -5.099 338 1HD2 ASN 45 HD22 ASN 45 -23.488 16.238 -5.058 339 2HD2 ASN 45 HD21 ASN 45 -25.154 15.991 -5.515 340 HA PRO 46 HA PRO 46 -25.105 9.094 -3.354 341 1HB PRO 46 HB2 PRO 46 -27.686 10.565 -3.912 342 2HB PRO 46 HB3 PRO 46 -27.431 9.036 -3.013 343 1HG PRO 46 HG2 PRO 46 -27.816 11.361 -1.671 344 2HG PRO 46 HG3 PRO 46 -26.551 10.210 -1.125 345 1HD PRO 46 HD2 PRO 46 -26.215 12.727 -2.774 346 2HD PRO 46 HD3 PRO 46 -25.233 12.128 -1.401 347 H ASN 47 H ASN 47 -25.715 11.894 -5.531 348 HA ASN 47 HA ASN 47 -26.366 10.333 -7.838 349 1HB ASN 47 HB2 ASN 47 -26.553 12.280 -8.882 350 2HB ASN 47 HB3 ASN 47 -26.338 13.058 -7.336 351 1HD2 ASN 47 HD22 ASN 47 -25.207 12.900 -10.555 352 2HD2 ASN 47 HD21 ASN 47 -23.642 13.637 -10.316 353 H ALA 48 H ALA 48 -23.256 11.352 -6.416 354 HA ALA 48 HA ALA 48 -21.674 10.442 -8.644 355 1HB ALA 48 HB1 ALA 48 -20.879 10.923 -5.730 356 2HB ALA 48 HB2 ALA 48 -19.783 10.751 -7.105 357 3HB ALA 48 HB3 ALA 48 -20.894 12.137 -7.029 358 H VAL 49 H VAL 49 -22.746 9.021 -5.510 359 HA VAL 49 HA VAL 49 -21.287 6.597 -5.763 360 HB VAL 49 HB VAL 49 -23.980 6.914 -4.390 361 1HG1 VAL 49 HG11 VAL 49 -23.146 4.998 -3.049 362 2HG1 VAL 49 HG12 VAL 49 -23.293 4.566 -4.758 363 3HG1 VAL 49 HG13 VAL 49 -21.694 4.914 -4.073 364 1HG2 VAL 49 HG21 VAL 49 -21.150 7.377 -3.395 365 2HG2 VAL 49 HG22 VAL 49 -22.465 8.564 -3.452 366 3HG2 VAL 49 HG23 VAL 49 -22.574 7.208 -2.334 367 H LYS 50 H LYS 50 -24.698 7.390 -6.800 368 HA LYS 50 HA LYS 50 -24.993 4.775 -7.872 369 1HB LYS 50 HB2 LYS 50 -26.853 6.433 -7.210 370 2HB LYS 50 HB3 LYS 50 -26.630 7.152 -8.818 371 1HG LYS 50 HG2 LYS 50 -27.011 4.848 -9.817 372 2HG LYS 50 HG3 LYS 50 -27.287 4.227 -8.184 373 1HD LYS 50 HD2 LYS 50 -29.218 5.791 -7.943 374 2HD LYS 50 HD3 LYS 50 -28.945 6.337 -9.616 375 1HE LYS 50 HE2 LYS 50 -29.285 4.019 -10.432 376 2HE LYS 50 HE3 LYS 50 -29.557 3.470 -8.773 377 1HZ LYS 50 HZ1 LYS 50 -31.266 5.410 -10.226 378 2HZ LYS 50 HZ2 LYS 50 -31.638 3.852 -9.927 379 3HZ LYS 50 HZ3 LYS 50 -31.514 4.903 -8.690 380 H ALA 51 H ALA 51 -24.023 7.863 -9.467 381 HA ALA 51 HA ALA 51 -24.033 6.922 -12.105 382 1HB ALA 51 HB1 ALA 51 -23.649 9.299 -11.507 383 2HB ALA 51 HB2 ALA 51 -22.076 8.873 -10.785 384 3HB ALA 51 HB3 ALA 51 -22.329 8.696 -12.531 385 H MET 52 H MET 52 -21.350 6.757 -9.685 386 HA MET 52 HA MET 52 -19.558 5.398 -11.458 387 1HB MET 52 HB2 MET 52 -19.726 5.753 -8.443 388 2HB MET 52 HB3 MET 52 -18.342 5.058 -9.286 389 1HG MET 52 HG2 MET 52 -19.445 7.868 -9.717 390 2HG MET 52 HG3 MET 52 -18.027 7.464 -8.766 391 1HE MET 52 HE1 MET 52 -15.425 6.302 -11.315 392 2HE MET 52 HE2 MET 52 -15.796 6.748 -9.635 393 3HE MET 52 HE3 MET 52 -16.549 5.324 -10.385 394 H LYS 53 H LYS 53 -21.855 4.276 -8.896 395 HA LYS 53 HA LYS 53 -21.019 1.584 -8.965 396 1HB LYS 53 HB2 LYS 53 -22.314 2.745 -7.191 397 2HB LYS 53 HB3 LYS 53 -23.745 2.727 -8.231 398 1HG LYS 53 HG2 LYS 53 -23.788 0.279 -8.176 399 2HG LYS 53 HG3 LYS 53 -22.261 0.227 -7.276 400 1HD LYS 53 HD2 LYS 53 -24.787 1.606 -6.270 401 2HD LYS 53 HD3 LYS 53 -24.363 -0.076 -5.883 402 1HE LYS 53 HE2 LYS 53 -22.233 0.700 -4.845 403 2HE LYS 53 HE3 LYS 53 -22.660 2.371 -5.209 404 1HZ LYS 53 HZ1 LYS 53 -23.198 1.895 -2.972 405 2HZ LYS 53 HZ2 LYS 53 -24.621 2.080 -3.758 406 3HZ LYS 53 HZ3 LYS 53 -24.100 0.579 -3.352 407 H GLU 54 H GLU 54 -23.294 3.363 -11.039 408 HA GLU 54 HA GLU 54 -24.294 1.071 -12.415 409 1HB GLU 54 HB2 GLU 54 -24.193 4.046 -13.009 410 2HB GLU 54 HB3 GLU 54 -24.810 2.918 -14.210 411 1HG GLU 54 HG2 GLU 54 -25.868 3.064 -11.363 412 2HG GLU 54 HG3 GLU 54 -26.533 3.990 -12.703 413 H VAL 55 H VAL 55 -21.197 2.724 -12.645 414 HA VAL 55 HA VAL 55 -20.504 1.490 -15.229 415 HB VAL 55 HB VAL 55 -18.667 2.679 -13.103 416 1HG1 VAL 55 HG11 VAL 55 -17.094 3.034 -14.942 417 2HG1 VAL 55 HG12 VAL 55 -17.454 1.324 -14.755 418 3HG1 VAL 55 HG13 VAL 55 -18.210 2.239 -16.077 419 1HG2 VAL 55 HG21 VAL 55 -18.682 4.761 -14.331 420 2HG2 VAL 55 HG22 VAL 55 -19.820 4.103 -15.533 421 3HG2 VAL 55 HG23 VAL 55 -20.320 4.388 -13.848 422 H GLY 56 H GLY 56 -20.472 0.730 -11.802 423 1HA GLY 56 HA1 GLY 56 -20.230 -1.552 -11.020 424 2HA GLY 56 HA2 GLY 56 -18.968 -1.818 -12.236 425 H ILE 57 H ILE 57 -18.938 1.332 -10.684 426 HA ILE 57 HA ILE 57 -16.495 0.551 -9.171 427 HB ILE 57 HB ILE 57 -17.277 3.228 -10.373 428 1HG1 ILE 57 HG12 ILE 57 -15.216 1.202 -11.344 429 2HG1 ILE 57 HG13 ILE 57 -16.735 1.599 -12.148 430 1HG2 ILE 57 HG21 ILE 57 -14.952 3.879 -9.711 431 2HG2 ILE 57 HG22 ILE 57 -15.845 3.336 -8.300 432 3HG2 ILE 57 HG23 ILE 57 -14.668 2.255 -9.070 433 1HD1 ILE 57 HD11 ILE 57 -14.313 3.391 -11.837 434 2HD1 ILE 57 HD12 ILE 57 -15.086 2.804 -13.317 435 3HD1 ILE 57 HD13 ILE 57 -15.922 4.004 -12.326 436 H ASP 58 H ASP 58 -17.340 0.073 -7.209 437 HA ASP 58 HA ASP 58 -19.581 1.575 -6.088 438 1HB ASP 58 HB2 ASP 58 -19.488 -0.800 -5.696 439 2HB ASP 58 HB3 ASP 58 -17.881 -0.671 -4.962 440 H ILE 59 H ILE 59 -18.665 3.721 -6.027 441 HA ILE 59 HA ILE 59 -16.402 4.223 -4.289 442 HB ILE 59 HB ILE 59 -16.636 6.503 -4.761 443 1HG1 ILE 59 HG12 ILE 59 -19.226 6.164 -6.270 444 2HG1 ILE 59 HG13 ILE 59 -19.206 6.580 -4.560 445 1HG2 ILE 59 HG21 ILE 59 -16.423 6.572 -7.166 446 2HG2 ILE 59 HG22 ILE 59 -15.711 5.075 -6.551 447 3HG2 ILE 59 HG23 ILE 59 -17.311 5.046 -7.329 448 1HD1 ILE 59 HD11 ILE 59 -17.762 8.562 -5.055 449 2HD1 ILE 59 HD12 ILE 59 -17.976 8.252 -6.780 450 3HD1 ILE 59 HD13 ILE 59 -19.381 8.629 -5.764 451 H SER 60 H SER 60 -19.364 3.153 -3.283 452 HA SER 60 HA SER 60 -20.312 5.115 -1.555 453 1HB SER 60 HB2 SER 60 -20.313 2.155 -0.880 454 2HB SER 60 HB3 SER 60 -21.478 3.390 -0.379 455 HG SER 60 HG SER 60 -21.056 2.139 -2.864 456 H ASN 61 H ASN 61 -17.488 3.059 -1.212 457 HA ASN 61 HA ASN 61 -17.088 3.310 1.614 458 1HB ASN 61 HB2 ASN 61 -16.177 1.454 0.255 459 2HB ASN 61 HB3 ASN 61 -15.183 2.594 -0.659 460 1HD2 ASN 61 HD22 ASN 61 -15.764 1.423 2.723 461 2HD2 ASN 61 HD21 ASN 61 -14.112 1.637 3.236 462 H GLN 62 H GLN 62 -16.467 5.536 -1.028 463 HA GLN 62 HA GLN 62 -14.161 6.812 0.122 464 1HB GLN 62 HB2 GLN 62 -16.047 7.782 -2.058 465 2HB GLN 62 HB3 GLN 62 -14.477 8.476 -1.615 466 1HG GLN 62 HG2 GLN 62 -13.356 6.362 -2.246 467 2HG GLN 62 HG3 GLN 62 -14.914 5.693 -2.747 468 1HE2 GLN 62 HE22 GLN 62 -14.849 9.035 -3.667 469 2HE2 GLN 62 HE21 GLN 62 -14.429 8.729 -5.346 470 H THR 63 H THR 63 -14.364 9.264 0.621 471 HA THR 63 HA THR 63 -16.916 10.207 1.606 472 HB THR 63 HB THR 63 -15.666 10.977 3.776 473 HG1 THR 63 HG1 THR 63 -14.055 9.641 4.475 474 1HG2 THR 63 HG21 THR 63 -16.458 9.088 5.035 475 2HG2 THR 63 HG22 THR 63 -17.592 9.375 3.706 476 3HG2 THR 63 HG23 THR 63 -16.428 8.035 3.605 477 H SER 64 H SER 64 -16.846 12.599 1.954 478 HA SER 64 HA SER 64 -14.847 13.742 0.149 479 1HB SER 64 HB2 SER 64 -17.553 14.778 1.060 480 2HB SER 64 HB3 SER 64 -16.523 15.516 -0.179 481 HG SER 64 HG SER 64 -18.300 14.020 -0.842 482 H ASP 65 H ASP 65 -13.956 15.796 0.512 483 HA ASP 65 HA ASP 65 -13.905 16.944 3.212 484 1HB ASP 65 HB2 ASP 65 -12.215 15.015 3.173 485 2HB ASP 65 HB3 ASP 65 -11.372 15.895 1.888 486 H ILE 66 H ILE 66 -12.740 19.037 3.171 487 HA ILE 66 HA ILE 66 -12.751 20.257 0.478 488 HB ILE 66 HB ILE 66 -12.838 22.321 1.487 489 1HG1 ILE 66 HG12 ILE 66 -11.961 21.072 4.115 490 2HG1 ILE 66 HG13 ILE 66 -11.071 22.231 3.106 491 1HG2 ILE 66 HG21 ILE 66 -14.866 20.762 1.792 492 2HG2 ILE 66 HG22 ILE 66 -14.449 20.706 3.502 493 3HG2 ILE 66 HG23 ILE 66 -14.862 22.256 2.742 494 1HD1 ILE 66 HD11 ILE 66 -13.579 22.730 4.724 495 2HD1 ILE 66 HD12 ILE 66 -11.984 23.484 4.913 496 3HD1 ILE 66 HD13 ILE 66 -12.987 23.863 3.483 497 H ILE 67 H ILE 67 -10.825 21.623 -0.027 498 HA ILE 67 HA ILE 67 -8.625 20.016 -0.284 499 HB ILE 67 HB ILE 67 -9.228 21.881 -1.729 500 1HG1 ILE 67 HG12 ILE 67 -6.398 21.810 -0.660 501 2HG1 ILE 67 HG13 ILE 67 -7.106 20.935 -2.025 502 1HG2 ILE 67 HG21 ILE 67 -8.812 24.185 -1.248 503 2HG2 ILE 67 HG22 ILE 67 -9.833 23.556 0.031 504 3HG2 ILE 67 HG23 ILE 67 -8.097 23.803 0.333 505 1HD1 ILE 67 HD11 ILE 67 -7.373 23.178 -3.187 506 2HD1 ILE 67 HD12 ILE 67 -6.491 23.914 -1.833 507 3HD1 ILE 67 HD13 ILE 67 -5.697 22.713 -2.860 508 H ASP 68 H ASP 68 -6.840 19.530 0.761 509 HA ASP 68 HA ASP 68 -6.115 20.982 3.268 510 1HB ASP 68 HB2 ASP 68 -6.936 18.742 3.765 511 2HB ASP 68 HB3 ASP 68 -5.820 18.036 2.587 512 H SER 69 H SER 69 -4.486 22.259 2.754 513 HA SER 69 HA SER 69 -2.830 22.162 0.570 514 1HB SER 69 HB2 SER 69 -2.044 23.283 3.274 515 2HB SER 69 HB3 SER 69 -1.614 23.896 1.666 516 HG SER 69 HG SER 69 -3.314 25.086 2.714 517 H ASP 70 H ASP 70 -2.549 20.210 3.514 518 HA ASP 70 HA ASP 70 0.286 19.763 3.270 519 1HB ASP 70 HB2 ASP 70 -0.850 19.470 5.418 520 2HB ASP 70 HB3 ASP 70 -1.846 18.177 4.735 521 H ILE 71 H ILE 71 -2.631 17.975 2.186 522 HA ILE 71 HA ILE 71 -1.012 15.788 1.096 523 HB ILE 71 HB ILE 71 -3.946 16.495 0.670 524 1HG1 ILE 71 HG12 ILE 71 -2.538 14.272 2.234 525 2HG1 ILE 71 HG13 ILE 71 -3.277 15.707 2.960 526 1HG2 ILE 71 HG21 ILE 71 -3.045 15.309 -1.322 527 2HG2 ILE 71 HG22 ILE 71 -2.310 14.082 -0.270 528 3HG2 ILE 71 HG23 ILE 71 -4.085 14.242 -0.411 529 1HD1 ILE 71 HD11 ILE 71 -4.812 13.910 3.246 530 2HD1 ILE 71 HD12 ILE 71 -5.493 14.977 1.999 531 3HD1 ILE 71 HD13 ILE 71 -4.711 13.436 1.545 532 H LEU 72 H LEU 72 -2.641 18.732 -0.130 533 HA LEU 72 HA LEU 72 -2.047 18.555 -2.846 534 1HB LEU 72 HB2 LEU 72 -3.377 20.321 -1.663 535 2HB LEU 72 HB3 LEU 72 -1.874 20.962 -1.008 536 HG LEU 72 HG LEU 72 -1.157 21.245 -3.513 537 1HD1 LEU 72 HD11 LEU 72 -3.068 21.705 -5.013 538 2HD1 LEU 72 HD12 LEU 72 -3.100 20.016 -4.475 539 3HD1 LEU 72 HD13 LEU 72 -4.211 21.189 -3.760 540 1HD2 LEU 72 HD21 LEU 72 -2.247 23.480 -3.534 541 2HD2 LEU 72 HD22 LEU 72 -3.280 22.961 -2.174 542 3HD2 LEU 72 HD23 LEU 72 -1.520 23.101 -1.973 543 H ASN 73 H ASN 73 0.103 19.860 -0.230 544 HA ASN 73 HA ASN 73 2.242 20.286 -2.089 545 1HB ASN 73 HB2 ASN 73 1.954 20.588 0.901 546 2HB ASN 73 HB3 ASN 73 3.550 20.622 0.166 547 1HD2 ASN 73 HD22 ASN 73 0.387 22.276 0.143 548 2HD2 ASN 73 HD21 ASN 73 0.912 23.654 -0.825 549 H ASN 74 H ASN 74 1.208 17.366 -0.652 550 HA ASN 74 HA ASN 74 3.931 16.140 -0.764 551 1HB ASN 74 HB2 ASN 74 1.230 15.211 0.287 552 2HB ASN 74 HB3 ASN 74 2.465 14.051 -0.157 553 1HD2 ASN 74 HD22 ASN 74 1.529 16.382 2.237 554 2HD2 ASN 74 HD21 ASN 74 2.810 16.002 3.372 555 H ALA 75 H ALA 75 1.018 16.655 -2.643 556 HA ALA 75 HA ALA 75 0.928 14.164 -3.902 557 1HB ALA 75 HB1 ALA 75 -0.666 15.167 -5.402 558 2HB ALA 75 HB2 ALA 75 -0.951 15.771 -3.763 559 3HB ALA 75 HB3 ALA 75 -0.127 16.804 -4.958 560 H ASP 76 H ASP 76 1.784 13.392 -5.917 561 HA ASP 76 HA ASP 76 4.132 14.761 -7.034 562 1HB ASP 76 HB2 ASP 76 3.889 12.281 -7.198 563 2HB ASP 76 HB3 ASP 76 2.434 12.496 -8.181 564 H LEU 77 H LEU 77 0.666 14.521 -7.585 565 HA LEU 77 HA LEU 77 0.722 16.616 -9.664 566 1HB LEU 77 HB2 LEU 77 0.806 14.546 -10.859 567 2HB LEU 77 HB3 LEU 77 -0.410 13.814 -9.811 568 HG LEU 77 HG LEU 77 -2.135 15.351 -10.719 569 1HD1 LEU 77 HD11 LEU 77 -1.796 16.638 -12.714 570 2HD1 LEU 77 HD12 LEU 77 -0.561 17.175 -11.581 571 3HD1 LEU 77 HD13 LEU 77 -0.137 16.064 -12.903 572 1HD2 LEU 77 HD21 LEU 77 -0.634 13.706 -12.780 573 2HD2 LEU 77 HD22 LEU 77 -1.768 13.067 -11.579 574 3HD2 LEU 77 HD23 LEU 77 -2.355 14.155 -12.846 575 H VAL 78 H VAL 78 -1.029 17.854 -9.686 576 HA VAL 78 HA VAL 78 -3.363 17.202 -7.952 577 HB VAL 78 HB VAL 78 -2.215 19.946 -8.622 578 1HG1 VAL 78 HG11 VAL 78 -3.855 20.808 -7.005 579 2HG1 VAL 78 HG12 VAL 78 -4.688 19.944 -8.291 580 3HG1 VAL 78 HG13 VAL 78 -4.469 19.163 -6.710 581 1HG2 VAL 78 HG21 VAL 78 -2.140 18.469 -5.958 582 2HG2 VAL 78 HG22 VAL 78 -0.756 18.746 -7.020 583 3HG2 VAL 78 HG23 VAL 78 -1.542 20.126 -6.285 584 H VAL 79 H VAL 79 -5.337 17.294 -9.120 585 HA VAL 79 HA VAL 79 -5.125 18.266 -11.937 586 HB VAL 79 HB VAL 79 -6.829 15.894 -11.158 587 1HG1 VAL 79 HG11 VAL 79 -5.944 17.021 -13.835 588 2HG1 VAL 79 HG12 VAL 79 -7.001 15.608 -13.570 589 3HG1 VAL 79 HG13 VAL 79 -7.543 17.227 -13.096 590 1HG2 VAL 79 HG21 VAL 79 -4.530 15.140 -10.898 591 2HG2 VAL 79 HG22 VAL 79 -5.172 14.516 -12.419 592 3HG2 VAL 79 HG23 VAL 79 -4.070 15.909 -12.436 593 H THR 80 H THR 80 -6.177 20.123 -11.972 594 HA THR 80 HA THR 80 -8.412 20.596 -10.104 595 HB THR 80 HB THR 80 -8.194 22.929 -10.891 596 HG1 THR 80 HG1 THR 80 -7.362 22.386 -12.953 597 1HG2 THR 80 HG21 THR 80 -5.895 23.362 -9.958 598 2HG2 THR 80 HG22 THR 80 -6.841 22.260 -8.941 599 3HG2 THR 80 HG23 THR 80 -5.559 21.636 -10.000 600 H LEU 81 H LEU 81 -10.099 19.439 -10.869 601 HA LEU 81 HA LEU 81 -10.401 18.709 -13.604 602 1HB LEU 81 HB2 LEU 81 -12.358 18.610 -11.282 603 2HB LEU 81 HB3 LEU 81 -12.662 17.857 -12.844 604 HG LEU 81 HG LEU 81 -10.317 17.139 -11.033 605 1HD1 LEU 81 HD11 LEU 81 -12.915 15.621 -11.489 606 2HD1 LEU 81 HD12 LEU 81 -11.562 15.178 -10.419 607 3HD1 LEU 81 HD13 LEU 81 -12.550 16.609 -10.064 608 1HD2 LEU 81 HD21 LEU 81 -10.223 15.078 -12.476 609 2HD2 LEU 81 HD22 LEU 81 -11.414 15.820 -13.562 610 3HD2 LEU 81 HD23 LEU 81 -9.815 16.555 -13.348 611 H CYS 82 H CYS 82 -11.229 21.762 -12.215 612 HA CYS 82 HA CYS 82 -12.681 22.380 -14.673 613 1HB CYS 82 HB2 CYS 82 -14.466 21.702 -13.118 614 2HB CYS 82 HB3 CYS 82 -13.875 22.868 -11.909 615 HG CYS 82 HG CYS 82 -15.147 23.361 -14.937 616 H GLY 83 H GLY 83 -12.160 24.450 -15.336 617 1HA GLY 83 HA1 GLY 83 -9.708 25.424 -14.531 618 2HA GLY 83 HA2 GLY 83 -10.874 26.314 -15.524 619 H ASP 84 H ASP 84 -12.954 26.603 -13.497 620 HA ASP 84 HA ASP 84 -11.991 28.935 -12.158 621 1HB ASP 84 HB2 ASP 84 -14.363 28.536 -12.795 622 2HB ASP 84 HB3 ASP 84 -14.475 27.290 -11.545 623 H ALA 85 H ALA 85 -11.995 25.538 -11.230 624 HA ALA 85 HA ALA 85 -11.648 25.991 -8.381 625 1HB ALA 85 HB1 ALA 85 -11.344 23.649 -8.235 626 2HB ALA 85 HB2 ALA 85 -12.536 23.833 -9.532 627 3HB ALA 85 HB3 ALA 85 -10.840 23.493 -9.922 628 H ALA 86 H ALA 86 -9.556 26.026 -11.218 629 HA ALA 86 HA ALA 86 -7.219 25.027 -9.995 630 1HB ALA 86 HB1 ALA 86 -6.065 25.780 -11.988 631 2HB ALA 86 HB2 ALA 86 -7.650 25.143 -12.465 632 3HB ALA 86 HB3 ALA 86 -7.380 26.902 -12.385 633 H ASP 87 H ASP 87 -8.657 28.130 -9.594 634 HA ASP 87 HA ASP 87 -6.347 29.659 -8.900 635 1HB ASP 87 HB2 ASP 87 -8.560 30.664 -9.275 636 2HB ASP 87 HB3 ASP 87 -9.212 29.777 -7.891 637 H LYS 88 H LYS 88 -8.221 27.179 -7.200 638 HA LYS 88 HA LYS 88 -7.076 27.926 -4.597 639 1HB LYS 88 HB2 LYS 88 -9.522 27.289 -4.964 640 2HB LYS 88 HB3 LYS 88 -8.961 25.639 -5.237 641 1HG LYS 88 HG2 LYS 88 -9.689 25.775 -2.996 642 2HG LYS 88 HG3 LYS 88 -7.925 25.697 -2.929 643 1HD LYS 88 HD2 LYS 88 -7.783 28.099 -2.477 644 2HD LYS 88 HD3 LYS 88 -9.529 28.294 -2.771 645 1HE LYS 88 HE2 LYS 88 -10.017 26.781 -0.884 646 2HE LYS 88 HE3 LYS 88 -8.285 26.585 -0.575 647 1HZ LYS 88 HZ1 LYS 88 -9.777 29.143 -0.360 648 2HZ LYS 88 HZ2 LYS 88 -9.265 28.240 0.894 649 3HZ LYS 88 HZ3 LYS 88 -8.176 28.967 -0.075 650 H CYS 89 H CYS 89 -4.892 27.506 -5.394 651 HA CYS 89 HA CYS 89 -4.097 24.752 -4.612 652 1HB CYS 89 HB2 CYS 89 -3.230 26.205 -7.118 653 2HB CYS 89 HB3 CYS 89 -2.186 25.010 -6.333 654 HG CYS 89 HG CYS 89 -5.362 24.319 -6.710 655 HA PRO 90 HA PRO 90 -2.088 28.125 -2.121 656 1HB PRO 90 HB2 PRO 90 -2.236 26.871 0.314 657 2HB PRO 90 HB3 PRO 90 -3.565 27.838 -0.397 658 1HG PRO 90 HG2 PRO 90 -3.163 24.841 -0.568 659 2HG PRO 90 HG3 PRO 90 -4.643 25.718 -0.041 660 1HD PRO 90 HD2 PRO 90 -4.425 24.825 -2.558 661 2HD PRO 90 HD3 PRO 90 -5.080 26.457 -2.267 662 H MET 91 H MET 91 -0.404 27.677 -3.339 663 HA MET 91 HA MET 91 1.529 27.178 -4.110 664 1HB MET 91 HB2 MET 91 3.437 26.676 -2.729 665 2HB MET 91 HB3 MET 91 2.478 28.022 -2.121 666 1HG MET 91 HG2 MET 91 1.568 26.657 -0.340 667 2HG MET 91 HG3 MET 91 2.319 25.205 -1.011 668 1HE MET 91 HE1 MET 91 3.306 24.538 1.298 669 2HE MET 91 HE2 MET 91 4.235 25.637 2.341 670 3HE MET 91 HE3 MET 91 2.516 25.959 2.019 671 H THR 92 H THR 92 2.279 25.766 -5.449 672 HA THR 92 HA THR 92 2.305 22.877 -4.818 673 HB THR 92 HB THR 92 1.490 22.480 -7.206 674 HG1 THR 92 HG1 THR 92 1.597 24.671 -7.898 675 1HG2 THR 92 HG21 THR 92 -0.554 23.685 -5.307 676 2HG2 THR 92 HG22 THR 92 -0.849 22.517 -6.615 677 3HG2 THR 92 HG23 THR 92 0.094 22.041 -5.201 678 HA PRO 93 HA PRO 93 6.418 24.616 -6.078 679 1HB PRO 93 HB2 PRO 93 7.133 22.036 -4.668 680 2HB PRO 93 HB3 PRO 93 7.956 23.625 -4.582 681 1HG PRO 93 HG2 PRO 93 6.337 22.830 -2.573 682 2HG PRO 93 HG3 PRO 93 6.251 24.519 -3.176 683 1HD PRO 93 HD2 PRO 93 4.427 22.198 -3.827 684 2HD PRO 93 HD3 PRO 93 4.015 23.893 -3.438 685 HA PRO 94 HA PRO 94 7.383 22.145 -9.679 686 1HB PRO 94 HB2 PRO 94 10.103 21.532 -8.506 687 2HB PRO 94 HB3 PRO 94 9.686 22.046 -10.173 688 1HG PRO 94 HG2 PRO 94 10.638 23.858 -8.406 689 2HG PRO 94 HG3 PRO 94 9.238 24.284 -9.444 690 1HD PRO 94 HD2 PRO 94 9.237 23.401 -6.554 691 2HD PRO 94 HD3 PRO 94 8.299 24.709 -7.337 692 H HIS 95 H HIS 95 8.105 20.567 -6.577 693 HA HIS 95 HA HIS 95 8.179 17.853 -7.453 694 1HB HIS 95 HB2 HIS 95 8.972 18.744 -5.261 695 2HB HIS 95 HB3 HIS 95 7.305 19.075 -4.800 696 HD1 HIS 95 HD1 HIS 95 9.621 16.040 -5.483 697 HD2 HIS 95 HD2 HIS 95 5.939 17.088 -3.722 698 HE1 HIS 95 HE1 HIS 95 8.816 13.979 -4.223 699 H VAL 96 H VAL 96 5.568 20.072 -7.428 700 HA VAL 96 HA VAL 96 3.444 17.998 -7.322 701 HB VAL 96 HB VAL 96 3.327 20.881 -6.320 702 1HG1 VAL 96 HG11 VAL 96 1.262 20.121 -5.223 703 2HG1 VAL 96 HG12 VAL 96 1.180 19.935 -6.980 704 3HG1 VAL 96 HG13 VAL 96 1.457 18.518 -5.947 705 1HG2 VAL 96 HG21 VAL 96 3.818 18.417 -4.625 706 2HG2 VAL 96 HG22 VAL 96 4.880 19.825 -4.818 707 3HG2 VAL 96 HG23 VAL 96 3.325 20.005 -4.017 708 H LYS 97 H LYS 97 3.510 17.817 -9.628 709 HA LYS 97 HA LYS 97 3.363 20.209 -11.292 710 1HB LYS 97 HB2 LYS 97 3.426 18.783 -13.129 711 2HB LYS 97 HB3 LYS 97 4.416 17.969 -11.928 712 1HG LYS 97 HG2 LYS 97 2.075 16.714 -11.428 713 2HG LYS 97 HG3 LYS 97 1.772 17.213 -13.105 714 1HD LYS 97 HD2 LYS 97 3.977 16.107 -13.728 715 2HD LYS 97 HD3 LYS 97 4.090 15.553 -12.045 716 1HE LYS 97 HE2 LYS 97 1.678 14.558 -12.525 717 2HE LYS 97 HE3 LYS 97 2.138 14.700 -14.220 718 1HZ LYS 97 HZ1 LYS 97 2.732 12.534 -13.357 719 2HZ LYS 97 HZ2 LYS 97 4.136 13.332 -13.599 720 3HZ LYS 97 HZ3 LYS 97 3.525 13.168 -12.071 721 H ARG 98 H ARG 98 1.400 20.438 -12.778 722 HA ARG 98 HA ARG 98 -1.109 19.665 -11.406 723 1HB ARG 98 HB2 ARG 98 -0.605 22.470 -12.464 724 2HB ARG 98 HB3 ARG 98 -2.120 21.825 -11.825 725 1HG ARG 98 HG2 ARG 98 -0.746 21.350 -9.644 726 2HG ARG 98 HG3 ARG 98 0.415 22.503 -10.305 727 1HD ARG 98 HD2 ARG 98 -2.551 22.995 -9.786 728 2HD ARG 98 HD3 ARG 98 -1.229 23.557 -8.761 729 HE ARG 98 HE ARG 98 -0.539 24.683 -11.110 730 1HH1 ARG 98 HH11 ARG 98 -3.557 24.724 -9.255 731 2HH1 ARG 98 HH12 ARG 98 -4.119 26.230 -9.878 732 1HH2 ARG 98 HH21 ARG 98 -1.260 26.717 -11.957 733 2HH2 ARG 98 HH22 ARG 98 -2.756 27.394 -11.439 734 H GLU 99 H GLU 99 -2.942 19.572 -12.770 735 HA GLU 99 HA GLU 99 -2.574 19.925 -15.650 736 1HB GLU 99 HB2 GLU 99 -2.018 17.533 -15.128 737 2HB GLU 99 HB3 GLU 99 -3.600 17.341 -14.371 738 1HG GLU 99 HG2 GLU 99 -3.442 16.397 -16.646 739 2HG GLU 99 HG3 GLU 99 -4.721 17.604 -16.477 740 H HIS 100 H HIS 100 -4.779 20.135 -16.677 741 HA HIS 100 HA HIS 100 -6.824 21.034 -14.701 742 1HB HIS 100 HB2 HIS 100 -5.971 22.780 -17.022 743 2HB HIS 100 HB3 HIS 100 -6.928 23.217 -15.616 744 HD1 HIS 100 HD1 HIS 100 -5.205 22.948 -13.192 745 HD2 HIS 100 HD2 HIS 100 -3.568 23.676 -17.002 746 HE1 HIS 100 HE1 HIS 100 -2.883 23.928 -12.806 747 H TRP 101 H TRP 101 -8.933 20.946 -15.436 748 HA TRP 101 HA TRP 101 -9.509 20.416 -18.293 749 1HB TRP 101 HB2 TRP 101 -10.630 18.725 -16.068 750 2HB TRP 101 HB3 TRP 101 -10.878 18.548 -17.809 751 HD1 TRP 101 HD1 TRP 101 -8.671 17.521 -15.020 752 HE1 TRP 101 HE1 TRP 101 -6.684 16.120 -15.792 753 HE3 TRP 101 HE3 TRP 101 -9.073 18.278 -20.067 754 HZ2 TRP 101 HZ2 TRP 101 -5.498 15.293 -18.293 755 HZ3 TRP 101 HZ3 TRP 101 -7.496 17.161 -21.621 756 HH2 TRP 101 HH2 TRP 101 -5.720 15.646 -20.744 757 H GLY 102 H GLY 102 -12.288 20.157 -18.057 758 1HA GLY 102 HA1 GLY 102 -13.123 22.762 -16.844 759 2HA GLY 102 HA2 GLY 102 -13.359 22.395 -18.551 760 H PHE 103 H PHE 103 -13.804 20.260 -15.671 761 HA PHE 103 HA PHE 103 -16.313 19.321 -16.747 762 1HB PHE 103 HB2 PHE 103 -14.729 18.613 -14.269 763 2HB PHE 103 HB3 PHE 103 -16.303 17.919 -14.638 764 HD1 PHE 103 HD1 PHE 103 -12.754 18.010 -15.697 765 HD2 PHE 103 HD2 PHE 103 -16.674 16.467 -16.578 766 HE1 PHE 103 HE1 PHE 103 -11.755 16.512 -17.365 767 HE2 PHE 103 HE2 PHE 103 -15.672 14.880 -18.175 768 HZ PHE 103 HZ PHE 103 -13.225 14.889 -18.601 769 H ASP 104 H ASP 104 -17.911 20.714 -16.742 770 HA ASP 104 HA ASP 104 -18.736 22.442 -14.618 771 1HB ASP 104 HB2 ASP 104 -19.459 22.612 -17.008 772 2HB ASP 104 HB3 ASP 104 -20.369 21.109 -16.806 773 H ASP 105 H ASP 105 -20.768 22.118 -13.345 774 HA ASP 105 HA ASP 105 -20.290 19.715 -11.833 775 1HB ASP 105 HB2 ASP 105 -20.702 22.009 -10.870 776 2HB ASP 105 HB3 ASP 105 -22.416 21.788 -11.254 777 HA PRO 106 HA PRO 106 -23.675 17.516 -13.807 778 1HB PRO 106 HB2 PRO 106 -23.453 15.090 -12.535 779 2HB PRO 106 HB3 PRO 106 -22.245 15.651 -13.725 780 1HG PRO 106 HG2 PRO 106 -22.127 15.851 -10.690 781 2HG PRO 106 HG3 PRO 106 -20.865 15.231 -11.807 782 1HD PRO 106 HD2 PRO 106 -20.889 17.786 -10.853 783 2HD PRO 106 HD3 PRO 106 -20.310 17.414 -12.511 784 H ALA 107 H ALA 107 -23.351 17.497 -10.212 785 HA ALA 107 HA ALA 107 -25.983 16.493 -9.746 786 1HB ALA 107 HB1 ALA 107 -25.518 17.158 -7.398 787 2HB ALA 107 HB2 ALA 107 -24.183 16.230 -8.110 788 3HB ALA 107 HB3 ALA 107 -24.040 17.990 -7.930 789 H ARG 108 H ARG 108 -24.628 19.721 -10.155 790 HA ARG 108 HA ARG 108 -27.255 20.989 -9.627 791 1HB ARG 108 HB2 ARG 108 -24.364 21.951 -9.740 792 2HB ARG 108 HB3 ARG 108 -25.715 23.077 -9.785 793 1HG ARG 108 HG2 ARG 108 -25.073 22.969 -7.540 794 2HG ARG 108 HG3 ARG 108 -26.607 22.115 -7.703 795 1HD ARG 108 HD2 ARG 108 -25.324 20.865 -6.152 796 2HD ARG 108 HD3 ARG 108 -25.315 19.938 -7.633 797 HE ARG 108 HE ARG 108 -23.079 20.379 -8.007 798 1HH1 ARG 108 HH21 ARG 108 -24.139 21.980 -5.001 799 2HH1 ARG 108 HH22 ARG 108 -22.539 22.215 -4.405 800 1HH2 ARG 108 HH11 ARG 108 -21.003 20.757 -7.279 801 2HH2 ARG 108 HH12 ARG 108 -20.691 21.488 -5.724 802 H ALA 109 H ALA 109 -26.148 19.497 -12.241 803 HA ALA 109 HA ALA 109 -25.976 21.339 -14.289 804 1HB ALA 109 HB1 ALA 109 -27.273 18.573 -14.380 805 2HB ALA 109 HB2 ALA 109 -26.733 19.498 -15.794 806 3HB ALA 109 HB3 ALA 109 -25.543 18.942 -14.604 807 H GLN 110 H GLN 110 -28.916 19.971 -12.914 808 HA GLN 110 HA GLN 110 -31.109 20.435 -13.000 809 1HB GLN 110 HB2 GLN 110 -30.054 23.236 -13.484 810 2HB GLN 110 HB3 GLN 110 -31.744 22.884 -13.141 811 1HG GLN 110 HG2 GLN 110 -31.307 22.105 -10.954 812 2HG GLN 110 HG3 GLN 110 -29.579 21.929 -11.241 813 1HE2 GLN 110 HE22 GLN 110 -28.230 23.815 -11.416 814 2HE2 GLN 110 HE21 GLN 110 -28.740 25.348 -10.725 815 H GLY 111 H GLY 111 -32.880 21.755 -14.395 816 1HA GLY 111 HA1 GLY 111 -33.408 22.460 -16.698 817 2HA GLY 111 HA2 GLY 111 -32.522 21.040 -17.280 818 H THR 112 H THR 112 -33.229 18.925 -16.157 819 HA THR 112 HA THR 112 -35.771 18.671 -14.947 820 HB THR 112 HB THR 112 -36.667 18.889 -17.199 821 HG1 THR 112 HG1 THR 112 -37.781 17.413 -16.112 822 1HG2 THR 112 HG21 THR 112 -36.131 17.261 -18.996 823 2HG2 THR 112 HG22 THR 112 -34.797 18.357 -18.625 824 3HG2 THR 112 HG23 THR 112 -34.757 16.681 -18.033 825 H GLU 113 H GLU 113 -35.986 16.290 -14.286 826 HA GLU 113 HA GLU 113 -33.549 15.551 -13.110 827 1HB GLU 113 HB2 GLU 113 -35.706 14.932 -12.182 828 2HB GLU 113 HB3 GLU 113 -36.086 13.932 -13.595 829 1HG GLU 113 HG2 GLU 113 -34.278 12.388 -13.067 830 2HG GLU 113 HG3 GLU 113 -33.712 13.431 -11.753 831 H GLU 114 H GLU 114 -35.057 14.334 -16.088 832 HA GLU 114 HA GLU 114 -33.095 12.294 -16.500 833 1HB GLU 114 HB2 GLU 114 -34.034 12.044 -18.729 834 2HB GLU 114 HB3 GLU 114 -35.298 12.118 -17.503 835 1HG GLU 114 HG2 GLU 114 -35.747 14.485 -18.099 836 2HG GLU 114 HG3 GLU 114 -34.474 14.422 -19.324 837 H GLU 115 H GLU 115 -33.115 15.751 -17.189 838 HA GLU 115 HA GLU 115 -30.925 15.646 -19.064 839 1HB GLU 115 HB2 GLU 115 -32.612 17.509 -18.989 840 2HB GLU 115 HB3 GLU 115 -31.933 18.007 -17.437 841 1HG GLU 115 HG2 GLU 115 -31.002 19.422 -19.085 842 2HG GLU 115 HG3 GLU 115 -29.712 18.345 -18.577 843 H LYS 116 H LYS 116 -31.378 16.225 -15.535 844 HA LYS 116 HA LYS 116 -28.642 16.672 -14.915 845 1HB LYS 116 HB2 LYS 116 -30.711 15.262 -13.161 846 2HB LYS 116 HB3 LYS 116 -29.166 15.936 -12.649 847 1HG LYS 116 HG2 LYS 116 -29.981 18.196 -13.446 848 2HG LYS 116 HG3 LYS 116 -31.553 17.449 -13.746 849 1HD LYS 116 HD2 LYS 116 -31.708 18.485 -11.614 850 2HD LYS 116 HD3 LYS 116 -31.633 16.726 -11.354 851 1HE LYS 116 HE2 LYS 116 -29.189 16.940 -10.836 852 2HE LYS 116 HE3 LYS 116 -29.283 18.676 -11.108 853 1HZ LYS 116 HZ1 LYS 116 -30.653 17.195 -8.941 854 2HZ LYS 116 HZ2 LYS 116 -29.359 18.197 -8.809 855 3HZ LYS 116 HZ3 LYS 116 -30.825 18.802 -9.213 856 H TRP 117 H TRP 117 -30.544 13.653 -14.815 857 HA TRP 117 HA TRP 117 -28.369 11.964 -14.198 858 1HB TRP 117 HB2 TRP 117 -30.719 11.213 -14.108 859 2HB TRP 117 HB3 TRP 117 -30.806 11.252 -15.872 860 HD1 TRP 117 HD1 TRP 117 -29.546 9.325 -17.204 861 HE1 TRP 117 HE1 TRP 117 -28.542 7.056 -16.546 862 HE3 TRP 117 HE3 TRP 117 -29.411 9.932 -12.128 863 HZ2 TRP 117 HZ2 TRP 117 -27.506 5.817 -14.185 864 HZ3 TRP 117 HZ3 TRP 117 -28.250 8.268 -10.710 865 HH2 TRP 117 HH2 TRP 117 -27.284 6.204 -11.724 866 H ALA 118 H ALA 118 -29.544 13.077 -17.417 867 HA ALA 118 HA ALA 118 -27.715 11.526 -18.934 868 1HB ALA 118 HB1 ALA 118 -28.097 13.193 -20.729 869 2HB ALA 118 HB2 ALA 118 -29.615 12.690 -19.960 870 3HB ALA 118 HB3 ALA 118 -28.895 14.266 -19.566 871 H PHE 119 H PHE 119 -27.346 14.738 -17.381 872 HA PHE 119 HA PHE 119 -24.717 15.234 -18.327 873 1HB PHE 119 HB2 PHE 119 -26.558 16.717 -17.006 874 2HB PHE 119 HB3 PHE 119 -25.545 16.287 -15.644 875 HD1 PHE 119 HD1 PHE 119 -25.955 18.387 -18.565 876 HD2 PHE 119 HD2 PHE 119 -23.014 16.853 -15.812 877 HE1 PHE 119 HE1 PHE 119 -24.390 20.194 -19.225 878 HE2 PHE 119 HE2 PHE 119 -21.460 18.681 -16.452 879 HZ PHE 119 HZ PHE 119 -22.143 20.346 -18.174 880 H PHE 120 H PHE 120 -25.920 13.477 -15.400 881 HA PHE 120 HA PHE 120 -23.403 13.011 -14.174 882 1HB PHE 120 HB2 PHE 120 -25.627 10.955 -14.272 883 2HB PHE 120 HB3 PHE 120 -24.342 11.095 -13.108 884 HD1 PHE 120 HD1 PHE 120 -25.411 14.441 -13.218 885 HD2 PHE 120 HD2 PHE 120 -26.783 10.516 -12.078 886 HE1 PHE 120 HE1 PHE 120 -27.035 15.451 -11.675 887 HE2 PHE 120 HE2 PHE 120 -28.462 11.552 -10.574 888 HZ PHE 120 HZ PHE 120 -28.592 14.025 -10.367 889 H GLN 121 H GLN 121 -25.222 11.138 -16.667 890 HA GLN 121 HA GLN 121 -23.323 9.070 -16.965 891 1HB GLN 121 HB2 GLN 121 -25.332 10.154 -18.979 892 2HB GLN 121 HB3 GLN 121 -24.423 8.665 -19.186 893 1HG GLN 121 HG2 GLN 121 -26.386 9.187 -16.913 894 2HG GLN 121 HG3 GLN 121 -26.749 8.306 -18.386 895 1HE2 GLN 121 HE22 GLN 121 -25.492 8.049 -15.181 896 2HE2 GLN 121 HE21 GLN 121 -24.928 6.400 -15.295 897 H ARG 122 H ARG 122 -23.593 12.180 -18.722 898 HA ARG 122 HA ARG 122 -21.378 11.646 -20.471 899 1HB ARG 122 HB2 ARG 122 -22.844 14.173 -19.643 900 2HB ARG 122 HB3 ARG 122 -21.281 14.306 -20.436 901 1HG ARG 122 HG2 ARG 122 -22.878 14.484 -22.153 902 2HG ARG 122 HG3 ARG 122 -22.106 12.903 -22.329 903 1HD ARG 122 HD2 ARG 122 -24.083 11.881 -21.149 904 2HD ARG 122 HD3 ARG 122 -24.836 13.495 -21.126 905 HE ARG 122 HE ARG 122 -24.201 13.034 -23.781 906 1HH1 ARG 122 HH21 ARG 122 -26.177 11.415 -21.333 907 2HH1 ARG 122 HH22 ARG 122 -27.320 10.766 -22.457 908 1HH2 ARG 122 HH12 ARG 122 -25.722 12.185 -25.301 909 2HH2 ARG 122 HH11 ARG 122 -27.052 11.229 -24.769 910 H VAL 123 H VAL 123 -21.540 13.468 -17.345 911 HA VAL 123 HA VAL 123 -18.784 14.118 -17.421 912 HB VAL 123 HB VAL 123 -20.805 14.029 -15.153 913 1HG1 VAL 123 HG11 VAL 123 -19.196 15.384 -13.810 914 2HG1 VAL 123 HG12 VAL 123 -18.636 13.727 -14.050 915 3HG1 VAL 123 HG13 VAL 123 -17.930 15.044 -15.008 916 1HG2 VAL 123 HG21 VAL 123 -21.083 15.773 -16.931 917 2HG2 VAL 123 HG22 VAL 123 -20.637 16.501 -15.378 918 3HG2 VAL 123 HG23 VAL 123 -19.423 16.320 -16.651 919 H ARG 124 H ARG 124 -20.374 11.208 -15.819 920 HA ARG 124 HA ARG 124 -17.854 10.346 -14.834 921 1HB ARG 124 HB2 ARG 124 -18.794 8.140 -14.500 922 2HB ARG 124 HB3 ARG 124 -20.029 9.338 -14.077 923 1HG ARG 124 HG2 ARG 124 -20.981 8.937 -16.404 924 2HG ARG 124 HG3 ARG 124 -19.839 7.579 -16.539 925 1HD ARG 124 HD2 ARG 124 -20.972 6.953 -14.201 926 2HD ARG 124 HD3 ARG 124 -22.315 7.883 -14.863 927 HE ARG 124 HE ARG 124 -21.999 5.295 -15.250 928 1HH1 ARG 124 HH21 ARG 124 -21.639 7.768 -17.879 929 2HH1 ARG 124 HH22 ARG 124 -22.091 6.632 -19.084 930 1HH2 ARG 124 HH11 ARG 124 -22.514 3.886 -16.921 931 2HH2 ARG 124 HH12 ARG 124 -22.590 4.433 -18.545 932 H ASP 125 H ASP 125 -19.403 9.750 -18.002 933 HA ASP 125 HA ASP 125 -17.497 7.831 -18.874 934 1HB ASP 125 HB2 ASP 125 -19.641 8.170 -20.028 935 2HB ASP 125 HB3 ASP 125 -19.140 9.787 -20.531 936 H GLU 126 H GLU 126 -17.603 11.412 -19.156 937 HA GLU 126 HA GLU 126 -15.182 11.449 -20.678 938 1HB GLU 126 HB2 GLU 126 -16.950 13.590 -19.498 939 2HB GLU 126 HB3 GLU 126 -15.434 13.994 -20.313 940 1HG GLU 126 HG2 GLU 126 -17.581 12.314 -21.664 941 2HG GLU 126 HG3 GLU 126 -17.587 14.074 -21.690 942 H ILE 127 H ILE 127 -15.837 11.752 -17.179 943 HA ILE 127 HA ILE 127 -13.159 12.633 -16.563 944 HB ILE 127 HB ILE 127 -15.488 12.218 -15.071 945 1HG1 ILE 127 HG12 ILE 127 -14.068 12.745 -13.040 946 2HG1 ILE 127 HG13 ILE 127 -12.660 12.753 -14.117 947 1HG2 ILE 127 HG21 ILE 127 -15.042 10.740 -13.256 948 2HG2 ILE 127 HG22 ILE 127 -15.119 9.877 -14.789 949 3HG2 ILE 127 HG23 ILE 127 -13.537 10.185 -14.021 950 1HD1 ILE 127 HD11 ILE 127 -13.685 14.558 -15.409 951 2HD1 ILE 127 HD12 ILE 127 -15.191 14.431 -14.466 952 3HD1 ILE 127 HD13 ILE 127 -13.697 15.012 -13.694 953 H GLY 128 H GLY 128 -14.753 9.438 -16.981 954 1HA GLY 128 HA1 GLY 128 -12.552 7.791 -16.419 955 2HA GLY 128 HA2 GLY 128 -13.930 7.388 -17.468 956 H ASN 129 H ASN 129 -13.688 9.107 -19.582 957 HA ASN 129 HA ASN 129 -11.639 8.032 -21.201 958 1HB ASN 129 HB2 ASN 129 -13.040 10.714 -21.519 959 2HB ASN 129 HB3 ASN 129 -12.097 9.912 -22.766 960 1HD2 ASN 129 HD22 ASN 129 -14.931 10.756 -22.763 961 2HD2 ASN 129 HD21 ASN 129 -15.940 9.319 -22.853 962 H ARG 130 H ARG 130 -11.700 11.066 -19.296 963 HA ARG 130 HA ARG 130 -9.226 12.068 -20.307 964 1HB ARG 130 HB2 ARG 130 -11.182 12.961 -18.410 965 2HB ARG 130 HB3 ARG 130 -9.718 12.771 -17.481 966 1HG ARG 130 HG2 ARG 130 -9.659 14.970 -18.174 967 2HG ARG 130 HG3 ARG 130 -8.536 14.180 -19.277 968 1HD ARG 130 HD2 ARG 130 -11.442 14.933 -19.874 969 2HD ARG 130 HD3 ARG 130 -10.039 15.817 -20.419 970 HE ARG 130 HE ARG 130 -9.396 13.949 -21.834 971 1HH1 ARG 130 HH21 ARG 130 -12.742 13.677 -20.641 972 2HH1 ARG 130 HH22 ARG 130 -13.374 13.112 -22.150 973 1HH2 ARG 130 HH11 ARG 130 -10.133 12.726 -23.568 974 2HH2 ARG 130 HH12 ARG 130 -11.844 12.508 -23.839 975 H LEU 131 H LEU 131 -10.005 10.072 -17.482 976 HA LEU 131 HA LEU 131 -7.285 9.966 -16.573 977 1HB LEU 131 HB2 LEU 131 -9.754 8.321 -15.910 978 2HB LEU 131 HB3 LEU 131 -8.230 8.178 -15.023 979 HG LEU 131 HG LEU 131 -9.616 10.888 -15.368 980 1HD1 LEU 131 HD11 LEU 131 -11.232 9.432 -14.367 981 2HD1 LEU 131 HD12 LEU 131 -10.051 8.895 -13.144 982 3HD1 LEU 131 HD13 LEU 131 -10.615 10.582 -13.175 983 1HD2 LEU 131 HD21 LEU 131 -7.293 11.043 -14.697 984 2HD2 LEU 131 HD22 LEU 131 -8.353 11.453 -13.355 985 3HD2 LEU 131 HD23 LEU 131 -7.550 9.860 -13.398 986 H LYS 132 H LYS 132 -9.250 7.828 -18.648 987 HA LYS 132 HA LYS 132 -7.301 5.816 -19.023 988 1HB LYS 132 HB2 LYS 132 -9.473 5.365 -19.751 989 2HB LYS 132 HB3 LYS 132 -9.652 6.877 -20.602 990 1HG LYS 132 HG2 LYS 132 -7.603 4.927 -21.661 991 2HG LYS 132 HG3 LYS 132 -9.319 4.538 -21.825 992 1HD LYS 132 HD2 LYS 132 -9.619 6.891 -22.860 993 2HD LYS 132 HD3 LYS 132 -7.846 6.914 -23.005 994 1HE LYS 132 HE2 LYS 132 -7.972 4.735 -24.247 995 2HE LYS 132 HE3 LYS 132 -9.737 4.816 -24.137 996 1HZ LYS 132 HZ1 LYS 132 -8.952 5.635 -26.260 997 2HZ LYS 132 HZ2 LYS 132 -9.666 6.852 -25.453 998 3HZ LYS 132 HZ3 LYS 132 -8.032 6.780 -25.562 999 H GLU 133 H GLU 133 -7.797 8.845 -20.915 1000 HA GLU 133 HA GLU 133 -5.501 8.376 -22.582 1001 1HB GLU 133 HB2 GLU 133 -6.856 10.969 -21.720 1002 2HB GLU 133 HB3 GLU 133 -5.505 10.885 -22.865 1003 1HG GLU 133 HG2 GLU 133 -6.836 9.432 -24.357 1004 2HG GLU 133 HG3 GLU 133 -8.223 9.569 -23.276 1005 H PHE 134 H PHE 134 -5.826 10.272 -19.532 1006 HA PHE 134 HA PHE 134 -3.161 11.094 -19.380 1007 1HB PHE 134 HB2 PHE 134 -4.827 12.024 -17.978 1008 2HB PHE 134 HB3 PHE 134 -5.291 10.446 -17.345 1009 HD1 PHE 134 HD1 PHE 134 -2.789 13.157 -17.116 1010 HD2 PHE 134 HD2 PHE 134 -4.122 9.358 -15.576 1011 HE1 PHE 134 HE1 PHE 134 -1.245 13.395 -15.191 1012 HE2 PHE 134 HE2 PHE 134 -2.603 9.622 -13.618 1013 HZ PHE 134 HZ PHE 134 -1.162 11.622 -13.447 1014 H ALA 135 H ALA 135 -4.596 7.990 -18.393 1015 HA ALA 135 HA ALA 135 -2.194 6.965 -17.208 1016 1HB ALA 135 HB1 ALA 135 -4.417 6.137 -16.578 1017 2HB ALA 135 HB2 ALA 135 -4.661 5.496 -18.218 1018 3HB ALA 135 HB3 ALA 135 -3.395 4.816 -17.176 1019 H GLU 136 H GLU 136 -3.756 6.501 -20.380 1020 HA GLU 136 HA GLU 136 -1.901 4.528 -21.305 1021 1HB GLU 136 HB2 GLU 136 -4.026 6.207 -22.674 1022 2HB GLU 136 HB3 GLU 136 -3.038 5.052 -23.558 1023 1HG GLU 136 HG2 GLU 136 -4.765 4.277 -21.165 1024 2HG GLU 136 HG3 GLU 136 -5.292 4.190 -22.842 1025 H THR 137 H THR 137 -2.177 8.023 -21.782 1026 HA THR 137 HA THR 137 -0.021 8.059 -23.677 1027 HB THR 137 HB THR 137 -0.511 10.390 -23.898 1028 HG1 THR 137 HG1 THR 137 -2.447 10.064 -21.871 1029 1HG2 THR 137 HG21 THR 137 -1.943 8.835 -25.123 1030 2HG2 THR 137 HG22 THR 137 -3.047 8.678 -23.754 1031 3HG2 THR 137 HG23 THR 137 -2.895 10.239 -24.593 1032 H GLY 138 H GLY 138 -0.451 8.476 -20.227 1033 1HA GLY 138 HA1 GLY 138 0.915 9.031 -18.512 1034 2HA GLY 138 HA2 GLY 138 2.331 8.789 -19.567 1035 H LYS 139 H LYS 139 -0.494 10.955 -19.826 1036 HA LYS 139 HA LYS 139 0.682 13.110 -21.008 1037 1HB LYS 139 HB2 LYS 139 -1.802 12.656 -20.459 1038 2HB LYS 139 HB3 LYS 139 -1.469 13.400 -18.899 1039 1HG LYS 139 HG2 LYS 139 -2.437 15.056 -20.342 1040 2HG LYS 139 HG3 LYS 139 -0.754 15.481 -20.035 1041 1HD LYS 139 HD2 LYS 139 -1.413 15.912 -22.361 1042 2HD LYS 139 HD3 LYS 139 -0.101 14.737 -22.275 1043 1HE LYS 139 HE2 LYS 139 -1.724 12.885 -22.598 1044 2HE LYS 139 HE3 LYS 139 -3.058 14.046 -22.622 1045 1HZ LYS 139 HZ1 LYS 139 -0.858 13.933 -24.608 1046 2HZ LYS 139 HZ2 LYS 139 -2.385 13.418 -24.852 1047 3HZ LYS 139 HZ3 LYS 139 -2.092 15.005 -24.634 Start of MODEL 13 1 1H MET 1 H1 MET 1 3.658 -1.545 0.455 2 2H MET 1 H2 MET 1 2.398 -0.770 -0.250 3 3H MET 1 H3 MET 1 3.608 -1.361 -1.177 4 HA MET 1 HA MET 1 3.839 0.819 0.772 5 1HB MET 1 HB2 MET 1 5.902 -0.600 0.555 6 2HB MET 1 HB3 MET 1 5.967 -0.196 -1.166 7 1HG MET 1 HG2 MET 1 6.185 2.205 -0.576 8 2HG MET 1 HG3 MET 1 6.071 1.797 1.138 9 1HE MET 1 HE1 MET 1 9.778 3.002 0.701 10 2HE MET 1 HE2 MET 1 8.348 3.609 -0.163 11 3HE MET 1 HE3 MET 1 8.247 3.235 1.574 12 H GLU 2 H GLU 2 3.368 2.821 0.009 13 HA GLU 2 HA GLU 2 2.137 3.156 -2.583 14 1HB GLU 2 HB2 GLU 2 2.066 5.551 -1.935 15 2HB GLU 2 HB3 GLU 2 1.310 4.462 -0.788 16 1HG GLU 2 HG2 GLU 2 4.168 5.334 -0.308 17 2HG GLU 2 HG3 GLU 2 2.854 6.463 -0.008 18 H ASN 3 H ASN 3 2.843 4.987 -4.065 19 HA ASN 3 HA ASN 3 5.779 5.142 -4.408 20 1HB ASN 3 HB2 ASN 3 5.358 3.155 -5.580 21 2HB ASN 3 HB3 ASN 3 3.880 3.768 -6.295 22 1HD2 ASN 3 HD22 ASN 3 3.975 4.890 -8.223 23 2HD2 ASN 3 HD21 ASN 3 5.489 5.203 -9.082 24 H LYS 4 H LYS 4 2.575 6.212 -5.596 25 HA LYS 4 HA LYS 4 3.694 8.969 -5.805 26 1HB LYS 4 HB2 LYS 4 2.051 7.486 -7.900 27 2HB LYS 4 HB3 LYS 4 2.049 9.246 -7.811 28 1HG LYS 4 HG2 LYS 4 4.460 9.360 -8.119 29 2HG LYS 4 HG3 LYS 4 4.583 7.602 -8.157 30 1HD LYS 4 HD2 LYS 4 3.069 9.303 -10.184 31 2HD LYS 4 HD3 LYS 4 4.682 8.593 -10.398 32 1HE LYS 4 HE2 LYS 4 3.623 6.319 -9.952 33 2HE LYS 4 HE3 LYS 4 2.046 7.105 -10.042 34 1HZ LYS 4 HZ1 LYS 4 2.829 6.051 -12.135 35 2HZ LYS 4 HZ2 LYS 4 2.472 7.650 -12.319 36 3HZ LYS 4 HZ3 LYS 4 4.034 7.145 -12.246 37 H ILE 5 H ILE 5 1.890 10.600 -5.823 38 HA ILE 5 HA ILE 5 -0.629 9.686 -4.559 39 HB ILE 5 HB ILE 5 1.200 11.947 -3.595 40 1HG1 ILE 5 HG12 ILE 5 -0.222 9.749 -2.042 41 2HG1 ILE 5 HG13 ILE 5 1.431 9.604 -2.643 42 1HG2 ILE 5 HG21 ILE 5 -1.088 12.895 -3.846 43 2HG2 ILE 5 HG22 ILE 5 -1.759 11.529 -2.946 44 3HG2 ILE 5 HG23 ILE 5 -0.686 12.711 -2.152 45 1HD1 ILE 5 HD11 ILE 5 0.460 11.632 -0.596 46 2HD1 ILE 5 HD12 ILE 5 1.503 10.229 -0.324 47 3HD1 ILE 5 HD13 ILE 5 2.094 11.582 -1.306 48 H ILE 6 H ILE 6 -2.335 10.499 -5.672 49 HA ILE 6 HA ILE 6 -1.905 12.821 -7.471 50 HB ILE 6 HB ILE 6 -2.011 11.043 -8.965 51 1HG1 ILE 6 HG12 ILE 6 -4.827 12.198 -8.770 52 2HG1 ILE 6 HG13 ILE 6 -3.424 12.975 -9.507 53 1HG2 ILE 6 HG21 ILE 6 -4.418 9.898 -7.505 54 2HG2 ILE 6 HG22 ILE 6 -3.692 9.244 -8.989 55 3HG2 ILE 6 HG23 ILE 6 -2.779 9.218 -7.497 56 1HD1 ILE 6 HD11 ILE 6 -3.315 10.996 -11.124 57 2HD1 ILE 6 HD12 ILE 6 -4.892 10.493 -10.468 58 3HD1 ILE 6 HD13 ILE 6 -4.734 12.052 -11.279 59 H TYR 7 H TYR 7 -3.386 14.438 -7.099 60 HA TYR 7 HA TYR 7 -5.493 13.928 -5.056 61 1HB TYR 7 HB2 TYR 7 -3.335 14.921 -4.246 62 2HB TYR 7 HB3 TYR 7 -3.618 16.309 -5.282 63 HD1 TYR 7 HD1 TYR 7 -6.131 14.482 -3.086 64 HD2 TYR 7 HD2 TYR 7 -3.742 18.024 -3.696 65 HE1 TYR 7 HE1 TYR 7 -7.049 15.455 -1.006 66 HE2 TYR 7 HE2 TYR 7 -4.653 18.979 -1.592 67 HH TYR 7 HH TYR 7 -5.669 18.488 0.339 68 H PHE 8 H PHE 8 -7.416 14.143 -6.119 69 HA PHE 8 HA PHE 8 -7.721 16.004 -8.367 70 1HB PHE 8 HB2 PHE 8 -9.741 14.313 -6.825 71 2HB PHE 8 HB3 PHE 8 -10.132 15.314 -8.219 72 HD1 PHE 8 HD1 PHE 8 -8.815 14.925 -10.402 73 HD2 PHE 8 HD2 PHE 8 -8.960 12.066 -7.174 74 HE1 PHE 8 HE1 PHE 8 -7.878 13.190 -11.900 75 HE2 PHE 8 HE2 PHE 8 -8.084 10.320 -8.707 76 HZ PHE 8 HZ PHE 8 -7.472 10.891 -11.030 77 H LEU 9 H LEU 9 -8.882 17.914 -8.396 78 HA LEU 9 HA LEU 9 -9.796 19.088 -5.839 79 1HB LEU 9 HB2 LEU 9 -7.335 19.524 -6.269 80 2HB LEU 9 HB3 LEU 9 -7.757 20.305 -7.776 81 HG LEU 9 HG LEU 9 -7.186 21.846 -5.945 82 1HD1 LEU 9 HD11 LEU 9 -8.825 22.531 -7.767 83 2HD1 LEU 9 HD12 LEU 9 -10.115 22.300 -6.555 84 3HD1 LEU 9 HD13 LEU 9 -8.833 23.480 -6.279 85 1HD2 LEU 9 HD21 LEU 9 -8.064 20.529 -4.061 86 2HD2 LEU 9 HD22 LEU 9 -8.639 22.214 -4.047 87 3HD2 LEU 9 HD23 LEU 9 -9.720 20.911 -4.558 88 H CYS 10 H CYS 10 -11.763 20.133 -6.238 89 HA CYS 10 HA CYS 10 -12.226 21.361 -8.849 90 1HB CYS 10 HB2 CYS 10 -12.979 18.817 -8.794 91 2HB CYS 10 HB3 CYS 10 -14.376 19.451 -7.908 92 HG CYS 10 HG CYS 10 -14.869 19.150 -10.510 93 H THR 11 H THR 11 -14.619 22.481 -8.731 94 HA THR 11 HA THR 11 -14.494 24.178 -6.434 95 HB THR 11 HB THR 11 -16.743 24.995 -7.509 96 HG1 THR 11 HG1 THR 11 -16.784 24.472 -9.725 97 1HG2 THR 11 HG21 THR 11 -14.104 25.171 -9.030 98 2HG2 THR 11 HG22 THR 11 -15.444 26.328 -9.081 99 3HG2 THR 11 HG23 THR 11 -14.504 26.124 -7.592 100 H GLY 12 H GLY 12 -15.850 21.103 -6.713 101 1HA GLY 12 HA1 GLY 12 -16.779 21.249 -4.005 102 2HA GLY 12 HA2 GLY 12 -18.091 20.891 -5.157 103 H ASN 13 H ASN 13 -15.783 19.464 -3.258 104 HA ASN 13 HA ASN 13 -14.465 17.532 -4.831 105 1HB ASN 13 HB2 ASN 13 -14.026 18.045 -2.426 106 2HB ASN 13 HB3 ASN 13 -15.545 17.302 -1.976 107 1HD2 ASN 13 HD22 ASN 13 -13.052 16.544 -0.929 108 2HD2 ASN 13 HD21 ASN 13 -12.636 14.934 -1.484 109 H SER 14 H SER 14 -17.550 17.416 -3.171 110 HA SER 14 HA SER 14 -18.332 14.906 -3.082 111 1HB SER 14 HB2 SER 14 -20.066 17.320 -3.734 112 2HB SER 14 HB3 SER 14 -20.554 15.874 -2.819 113 HG SER 14 HG SER 14 -19.015 16.360 -1.284 114 H CYS 15 H CYS 15 -18.253 16.618 -6.147 115 HA CYS 15 HA CYS 15 -19.869 14.429 -7.384 116 1HB CYS 15 HB2 CYS 15 -19.488 17.253 -8.446 117 2HB CYS 15 HB3 CYS 15 -20.559 15.992 -9.076 118 HG CYS 15 HG CYS 15 -21.781 18.009 -7.921 119 H ARG 16 H ARG 16 -17.744 16.825 -8.943 120 HA ARG 16 HA ARG 16 -16.759 14.859 -10.711 121 1HB ARG 16 HB2 ARG 16 -15.957 17.727 -10.110 122 2HB ARG 16 HB3 ARG 16 -15.063 16.789 -11.300 123 1HG ARG 16 HG2 ARG 16 -16.910 16.492 -12.722 124 2HG ARG 16 HG3 ARG 16 -18.092 16.910 -11.482 125 1HD ARG 16 HD2 ARG 16 -16.109 18.887 -12.673 126 2HD ARG 16 HD3 ARG 16 -17.778 18.678 -13.224 127 HE ARG 16 HE ARG 16 -18.176 19.093 -10.568 128 1HH1 ARG 16 HH21 ARG 16 -16.655 21.083 -13.086 129 2HH1 ARG 16 HH22 ARG 16 -16.454 22.446 -12.023 130 1HH2 ARG 16 HH11 ARG 16 -18.149 20.839 -9.327 131 2HH2 ARG 16 HH12 ARG 16 -17.269 22.299 -9.751 132 H SER 17 H SER 17 -15.110 16.155 -7.724 133 HA SER 17 HA SER 17 -12.709 14.730 -8.372 134 1HB SER 17 HB2 SER 17 -13.539 15.627 -5.616 135 2HB SER 17 HB3 SER 17 -11.908 15.413 -6.269 136 HG SER 17 HG SER 17 -12.457 17.573 -6.167 137 H GLN 18 H GLN 18 -15.539 13.908 -6.272 138 HA GLN 18 HA GLN 18 -14.489 11.423 -5.321 139 1HB GLN 18 HB2 GLN 18 -17.352 12.377 -5.876 140 2HB GLN 18 HB3 GLN 18 -16.991 10.829 -5.130 141 1HG GLN 18 HG2 GLN 18 -16.229 13.529 -3.975 142 2HG GLN 18 HG3 GLN 18 -17.594 12.549 -3.475 143 1HE2 GLN 18 HE22 GLN 18 -14.483 13.325 -2.625 144 2HE2 GLN 18 HE21 GLN 18 -14.160 11.936 -1.594 145 H MET 19 H MET 19 -16.422 12.164 -8.276 146 HA MET 19 HA MET 19 -16.591 9.435 -9.148 147 1HB MET 19 HB2 MET 19 -16.751 12.081 -10.676 148 2HB MET 19 HB3 MET 19 -17.138 10.507 -11.382 149 1HG MET 19 HG2 MET 19 -19.044 10.210 -10.009 150 2HG MET 19 HG3 MET 19 -18.527 11.443 -8.871 151 1HE MET 19 HE1 MET 19 -20.413 12.408 -13.001 152 2HE MET 19 HE2 MET 19 -18.820 11.636 -12.860 153 3HE MET 19 HE3 MET 19 -20.287 10.771 -12.327 154 H ALA 20 H ALA 20 -14.254 12.089 -9.943 155 HA ALA 20 HA ALA 20 -12.671 10.642 -11.761 156 1HB ALA 20 HB1 ALA 20 -11.781 12.766 -9.762 157 2HB ALA 20 HB2 ALA 20 -10.919 12.274 -11.229 158 3HB ALA 20 HB3 ALA 20 -12.484 13.094 -11.359 159 H GLU 21 H GLU 21 -12.417 10.874 -8.175 160 HA GLU 21 HA GLU 21 -10.094 9.321 -7.889 161 1HB GLU 21 HB2 GLU 21 -10.972 10.624 -6.071 162 2HB GLU 21 HB3 GLU 21 -12.489 9.710 -6.042 163 1HG GLU 21 HG2 GLU 21 -11.311 7.694 -5.399 164 2HG GLU 21 HG3 GLU 21 -9.754 8.510 -5.475 165 H GLY 22 H GLY 22 -13.548 8.279 -7.996 166 1HA GLY 22 HA1 GLY 22 -13.265 5.535 -7.739 167 2HA GLY 22 HA2 GLY 22 -14.493 6.351 -8.718 168 H TRP 23 H TRP 23 -13.193 7.336 -10.954 169 HA TRP 23 HA TRP 23 -12.597 4.859 -12.348 170 1HB TRP 23 HB2 TRP 23 -12.143 7.712 -13.244 171 2HB TRP 23 HB3 TRP 23 -11.946 6.299 -14.258 172 HD1 TRP 23 HD1 TRP 23 -14.535 8.517 -12.685 173 HE1 TRP 23 HE1 TRP 23 -16.709 8.370 -13.956 174 HE3 TRP 23 HE3 TRP 23 -13.468 4.488 -15.697 175 HZ2 TRP 23 HZ2 TRP 23 -17.893 6.731 -16.004 176 HZ3 TRP 23 HZ3 TRP 23 -15.151 3.729 -17.359 177 HH2 TRP 23 HH2 TRP 23 -17.387 4.901 -17.518 178 H ALA 24 H ALA 24 -10.497 7.459 -10.967 179 HA ALA 24 HA ALA 24 -8.220 6.645 -12.413 180 1HB ALA 24 HB1 ALA 24 -8.445 8.836 -11.231 181 2HB ALA 24 HB2 ALA 24 -8.294 7.999 -9.677 182 3HB ALA 24 HB3 ALA 24 -6.932 8.011 -10.821 183 H LYS 25 H LYS 25 -9.502 5.436 -9.320 184 HA LYS 25 HA LYS 25 -7.285 3.831 -8.582 185 1HB LYS 25 HB2 LYS 25 -10.278 3.495 -8.199 186 2HB LYS 25 HB3 LYS 25 -9.109 2.371 -7.491 187 1HG LYS 25 HG2 LYS 25 -8.125 4.047 -6.115 188 2HG LYS 25 HG3 LYS 25 -8.893 5.367 -7.008 189 1HD LYS 25 HD2 LYS 25 -11.123 4.612 -6.257 190 2HD LYS 25 HD3 LYS 25 -10.367 3.306 -5.306 191 1HE LYS 25 HE2 LYS 25 -9.160 4.952 -3.938 192 2HE LYS 25 HE3 LYS 25 -9.711 6.263 -4.988 193 1HZ LYS 25 HZ1 LYS 25 -11.089 6.318 -3.139 194 2HZ LYS 25 HZ2 LYS 25 -12.017 5.674 -4.298 195 3HZ LYS 25 HZ3 LYS 25 -11.376 4.682 -3.134 196 H GLN 26 H GLN 26 -9.748 3.265 -11.063 197 HA GLN 26 HA GLN 26 -9.043 0.465 -11.510 198 1HB GLN 26 HB2 GLN 26 -10.753 2.503 -12.976 199 2HB GLN 26 HB3 GLN 26 -10.349 0.979 -13.707 200 1HG GLN 26 HG2 GLN 26 -12.596 1.327 -12.355 201 2HG GLN 26 HG3 GLN 26 -11.752 -0.219 -12.428 202 1HE2 GLN 26 HE22 GLN 26 -12.033 2.737 -10.257 203 2HE2 GLN 26 HE21 GLN 26 -11.857 1.788 -8.816 204 H TYR 27 H TYR 27 -8.465 3.568 -13.192 205 HA TYR 27 HA TYR 27 -6.908 2.333 -15.262 206 1HB TYR 27 HB2 TYR 27 -7.350 5.225 -14.438 207 2HB TYR 27 HB3 TYR 27 -6.383 4.770 -15.832 208 HD1 TYR 27 HD1 TYR 27 -9.545 5.900 -14.992 209 HD2 TYR 27 HD2 TYR 27 -7.616 2.903 -17.423 210 HE1 TYR 27 HE1 TYR 27 -11.513 5.850 -16.490 211 HE2 TYR 27 HE2 TYR 27 -9.608 2.800 -18.886 212 HH TYR 27 HH TYR 27 -12.505 4.859 -18.356 213 H LEU 28 H LEU 28 -5.938 3.933 -12.225 214 HA LEU 28 HA LEU 28 -3.139 4.054 -13.158 215 1HB LEU 28 HB2 LEU 28 -4.462 5.214 -10.680 216 2HB LEU 28 HB3 LEU 28 -2.844 5.536 -11.244 217 HG LEU 28 HG LEU 28 -5.403 6.375 -12.627 218 1HD1 LEU 28 HD11 LEU 28 -4.630 8.622 -12.140 219 2HD1 LEU 28 HD12 LEU 28 -4.648 7.682 -10.635 220 3HD1 LEU 28 HD13 LEU 28 -3.109 8.001 -11.454 221 1HD2 LEU 28 HD21 LEU 28 -3.987 7.499 -14.289 222 2HD2 LEU 28 HD22 LEU 28 -2.536 6.749 -13.590 223 3HD2 LEU 28 HD23 LEU 28 -3.787 5.762 -14.379 224 H GLY 29 H GLY 29 -4.973 2.508 -10.529 225 1HA GLY 29 HA1 GLY 29 -4.476 0.597 -9.370 226 2HA GLY 29 HA2 GLY 29 -3.058 0.379 -10.394 227 H ASP 30 H ASP 30 -2.331 -0.460 -8.296 228 HA ASP 30 HA ASP 30 -2.055 1.003 -5.921 229 1HB ASP 30 HB2 ASP 30 -2.073 -1.452 -6.139 230 2HB ASP 30 HB3 ASP 30 -0.498 -1.399 -6.934 231 H GLU 31 H GLU 31 -0.108 1.229 -8.732 232 HA GLU 31 HA GLU 31 2.383 2.171 -7.695 233 1HB GLU 31 HB2 GLU 31 1.882 1.402 -10.023 234 2HB GLU 31 HB3 GLU 31 0.852 2.802 -10.267 235 1HG GLU 31 HG2 GLU 31 2.886 4.266 -9.941 236 2HG GLU 31 HG3 GLU 31 3.866 2.799 -9.850 237 H TRP 32 H TRP 32 -0.736 3.509 -7.314 238 HA TRP 32 HA TRP 32 0.416 6.122 -6.526 239 1HB TRP 32 HB2 TRP 32 -2.240 5.886 -7.960 240 2HB TRP 32 HB3 TRP 32 -1.310 7.328 -7.620 241 HD1 TRP 32 HD1 TRP 32 -0.868 4.142 -9.779 242 HE1 TRP 32 HE1 TRP 32 -0.187 4.806 -12.135 243 HE3 TRP 32 HE3 TRP 32 -0.542 9.203 -9.114 244 HZ2 TRP 32 HZ2 TRP 32 0.200 7.211 -13.621 245 HZ3 TRP 32 HZ3 TRP 32 -0.133 10.677 -11.053 246 HH2 TRP 32 HH2 TRP 32 0.218 9.675 -13.340 247 H LYS 33 H LYS 33 -0.883 7.230 -5.011 248 HA LYS 33 HA LYS 33 -3.104 5.737 -3.659 249 1HB LYS 33 HB2 LYS 33 -1.139 7.803 -2.619 250 2HB LYS 33 HB3 LYS 33 -2.690 7.430 -1.837 251 1HG LYS 33 HG2 LYS 33 -1.920 4.927 -2.011 252 2HG LYS 33 HG3 LYS 33 -0.304 5.603 -2.255 253 1HD LYS 33 HD2 LYS 33 -2.200 6.130 0.060 254 2HD LYS 33 HD3 LYS 33 -0.817 5.022 0.117 255 1HE LYS 33 HE2 LYS 33 0.683 7.025 -0.435 256 2HE LYS 33 HE3 LYS 33 -0.735 8.054 -0.232 257 1HZ LYS 33 HZ1 LYS 33 -0.878 7.150 2.078 258 2HZ LYS 33 HZ2 LYS 33 0.575 6.389 1.843 259 3HZ LYS 33 HZ3 LYS 33 0.473 8.018 1.804 260 H VAL 34 H VAL 34 -5.053 6.863 -3.618 261 HA VAL 34 HA VAL 34 -5.140 9.285 -5.368 262 HB VAL 34 HB VAL 34 -7.163 7.013 -5.373 263 1HG1 VAL 34 HG11 VAL 34 -6.574 9.111 -7.494 264 2HG1 VAL 34 HG12 VAL 34 -7.965 8.007 -7.394 265 3HG1 VAL 34 HG13 VAL 34 -7.797 9.334 -6.234 266 1HG2 VAL 34 HG21 VAL 34 -5.125 5.963 -6.200 267 2HG2 VAL 34 HG22 VAL 34 -6.195 6.289 -7.561 268 3HG2 VAL 34 HG23 VAL 34 -4.796 7.344 -7.269 269 H TYR 35 H TYR 35 -6.094 10.948 -4.388 270 HA TYR 35 HA TYR 35 -8.385 10.413 -2.614 271 1HB TYR 35 HB2 TYR 35 -6.825 12.745 -1.732 272 2HB TYR 35 HB3 TYR 35 -7.728 11.578 -0.814 273 HD1 TYR 35 HD1 TYR 35 -6.565 9.263 -0.333 274 HD2 TYR 35 HD2 TYR 35 -4.505 12.776 -1.752 275 HE1 TYR 35 HE1 TYR 35 -4.444 8.413 0.640 276 HE2 TYR 35 HE2 TYR 35 -2.417 11.981 -0.740 277 HH TYR 35 HH TYR 35 -1.407 10.340 0.569 278 H SER 36 H SER 36 -9.620 12.504 -2.283 279 HA SER 36 HA SER 36 -9.411 14.370 -4.570 280 1HB SER 36 HB2 SER 36 -11.963 14.142 -4.631 281 2HB SER 36 HB3 SER 36 -11.031 12.801 -5.319 282 HG SER 36 HG SER 36 -11.432 11.595 -3.498 283 H ALA 37 H ALA 37 -9.944 16.430 -4.080 284 HA ALA 37 HA ALA 37 -11.265 17.093 -1.532 285 1HB ALA 37 HB1 ALA 37 -9.681 18.827 -1.111 286 2HB ALA 37 HB2 ALA 37 -8.914 17.247 -1.043 287 3HB ALA 37 HB3 ALA 37 -8.656 18.301 -2.474 288 H GLY 38 H GLY 38 -11.474 19.725 -1.745 289 1HA GLY 38 HA1 GLY 38 -11.871 20.699 -4.405 290 2HA GLY 38 HA2 GLY 38 -13.406 20.326 -3.607 291 H ILE 39 H ILE 39 -13.045 22.843 -4.279 292 HA ILE 39 HA ILE 39 -11.980 24.653 -2.344 293 HB ILE 39 HB ILE 39 -14.247 24.699 -4.354 294 1HG1 ILE 39 HG12 ILE 39 -12.970 26.550 -5.353 295 2HG1 ILE 39 HG13 ILE 39 -11.796 26.477 -4.040 296 1HG2 ILE 39 HG21 ILE 39 -15.214 26.039 -2.590 297 2HG2 ILE 39 HG22 ILE 39 -13.708 26.981 -2.427 298 3HG2 ILE 39 HG23 ILE 39 -14.693 27.082 -3.904 299 1HD1 ILE 39 HD11 ILE 39 -12.276 24.277 -6.093 300 2HD1 ILE 39 HD12 ILE 39 -10.991 25.478 -6.153 301 3HD1 ILE 39 HD13 ILE 39 -11.000 24.293 -4.843 302 H GLU 40 H GLU 40 -15.029 22.804 -2.544 303 HA GLU 40 HA GLU 40 -15.112 22.780 0.378 304 1HB GLU 40 HB2 GLU 40 -17.448 23.306 0.563 305 2HB GLU 40 HB3 GLU 40 -16.599 24.666 -0.150 306 1HG GLU 40 HG2 GLU 40 -17.527 24.282 -2.312 307 2HG GLU 40 HG3 GLU 40 -18.026 22.637 -1.922 308 H ALA 41 H ALA 41 -17.094 21.240 0.956 309 HA ALA 41 HA ALA 41 -17.556 19.089 -1.001 310 1HB ALA 41 HB1 ALA 41 -16.391 18.704 1.806 311 2HB ALA 41 HB2 ALA 41 -17.092 17.416 0.817 312 3HB ALA 41 HB3 ALA 41 -15.623 18.261 0.264 313 H HIS 42 H HIS 42 -19.714 18.862 -1.012 314 HA HIS 42 HA HIS 42 -21.433 20.087 0.994 315 1HB HIS 42 HB2 HIS 42 -22.371 18.098 -1.071 316 2HB HIS 42 HB3 HIS 42 -23.200 19.508 -0.436 317 HD1 HIS 42 HD1 HIS 42 -20.922 21.756 -1.324 318 HD2 HIS 42 HD2 HIS 42 -22.414 18.514 -3.591 319 HE1 HIS 42 HE1 HIS 42 -20.482 22.306 -3.750 320 H GLY 43 H GLY 43 -20.365 16.841 0.044 321 1HA GLY 43 HA1 GLY 43 -20.268 15.453 2.409 322 2HA GLY 43 HA2 GLY 43 -21.952 15.290 1.853 323 H LEU 44 H LEU 44 -21.179 12.900 1.580 324 HA LEU 44 HA LEU 44 -19.671 12.452 -0.945 325 1HB LEU 44 HB2 LEU 44 -19.359 10.805 0.878 326 2HB LEU 44 HB3 LEU 44 -21.106 10.519 0.927 327 HG LEU 44 HG LEU 44 -21.031 9.713 -1.419 328 1HD1 LEU 44 HD11 LEU 44 -18.011 9.893 -1.106 329 2HD1 LEU 44 HD12 LEU 44 -18.858 9.041 -2.414 330 3HD1 LEU 44 HD13 LEU 44 -19.003 10.791 -2.277 331 1HD2 LEU 44 HD21 LEU 44 -19.924 7.540 -0.881 332 2HD2 LEU 44 HD22 LEU 44 -19.259 8.277 0.585 333 3HD2 LEU 44 HD23 LEU 44 -21.014 8.110 0.394 334 H ASN 45 H ASN 45 -20.935 13.307 -2.628 335 HA ASN 45 HA ASN 45 -23.723 13.676 -2.415 336 1HB ASN 45 HB2 ASN 45 -22.150 14.894 -3.960 337 2HB ASN 45 HB3 ASN 45 -22.191 13.494 -5.035 338 1HD2 ASN 45 HD22 ASN 45 -23.180 16.331 -5.427 339 2HD2 ASN 45 HD21 ASN 45 -24.886 16.175 -5.769 340 HA PRO 46 HA PRO 46 -25.004 9.378 -3.188 341 1HB PRO 46 HB2 PRO 46 -27.599 10.772 -3.854 342 2HB PRO 46 HB3 PRO 46 -27.330 9.297 -2.872 343 1HG PRO 46 HG2 PRO 46 -27.793 11.681 -1.662 344 2HG PRO 46 HG3 PRO 46 -26.519 10.586 -1.029 345 1HD PRO 46 HD2 PRO 46 -26.193 13.010 -2.815 346 2HD PRO 46 HD3 PRO 46 -25.243 12.526 -1.377 347 H ASN 47 H ASN 47 -25.584 12.109 -5.460 348 HA ASN 47 HA ASN 47 -26.190 10.444 -7.710 349 1HB ASN 47 HB2 ASN 47 -26.473 12.333 -8.809 350 2HB ASN 47 HB3 ASN 47 -26.239 13.190 -7.308 351 1HD2 ASN 47 HD22 ASN 47 -25.297 13.065 -10.536 352 2HD2 ASN 47 HD21 ASN 47 -23.725 13.819 -10.389 353 H ALA 48 H ALA 48 -23.087 11.521 -6.288 354 HA ALA 48 HA ALA 48 -21.509 10.585 -8.521 355 1HB ALA 48 HB1 ALA 48 -19.608 10.891 -6.959 356 2HB ALA 48 HB2 ALA 48 -20.659 12.319 -6.993 357 3HB ALA 48 HB3 ALA 48 -20.730 11.186 -5.624 358 H VAL 49 H VAL 49 -22.596 9.279 -5.360 359 HA VAL 49 HA VAL 49 -21.111 6.862 -5.480 360 HB VAL 49 HB VAL 49 -23.772 7.297 -4.091 361 1HG1 VAL 49 HG11 VAL 49 -23.190 4.913 -4.354 362 2HG1 VAL 49 HG12 VAL 49 -21.548 5.220 -3.766 363 3HG1 VAL 49 HG13 VAL 49 -22.945 5.408 -2.675 364 1HG2 VAL 49 HG21 VAL 49 -22.085 8.921 -3.297 365 2HG2 VAL 49 HG22 VAL 49 -22.361 7.682 -2.078 366 3HG2 VAL 49 HG23 VAL 49 -20.903 7.619 -3.095 367 H LYS 50 H LYS 50 -24.550 7.547 -6.513 368 HA LYS 50 HA LYS 50 -24.835 4.895 -7.493 369 1HB LYS 50 HB2 LYS 50 -26.708 6.581 -6.953 370 2HB LYS 50 HB3 LYS 50 -26.443 7.229 -8.582 371 1HG LYS 50 HG2 LYS 50 -26.809 4.869 -9.485 372 2HG LYS 50 HG3 LYS 50 -27.156 4.347 -7.828 373 1HD LYS 50 HD2 LYS 50 -28.993 6.117 -7.793 374 2HD LYS 50 HD3 LYS 50 -28.735 6.318 -9.528 375 1HE LYS 50 HE2 LYS 50 -29.466 3.672 -8.179 376 2HE LYS 50 HE3 LYS 50 -30.645 4.809 -8.830 377 1HZ LYS 50 HZ1 LYS 50 -28.660 3.257 -10.399 378 2HZ LYS 50 HZ2 LYS 50 -30.275 3.191 -10.455 379 3HZ LYS 50 HZ3 LYS 50 -29.531 4.519 -11.022 380 H ALA 51 H ALA 51 -23.875 7.940 -9.187 381 HA ALA 51 HA ALA 51 -23.842 6.956 -11.780 382 1HB ALA 51 HB1 ALA 51 -21.866 8.898 -10.480 383 2HB ALA 51 HB2 ALA 51 -22.079 8.684 -12.222 384 3HB ALA 51 HB3 ALA 51 -23.412 9.326 -11.256 385 H MET 52 H MET 52 -21.165 6.745 -9.361 386 HA MET 52 HA MET 52 -19.513 5.229 -11.207 387 1HB MET 52 HB2 MET 52 -19.312 5.763 -8.226 388 2HB MET 52 HB3 MET 52 -18.076 4.940 -9.180 389 1HG MET 52 HG2 MET 52 -18.990 7.815 -9.465 390 2HG MET 52 HG3 MET 52 -17.430 7.235 -8.898 391 1HE MET 52 HE1 MET 52 -15.731 5.807 -10.516 392 2HE MET 52 HE2 MET 52 -17.037 4.814 -11.204 393 3HE MET 52 HE3 MET 52 -15.939 5.675 -12.269 394 H LYS 53 H LYS 53 -21.751 4.338 -8.525 395 HA LYS 53 HA LYS 53 -20.944 1.646 -8.324 396 1HB LYS 53 HB2 LYS 53 -22.350 2.946 -6.706 397 2HB LYS 53 HB3 LYS 53 -23.682 2.892 -7.872 398 1HG LYS 53 HG2 LYS 53 -23.537 0.331 -7.685 399 2HG LYS 53 HG3 LYS 53 -22.433 0.579 -6.324 400 1HD LYS 53 HD2 LYS 53 -25.251 1.701 -6.598 401 2HD LYS 53 HD3 LYS 53 -24.859 0.252 -5.674 402 1HE LYS 53 HE2 LYS 53 -23.763 3.039 -5.061 403 2HE LYS 53 HE3 LYS 53 -25.230 2.377 -4.341 404 1HZ LYS 53 HZ1 LYS 53 -23.884 0.598 -3.374 405 2HZ LYS 53 HZ2 LYS 53 -22.499 1.258 -3.977 406 3HZ LYS 53 HZ3 LYS 53 -23.362 2.070 -2.885 407 H GLU 54 H GLU 54 -23.178 3.266 -10.580 408 HA GLU 54 HA GLU 54 -24.137 0.902 -11.835 409 1HB GLU 54 HB2 GLU 54 -23.936 3.790 -12.737 410 2HB GLU 54 HB3 GLU 54 -24.677 2.551 -13.743 411 1HG GLU 54 HG2 GLU 54 -25.562 3.275 -10.927 412 2HG GLU 54 HG3 GLU 54 -26.279 3.910 -12.402 413 H VAL 55 H VAL 55 -20.987 2.433 -12.084 414 HA VAL 55 HA VAL 55 -20.271 0.999 -14.561 415 HB VAL 55 HB VAL 55 -18.383 2.433 -12.636 416 1HG1 VAL 55 HG11 VAL 55 -18.191 1.829 -15.622 417 2HG1 VAL 55 HG12 VAL 55 -17.036 2.817 -14.704 418 3HG1 VAL 55 HG13 VAL 55 -17.205 1.108 -14.331 419 1HG2 VAL 55 HG21 VAL 55 -18.576 4.434 -14.106 420 2HG2 VAL 55 HG22 VAL 55 -19.891 3.630 -14.989 421 3HG2 VAL 55 HG23 VAL 55 -20.089 4.079 -13.278 422 H GLY 56 H GLY 56 -20.727 0.193 -11.276 423 1HA GLY 56 HA1 GLY 56 -20.207 -1.740 -10.132 424 2HA GLY 56 HA2 GLY 56 -19.076 -2.237 -11.404 425 H ILE 57 H ILE 57 -18.985 1.054 -10.019 426 HA ILE 57 HA ILE 57 -16.445 0.408 -8.594 427 HB ILE 57 HB ILE 57 -17.172 2.884 -10.190 428 1HG1 ILE 57 HG12 ILE 57 -15.000 0.793 -10.690 429 2HG1 ILE 57 HG13 ILE 57 -16.522 0.888 -11.577 430 1HG2 ILE 57 HG21 ILE 57 -14.615 2.231 -8.645 431 2HG2 ILE 57 HG22 ILE 57 -14.932 3.715 -9.572 432 3HG2 ILE 57 HG23 ILE 57 -15.853 3.383 -8.117 433 1HD1 ILE 57 HD11 ILE 57 -15.933 3.158 -12.372 434 2HD1 ILE 57 HD12 ILE 57 -14.334 2.986 -11.602 435 3HD1 ILE 57 HD13 ILE 57 -14.821 1.895 -12.913 436 H ASP 58 H ASP 58 -17.451 0.059 -6.700 437 HA ASP 58 HA ASP 58 -19.698 1.683 -5.811 438 1HB ASP 58 HB2 ASP 58 -19.684 -0.698 -5.365 439 2HB ASP 58 HB3 ASP 58 -18.176 -0.562 -4.445 440 H ILE 59 H ILE 59 -18.647 3.795 -5.796 441 HA ILE 59 HA ILE 59 -16.450 4.249 -4.008 442 HB ILE 59 HB ILE 59 -16.588 6.547 -4.540 443 1HG1 ILE 59 HG12 ILE 59 -19.170 6.168 -6.059 444 2HG1 ILE 59 HG13 ILE 59 -19.117 6.739 -4.395 445 1HG2 ILE 59 HG21 ILE 59 -17.179 5.005 -7.065 446 2HG2 ILE 59 HG22 ILE 59 -16.279 6.530 -6.926 447 3HG2 ILE 59 HG23 ILE 59 -15.615 5.050 -6.222 448 1HD1 ILE 59 HD11 ILE 59 -17.937 8.169 -6.789 449 2HD1 ILE 59 HD12 ILE 59 -19.253 8.688 -5.716 450 3HD1 ILE 59 HD13 ILE 59 -17.603 8.608 -5.097 451 H SER 60 H SER 60 -19.437 3.373 -3.001 452 HA SER 60 HA SER 60 -20.298 5.340 -1.236 453 1HB SER 60 HB2 SER 60 -20.320 2.352 -0.645 454 2HB SER 60 HB3 SER 60 -21.437 3.583 -0.035 455 HG SER 60 HG SER 60 -21.232 2.378 -2.566 456 H ASN 61 H ASN 61 -17.517 3.199 -0.977 457 HA ASN 61 HA ASN 61 -17.022 3.483 1.833 458 1HB ASN 61 HB2 ASN 61 -16.207 1.577 0.490 459 2HB ASN 61 HB3 ASN 61 -15.210 2.667 -0.481 460 1HD2 ASN 61 HD22 ASN 61 -15.710 1.595 2.954 461 2HD2 ASN 61 HD21 ASN 61 -14.035 1.765 3.400 462 H GLN 62 H GLN 62 -16.448 5.662 -0.849 463 HA GLN 62 HA GLN 62 -14.079 6.924 0.203 464 1HB GLN 62 HB2 GLN 62 -16.079 7.915 -1.878 465 2HB GLN 62 HB3 GLN 62 -14.495 8.621 -1.513 466 1HG GLN 62 HG2 GLN 62 -13.413 6.476 -2.154 467 2HG GLN 62 HG3 GLN 62 -14.982 5.856 -2.665 468 1HE2 GLN 62 HE22 GLN 62 -15.091 9.128 -3.608 469 2HE2 GLN 62 HE21 GLN 62 -14.529 8.863 -5.255 470 H THR 63 H THR 63 -14.250 9.390 0.567 471 HA THR 63 HA THR 63 -16.712 10.358 1.734 472 HB THR 63 HB THR 63 -15.223 11.327 3.679 473 HG1 THR 63 HG1 THR 63 -13.244 10.443 2.998 474 1HG2 THR 63 HG21 THR 63 -16.013 8.390 3.814 475 2HG2 THR 63 HG22 THR 63 -15.816 9.519 5.170 476 3HG2 THR 63 HG23 THR 63 -17.128 9.762 4.007 477 H SER 64 H SER 64 -16.736 12.687 1.733 478 HA SER 64 HA SER 64 -14.770 13.886 -0.125 479 1HB SER 64 HB2 SER 64 -17.402 14.969 0.926 480 2HB SER 64 HB3 SER 64 -16.412 15.638 -0.388 481 HG SER 64 HG SER 64 -18.324 14.178 -0.837 482 H ASP 65 H ASP 65 -13.771 15.838 0.422 483 HA ASP 65 HA ASP 65 -13.811 16.929 3.138 484 1HB ASP 65 HB2 ASP 65 -12.092 15.009 3.083 485 2HB ASP 65 HB3 ASP 65 -11.215 15.952 1.865 486 H ILE 66 H ILE 66 -12.495 19.013 3.134 487 HA ILE 66 HA ILE 66 -12.493 20.241 0.435 488 HB ILE 66 HB ILE 66 -12.726 22.304 1.443 489 1HG1 ILE 66 HG12 ILE 66 -12.040 21.046 4.127 490 2HG1 ILE 66 HG13 ILE 66 -11.094 22.242 3.216 491 1HG2 ILE 66 HG21 ILE 66 -14.846 22.123 2.532 492 2HG2 ILE 66 HG22 ILE 66 -14.704 20.662 1.533 493 3HG2 ILE 66 HG23 ILE 66 -14.433 20.567 3.273 494 1HD1 ILE 66 HD11 ILE 66 -13.761 22.649 4.595 495 2HD1 ILE 66 HD12 ILE 66 -12.212 23.435 4.954 496 3HD1 ILE 66 HD13 ILE 66 -13.080 23.820 3.440 497 H ILE 67 H ILE 67 -10.587 21.652 -0.024 498 HA ILE 67 HA ILE 67 -8.373 19.985 -0.063 499 HB ILE 67 HB ILE 67 -8.914 21.534 -1.761 500 1HG1 ILE 67 HG12 ILE 67 -6.573 20.621 -1.435 501 2HG1 ILE 67 HG13 ILE 67 -6.823 21.937 -2.564 502 1HG2 ILE 67 HG21 ILE 67 -9.692 23.483 -0.577 503 2HG2 ILE 67 HG22 ILE 67 -8.047 23.827 0.015 504 3HG2 ILE 67 HG23 ILE 67 -8.412 23.892 -1.719 505 1HD1 ILE 67 HD11 ILE 67 -5.690 22.359 0.217 506 2HD1 ILE 67 HD12 ILE 67 -4.751 22.211 -1.275 507 3HD1 ILE 67 HD13 ILE 67 -5.869 23.567 -1.067 508 H ASP 68 H ASP 68 -7.071 19.302 1.340 509 HA ASP 68 HA ASP 68 -6.040 21.007 3.542 510 1HB ASP 68 HB2 ASP 68 -6.711 18.740 4.153 511 2HB ASP 68 HB3 ASP 68 -5.693 18.054 2.882 512 H SER 69 H SER 69 -4.402 22.285 2.901 513 HA SER 69 HA SER 69 -3.032 22.103 0.494 514 1HB SER 69 HB2 SER 69 -2.046 23.473 3.020 515 2HB SER 69 HB3 SER 69 -1.756 23.958 1.340 516 HG SER 69 HG SER 69 -3.420 25.180 2.416 517 H ASP 70 H ASP 70 -2.325 20.413 3.518 518 HA ASP 70 HA ASP 70 0.493 20.136 3.084 519 1HB ASP 70 HB2 ASP 70 -0.513 19.820 5.294 520 2HB ASP 70 HB3 ASP 70 -1.430 18.428 4.699 521 H ILE 71 H ILE 71 -2.333 18.204 2.137 522 HA ILE 71 HA ILE 71 -0.801 15.992 1.054 523 HB ILE 71 HB ILE 71 -3.666 16.883 0.560 524 1HG1 ILE 71 HG12 ILE 71 -2.488 14.596 2.209 525 2HG1 ILE 71 HG13 ILE 71 -3.151 16.095 2.869 526 1HG2 ILE 71 HG21 ILE 71 -3.996 14.674 -0.513 527 2HG2 ILE 71 HG22 ILE 71 -2.818 15.605 -1.403 528 3HG2 ILE 71 HG23 ILE 71 -2.263 14.311 -0.322 529 1HD1 ILE 71 HD11 ILE 71 -4.691 13.894 1.451 530 2HD1 ILE 71 HD12 ILE 71 -4.818 14.411 3.136 531 3HD1 ILE 71 HD13 ILE 71 -5.381 15.492 1.843 532 H LEU 72 H LEU 72 -2.347 18.939 -0.338 533 HA LEU 72 HA LEU 72 -1.590 18.544 -3.008 534 1HB LEU 72 HB2 LEU 72 -3.146 20.257 -2.262 535 2HB LEU 72 HB3 LEU 72 -1.902 21.090 -1.366 536 HG LEU 72 HG LEU 72 -1.130 20.772 -4.182 537 1HD1 LEU 72 HD11 LEU 72 -3.561 20.763 -4.581 538 2HD1 LEU 72 HD12 LEU 72 -3.744 22.242 -3.626 539 3HD1 LEU 72 HD13 LEU 72 -2.834 22.274 -5.156 540 1HD2 LEU 72 HD21 LEU 72 -0.855 23.233 -3.993 541 2HD2 LEU 72 HD22 LEU 72 -1.673 23.197 -2.423 542 3HD2 LEU 72 HD23 LEU 72 -0.118 22.378 -2.634 543 H ASN 73 H ASN 73 0.260 20.154 -0.378 544 HA ASN 73 HA ASN 73 2.468 20.808 -2.036 545 1HB ASN 73 HB2 ASN 73 1.962 20.830 0.942 546 2HB ASN 73 HB3 ASN 73 3.606 21.013 0.363 547 1HD2 ASN 73 HD22 ASN 73 0.349 22.462 0.091 548 2HD2 ASN 73 HD21 ASN 73 0.883 23.984 -0.608 549 H ASN 74 H ASN 74 1.647 17.646 -1.162 550 HA ASN 74 HA ASN 74 4.443 16.865 -1.740 551 1HB ASN 74 HB2 ASN 74 4.648 15.259 -0.134 552 2HB ASN 74 HB3 ASN 74 3.944 16.607 0.765 553 1HD2 ASN 74 HD22 ASN 74 1.549 16.404 1.313 554 2HD2 ASN 74 HD21 ASN 74 0.947 14.773 1.524 555 H ALA 75 H ALA 75 1.345 16.738 -2.891 556 HA ALA 75 HA ALA 75 1.178 14.020 -3.723 557 1HB ALA 75 HB1 ALA 75 0.049 16.538 -5.019 558 2HB ALA 75 HB2 ALA 75 -0.463 14.867 -5.337 559 3HB ALA 75 HB3 ALA 75 -0.747 15.586 -3.743 560 H ASP 76 H ASP 76 1.755 13.128 -5.884 561 HA ASP 76 HA ASP 76 4.176 14.288 -7.097 562 1HB ASP 76 HB2 ASP 76 3.744 11.825 -7.223 563 2HB ASP 76 HB3 ASP 76 2.268 12.147 -8.149 564 H LEU 77 H LEU 77 0.675 14.253 -7.513 565 HA LEU 77 HA LEU 77 0.782 16.323 -9.609 566 1HB LEU 77 HB2 LEU 77 0.782 14.252 -10.794 567 2HB LEU 77 HB3 LEU 77 -0.445 13.565 -9.726 568 HG LEU 77 HG LEU 77 -2.121 15.160 -10.616 569 1HD1 LEU 77 HD11 LEU 77 -1.773 16.420 -12.621 570 2HD1 LEU 77 HD12 LEU 77 -0.490 16.915 -11.520 571 3HD1 LEU 77 HD13 LEU 77 -0.142 15.780 -12.843 572 1HD2 LEU 77 HD21 LEU 77 -0.699 13.436 -12.662 573 2HD2 LEU 77 HD22 LEU 77 -1.870 12.859 -11.464 574 3HD2 LEU 77 HD23 LEU 77 -2.398 13.956 -12.748 575 H VAL 78 H VAL 78 -0.930 17.629 -9.626 576 HA VAL 78 HA VAL 78 -3.284 17.070 -7.885 577 HB VAL 78 HB VAL 78 -2.064 19.774 -8.602 578 1HG1 VAL 78 HG11 VAL 78 -3.726 20.706 -7.025 579 2HG1 VAL 78 HG12 VAL 78 -4.535 19.883 -8.355 580 3HG1 VAL 78 HG13 VAL 78 -4.418 19.082 -6.774 581 1HG2 VAL 78 HG21 VAL 78 -2.146 18.366 -5.895 582 2HG2 VAL 78 HG22 VAL 78 -0.704 18.578 -6.908 583 3HG2 VAL 78 HG23 VAL 78 -1.498 19.993 -6.250 584 H VAL 79 H VAL 79 -5.248 17.158 -9.030 585 HA VAL 79 HA VAL 79 -5.072 17.944 -11.918 586 HB VAL 79 HB VAL 79 -6.706 15.677 -10.735 587 1HG1 VAL 79 HG11 VAL 79 -7.180 15.167 -13.142 588 2HG1 VAL 79 HG12 VAL 79 -7.805 16.749 -12.669 589 3HG1 VAL 79 HG13 VAL 79 -6.296 16.640 -13.604 590 1HG2 VAL 79 HG21 VAL 79 -5.232 14.216 -12.146 591 2HG2 VAL 79 HG22 VAL 79 -4.178 15.619 -12.426 592 3HG2 VAL 79 HG23 VAL 79 -4.404 14.966 -10.782 593 H THR 80 H THR 80 -6.075 19.796 -12.099 594 HA THR 80 HA THR 80 -8.276 20.508 -10.266 595 HB THR 80 HB THR 80 -8.026 22.760 -11.274 596 HG1 THR 80 HG1 THR 80 -5.828 21.536 -12.618 597 1HG2 THR 80 HG21 THR 80 -6.873 22.242 -9.187 598 2HG2 THR 80 HG22 THR 80 -5.515 21.506 -10.062 599 3HG2 THR 80 HG23 THR 80 -5.821 23.240 -10.205 600 H LEU 81 H LEU 81 -10.091 19.526 -10.854 601 HA LEU 81 HA LEU 81 -10.483 18.569 -13.545 602 1HB LEU 81 HB2 LEU 81 -12.174 18.539 -11.034 603 2HB LEU 81 HB3 LEU 81 -12.748 17.832 -12.543 604 HG LEU 81 HG LEU 81 -10.136 17.006 -11.201 605 1HD1 LEU 81 HD11 LEU 81 -12.090 16.557 -9.751 606 2HD1 LEU 81 HD12 LEU 81 -12.853 15.651 -11.082 607 3HD1 LEU 81 HD13 LEU 81 -11.340 15.074 -10.353 608 1HD2 LEU 81 HD21 LEU 81 -10.403 14.969 -12.639 609 2HD2 LEU 81 HD22 LEU 81 -11.803 15.730 -13.424 610 3HD2 LEU 81 HD23 LEU 81 -10.191 16.433 -13.601 611 H CYS 82 H CYS 82 -11.126 21.682 -12.304 612 HA CYS 82 HA CYS 82 -12.413 22.216 -14.791 613 1HB CYS 82 HB2 CYS 82 -14.406 23.292 -14.051 614 2HB CYS 82 HB3 CYS 82 -14.363 21.685 -13.291 615 HG CYS 82 HG CYS 82 -13.542 22.388 -11.013 616 H GLY 83 H GLY 83 -12.389 24.589 -15.262 617 1HA GLY 83 HA1 GLY 83 -9.779 25.480 -14.756 618 2HA GLY 83 HA2 GLY 83 -11.064 26.415 -15.540 619 H ASP 84 H ASP 84 -12.911 26.677 -13.401 620 HA ASP 84 HA ASP 84 -11.775 28.914 -12.062 621 1HB ASP 84 HB2 ASP 84 -14.194 28.641 -12.532 622 2HB ASP 84 HB3 ASP 84 -14.277 27.347 -11.329 623 H ALA 85 H ALA 85 -12.063 25.506 -11.109 624 HA ALA 85 HA ALA 85 -11.532 25.850 -8.328 625 1HB ALA 85 HB1 ALA 85 -11.039 23.476 -8.329 626 2HB ALA 85 HB2 ALA 85 -12.440 23.751 -9.363 627 3HB ALA 85 HB3 ALA 85 -10.844 23.451 -10.088 628 H ALA 86 H ALA 86 -9.409 25.888 -11.159 629 HA ALA 86 HA ALA 86 -7.042 25.043 -9.847 630 1HB ALA 86 HB1 ALA 86 -5.899 25.831 -11.834 631 2HB ALA 86 HB2 ALA 86 -7.417 25.033 -12.311 632 3HB ALA 86 HB3 ALA 86 -7.298 26.813 -12.309 633 H ASP 87 H ASP 87 -8.707 28.078 -9.560 634 HA ASP 87 HA ASP 87 -6.516 29.759 -8.850 635 1HB ASP 87 HB2 ASP 87 -8.785 30.615 -9.230 636 2HB ASP 87 HB3 ASP 87 -9.385 29.687 -7.848 637 H LYS 88 H LYS 88 -8.224 27.174 -7.139 638 HA LYS 88 HA LYS 88 -7.078 27.931 -4.537 639 1HB LYS 88 HB2 LYS 88 -9.508 27.229 -4.929 640 2HB LYS 88 HB3 LYS 88 -8.892 25.604 -5.228 641 1HG LYS 88 HG2 LYS 88 -9.621 25.607 -3.013 642 2HG LYS 88 HG3 LYS 88 -7.859 25.698 -2.896 643 1HD LYS 88 HD2 LYS 88 -7.971 28.099 -2.404 644 2HD LYS 88 HD3 LYS 88 -9.735 28.093 -2.668 645 1HE LYS 88 HE2 LYS 88 -10.002 26.434 -0.855 646 2HE LYS 88 HE3 LYS 88 -8.258 26.428 -0.581 647 1HZ LYS 88 HZ1 LYS 88 -8.417 28.775 0.057 648 2HZ LYS 88 HZ2 LYS 88 -10.032 28.779 -0.195 649 3HZ LYS 88 HZ3 LYS 88 -9.393 27.874 0.997 650 H CYS 89 H CYS 89 -4.930 27.507 -5.852 651 HA CYS 89 HA CYS 89 -4.023 24.733 -5.164 652 1HB CYS 89 HB2 CYS 89 -3.045 26.473 -7.455 653 2HB CYS 89 HB3 CYS 89 -2.333 24.937 -6.930 654 HG CYS 89 HG CYS 89 -5.205 25.680 -8.287 655 HA PRO 90 HA PRO 90 -1.826 27.822 -2.526 656 1HB PRO 90 HB2 PRO 90 -1.930 26.507 -0.134 657 2HB PRO 90 HB3 PRO 90 -3.285 27.456 -0.805 658 1HG PRO 90 HG2 PRO 90 -2.853 24.469 -0.993 659 2HG PRO 90 HG3 PRO 90 -4.340 25.341 -0.492 660 1HD PRO 90 HD2 PRO 90 -4.003 24.418 -3.025 661 2HD PRO 90 HD3 PRO 90 -4.837 25.962 -2.699 662 H MET 91 H MET 91 -0.325 26.988 -4.187 663 HA MET 91 HA MET 91 1.843 26.823 -4.642 664 1HB MET 91 HB2 MET 91 2.370 25.912 -1.793 665 2HB MET 91 HB3 MET 91 3.571 26.342 -3.006 666 1HG MET 91 HG2 MET 91 2.622 28.630 -3.144 667 2HG MET 91 HG3 MET 91 1.450 28.213 -1.887 668 1HE MET 91 HE1 MET 91 3.320 30.766 -1.756 669 2HE MET 91 HE2 MET 91 2.145 30.330 -0.494 670 3HE MET 91 HE3 MET 91 3.820 30.721 -0.052 671 H THR 92 H THR 92 1.704 25.311 -6.246 672 HA THR 92 HA THR 92 2.284 22.491 -5.500 673 HB THR 92 HB THR 92 1.613 22.021 -7.860 674 HG1 THR 92 HG1 THR 92 1.881 24.157 -8.654 675 1HG2 THR 92 HG21 THR 92 0.037 21.804 -5.933 676 2HG2 THR 92 HG22 THR 92 -0.573 23.432 -6.304 677 3HG2 THR 92 HG23 THR 92 -0.740 22.115 -7.488 678 HA PRO 93 HA PRO 93 6.343 24.424 -6.728 679 1HB PRO 93 HB2 PRO 93 7.968 22.885 -5.119 680 2HB PRO 93 HB3 PRO 93 7.075 24.316 -4.530 681 1HG PRO 93 HG2 PRO 93 6.262 21.399 -4.354 682 2HG PRO 93 HG3 PRO 93 6.295 22.618 -3.037 683 1HD PRO 93 HD2 PRO 93 4.005 22.045 -4.356 684 2HD PRO 93 HD3 PRO 93 4.400 23.726 -3.885 685 HA PRO 94 HA PRO 94 7.637 21.601 -9.845 686 1HB PRO 94 HB2 PRO 94 10.304 21.220 -8.461 687 2HB PRO 94 HB3 PRO 94 9.974 21.462 -10.209 688 1HG PRO 94 HG2 PRO 94 10.756 23.563 -8.704 689 2HG PRO 94 HG3 PRO 94 9.387 23.763 -9.847 690 1HD PRO 94 HD2 PRO 94 9.305 23.345 -6.862 691 2HD PRO 94 HD3 PRO 94 8.317 24.438 -7.877 692 H HIS 95 H HIS 95 8.241 20.296 -6.582 693 HA HIS 95 HA HIS 95 8.423 17.531 -7.337 694 1HB HIS 95 HB2 HIS 95 7.509 18.765 -4.706 695 2HB HIS 95 HB3 HIS 95 8.071 17.114 -4.949 696 HD1 HIS 95 HD1 HIS 95 10.815 17.141 -6.055 697 HD2 HIS 95 HD2 HIS 95 9.336 20.338 -3.745 698 HE1 HIS 95 HE1 HIS 95 12.849 18.416 -5.211 699 H VAL 96 H VAL 96 5.803 19.638 -7.547 700 HA VAL 96 HA VAL 96 3.674 17.574 -7.350 701 HB VAL 96 HB VAL 96 3.567 20.483 -6.404 702 1HG1 VAL 96 HG11 VAL 96 1.431 19.921 -5.473 703 2HG1 VAL 96 HG12 VAL 96 1.431 19.475 -7.177 704 3HG1 VAL 96 HG13 VAL 96 1.613 18.216 -5.937 705 1HG2 VAL 96 HG21 VAL 96 3.458 19.695 -4.092 706 2HG2 VAL 96 HG22 VAL 96 3.907 18.067 -4.615 707 3HG2 VAL 96 HG23 VAL 96 5.035 19.414 -4.829 708 H LYS 97 H LYS 97 3.671 17.351 -9.649 709 HA LYS 97 HA LYS 97 3.580 19.740 -11.335 710 1HB LYS 97 HB2 LYS 97 3.535 18.317 -13.162 711 2HB LYS 97 HB3 LYS 97 4.533 17.463 -11.997 712 1HG LYS 97 HG2 LYS 97 2.134 16.321 -11.422 713 2HG LYS 97 HG3 LYS 97 1.836 16.808 -13.102 714 1HD LYS 97 HD2 LYS 97 4.000 15.603 -13.718 715 2HD LYS 97 HD3 LYS 97 4.073 15.049 -12.032 716 1HE LYS 97 HE2 LYS 97 1.614 14.191 -12.512 717 2HE LYS 97 HE3 LYS 97 2.076 14.321 -14.211 718 1HZ LYS 97 HZ1 LYS 97 2.546 12.116 -13.382 719 2HZ LYS 97 HZ2 LYS 97 3.996 12.836 -13.603 720 3HZ LYS 97 HZ3 LYS 97 3.366 12.685 -12.082 721 H ARG 98 H ARG 98 1.549 20.018 -12.747 722 HA ARG 98 HA ARG 98 -0.921 19.318 -11.310 723 1HB ARG 98 HB2 ARG 98 -0.253 21.339 -10.197 724 2HB ARG 98 HB3 ARG 98 -0.002 22.184 -11.733 725 1HG ARG 98 HG2 ARG 98 -2.318 22.303 -12.186 726 2HG ARG 98 HG3 ARG 98 -2.725 21.044 -11.024 727 1HD ARG 98 HD2 ARG 98 -3.320 23.443 -10.375 728 2HD ARG 98 HD3 ARG 98 -2.513 22.436 -9.178 729 HE ARG 98 HE ARG 98 -0.598 23.698 -9.259 730 1HH1 ARG 98 HH11 ARG 98 -2.685 24.962 -11.875 731 2HH1 ARG 98 HH12 ARG 98 -2.093 26.570 -11.698 732 1HH2 ARG 98 HH21 ARG 98 0.240 25.701 -9.152 733 2HH2 ARG 98 HH22 ARG 98 -0.295 26.995 -10.179 734 H GLU 99 H GLU 99 -2.742 19.336 -12.579 735 HA GLU 99 HA GLU 99 -2.410 19.880 -15.467 736 1HB GLU 99 HB2 GLU 99 -1.976 17.475 -14.925 737 2HB GLU 99 HB3 GLU 99 -3.573 17.363 -14.184 738 1HG GLU 99 HG2 GLU 99 -3.452 16.393 -16.447 739 2HG GLU 99 HG3 GLU 99 -4.651 17.682 -16.318 740 H HIS 100 H HIS 100 -4.567 20.110 -16.535 741 HA HIS 100 HA HIS 100 -6.638 21.195 -14.691 742 1HB HIS 100 HB2 HIS 100 -5.528 22.760 -17.046 743 2HB HIS 100 HB3 HIS 100 -6.618 23.318 -15.788 744 HD1 HIS 100 HD1 HIS 100 -2.873 22.629 -16.394 745 HD2 HIS 100 HD2 HIS 100 -5.497 24.311 -13.578 746 HE1 HIS 100 HE1 HIS 100 -1.417 23.842 -14.696 747 H TRP 101 H TRP 101 -8.694 20.915 -15.436 748 HA TRP 101 HA TRP 101 -9.196 20.538 -18.322 749 1HB TRP 101 HB2 TRP 101 -10.510 18.898 -16.131 750 2HB TRP 101 HB3 TRP 101 -10.647 18.710 -17.883 751 HD1 TRP 101 HD1 TRP 101 -8.570 17.665 -14.952 752 HE1 TRP 101 HE1 TRP 101 -6.627 16.169 -15.657 753 HE3 TRP 101 HE3 TRP 101 -8.868 18.301 -20.025 754 HZ2 TRP 101 HZ2 TRP 101 -5.371 15.305 -18.121 755 HZ3 TRP 101 HZ3 TRP 101 -7.282 17.127 -21.527 756 HH2 TRP 101 HH2 TRP 101 -5.541 15.624 -20.587 757 H GLY 102 H GLY 102 -12.002 20.468 -18.183 758 1HA GLY 102 HA1 GLY 102 -12.937 22.801 -16.659 759 2HA GLY 102 HA2 GLY 102 -12.523 23.142 -18.328 760 H PHE 103 H PHE 103 -14.585 20.971 -16.271 761 HA PHE 103 HA PHE 103 -16.740 21.587 -18.123 762 1HB PHE 103 HB2 PHE 103 -17.551 19.167 -18.091 763 2HB PHE 103 HB3 PHE 103 -16.344 19.676 -19.236 764 HD1 PHE 103 HD1 PHE 103 -13.782 19.245 -18.511 765 HD2 PHE 103 HD2 PHE 103 -17.225 17.036 -17.150 766 HE1 PHE 103 HE1 PHE 103 -12.320 17.342 -17.953 767 HE2 PHE 103 HE2 PHE 103 -15.782 15.057 -16.774 768 HZ PHE 103 HZ PHE 103 -13.326 15.201 -17.185 769 H ASP 104 H ASP 104 -18.800 21.273 -17.351 770 HA ASP 104 HA ASP 104 -19.021 22.522 -14.816 771 1HB ASP 104 HB2 ASP 104 -20.368 22.999 -16.871 772 2HB ASP 104 HB3 ASP 104 -21.175 21.440 -16.660 773 H ASP 105 H ASP 105 -20.656 21.960 -13.175 774 HA ASP 105 HA ASP 105 -20.004 19.332 -12.131 775 1HB ASP 105 HB2 ASP 105 -20.076 21.535 -10.824 776 2HB ASP 105 HB3 ASP 105 -21.823 21.393 -10.869 777 HA PRO 106 HA PRO 106 -23.722 17.673 -13.811 778 1HB PRO 106 HB2 PRO 106 -23.666 15.111 -12.786 779 2HB PRO 106 HB3 PRO 106 -22.525 15.690 -14.032 780 1HG PRO 106 HG2 PRO 106 -22.119 15.486 -11.035 781 2HG PRO 106 HG3 PRO 106 -21.004 14.972 -12.341 782 1HD PRO 106 HD2 PRO 106 -20.747 17.368 -11.036 783 2HD PRO 106 HD3 PRO 106 -20.347 17.199 -12.768 784 H ALA 107 H ALA 107 -23.391 17.641 -10.272 785 HA ALA 107 HA ALA 107 -25.859 16.365 -9.745 786 1HB ALA 107 HB1 ALA 107 -25.532 17.185 -7.440 787 2HB ALA 107 HB2 ALA 107 -24.051 16.488 -8.127 788 3HB ALA 107 HB3 ALA 107 -24.234 18.258 -8.002 789 H ARG 108 H ARG 108 -25.394 19.515 -10.932 790 HA ARG 108 HA ARG 108 -28.082 20.335 -10.020 791 1HB ARG 108 HB2 ARG 108 -27.300 22.723 -10.101 792 2HB ARG 108 HB3 ARG 108 -26.874 21.737 -8.730 793 1HG ARG 108 HG2 ARG 108 -24.922 22.090 -11.021 794 2HG ARG 108 HG3 ARG 108 -25.098 23.337 -9.786 795 1HD ARG 108 HD2 ARG 108 -24.441 20.437 -9.155 796 2HD ARG 108 HD3 ARG 108 -23.239 21.723 -9.348 797 HE ARG 108 HE ARG 108 -25.127 22.541 -7.412 798 1HH1 ARG 108 HH21 ARG 108 -22.487 20.139 -7.811 799 2HH1 ARG 108 HH22 ARG 108 -22.053 20.213 -6.119 800 1HH2 ARG 108 HH11 ARG 108 -24.527 22.493 -5.156 801 2HH2 ARG 108 HH12 ARG 108 -23.204 21.481 -4.653 802 H ALA 109 H ALA 109 -26.764 19.066 -12.614 803 HA ALA 109 HA ALA 109 -27.496 20.783 -14.770 804 1HB ALA 109 HB1 ALA 109 -27.543 17.739 -14.451 805 2HB ALA 109 HB2 ALA 109 -27.644 18.617 -15.992 806 3HB ALA 109 HB3 ALA 109 -26.152 18.700 -15.020 807 H GLN 110 H GLN 110 -29.568 20.956 -15.747 808 HA GLN 110 HA GLN 110 -31.905 19.709 -14.393 809 1HB GLN 110 HB2 GLN 110 -31.222 22.672 -14.563 810 2HB GLN 110 HB3 GLN 110 -32.894 22.140 -14.420 811 1HG GLN 110 HG2 GLN 110 -32.586 21.215 -12.269 812 2HG GLN 110 HG3 GLN 110 -30.835 21.203 -12.404 813 1HE2 GLN 110 HE22 GLN 110 -29.616 23.052 -12.011 814 2HE2 GLN 110 HE21 GLN 110 -30.313 24.526 -11.353 815 H GLY 111 H GLY 111 -33.896 20.113 -15.596 816 1HA GLY 111 HA1 GLY 111 -34.575 21.359 -17.822 817 2HA GLY 111 HA2 GLY 111 -33.572 20.068 -18.526 818 H THR 112 H THR 112 -34.009 17.927 -17.001 819 HA THR 112 HA THR 112 -36.580 17.442 -15.992 820 HB THR 112 HB THR 112 -37.370 17.280 -18.249 821 HG1 THR 112 HG1 THR 112 -38.179 15.282 -18.171 822 1HG2 THR 112 HG21 THR 112 -35.359 16.992 -19.560 823 2HG2 THR 112 HG22 THR 112 -35.059 15.398 -18.832 824 3HG2 THR 112 HG23 THR 112 -36.458 15.651 -19.897 825 H GLU 113 H GLU 113 -36.545 15.025 -15.250 826 HA GLU 113 HA GLU 113 -34.141 14.697 -13.772 827 1HB GLU 113 HB2 GLU 113 -36.277 13.855 -12.975 828 2HB GLU 113 HB3 GLU 113 -36.432 12.775 -14.370 829 1HG GLU 113 HG2 GLU 113 -34.515 11.455 -13.638 830 2HG GLU 113 HG3 GLU 113 -34.182 12.587 -12.321 831 H GLU 114 H GLU 114 -35.273 13.179 -16.786 832 HA GLU 114 HA GLU 114 -33.050 11.388 -16.950 833 1HB GLU 114 HB2 GLU 114 -33.785 10.897 -19.211 834 2HB GLU 114 HB3 GLU 114 -35.134 10.878 -18.076 835 1HG GLU 114 HG2 GLU 114 -35.835 13.123 -18.853 836 2HG GLU 114 HG3 GLU 114 -34.473 13.167 -19.981 837 H GLU 115 H GLU 115 -33.443 14.769 -17.872 838 HA GLU 115 HA GLU 115 -31.131 14.824 -19.601 839 1HB GLU 115 HB2 GLU 115 -33.027 16.443 -19.789 840 2HB GLU 115 HB3 GLU 115 -32.588 17.108 -18.215 841 1HG GLU 115 HG2 GLU 115 -31.713 18.569 -19.862 842 2HG GLU 115 HG3 GLU 115 -30.338 17.731 -19.161 843 H LYS 116 H LYS 116 -31.911 15.685 -16.209 844 HA LYS 116 HA LYS 116 -29.340 16.501 -15.376 845 1HB LYS 116 HB2 LYS 116 -31.273 16.952 -14.032 846 2HB LYS 116 HB3 LYS 116 -31.701 15.244 -13.942 847 1HG LYS 116 HG2 LYS 116 -29.779 14.741 -12.591 848 2HG LYS 116 HG3 LYS 116 -29.170 16.402 -12.706 849 1HD LYS 116 HD2 LYS 116 -31.933 15.853 -11.594 850 2HD LYS 116 HD3 LYS 116 -30.498 15.531 -10.597 851 1HE LYS 116 HE2 LYS 116 -29.768 17.906 -10.969 852 2HE LYS 116 HE3 LYS 116 -31.295 18.200 -11.806 853 1HZ LYS 116 HZ1 LYS 116 -31.039 17.366 -8.971 854 2HZ LYS 116 HZ2 LYS 116 -31.433 18.858 -9.490 855 3HZ LYS 116 HZ3 LYS 116 -32.459 17.618 -9.744 856 H TRP 117 H TRP 117 -30.834 13.233 -15.288 857 HA TRP 117 HA TRP 117 -28.498 11.932 -14.305 858 1HB TRP 117 HB2 TRP 117 -30.712 10.875 -14.248 859 2HB TRP 117 HB3 TRP 117 -30.748 10.802 -16.011 860 HD1 TRP 117 HD1 TRP 117 -29.252 8.972 -17.202 861 HE1 TRP 117 HE1 TRP 117 -28.044 6.854 -16.403 862 HE3 TRP 117 HE3 TRP 117 -29.328 9.837 -12.156 863 HZ2 TRP 117 HZ2 TRP 117 -27.000 5.818 -13.952 864 HZ3 TRP 117 HZ3 TRP 117 -28.095 8.335 -10.620 865 HH2 TRP 117 HH2 TRP 117 -26.913 6.324 -11.502 866 H ALA 118 H ALA 118 -29.596 12.528 -17.720 867 HA ALA 118 HA ALA 118 -27.477 11.130 -18.946 868 1HB ALA 118 HB1 ALA 118 -28.912 13.642 -19.912 869 2HB ALA 118 HB2 ALA 118 -27.913 12.565 -20.908 870 3HB ALA 118 HB3 ALA 118 -29.422 11.963 -20.195 871 H PHE 119 H PHE 119 -27.588 14.490 -17.663 872 HA PHE 119 HA PHE 119 -24.977 15.185 -18.523 873 1HB PHE 119 HB2 PHE 119 -26.959 16.605 -17.481 874 2HB PHE 119 HB3 PHE 119 -26.112 16.291 -15.974 875 HD1 PHE 119 HD1 PHE 119 -23.569 16.954 -15.892 876 HD2 PHE 119 HD2 PHE 119 -26.285 18.316 -18.951 877 HE1 PHE 119 HE1 PHE 119 -22.049 18.850 -16.394 878 HE2 PHE 119 HE2 PHE 119 -24.750 20.193 -19.471 879 HZ PHE 119 HZ PHE 119 -22.632 20.463 -18.201 880 H PHE 120 H PHE 120 -26.123 13.520 -15.509 881 HA PHE 120 HA PHE 120 -23.612 13.334 -14.200 882 1HB PHE 120 HB2 PHE 120 -25.633 11.076 -14.293 883 2HB PHE 120 HB3 PHE 120 -24.356 11.325 -13.148 884 HD1 PHE 120 HD1 PHE 120 -25.724 14.579 -13.290 885 HD2 PHE 120 HD2 PHE 120 -26.678 10.559 -12.043 886 HE1 PHE 120 HE1 PHE 120 -27.283 15.463 -11.608 887 HE2 PHE 120 HE2 PHE 120 -28.324 11.461 -10.424 888 HZ PHE 120 HZ PHE 120 -28.605 13.920 -10.177 889 H GLN 121 H GLN 121 -25.130 11.167 -16.671 890 HA GLN 121 HA GLN 121 -22.950 9.364 -16.830 891 1HB GLN 121 HB2 GLN 121 -24.967 10.069 -19.005 892 2HB GLN 121 HB3 GLN 121 -23.911 8.666 -19.005 893 1HG GLN 121 HG2 GLN 121 -26.112 9.201 -16.964 894 2HG GLN 121 HG3 GLN 121 -26.224 8.122 -18.340 895 1HE2 GLN 121 HE22 GLN 121 -25.097 8.452 -15.050 896 2HE2 GLN 121 HE21 GLN 121 -24.400 6.855 -14.914 897 H ARG 122 H ARG 122 -23.585 12.318 -18.757 898 HA ARG 122 HA ARG 122 -21.339 12.027 -20.490 899 1HB ARG 122 HB2 ARG 122 -23.029 14.395 -19.628 900 2HB ARG 122 HB3 ARG 122 -21.485 14.697 -20.409 901 1HG ARG 122 HG2 ARG 122 -23.048 14.750 -22.141 902 2HG ARG 122 HG3 ARG 122 -22.163 13.235 -22.322 903 1HD ARG 122 HD2 ARG 122 -24.109 12.059 -21.185 904 2HD ARG 122 HD3 ARG 122 -24.945 13.614 -21.146 905 HE ARG 122 HE ARG 122 -25.327 13.541 -23.416 906 1HH1 ARG 122 HH21 ARG 122 -23.293 10.770 -22.517 907 2HH1 ARG 122 HH22 ARG 122 -23.511 9.944 -24.014 908 1HH2 ARG 122 HH11 ARG 122 -25.619 12.440 -25.407 909 2HH2 ARG 122 HH12 ARG 122 -24.866 10.918 -25.689 910 H VAL 123 H VAL 123 -21.593 13.819 -17.349 911 HA VAL 123 HA VAL 123 -18.830 14.559 -17.434 912 HB VAL 123 HB VAL 123 -20.767 14.359 -15.097 913 1HG1 VAL 123 HG11 VAL 123 -17.977 15.598 -15.228 914 2HG1 VAL 123 HG12 VAL 123 -19.139 15.877 -13.925 915 3HG1 VAL 123 HG13 VAL 123 -18.495 14.259 -14.182 916 1HG2 VAL 123 HG21 VAL 123 -19.743 16.740 -16.732 917 2HG2 VAL 123 HG22 VAL 123 -21.365 16.042 -16.848 918 3HG2 VAL 123 HG23 VAL 123 -20.849 16.834 -15.354 919 H ARG 124 H ARG 124 -20.484 11.655 -16.040 920 HA ARG 124 HA ARG 124 -18.223 10.544 -14.799 921 1HB ARG 124 HB2 ARG 124 -20.858 9.706 -15.200 922 2HB ARG 124 HB3 ARG 124 -20.004 8.666 -16.344 923 1HG ARG 124 HG2 ARG 124 -18.545 7.939 -14.395 924 2HG ARG 124 HG3 ARG 124 -19.608 8.837 -13.337 925 1HD ARG 124 HD2 ARG 124 -20.133 6.409 -13.478 926 2HD ARG 124 HD3 ARG 124 -21.497 7.459 -13.914 927 HE ARG 124 HE ARG 124 -20.025 6.653 -16.246 928 1HH1 ARG 124 HH21 ARG 124 -22.303 5.273 -13.901 929 2HH1 ARG 124 HH22 ARG 124 -23.220 4.425 -15.109 930 1HH2 ARG 124 HH11 ARG 124 -21.163 5.428 -17.811 931 2HH2 ARG 124 HH12 ARG 124 -22.562 4.538 -17.364 932 H ASP 125 H ASP 125 -19.410 10.114 -18.133 933 HA ASP 125 HA ASP 125 -17.388 8.354 -18.999 934 1HB ASP 125 HB2 ASP 125 -19.476 8.674 -20.230 935 2HB ASP 125 HB3 ASP 125 -19.048 10.351 -20.585 936 H GLU 126 H GLU 126 -17.536 11.969 -19.094 937 HA GLU 126 HA GLU 126 -15.032 12.079 -20.465 938 1HB GLU 126 HB2 GLU 126 -16.804 14.185 -19.220 939 2HB GLU 126 HB3 GLU 126 -15.259 14.594 -19.967 940 1HG GLU 126 HG2 GLU 126 -17.415 13.049 -21.469 941 2HG GLU 126 HG3 GLU 126 -17.353 14.804 -21.413 942 H ILE 127 H ILE 127 -15.851 12.080 -17.004 943 HA ILE 127 HA ILE 127 -13.204 12.937 -16.185 944 HB ILE 127 HB ILE 127 -15.651 12.370 -14.880 945 1HG1 ILE 127 HG12 ILE 127 -14.394 12.948 -12.754 946 2HG1 ILE 127 HG13 ILE 127 -12.933 13.088 -13.747 947 1HG2 ILE 127 HG21 ILE 127 -15.177 10.082 -14.640 948 2HG2 ILE 127 HG22 ILE 127 -13.627 10.425 -13.822 949 3HG2 ILE 127 HG23 ILE 127 -15.182 10.876 -13.073 950 1HD1 ILE 127 HD11 ILE 127 -13.931 14.892 -14.997 951 2HD1 ILE 127 HD12 ILE 127 -15.541 14.582 -14.287 952 3HD1 ILE 127 HD13 ILE 127 -14.224 15.239 -13.286 953 H GLY 128 H GLY 128 -14.798 9.771 -16.840 954 1HA GLY 128 HA1 GLY 128 -12.573 8.134 -16.233 955 2HA GLY 128 HA2 GLY 128 -13.944 7.709 -17.281 956 H ASN 129 H ASN 129 -13.702 9.507 -19.349 957 HA ASN 129 HA ASN 129 -11.706 8.482 -21.037 958 1HB ASN 129 HB2 ASN 129 -13.837 9.557 -21.734 959 2HB ASN 129 HB3 ASN 129 -13.211 11.111 -21.183 960 1HD2 ASN 129 HD22 ASN 129 -13.679 11.889 -23.307 961 2HD2 ASN 129 HD21 ASN 129 -12.671 11.443 -24.682 962 H ARG 130 H ARG 130 -11.699 11.433 -19.005 963 HA ARG 130 HA ARG 130 -9.201 12.470 -19.920 964 1HB ARG 130 HB2 ARG 130 -11.091 13.073 -17.769 965 2HB ARG 130 HB3 ARG 130 -9.507 12.913 -17.067 966 1HG ARG 130 HG2 ARG 130 -9.747 15.169 -17.551 967 2HG ARG 130 HG3 ARG 130 -8.628 14.555 -18.771 968 1HD ARG 130 HD2 ARG 130 -11.615 14.992 -19.199 969 2HD ARG 130 HD3 ARG 130 -10.391 16.191 -19.581 970 HE ARG 130 HE ARG 130 -9.388 14.610 -21.190 971 1HH1 ARG 130 HH21 ARG 130 -12.758 13.991 -20.269 972 2HH1 ARG 130 HH22 ARG 130 -13.268 13.549 -21.868 973 1HH2 ARG 130 HH11 ARG 130 -9.908 13.410 -23.076 974 2HH2 ARG 130 HH12 ARG 130 -11.566 13.021 -23.418 975 H LEU 131 H LEU 131 -10.017 10.211 -17.294 976 HA LEU 131 HA LEU 131 -7.281 9.953 -16.474 977 1HB LEU 131 HB2 LEU 131 -9.798 8.389 -15.811 978 2HB LEU 131 HB3 LEU 131 -8.254 8.103 -14.993 979 HG LEU 131 HG LEU 131 -9.442 10.918 -15.144 980 1HD1 LEU 131 HD11 LEU 131 -11.172 9.588 -14.192 981 2HD1 LEU 131 HD12 LEU 131 -10.031 8.832 -13.046 982 3HD1 LEU 131 HD13 LEU 131 -10.409 10.566 -12.933 983 1HD2 LEU 131 HD21 LEU 131 -7.479 9.618 -13.222 984 2HD2 LEU 131 HD22 LEU 131 -7.074 10.767 -14.512 985 3HD2 LEU 131 HD23 LEU 131 -8.084 11.295 -13.179 986 H LYS 132 H LYS 132 -9.340 8.046 -18.655 987 HA LYS 132 HA LYS 132 -7.473 5.988 -19.190 988 1HB LYS 132 HB2 LYS 132 -9.559 5.531 -19.975 989 2HB LYS 132 HB3 LYS 132 -9.891 7.147 -20.524 990 1HG LYS 132 HG2 LYS 132 -7.888 5.417 -22.017 991 2HG LYS 132 HG3 LYS 132 -9.625 5.182 -22.205 992 1HD LYS 132 HD2 LYS 132 -9.451 7.915 -22.540 993 2HD LYS 132 HD3 LYS 132 -7.913 7.384 -23.236 994 1HE LYS 132 HE2 LYS 132 -9.066 5.936 -24.811 995 2HE LYS 132 HE3 LYS 132 -10.606 6.170 -23.970 996 1HZ LYS 132 HZ1 LYS 132 -10.529 7.549 -25.913 997 2HZ LYS 132 HZ2 LYS 132 -10.532 8.516 -24.590 998 3HZ LYS 132 HZ3 LYS 132 -9.146 8.275 -25.448 999 H GLU 133 H GLU 133 -7.861 9.180 -20.873 1000 HA GLU 133 HA GLU 133 -5.585 8.707 -22.577 1001 1HB GLU 133 HB2 GLU 133 -6.794 11.313 -21.548 1002 2HB GLU 133 HB3 GLU 133 -5.482 11.211 -22.735 1003 1HG GLU 133 HG2 GLU 133 -6.945 9.933 -24.264 1004 2HG GLU 133 HG3 GLU 133 -8.291 10.102 -23.136 1005 H PHE 134 H PHE 134 -5.863 10.385 -19.405 1006 HA PHE 134 HA PHE 134 -3.169 11.135 -19.216 1007 1HB PHE 134 HB2 PHE 134 -4.828 12.021 -17.771 1008 2HB PHE 134 HB3 PHE 134 -5.304 10.416 -17.214 1009 HD1 PHE 134 HD1 PHE 134 -4.283 9.346 -15.404 1010 HD2 PHE 134 HD2 PHE 134 -2.627 12.992 -16.990 1011 HE1 PHE 134 HE1 PHE 134 -2.726 9.489 -13.461 1012 HE2 PHE 134 HE2 PHE 134 -1.064 13.120 -15.073 1013 HZ PHE 134 HZ PHE 134 -1.131 11.367 -13.308 1014 H ALA 135 H ALA 135 -4.696 8.016 -18.424 1015 HA ALA 135 HA ALA 135 -2.316 6.847 -17.334 1016 1HB ALA 135 HB1 ALA 135 -4.545 6.031 -16.735 1017 2HB ALA 135 HB2 ALA 135 -4.838 5.528 -18.414 1018 3HB ALA 135 HB3 ALA 135 -3.576 4.732 -17.453 1019 H GLU 136 H GLU 136 -3.958 6.571 -20.495 1020 HA GLU 136 HA GLU 136 -2.152 4.661 -21.591 1021 1HB GLU 136 HB2 GLU 136 -4.223 6.506 -22.826 1022 2HB GLU 136 HB3 GLU 136 -3.280 5.379 -23.790 1023 1HG GLU 136 HG2 GLU 136 -5.026 4.503 -21.448 1024 2HG GLU 136 HG3 GLU 136 -5.564 4.553 -23.121 1025 H THR 137 H THR 137 -2.311 8.197 -21.833 1026 HA THR 137 HA THR 137 -0.100 8.250 -23.661 1027 HB THR 137 HB THR 137 -0.475 10.586 -23.816 1028 HG1 THR 137 HG1 THR 137 -2.457 10.285 -21.828 1029 1HG2 THR 137 HG21 THR 137 -2.792 10.568 -24.639 1030 2HG2 THR 137 HG22 THR 137 -1.946 9.071 -25.091 1031 3HG2 THR 137 HG23 THR 137 -3.115 9.054 -23.766 1032 H GLY 138 H GLY 138 -0.558 8.322 -20.225 1033 1HA GLY 138 HA1 GLY 138 0.768 8.668 -18.438 1034 2HA GLY 138 HA2 GLY 138 2.199 8.473 -19.485 1035 H LYS 139 H LYS 139 -0.499 10.796 -19.634 1036 HA LYS 139 HA LYS 139 0.951 12.890 -20.627 1037 1HB LYS 139 HB2 LYS 139 -1.596 12.504 -20.377 1038 2HB LYS 139 HB3 LYS 139 -1.458 13.350 -18.839 1039 1HG LYS 139 HG2 LYS 139 -0.615 15.340 -19.909 1040 2HG LYS 139 HG3 LYS 139 -0.428 14.514 -21.458 1041 1HD LYS 139 HD2 LYS 139 -3.038 15.208 -20.062 1042 2HD LYS 139 HD3 LYS 139 -2.391 15.945 -21.519 1043 1HE LYS 139 HE2 LYS 139 -3.535 13.136 -21.203 1044 2HE LYS 139 HE3 LYS 139 -4.182 14.477 -22.149 1045 1HZ LYS 139 HZ1 LYS 139 -2.067 14.259 -23.512 1046 2HZ LYS 139 HZ2 LYS 139 -1.838 12.801 -22.755 1047 3HZ LYS 139 HZ3 LYS 139 -3.158 13.056 -23.659 Start of MODEL 14 1 1H MET 1 H1 MET 1 1.852 -0.424 -2.439 2 2H MET 1 H2 MET 1 3.405 -0.084 -2.021 3 3H MET 1 H3 MET 1 2.653 -1.405 -1.403 4 HA MET 1 HA MET 1 1.042 -0.026 -0.287 5 1HB MET 1 HB2 MET 1 3.099 -0.856 0.879 6 2HB MET 1 HB3 MET 1 3.880 0.694 0.553 7 1HG MET 1 HG2 MET 1 2.027 1.832 1.793 8 2HG MET 1 HG3 MET 1 1.308 0.265 2.140 9 1HE MET 1 HE1 MET 1 2.177 -1.439 3.892 10 2HE MET 1 HE2 MET 1 3.710 -1.637 3.007 11 3HE MET 1 HE3 MET 1 3.727 -1.307 4.750 12 H GLU 2 H GLU 2 3.830 2.238 -1.025 13 HA GLU 2 HA GLU 2 1.903 4.185 -2.138 14 1HB GLU 2 HB2 GLU 2 3.984 4.791 0.019 15 2HB GLU 2 HB3 GLU 2 3.036 5.988 -0.868 16 1HG GLU 2 HG2 GLU 2 0.948 5.018 0.118 17 2HG GLU 2 HG3 GLU 2 1.934 3.909 1.063 18 H ASN 3 H ASN 3 3.007 5.602 -3.654 19 HA ASN 3 HA ASN 3 5.845 5.399 -4.071 20 1HB ASN 3 HB2 ASN 3 5.451 3.325 -5.147 21 2HB ASN 3 HB3 ASN 3 4.028 3.919 -5.973 22 1HD2 ASN 3 HD22 ASN 3 4.278 4.862 -7.993 23 2HD2 ASN 3 HD21 ASN 3 5.847 5.116 -8.762 24 H LYS 4 H LYS 4 2.731 6.333 -5.539 25 HA LYS 4 HA LYS 4 3.804 9.095 -5.854 26 1HB LYS 4 HB2 LYS 4 2.217 7.493 -7.907 27 2HB LYS 4 HB3 LYS 4 2.258 9.254 -7.921 28 1HG LYS 4 HG2 LYS 4 4.682 9.284 -8.184 29 2HG LYS 4 HG3 LYS 4 4.749 7.523 -8.119 30 1HD LYS 4 HD2 LYS 4 3.356 9.174 -10.275 31 2HD LYS 4 HD3 LYS 4 4.915 8.337 -10.415 32 1HE LYS 4 HE2 LYS 4 3.644 6.184 -9.801 33 2HE LYS 4 HE3 LYS 4 2.157 7.098 -10.050 34 1HZ LYS 4 HZ1 LYS 4 2.992 5.779 -11.998 35 2HZ LYS 4 HZ2 LYS 4 2.720 7.372 -12.337 36 3HZ LYS 4 HZ3 LYS 4 4.247 6.806 -12.135 37 H ILE 5 H ILE 5 1.935 10.659 -5.986 38 HA ILE 5 HA ILE 5 -0.572 9.688 -4.763 39 HB ILE 5 HB ILE 5 1.227 11.916 -3.724 40 1HG1 ILE 5 HG12 ILE 5 -0.302 9.775 -2.214 41 2HG1 ILE 5 HG13 ILE 5 1.357 9.568 -2.783 42 1HG2 ILE 5 HG21 ILE 5 -0.700 12.715 -2.322 43 2HG2 ILE 5 HG22 ILE 5 -1.021 12.944 -4.030 44 3HG2 ILE 5 HG23 ILE 5 -1.768 11.584 -3.191 45 1HD1 ILE 5 HD11 ILE 5 2.062 11.529 -1.436 46 2HD1 ILE 5 HD12 ILE 5 0.420 11.617 -0.746 47 3HD1 ILE 5 HD13 ILE 5 1.419 10.186 -0.471 48 H ILE 6 H ILE 6 -2.292 10.517 -5.823 49 HA ILE 6 HA ILE 6 -1.883 12.837 -7.615 50 HB ILE 6 HB ILE 6 -2.008 11.027 -9.097 51 1HG1 ILE 6 HG12 ILE 6 -4.771 12.315 -8.938 52 2HG1 ILE 6 HG13 ILE 6 -3.327 13.044 -9.641 53 1HG2 ILE 6 HG21 ILE 6 -3.746 9.311 -9.135 54 2HG2 ILE 6 HG22 ILE 6 -2.918 9.276 -7.587 55 3HG2 ILE 6 HG23 ILE 6 -4.521 10.042 -7.716 56 1HD1 ILE 6 HD11 ILE 6 -4.655 12.203 -11.440 57 2HD1 ILE 6 HD12 ILE 6 -3.270 11.096 -11.292 58 3HD1 ILE 6 HD13 ILE 6 -4.856 10.622 -10.663 59 H TYR 7 H TYR 7 -3.385 14.442 -7.224 60 HA TYR 7 HA TYR 7 -5.457 13.903 -5.153 61 1HB TYR 7 HB2 TYR 7 -3.295 14.826 -4.337 62 2HB TYR 7 HB3 TYR 7 -3.538 16.242 -5.346 63 HD1 TYR 7 HD1 TYR 7 -5.922 14.346 -3.052 64 HD2 TYR 7 HD2 TYR 7 -3.790 18.014 -3.857 65 HE1 TYR 7 HE1 TYR 7 -6.806 15.319 -0.955 66 HE2 TYR 7 HE2 TYR 7 -4.665 18.973 -1.737 67 HH TYR 7 HH TYR 7 -5.551 18.451 0.266 68 H PHE 8 H PHE 8 -7.346 14.098 -6.238 69 HA PHE 8 HA PHE 8 -7.818 16.000 -8.400 70 1HB PHE 8 HB2 PHE 8 -9.593 14.108 -6.763 71 2HB PHE 8 HB3 PHE 8 -10.140 15.014 -8.157 72 HD1 PHE 8 HD1 PHE 8 -8.999 14.613 -10.405 73 HD2 PHE 8 HD2 PHE 8 -8.458 11.982 -7.040 74 HE1 PHE 8 HE1 PHE 8 -7.964 12.928 -11.893 75 HE2 PHE 8 HE2 PHE 8 -7.423 10.296 -8.546 76 HZ PHE 8 HZ PHE 8 -7.161 10.782 -10.954 77 H LEU 9 H LEU 9 -8.953 17.909 -8.299 78 HA LEU 9 HA LEU 9 -9.920 18.783 -5.649 79 1HB LEU 9 HB2 LEU 9 -7.448 19.311 -6.214 80 2HB LEU 9 HB3 LEU 9 -8.032 20.360 -7.484 81 HG LEU 9 HG LEU 9 -7.299 21.474 -5.376 82 1HD1 LEU 9 HD11 LEU 9 -9.006 23.122 -5.233 83 2HD1 LEU 9 HD12 LEU 9 -8.972 22.567 -6.906 84 3HD1 LEU 9 HD13 LEU 9 -10.262 22.022 -5.808 85 1HD2 LEU 9 HD21 LEU 9 -8.058 19.798 -3.778 86 2HD2 LEU 9 HD22 LEU 9 -8.798 21.374 -3.400 87 3HD2 LEU 9 HD23 LEU 9 -9.756 20.145 -4.157 88 H CYS 10 H CYS 10 -11.832 19.962 -5.754 89 HA CYS 10 HA CYS 10 -12.607 21.215 -8.315 90 1HB CYS 10 HB2 CYS 10 -13.283 18.684 -8.200 91 2HB CYS 10 HB3 CYS 10 -14.496 19.210 -7.019 92 HG CYS 10 HG CYS 10 -13.926 20.382 -10.089 93 H THR 11 H THR 11 -15.009 22.250 -7.926 94 HA THR 11 HA THR 11 -14.629 24.020 -5.720 95 HB THR 11 HB THR 11 -17.067 24.716 -6.531 96 HG1 THR 11 HG1 THR 11 -17.325 24.263 -8.690 97 1HG2 THR 11 HG21 THR 11 -15.023 26.044 -6.691 98 2HG2 THR 11 HG22 THR 11 -14.468 25.098 -8.074 99 3HG2 THR 11 HG23 THR 11 -15.922 26.119 -8.219 100 H GLY 12 H GLY 12 -15.885 20.906 -5.592 101 1HA GLY 12 HA1 GLY 12 -16.410 21.284 -2.823 102 2HA GLY 12 HA2 GLY 12 -17.910 20.905 -3.697 103 H ASN 13 H ASN 13 -15.810 19.343 -1.875 104 HA ASN 13 HA ASN 13 -14.962 17.212 -3.655 105 1HB ASN 13 HB2 ASN 13 -13.673 18.028 -1.642 106 2HB ASN 13 HB3 ASN 13 -14.884 17.282 -0.621 107 1HD2 ASN 13 HD22 ASN 13 -13.782 15.671 -3.712 108 2HD2 ASN 13 HD21 ASN 13 -12.996 14.369 -2.851 109 H SER 14 H SER 14 -17.783 17.583 -3.624 110 HA SER 14 HA SER 14 -18.846 15.214 -2.166 111 1HB SER 14 HB2 SER 14 -20.159 17.811 -3.040 112 2HB SER 14 HB3 SER 14 -20.937 16.529 -2.108 113 HG SER 14 HG SER 14 -20.004 18.389 -0.921 114 H CYS 15 H CYS 15 -17.929 16.112 -5.282 115 HA CYS 15 HA CYS 15 -19.869 14.290 -6.551 116 1HB CYS 15 HB2 CYS 15 -20.439 16.119 -8.227 117 2HB CYS 15 HB3 CYS 15 -21.108 16.313 -6.609 118 HG CYS 15 HG CYS 15 -20.462 18.675 -7.414 119 H ARG 16 H ARG 16 -18.010 16.716 -8.254 120 HA ARG 16 HA ARG 16 -17.177 14.874 -10.216 121 1HB ARG 16 HB2 ARG 16 -16.299 17.681 -9.468 122 2HB ARG 16 HB3 ARG 16 -15.606 16.857 -10.863 123 1HG ARG 16 HG2 ARG 16 -17.590 16.838 -12.063 124 2HG ARG 16 HG3 ARG 16 -18.623 16.958 -10.642 125 1HD ARG 16 HD2 ARG 16 -16.813 19.228 -11.530 126 2HD ARG 16 HD3 ARG 16 -18.461 19.028 -12.132 127 HE ARG 16 HE ARG 16 -18.860 18.942 -9.437 128 1HH1 ARG 16 HH21 ARG 16 -17.254 21.331 -11.531 129 2HH1 ARG 16 HH22 ARG 16 -17.338 22.581 -10.323 130 1HH2 ARG 16 HH11 ARG 16 -19.378 20.746 -8.142 131 2HH2 ARG 16 HH12 ARG 16 -18.359 22.168 -8.269 132 H SER 17 H SER 17 -15.183 16.171 -7.448 133 HA SER 17 HA SER 17 -12.908 14.703 -8.421 134 1HB SER 17 HB2 SER 17 -11.874 15.430 -6.283 135 2HB SER 17 HB3 SER 17 -12.533 16.721 -7.255 136 HG SER 17 HG SER 17 -13.114 17.093 -5.188 137 H GLN 18 H GLN 18 -15.584 13.807 -6.307 138 HA GLN 18 HA GLN 18 -14.303 11.450 -5.192 139 1HB GLN 18 HB2 GLN 18 -17.244 12.217 -5.607 140 2HB GLN 18 HB3 GLN 18 -16.718 10.798 -4.736 141 1HG GLN 18 HG2 GLN 18 -15.914 13.621 -3.936 142 2HG GLN 18 HG3 GLN 18 -17.353 12.820 -3.333 143 1HE2 GLN 18 HE22 GLN 18 -15.290 13.736 -1.649 144 2HE2 GLN 18 HE21 GLN 18 -14.520 12.337 -0.887 145 H MET 19 H MET 19 -16.405 12.107 -8.064 146 HA MET 19 HA MET 19 -16.454 9.363 -8.947 147 1HB MET 19 HB2 MET 19 -16.806 11.946 -10.539 148 2HB MET 19 HB3 MET 19 -17.121 10.315 -11.143 149 1HG MET 19 HG2 MET 19 -18.738 10.025 -9.190 150 2HG MET 19 HG3 MET 19 -18.597 11.757 -8.920 151 1HE MET 19 HE1 MET 19 -20.138 13.219 -12.257 152 2HE MET 19 HE2 MET 19 -19.400 13.612 -10.685 153 3HE MET 19 HE3 MET 19 -18.419 12.881 -11.981 154 H ALA 20 H ALA 20 -14.317 12.161 -9.817 155 HA ALA 20 HA ALA 20 -12.700 10.827 -11.675 156 1HB ALA 20 HB1 ALA 20 -11.799 12.936 -9.666 157 2HB ALA 20 HB2 ALA 20 -11.049 12.550 -11.226 158 3HB ALA 20 HB3 ALA 20 -12.659 13.291 -11.180 159 H GLU 21 H GLU 21 -12.341 11.003 -8.112 160 HA GLU 21 HA GLU 21 -9.969 9.548 -7.840 161 1HB GLU 21 HB2 GLU 21 -11.066 10.873 -6.064 162 2HB GLU 21 HB3 GLU 21 -12.402 9.714 -5.993 163 1HG GLU 21 HG2 GLU 21 -10.745 7.949 -5.378 164 2HG GLU 21 HG3 GLU 21 -9.505 9.218 -5.290 165 H GLY 22 H GLY 22 -13.387 8.384 -7.851 166 1HA GLY 22 HA1 GLY 22 -12.938 5.632 -7.613 167 2HA GLY 22 HA2 GLY 22 -14.306 6.389 -8.434 168 H TRP 23 H TRP 23 -13.192 7.544 -10.749 169 HA TRP 23 HA TRP 23 -12.730 5.170 -12.331 170 1HB TRP 23 HB2 TRP 23 -12.293 8.096 -13.016 171 2HB TRP 23 HB3 TRP 23 -12.077 6.774 -14.146 172 HD1 TRP 23 HD1 TRP 23 -14.729 8.852 -12.511 173 HE1 TRP 23 HE1 TRP 23 -16.946 8.546 -13.685 174 HE3 TRP 23 HE3 TRP 23 -13.587 4.731 -15.351 175 HZ2 TRP 23 HZ2 TRP 23 -18.072 6.844 -15.701 176 HZ3 TRP 23 HZ3 TRP 23 -15.262 3.852 -16.958 177 HH2 TRP 23 HH2 TRP 23 -17.522 4.950 -17.141 178 H ALA 24 H ALA 24 -10.478 7.617 -10.926 179 HA ALA 24 HA ALA 24 -8.249 6.689 -12.382 180 1HB ALA 24 HB1 ALA 24 -6.897 7.930 -10.706 181 2HB ALA 24 HB2 ALA 24 -8.332 8.866 -11.168 182 3HB ALA 24 HB3 ALA 24 -8.323 8.019 -9.636 183 H LYS 25 H LYS 25 -9.602 5.498 -9.290 184 HA LYS 25 HA LYS 25 -7.448 3.737 -8.681 185 1HB LYS 25 HB2 LYS 25 -10.436 3.589 -8.114 186 2HB LYS 25 HB3 LYS 25 -9.295 2.400 -7.474 187 1HG LYS 25 HG2 LYS 25 -8.129 4.012 -6.173 188 2HG LYS 25 HG3 LYS 25 -8.880 5.373 -7.017 189 1HD LYS 25 HD2 LYS 25 -11.088 4.753 -6.106 190 2HD LYS 25 HD3 LYS 25 -10.338 3.416 -5.192 191 1HE LYS 25 HE2 LYS 25 -8.935 5.020 -3.948 192 2HE LYS 25 HE3 LYS 25 -9.512 6.341 -4.969 193 1HZ LYS 25 HZ1 LYS 25 -11.781 5.818 -4.103 194 2HZ LYS 25 HZ2 LYS 25 -11.060 4.886 -2.935 195 3HZ LYS 25 HZ3 LYS 25 -10.762 6.517 -3.061 196 H GLN 26 H GLN 26 -9.904 3.456 -11.178 197 HA GLN 26 HA GLN 26 -9.435 0.574 -11.602 198 1HB GLN 26 HB2 GLN 26 -11.208 2.714 -12.806 199 2HB GLN 26 HB3 GLN 26 -10.838 1.300 -13.763 200 1HG GLN 26 HG2 GLN 26 -12.998 1.339 -12.360 201 2HG GLN 26 HG3 GLN 26 -12.039 -0.134 -12.438 202 1HE2 GLN 26 HE22 GLN 26 -12.157 2.873 -10.293 203 2HE2 GLN 26 HE21 GLN 26 -12.077 1.933 -8.837 204 H TYR 27 H TYR 27 -8.744 3.678 -13.235 205 HA TYR 27 HA TYR 27 -7.303 2.387 -15.379 206 1HB TYR 27 HB2 TYR 27 -7.755 5.259 -14.534 207 2HB TYR 27 HB3 TYR 27 -6.743 4.848 -15.918 208 HD1 TYR 27 HD1 TYR 27 -9.991 5.817 -15.092 209 HD2 TYR 27 HD2 TYR 27 -7.878 2.984 -17.566 210 HE1 TYR 27 HE1 TYR 27 -11.942 5.680 -16.594 211 HE2 TYR 27 HE2 TYR 27 -9.865 2.769 -19.023 212 HH TYR 27 HH TYR 27 -12.882 4.647 -18.468 213 H LEU 28 H LEU 28 -6.266 3.778 -12.291 214 HA LEU 28 HA LEU 28 -3.410 3.589 -13.072 215 1HB LEU 28 HB2 LEU 28 -4.655 4.655 -10.517 216 2HB LEU 28 HB3 LEU 28 -2.980 4.796 -11.027 217 HG LEU 28 HG LEU 28 -5.355 6.151 -12.365 218 1HD1 LEU 28 HD11 LEU 28 -4.411 8.199 -11.460 219 2HD1 LEU 28 HD12 LEU 28 -4.711 7.047 -10.137 220 3HD1 LEU 28 HD13 LEU 28 -3.059 7.303 -10.741 221 1HD2 LEU 28 HD21 LEU 28 -3.737 7.357 -13.731 222 2HD2 LEU 28 HD22 LEU 28 -2.402 6.411 -13.053 223 3HD2 LEU 28 HD23 LEU 28 -3.642 5.636 -14.067 224 H GLY 29 H GLY 29 -3.115 3.075 -9.935 225 1HA GLY 29 HA1 GLY 29 -3.860 0.447 -9.355 226 2HA GLY 29 HA2 GLY 29 -2.325 0.364 -10.245 227 H ASP 30 H ASP 30 -1.865 -0.538 -7.890 228 HA ASP 30 HA ASP 30 -1.790 1.245 -5.713 229 1HB ASP 30 HB2 ASP 30 -1.812 -1.260 -5.598 230 2HB ASP 30 HB3 ASP 30 -0.100 -1.256 -6.052 231 H GLU 31 H GLU 31 0.318 1.111 -8.358 232 HA GLU 31 HA GLU 31 2.763 2.187 -7.388 233 1HB GLU 31 HB2 GLU 31 2.236 1.224 -9.668 234 2HB GLU 31 HB3 GLU 31 1.243 2.636 -10.004 235 1HG GLU 31 HG2 GLU 31 3.357 4.047 -9.734 236 2HG GLU 31 HG3 GLU 31 4.262 2.537 -9.642 237 H TRP 32 H TRP 32 -0.389 3.490 -7.248 238 HA TRP 32 HA TRP 32 0.634 6.204 -6.652 239 1HB TRP 32 HB2 TRP 32 -2.031 5.587 -7.977 240 2HB TRP 32 HB3 TRP 32 -1.305 7.158 -7.721 241 HD1 TRP 32 HD1 TRP 32 -0.635 3.979 -9.825 242 HE1 TRP 32 HE1 TRP 32 0.043 4.693 -12.192 243 HE3 TRP 32 HE3 TRP 32 -0.485 9.056 -9.147 244 HZ2 TRP 32 HZ2 TRP 32 0.337 7.103 -13.660 245 HZ3 TRP 32 HZ3 TRP 32 -0.091 10.544 -11.084 246 HH2 TRP 32 HH2 TRP 32 0.252 9.551 -13.366 247 H LYS 33 H LYS 33 -0.857 7.328 -5.250 248 HA LYS 33 HA LYS 33 -3.000 5.757 -3.911 249 1HB LYS 33 HB2 LYS 33 -1.052 7.785 -2.753 250 2HB LYS 33 HB3 LYS 33 -2.573 7.377 -1.961 251 1HG LYS 33 HG2 LYS 33 -0.392 5.354 -2.598 252 2HG LYS 33 HG3 LYS 33 -0.540 6.252 -1.090 253 1HD LYS 33 HD2 LYS 33 -1.501 4.248 -0.510 254 2HD LYS 33 HD3 LYS 33 -2.896 5.248 -0.855 255 1HE LYS 33 HE2 LYS 33 -3.203 2.993 -1.698 256 2HE LYS 33 HE3 LYS 33 -3.168 4.106 -3.066 257 1HZ LYS 33 HZ1 LYS 33 -1.132 3.299 -3.727 258 2HZ LYS 33 HZ2 LYS 33 -0.695 2.743 -2.222 259 3HZ LYS 33 HZ3 LYS 33 -1.764 1.919 -3.107 260 H VAL 34 H VAL 34 -4.924 6.804 -3.956 261 HA VAL 34 HA VAL 34 -4.990 9.344 -5.491 262 HB VAL 34 HB VAL 34 -5.456 8.082 -7.223 263 1HG1 VAL 34 HG11 VAL 34 -6.331 5.683 -5.608 264 2HG1 VAL 34 HG12 VAL 34 -6.183 5.779 -7.388 265 3HG1 VAL 34 HG13 VAL 34 -4.752 5.927 -6.387 266 1HG2 VAL 34 HG21 VAL 34 -7.759 7.538 -7.659 267 2HG2 VAL 34 HG22 VAL 34 -8.137 7.531 -5.945 268 3HG2 VAL 34 HG23 VAL 34 -7.690 9.055 -6.741 269 H TYR 35 H TYR 35 -5.954 10.834 -4.413 270 HA TYR 35 HA TYR 35 -8.377 10.203 -2.832 271 1HB TYR 35 HB2 TYR 35 -6.850 12.375 -1.606 272 2HB TYR 35 HB3 TYR 35 -7.665 11.021 -0.876 273 HD1 TYR 35 HD1 TYR 35 -4.528 12.531 -1.779 274 HD2 TYR 35 HD2 TYR 35 -6.364 8.795 -0.640 275 HE1 TYR 35 HE1 TYR 35 -2.355 11.726 -0.970 276 HE2 TYR 35 HE2 TYR 35 -4.171 7.958 0.156 277 HH TYR 35 HH TYR 35 -1.918 8.471 0.514 278 H SER 36 H SER 36 -9.481 12.367 -2.245 279 HA SER 36 HA SER 36 -9.061 14.438 -4.309 280 1HB SER 36 HB2 SER 36 -11.530 14.542 -4.533 281 2HB SER 36 HB3 SER 36 -10.841 13.036 -5.159 282 HG SER 36 HG SER 36 -11.574 11.951 -3.382 283 H ALA 37 H ALA 37 -9.972 16.493 -3.737 284 HA ALA 37 HA ALA 37 -11.117 16.892 -1.081 285 1HB ALA 37 HB1 ALA 37 -8.634 18.411 -1.973 286 2HB ALA 37 HB2 ALA 37 -9.601 18.671 -0.495 287 3HB ALA 37 HB3 ALA 37 -8.694 17.175 -0.687 288 H GLY 38 H GLY 38 -11.296 19.668 -1.215 289 1HA GLY 38 HA1 GLY 38 -11.851 20.657 -3.831 290 2HA GLY 38 HA2 GLY 38 -13.346 20.229 -2.982 291 H ILE 39 H ILE 39 -13.093 22.768 -3.644 292 HA ILE 39 HA ILE 39 -11.834 24.600 -1.899 293 HB ILE 39 HB ILE 39 -14.293 24.594 -3.647 294 1HG1 ILE 39 HG12 ILE 39 -13.145 26.371 -4.850 295 2HG1 ILE 39 HG13 ILE 39 -11.902 26.452 -3.610 296 1HG2 ILE 39 HG21 ILE 39 -15.116 25.989 -1.847 297 2HG2 ILE 39 HG22 ILE 39 -13.618 26.955 -1.866 298 3HG2 ILE 39 HG23 ILE 39 -14.737 26.977 -3.251 299 1HD1 ILE 39 HD11 ILE 39 -12.373 24.191 -5.585 300 2HD1 ILE 39 HD12 ILE 39 -11.031 25.335 -5.567 301 3HD1 ILE 39 HD13 ILE 39 -11.135 24.148 -4.290 302 H GLU 40 H GLU 40 -14.837 22.780 -1.581 303 HA GLU 40 HA GLU 40 -14.638 22.940 1.325 304 1HB GLU 40 HB2 GLU 40 -16.967 23.539 1.681 305 2HB GLU 40 HB3 GLU 40 -16.115 24.827 0.843 306 1HG GLU 40 HG2 GLU 40 -17.120 24.105 -1.319 307 2HG GLU 40 HG3 GLU 40 -17.964 22.794 -0.494 308 H ALA 41 H ALA 41 -16.654 21.413 2.124 309 HA ALA 41 HA ALA 41 -17.155 19.134 0.324 310 1HB ALA 41 HB1 ALA 41 -15.688 18.905 3.000 311 2HB ALA 41 HB2 ALA 41 -16.300 17.552 2.039 312 3HB ALA 41 HB3 ALA 41 -14.998 18.572 1.393 313 H HIS 42 H HIS 42 -18.803 17.756 1.252 314 HA HIS 42 HA HIS 42 -20.183 18.662 3.706 315 1HB HIS 42 HB2 HIS 42 -21.283 19.891 1.853 316 2HB HIS 42 HB3 HIS 42 -21.558 18.374 0.997 317 HD1 HIS 42 HD1 HIS 42 -22.716 20.140 4.263 318 HD2 HIS 42 HD2 HIS 42 -23.735 17.028 1.612 319 HE1 HIS 42 HE1 HIS 42 -25.013 19.314 4.980 320 H GLY 43 H GLY 43 -19.914 16.291 0.997 321 1HA GLY 43 HA1 GLY 43 -19.556 13.958 2.398 322 2HA GLY 43 HA2 GLY 43 -21.316 14.183 2.349 323 H LEU 44 H LEU 44 -19.327 12.367 0.726 324 HA LEU 44 HA LEU 44 -19.651 13.134 -2.010 325 1HB LEU 44 HB2 LEU 44 -19.066 11.050 -2.666 326 2HB LEU 44 HB3 LEU 44 -18.093 11.370 -1.235 327 HG LEU 44 HG LEU 44 -20.585 9.649 -1.366 328 1HD1 LEU 44 HD11 LEU 44 -17.663 8.894 -1.170 329 2HD1 LEU 44 HD12 LEU 44 -19.026 7.758 -1.175 330 3HD1 LEU 44 HD13 LEU 44 -18.674 8.723 -2.619 331 1HD2 LEU 44 HD21 LEU 44 -18.597 10.048 0.920 332 2HD2 LEU 44 HD22 LEU 44 -20.334 10.455 0.937 333 3HD2 LEU 44 HD23 LEU 44 -19.827 8.771 0.871 334 H ASN 45 H ASN 45 -21.445 13.555 -3.044 335 HA ASN 45 HA ASN 45 -23.912 13.099 -1.667 336 1HB ASN 45 HB2 ASN 45 -24.801 14.729 -2.970 337 2HB ASN 45 HB3 ASN 45 -23.111 15.148 -3.167 338 1HD2 ASN 45 HD22 ASN 45 -22.043 14.401 -5.227 339 2HD2 ASN 45 HD21 ASN 45 -23.063 14.121 -6.650 340 HA PRO 46 HA PRO 46 -25.512 9.428 -3.336 341 1HB PRO 46 HB2 PRO 46 -27.938 10.917 -4.352 342 2HB PRO 46 HB3 PRO 46 -27.863 9.421 -3.370 343 1HG PRO 46 HG2 PRO 46 -28.425 11.804 -2.200 344 2HG PRO 46 HG3 PRO 46 -27.301 10.654 -1.404 345 1HD PRO 46 HD2 PRO 46 -26.620 13.092 -3.070 346 2HD PRO 46 HD3 PRO 46 -25.919 12.547 -1.514 347 H ASN 47 H ASN 47 -25.777 12.182 -5.681 348 HA ASN 47 HA ASN 47 -26.088 10.452 -7.944 349 1HB ASN 47 HB2 ASN 47 -26.431 12.338 -9.020 350 2HB ASN 47 HB3 ASN 47 -26.096 13.276 -7.591 351 1HD2 ASN 47 HD22 ASN 47 -25.191 12.730 -10.828 352 2HD2 ASN 47 HD21 ASN 47 -23.598 13.452 -10.775 353 H ALA 48 H ALA 48 -23.176 11.568 -6.185 354 HA ALA 48 HA ALA 48 -21.390 10.747 -8.303 355 1HB ALA 48 HB1 ALA 48 -19.633 11.053 -6.621 356 2HB ALA 48 HB2 ALA 48 -20.774 12.407 -6.562 357 3HB ALA 48 HB3 ALA 48 -20.839 11.143 -5.318 358 H VAL 49 H VAL 49 -22.635 9.326 -5.249 359 HA VAL 49 HA VAL 49 -21.104 6.931 -5.428 360 HB VAL 49 HB VAL 49 -23.753 7.321 -3.991 361 1HG1 VAL 49 HG11 VAL 49 -21.489 5.268 -3.772 362 2HG1 VAL 49 HG12 VAL 49 -22.838 5.422 -2.614 363 3HG1 VAL 49 HG13 VAL 49 -23.152 4.952 -4.288 364 1HG2 VAL 49 HG21 VAL 49 -22.313 7.698 -2.002 365 2HG2 VAL 49 HG22 VAL 49 -20.876 7.671 -3.045 366 3HG2 VAL 49 HG23 VAL 49 -22.082 8.965 -3.208 367 H LYS 50 H LYS 50 -24.540 7.629 -6.454 368 HA LYS 50 HA LYS 50 -24.913 4.999 -7.449 369 1HB LYS 50 HB2 LYS 50 -26.744 6.606 -6.872 370 2HB LYS 50 HB3 LYS 50 -26.358 7.536 -8.333 371 1HG LYS 50 HG2 LYS 50 -26.858 5.534 -9.729 372 2HG LYS 50 HG3 LYS 50 -27.184 4.588 -8.266 373 1HD LYS 50 HD2 LYS 50 -29.075 6.075 -7.714 374 2HD LYS 50 HD3 LYS 50 -28.731 7.060 -9.153 375 1HE LYS 50 HE2 LYS 50 -29.133 5.085 -10.604 376 2HE LYS 50 HE3 LYS 50 -29.455 4.094 -9.176 377 1HZ LYS 50 HZ1 LYS 50 -31.371 5.510 -8.708 378 2HZ LYS 50 HZ2 LYS 50 -31.076 6.425 -10.032 379 3HZ LYS 50 HZ3 LYS 50 -31.500 4.861 -10.194 380 H ALA 51 H ALA 51 -23.779 8.008 -9.109 381 HA ALA 51 HA ALA 51 -23.855 6.961 -11.692 382 1HB ALA 51 HB1 ALA 51 -22.052 8.665 -12.204 383 2HB ALA 51 HB2 ALA 51 -23.449 9.333 -11.342 384 3HB ALA 51 HB3 ALA 51 -21.927 8.991 -10.472 385 H MET 52 H MET 52 -21.185 6.776 -9.279 386 HA MET 52 HA MET 52 -19.502 5.265 -11.085 387 1HB MET 52 HB2 MET 52 -19.406 5.743 -8.089 388 2HB MET 52 HB3 MET 52 -18.119 4.999 -9.041 389 1HG MET 52 HG2 MET 52 -19.149 7.839 -9.287 390 2HG MET 52 HG3 MET 52 -17.582 7.328 -8.674 391 1HE MET 52 HE1 MET 52 -15.818 5.978 -11.923 392 2HE MET 52 HE2 MET 52 -15.606 6.372 -10.205 393 3HE MET 52 HE3 MET 52 -16.732 5.097 -10.717 394 H LYS 53 H LYS 53 -21.791 4.379 -8.422 395 HA LYS 53 HA LYS 53 -21.009 1.679 -8.250 396 1HB LYS 53 HB2 LYS 53 -22.390 2.998 -6.625 397 2HB LYS 53 HB3 LYS 53 -23.743 2.918 -7.767 398 1HG LYS 53 HG2 LYS 53 -23.595 0.376 -7.569 399 2HG LYS 53 HG3 LYS 53 -22.408 0.607 -6.276 400 1HD LYS 53 HD2 LYS 53 -25.225 1.754 -6.352 401 2HD LYS 53 HD3 LYS 53 -24.798 0.278 -5.488 402 1HE LYS 53 HE2 LYS 53 -23.615 3.030 -4.882 403 2HE LYS 53 HE3 LYS 53 -25.052 2.385 -4.094 404 1HZ LYS 53 HZ1 LYS 53 -23.693 0.560 -3.236 405 2HZ LYS 53 HZ2 LYS 53 -22.328 1.210 -3.896 406 3HZ LYS 53 HZ3 LYS 53 -23.120 2.017 -2.754 407 H GLU 54 H GLU 54 -23.332 3.312 -10.412 408 HA GLU 54 HA GLU 54 -24.235 0.927 -11.687 409 1HB GLU 54 HB2 GLU 54 -24.318 3.875 -12.425 410 2HB GLU 54 HB3 GLU 54 -24.981 2.646 -13.500 411 1HG GLU 54 HG2 GLU 54 -25.826 3.037 -10.598 412 2HG GLU 54 HG3 GLU 54 -26.666 3.697 -11.995 413 H VAL 55 H VAL 55 -21.250 2.739 -12.113 414 HA VAL 55 HA VAL 55 -20.623 1.427 -14.677 415 HB VAL 55 HB VAL 55 -18.881 3.027 -12.742 416 1HG1 VAL 55 HG11 VAL 55 -17.283 3.227 -14.601 417 2HG1 VAL 55 HG12 VAL 55 -17.440 1.559 -14.068 418 3HG1 VAL 55 HG13 VAL 55 -18.244 2.083 -15.565 419 1HG2 VAL 55 HG21 VAL 55 -20.047 3.824 -15.453 420 2HG2 VAL 55 HG22 VAL 55 -20.701 4.345 -13.897 421 3HG2 VAL 55 HG23 VAL 55 -19.075 4.838 -14.359 422 H GLY 56 H GLY 56 -20.424 0.747 -11.247 423 1HA GLY 56 HA1 GLY 56 -20.115 -1.510 -10.476 424 2HA GLY 56 HA2 GLY 56 -18.920 -1.791 -11.750 425 H ILE 57 H ILE 57 -18.967 1.273 -9.968 426 HA ILE 57 HA ILE 57 -16.398 0.576 -8.623 427 HB ILE 57 HB ILE 57 -17.221 3.108 -10.076 428 1HG1 ILE 57 HG12 ILE 57 -15.043 1.099 -10.806 429 2HG1 ILE 57 HG13 ILE 57 -16.613 1.207 -11.601 430 1HG2 ILE 57 HG21 ILE 57 -14.917 3.908 -9.527 431 2HG2 ILE 57 HG22 ILE 57 -15.799 3.540 -8.055 432 3HG2 ILE 57 HG23 ILE 57 -14.598 2.392 -8.661 433 1HD1 ILE 57 HD11 ILE 57 -15.030 2.336 -12.974 434 2HD1 ILE 57 HD12 ILE 57 -16.137 3.531 -12.288 435 3HD1 ILE 57 HD13 ILE 57 -14.484 3.360 -11.635 436 H ASP 58 H ASP 58 -17.223 0.237 -6.635 437 HA ASP 58 HA ASP 58 -19.523 1.723 -5.663 438 1HB ASP 58 HB2 ASP 58 -19.313 -0.663 -5.227 439 2HB ASP 58 HB3 ASP 58 -17.816 -0.398 -4.317 440 H ILE 59 H ILE 59 -18.494 3.907 -5.759 441 HA ILE 59 HA ILE 59 -16.277 4.446 -4.014 442 HB ILE 59 HB ILE 59 -16.495 6.736 -4.511 443 1HG1 ILE 59 HG12 ILE 59 -19.092 6.307 -6.006 444 2HG1 ILE 59 HG13 ILE 59 -19.038 6.845 -4.333 445 1HG2 ILE 59 HG21 ILE 59 -17.084 5.205 -7.046 446 2HG2 ILE 59 HG22 ILE 59 -16.209 6.747 -6.895 447 3HG2 ILE 59 HG23 ILE 59 -15.511 5.272 -6.220 448 1HD1 ILE 59 HD11 ILE 59 -19.246 8.813 -5.634 449 2HD1 ILE 59 HD12 ILE 59 -17.597 8.773 -5.004 450 3HD1 ILE 59 HD13 ILE 59 -17.901 8.362 -6.703 451 H SER 60 H SER 60 -19.369 3.635 -3.055 452 HA SER 60 HA SER 60 -20.127 5.505 -1.182 453 1HB SER 60 HB2 SER 60 -20.174 2.515 -0.613 454 2HB SER 60 HB3 SER 60 -21.339 3.748 -0.110 455 HG SER 60 HG SER 60 -21.007 2.405 -2.547 456 H ASN 61 H ASN 61 -17.421 3.273 -1.076 457 HA ASN 61 HA ASN 61 -16.810 3.342 1.698 458 1HB ASN 61 HB2 ASN 61 -14.845 2.191 1.133 459 2HB ASN 61 HB3 ASN 61 -16.015 1.636 -0.049 460 1HD2 ASN 61 HD22 ASN 61 -15.713 2.370 -2.369 461 2HD2 ASN 61 HD21 ASN 61 -14.172 3.033 -2.824 462 H GLN 62 H GLN 62 -16.324 5.793 -0.755 463 HA GLN 62 HA GLN 62 -13.906 6.891 0.370 464 1HB GLN 62 HB2 GLN 62 -15.786 8.007 -1.748 465 2HB GLN 62 HB3 GLN 62 -14.199 8.654 -1.313 466 1HG GLN 62 HG2 GLN 62 -13.163 6.505 -1.988 467 2HG GLN 62 HG3 GLN 62 -14.745 5.902 -2.486 468 1HE2 GLN 62 HE22 GLN 62 -14.773 9.185 -3.447 469 2HE2 GLN 62 HE21 GLN 62 -14.301 8.863 -5.109 470 H THR 63 H THR 63 -13.988 9.348 0.857 471 HA THR 63 HA THR 63 -16.341 10.298 2.271 472 HB THR 63 HB THR 63 -14.699 10.911 4.224 473 HG1 THR 63 HG1 THR 63 -12.783 10.133 3.342 474 1HG2 THR 63 HG21 THR 63 -16.616 9.348 4.453 475 2HG2 THR 63 HG22 THR 63 -15.562 8.003 3.959 476 3HG2 THR 63 HG23 THR 63 -15.229 8.897 5.456 477 H SER 64 H SER 64 -15.888 12.709 2.937 478 HA SER 64 HA SER 64 -14.281 13.906 0.769 479 1HB SER 64 HB2 SER 64 -16.066 15.687 0.849 480 2HB SER 64 HB3 SER 64 -16.607 14.093 0.313 481 HG SER 64 HG SER 64 -16.942 15.165 2.926 482 H ASP 65 H ASP 65 -13.240 15.899 1.139 483 HA ASP 65 HA ASP 65 -13.125 17.068 3.827 484 1HB ASP 65 HB2 ASP 65 -11.396 15.190 3.757 485 2HB ASP 65 HB3 ASP 65 -10.623 16.052 2.417 486 H ILE 66 H ILE 66 -11.999 19.184 3.730 487 HA ILE 66 HA ILE 66 -12.253 20.423 1.068 488 HB ILE 66 HB ILE 66 -12.283 22.475 2.128 489 1HG1 ILE 66 HG12 ILE 66 -11.213 21.176 4.660 490 2HG1 ILE 66 HG13 ILE 66 -10.379 22.344 3.611 491 1HG2 ILE 66 HG21 ILE 66 -13.692 20.777 4.227 492 2HG2 ILE 66 HG22 ILE 66 -14.198 22.332 3.539 493 3HG2 ILE 66 HG23 ILE 66 -14.248 20.858 2.559 494 1HD1 ILE 66 HD11 ILE 66 -11.168 23.582 5.486 495 2HD1 ILE 66 HD12 ILE 66 -12.265 23.978 4.131 496 3HD1 ILE 66 HD13 ILE 66 -12.774 22.834 5.396 497 H ILE 67 H ILE 67 -10.402 21.900 0.458 498 HA ILE 67 HA ILE 67 -8.256 20.294 -0.083 499 HB ILE 67 HB ILE 67 -9.048 22.180 -1.391 500 1HG1 ILE 67 HG12 ILE 67 -6.054 22.081 -0.852 501 2HG1 ILE 67 HG13 ILE 67 -6.970 21.049 -1.954 502 1HG2 ILE 67 HG21 ILE 67 -8.529 24.431 -1.089 503 2HG2 ILE 67 HG22 ILE 67 -9.118 23.902 0.485 504 3HG2 ILE 67 HG23 ILE 67 -7.360 24.107 0.204 505 1HD1 ILE 67 HD11 ILE 67 -7.597 23.202 -3.228 506 2HD1 ILE 67 HD12 ILE 67 -6.406 24.014 -2.210 507 3HD1 ILE 67 HD13 ILE 67 -5.900 22.693 -3.293 508 H ASP 68 H ASP 68 -6.973 19.334 1.333 509 HA ASP 68 HA ASP 68 -5.607 20.901 3.441 510 1HB ASP 68 HB2 ASP 68 -6.329 18.633 4.003 511 2HB ASP 68 HB3 ASP 68 -5.369 17.968 2.676 512 H SER 69 H SER 69 -4.235 22.305 2.450 513 HA SER 69 HA SER 69 -2.938 21.906 0.040 514 1HB SER 69 HB2 SER 69 -1.796 23.706 2.167 515 2HB SER 69 HB3 SER 69 -1.950 23.989 0.419 516 HG SER 69 HG SER 69 -3.471 25.167 1.719 517 H ASP 70 H ASP 70 -2.092 20.433 3.112 518 HA ASP 70 HA ASP 70 0.740 20.243 2.579 519 1HB ASP 70 HB2 ASP 70 -0.141 20.145 4.871 520 2HB ASP 70 HB3 ASP 70 -1.010 18.655 4.477 521 H ILE 71 H ILE 71 -2.108 18.210 1.941 522 HA ILE 71 HA ILE 71 -0.602 15.915 0.971 523 HB ILE 71 HB ILE 71 -3.481 16.788 0.511 524 1HG1 ILE 71 HG12 ILE 71 -2.241 14.528 2.149 525 2HG1 ILE 71 HG13 ILE 71 -2.872 16.040 2.810 526 1HG2 ILE 71 HG21 ILE 71 -3.865 14.555 -0.512 527 2HG2 ILE 71 HG22 ILE 71 -2.719 15.471 -1.461 528 3HG2 ILE 71 HG23 ILE 71 -2.129 14.191 -0.379 529 1HD1 ILE 71 HD11 ILE 71 -4.470 13.815 1.494 530 2HD1 ILE 71 HD12 ILE 71 -4.534 14.368 3.172 531 3HD1 ILE 71 HD13 ILE 71 -5.145 15.421 1.877 532 H LEU 72 H LEU 72 -2.193 18.748 -0.527 533 HA LEU 72 HA LEU 72 -1.410 18.354 -3.190 534 1HB LEU 72 HB2 LEU 72 -2.998 19.962 -2.618 535 2HB LEU 72 HB3 LEU 72 -1.968 20.778 -1.475 536 HG LEU 72 HG LEU 72 -1.203 20.796 -4.385 537 1HD1 LEU 72 HD11 LEU 72 -3.576 21.345 -4.446 538 2HD1 LEU 72 HD12 LEU 72 -3.391 22.437 -3.068 539 3HD1 LEU 72 HD13 LEU 72 -2.653 22.843 -4.640 540 1HD2 LEU 72 HD21 LEU 72 -0.910 22.741 -2.043 541 2HD2 LEU 72 HD22 LEU 72 0.388 21.897 -2.910 542 3HD2 LEU 72 HD23 LEU 72 -0.521 23.169 -3.712 543 H ASN 73 H ASN 73 0.459 20.007 -0.570 544 HA ASN 73 HA ASN 73 2.641 20.637 -2.261 545 1HB ASN 73 HB2 ASN 73 2.152 20.684 0.703 546 2HB ASN 73 HB3 ASN 73 3.822 20.677 0.186 547 1HD2 ASN 73 HD22 ASN 73 0.799 22.520 -0.022 548 2HD2 ASN 73 HD21 ASN 73 1.541 23.996 -0.622 549 H ASN 74 H ASN 74 1.838 17.482 -1.230 550 HA ASN 74 HA ASN 74 4.606 16.658 -1.924 551 1HB ASN 74 HB2 ASN 74 4.816 15.078 -0.292 552 2HB ASN 74 HB3 ASN 74 4.152 16.455 0.591 553 1HD2 ASN 74 HD22 ASN 74 1.761 16.319 1.172 554 2HD2 ASN 74 HD21 ASN 74 1.134 14.707 1.444 555 H ALA 75 H ALA 75 1.520 16.634 -3.025 556 HA ALA 75 HA ALA 75 1.259 13.938 -3.897 557 1HB ALA 75 HB1 ALA 75 -0.371 14.850 -5.479 558 2HB ALA 75 HB2 ALA 75 -0.628 15.549 -3.876 559 3HB ALA 75 HB3 ALA 75 0.186 16.503 -5.138 560 H ASP 76 H ASP 76 1.816 13.067 -6.052 561 HA ASP 76 HA ASP 76 4.254 14.221 -7.261 562 1HB ASP 76 HB2 ASP 76 3.866 11.757 -7.333 563 2HB ASP 76 HB3 ASP 76 2.381 12.028 -8.261 564 H LEU 77 H LEU 77 0.751 14.174 -7.645 565 HA LEU 77 HA LEU 77 0.835 16.236 -9.752 566 1HB LEU 77 HB2 LEU 77 0.796 14.164 -10.937 567 2HB LEU 77 HB3 LEU 77 -0.403 13.482 -9.831 568 HG LEU 77 HG LEU 77 -2.111 15.069 -10.694 569 1HD1 LEU 77 HD11 LEU 77 -0.113 15.694 -12.911 570 2HD1 LEU 77 HD12 LEU 77 -1.763 16.288 -12.763 571 3HD1 LEU 77 HD13 LEU 77 -0.540 16.849 -11.628 572 1HD2 LEU 77 HD21 LEU 77 -2.435 13.827 -12.774 573 2HD2 LEU 77 HD22 LEU 77 -0.704 13.395 -12.792 574 3HD2 LEU 77 HD23 LEU 77 -1.761 12.743 -11.543 575 H VAL 78 H VAL 78 -0.879 17.548 -9.739 576 HA VAL 78 HA VAL 78 -3.217 17.009 -7.969 577 HB VAL 78 HB VAL 78 -1.827 19.669 -8.541 578 1HG1 VAL 78 HG11 VAL 78 -3.381 20.604 -6.813 579 2HG1 VAL 78 HG12 VAL 78 -4.263 19.991 -8.214 580 3HG1 VAL 78 HG13 VAL 78 -4.213 19.042 -6.710 581 1HG2 VAL 78 HG21 VAL 78 -0.600 18.186 -6.869 582 2HG2 VAL 78 HG22 VAL 78 -1.099 19.754 -6.283 583 3HG2 VAL 78 HG23 VAL 78 -2.024 18.293 -5.824 584 H VAL 79 H VAL 79 -5.206 17.365 -9.130 585 HA VAL 79 HA VAL 79 -4.936 18.817 -11.684 586 HB VAL 79 HB VAL 79 -6.419 17.427 -12.917 587 1HG1 VAL 79 HG11 VAL 79 -4.971 15.585 -13.412 588 2HG1 VAL 79 HG12 VAL 79 -3.964 16.965 -12.949 589 3HG1 VAL 79 HG13 VAL 79 -4.227 15.636 -11.799 590 1HG2 VAL 79 HG21 VAL 79 -6.417 15.497 -10.557 591 2HG2 VAL 79 HG22 VAL 79 -7.801 16.432 -11.188 592 3HG2 VAL 79 HG23 VAL 79 -7.071 15.171 -12.180 593 H THR 80 H THR 80 -6.343 20.372 -11.888 594 HA THR 80 HA THR 80 -8.482 20.620 -9.836 595 HB THR 80 HB THR 80 -8.686 22.939 -10.860 596 HG1 THR 80 HG1 THR 80 -6.085 22.380 -11.865 597 1HG2 THR 80 HG21 THR 80 -6.611 23.760 -9.680 598 2HG2 THR 80 HG22 THR 80 -7.591 22.636 -8.722 599 3HG2 THR 80 HG23 THR 80 -6.095 22.075 -9.489 600 H LEU 81 H LEU 81 -10.570 20.357 -10.441 601 HA LEU 81 HA LEU 81 -10.998 19.219 -13.153 602 1HB LEU 81 HB2 LEU 81 -12.457 18.842 -10.515 603 2HB LEU 81 HB3 LEU 81 -12.893 18.044 -12.022 604 HG LEU 81 HG LEU 81 -10.238 17.678 -10.558 605 1HD1 LEU 81 HD11 LEU 81 -12.107 16.707 -9.350 606 2HD1 LEU 81 HD12 LEU 81 -12.669 15.855 -10.804 607 3HD1 LEU 81 HD13 LEU 81 -11.119 15.423 -10.055 608 1HD2 LEU 81 HD21 LEU 81 -9.888 17.316 -12.930 609 2HD2 LEU 81 HD22 LEU 81 -9.970 15.742 -12.141 610 3HD2 LEU 81 HD23 LEU 81 -11.375 16.336 -13.047 611 H CYS 82 H CYS 82 -11.583 22.223 -11.842 612 HA CYS 82 HA CYS 82 -13.518 22.684 -13.894 613 1HB CYS 82 HB2 CYS 82 -15.281 23.679 -12.523 614 2HB CYS 82 HB3 CYS 82 -15.072 21.962 -12.166 615 HG CYS 82 HG CYS 82 -15.541 23.427 -9.906 616 H GLY 83 H GLY 83 -13.899 25.047 -14.163 617 1HA GLY 83 HA1 GLY 83 -11.459 26.330 -14.459 618 2HA GLY 83 HA2 GLY 83 -13.037 27.111 -14.537 619 H ASP 84 H ASP 84 -14.024 27.066 -12.034 620 HA ASP 84 HA ASP 84 -12.608 29.241 -10.879 621 1HB ASP 84 HB2 ASP 84 -15.049 28.969 -10.761 622 2HB ASP 84 HB3 ASP 84 -14.853 27.554 -9.726 623 H ALA 85 H ALA 85 -12.550 25.757 -10.102 624 HA ALA 85 HA ALA 85 -11.596 26.023 -7.461 625 1HB ALA 85 HB1 ALA 85 -12.473 23.899 -8.267 626 2HB ALA 85 HB2 ALA 85 -11.164 23.763 -9.472 627 3HB ALA 85 HB3 ALA 85 -10.811 23.662 -7.737 628 H ALA 86 H ALA 86 -9.892 26.245 -10.524 629 HA ALA 86 HA ALA 86 -7.245 25.823 -9.547 630 1HB ALA 86 HB1 ALA 86 -8.232 27.455 -11.911 631 2HB ALA 86 HB2 ALA 86 -6.573 26.864 -11.664 632 3HB ALA 86 HB3 ALA 86 -7.895 25.701 -11.913 633 H ASP 87 H ASP 87 -9.393 28.628 -9.293 634 HA ASP 87 HA ASP 87 -7.387 30.614 -8.837 635 1HB ASP 87 HB2 ASP 87 -9.801 31.110 -9.285 636 2HB ASP 87 HB3 ASP 87 -10.201 30.413 -7.701 637 H LYS 88 H LYS 88 -9.005 28.212 -6.814 638 HA LYS 88 HA LYS 88 -7.933 29.320 -4.297 639 1HB LYS 88 HB2 LYS 88 -10.166 28.250 -4.314 640 2HB LYS 88 HB3 LYS 88 -9.450 26.754 -4.925 641 1HG LYS 88 HG2 LYS 88 -9.944 26.546 -2.584 642 2HG LYS 88 HG3 LYS 88 -8.208 26.450 -2.825 643 1HD LYS 88 HD2 LYS 88 -7.925 28.758 -2.019 644 2HD LYS 88 HD3 LYS 88 -9.692 28.988 -1.972 645 1HE LYS 88 HE2 LYS 88 -9.887 27.173 -0.316 646 2HE LYS 88 HE3 LYS 88 -8.134 26.928 -0.353 647 1HZ LYS 88 HZ1 LYS 88 -9.491 29.407 0.561 648 2HZ LYS 88 HZ2 LYS 88 -8.795 28.299 1.530 649 3HZ LYS 88 HZ3 LYS 88 -7.871 29.185 0.524 650 H CYS 89 H CYS 89 -7.354 26.553 -6.432 651 HA CYS 89 HA CYS 89 -5.857 24.946 -4.901 652 1HB CYS 89 HB2 CYS 89 -6.621 24.505 -7.205 653 2HB CYS 89 HB3 CYS 89 -5.259 25.456 -7.825 654 HG CYS 89 HG CYS 89 -4.755 22.908 -8.085 655 HA PRO 90 HA PRO 90 -2.634 27.907 -3.815 656 1HB PRO 90 HB2 PRO 90 -1.460 26.548 -1.747 657 2HB PRO 90 HB3 PRO 90 -3.029 27.415 -1.670 658 1HG PRO 90 HG2 PRO 90 -2.561 24.459 -2.056 659 2HG PRO 90 HG3 PRO 90 -3.766 25.269 -0.994 660 1HD PRO 90 HD2 PRO 90 -4.403 24.307 -3.454 661 2HD PRO 90 HD3 PRO 90 -5.165 25.765 -2.754 662 H MET 91 H MET 91 -0.100 27.762 -3.407 663 HA MET 91 HA MET 91 0.948 27.129 -5.920 664 1HB MET 91 HB2 MET 91 2.361 27.649 -3.271 665 2HB MET 91 HB3 MET 91 3.193 27.533 -4.819 666 1HG MET 91 HG2 MET 91 1.052 29.562 -4.088 667 2HG MET 91 HG3 MET 91 2.780 29.868 -4.189 668 1HE MET 91 HE1 MET 91 3.511 29.790 -8.028 669 2HE MET 91 HE2 MET 91 4.170 30.045 -6.397 670 3HE MET 91 HE3 MET 91 3.694 28.413 -6.925 671 H THR 92 H THR 92 1.936 25.478 -6.803 672 HA THR 92 HA THR 92 2.422 22.986 -5.256 673 HB THR 92 HB THR 92 1.916 21.923 -7.575 674 HG1 THR 92 HG1 THR 92 1.841 23.869 -8.772 675 1HG2 THR 92 HG21 THR 92 -0.463 21.880 -7.169 676 2HG2 THR 92 HG22 THR 92 0.431 21.735 -5.648 677 3HG2 THR 92 HG23 THR 92 -0.343 23.273 -6.073 678 HA PRO 93 HA PRO 93 6.530 24.369 -6.709 679 1HB PRO 93 HB2 PRO 93 8.090 22.694 -5.176 680 2HB PRO 93 HB3 PRO 93 7.291 24.160 -4.537 681 1HG PRO 93 HG2 PRO 93 6.337 21.291 -4.382 682 2HG PRO 93 HG3 PRO 93 6.416 22.504 -3.065 683 1HD PRO 93 HD2 PRO 93 4.117 21.987 -4.435 684 2HD PRO 93 HD3 PRO 93 4.511 23.639 -3.872 685 HA PRO 94 HA PRO 94 7.546 21.594 -9.963 686 1HB PRO 94 HB2 PRO 94 10.318 21.204 -8.808 687 2HB PRO 94 HB3 PRO 94 9.845 21.526 -10.509 688 1HG PRO 94 HG2 PRO 94 10.745 23.552 -8.961 689 2HG PRO 94 HG3 PRO 94 9.301 23.805 -9.997 690 1HD PRO 94 HD2 PRO 94 9.416 23.242 -7.033 691 2HD PRO 94 HD3 PRO 94 8.379 24.391 -7.929 692 H HIS 95 H HIS 95 8.297 20.254 -6.764 693 HA HIS 95 HA HIS 95 8.520 17.504 -7.528 694 1HB HIS 95 HB2 HIS 95 7.500 18.694 -4.917 695 2HB HIS 95 HB3 HIS 95 8.118 17.063 -5.156 696 HD1 HIS 95 HD1 HIS 95 10.898 17.226 -6.220 697 HD2 HIS 95 HD2 HIS 95 9.240 20.276 -3.830 698 HE1 HIS 95 HE1 HIS 95 12.859 18.547 -5.281 699 H VAL 96 H VAL 96 5.853 19.593 -7.727 700 HA VAL 96 HA VAL 96 3.779 17.466 -7.603 701 HB VAL 96 HB VAL 96 3.550 20.383 -6.692 702 1HG1 VAL 96 HG11 VAL 96 1.735 18.001 -6.241 703 2HG1 VAL 96 HG12 VAL 96 1.449 19.678 -5.746 704 3HG1 VAL 96 HG13 VAL 96 1.481 19.269 -7.460 705 1HG2 VAL 96 HG21 VAL 96 5.067 19.423 -5.098 706 2HG2 VAL 96 HG22 VAL 96 3.472 19.618 -4.372 707 3HG2 VAL 96 HG23 VAL 96 4.022 18.012 -4.873 708 H LYS 97 H LYS 97 3.603 17.205 -9.871 709 HA LYS 97 HA LYS 97 3.567 19.589 -11.581 710 1HB LYS 97 HB2 LYS 97 3.437 18.179 -13.415 711 2HB LYS 97 HB3 LYS 97 4.513 17.375 -12.289 712 1HG LYS 97 HG2 LYS 97 2.111 16.187 -11.641 713 2HG LYS 97 HG3 LYS 97 1.866 16.572 -13.357 714 1HD LYS 97 HD2 LYS 97 4.108 15.426 -13.808 715 2HD LYS 97 HD3 LYS 97 4.098 14.935 -12.103 716 1HE LYS 97 HE2 LYS 97 1.723 13.948 -12.660 717 2HE LYS 97 HE3 LYS 97 2.214 14.090 -14.353 718 1HZ LYS 97 HZ1 LYS 97 2.762 11.916 -13.513 719 2HZ LYS 97 HZ2 LYS 97 4.183 12.699 -13.703 720 3HZ LYS 97 HZ3 LYS 97 3.528 12.520 -12.196 721 H ARG 98 H ARG 98 1.561 19.895 -12.983 722 HA ARG 98 HA ARG 98 -0.912 19.611 -11.391 723 1HB ARG 98 HB2 ARG 98 0.305 21.550 -10.577 724 2HB ARG 98 HB3 ARG 98 0.419 22.223 -12.201 725 1HG ARG 98 HG2 ARG 98 -1.863 22.840 -12.252 726 2HG ARG 98 HG3 ARG 98 -2.300 21.727 -10.923 727 1HD ARG 98 HD2 ARG 98 -1.115 22.974 -9.312 728 2HD ARG 98 HD3 ARG 98 -0.275 23.961 -10.523 729 HE ARG 98 HE ARG 98 -2.876 24.672 -10.896 730 1HH1 ARG 98 HH11 ARG 98 -0.674 24.496 -8.115 731 2HH1 ARG 98 HH12 ARG 98 -1.572 25.590 -7.119 732 1HH2 ARG 98 HH21 ARG 98 -3.821 26.517 -9.734 733 2HH2 ARG 98 HH22 ARG 98 -3.312 26.838 -8.105 734 H GLU 99 H GLU 99 -2.782 19.732 -12.628 735 HA GLU 99 HA GLU 99 -2.614 20.439 -15.479 736 1HB GLU 99 HB2 GLU 99 -2.593 17.728 -14.566 737 2HB GLU 99 HB3 GLU 99 -4.230 18.021 -15.138 738 1HG GLU 99 HG2 GLU 99 -1.702 18.591 -16.749 739 2HG GLU 99 HG3 GLU 99 -2.589 17.069 -16.791 740 H HIS 100 H HIS 100 -4.902 20.558 -16.364 741 HA HIS 100 HA HIS 100 -6.859 21.441 -14.304 742 1HB HIS 100 HB2 HIS 100 -5.377 23.356 -14.798 743 2HB HIS 100 HB3 HIS 100 -5.702 23.183 -16.526 744 HD1 HIS 100 HD1 HIS 100 -7.792 23.702 -13.303 745 HD2 HIS 100 HD2 HIS 100 -7.667 24.713 -17.386 746 HE1 HIS 100 HE1 HIS 100 -9.742 25.298 -13.704 747 H TRP 101 H TRP 101 -8.635 20.382 -14.823 748 HA TRP 101 HA TRP 101 -9.524 20.227 -17.664 749 1HB TRP 101 HB2 TRP 101 -10.222 18.287 -15.441 750 2HB TRP 101 HB3 TRP 101 -10.627 18.164 -17.152 751 HD1 TRP 101 HD1 TRP 101 -7.576 18.841 -18.162 752 HE1 TRP 101 HE1 TRP 101 -5.720 17.152 -17.938 753 HE3 TRP 101 HE3 TRP 101 -9.800 15.720 -14.778 754 HZ2 TRP 101 HZ2 TRP 101 -5.241 14.677 -16.479 755 HZ3 TRP 101 HZ3 TRP 101 -8.626 13.691 -13.998 756 HH2 TRP 101 HH2 TRP 101 -6.337 13.158 -14.828 757 H GLY 102 H GLY 102 -12.088 20.124 -17.668 758 1HA GLY 102 HA1 GLY 102 -13.055 22.228 -15.771 759 2HA GLY 102 HA2 GLY 102 -13.151 22.413 -17.503 760 H PHE 103 H PHE 103 -14.673 21.066 -14.693 761 HA PHE 103 HA PHE 103 -16.893 20.101 -16.386 762 1HB PHE 103 HB2 PHE 103 -15.695 18.780 -13.927 763 2HB PHE 103 HB3 PHE 103 -17.228 18.314 -14.661 764 HD1 PHE 103 HD1 PHE 103 -13.571 18.130 -14.975 765 HD2 PHE 103 HD2 PHE 103 -17.314 17.478 -17.019 766 HE1 PHE 103 HE1 PHE 103 -12.393 16.839 -16.737 767 HE2 PHE 103 HE2 PHE 103 -16.137 16.227 -18.784 768 HZ PHE 103 HZ PHE 103 -13.663 15.895 -18.655 769 H ASP 104 H ASP 104 -18.664 21.113 -16.105 770 HA ASP 104 HA ASP 104 -19.321 22.818 -13.864 771 1HB ASP 104 HB2 ASP 104 -20.212 23.130 -16.177 772 2HB ASP 104 HB3 ASP 104 -21.031 21.564 -16.046 773 H ASP 105 H ASP 105 -21.135 22.366 -12.378 774 HA ASP 105 HA ASP 105 -20.653 19.830 -11.143 775 1HB ASP 105 HB2 ASP 105 -21.115 21.968 -9.925 776 2HB ASP 105 HB3 ASP 105 -22.819 21.801 -10.379 777 HA PRO 106 HA PRO 106 -23.819 17.814 -13.518 778 1HB PRO 106 HB2 PRO 106 -23.659 15.248 -12.535 779 2HB PRO 106 HB3 PRO 106 -22.411 15.967 -13.594 780 1HG PRO 106 HG2 PRO 106 -22.397 15.764 -10.567 781 2HG PRO 106 HG3 PRO 106 -21.081 15.358 -11.713 782 1HD PRO 106 HD2 PRO 106 -21.180 17.754 -10.416 783 2HD PRO 106 HD3 PRO 106 -20.584 17.624 -12.102 784 H ALA 107 H ALA 107 -23.908 17.739 -9.947 785 HA ALA 107 HA ALA 107 -26.425 16.396 -9.801 786 1HB ALA 107 HB1 ALA 107 -24.804 16.399 -7.945 787 2HB ALA 107 HB2 ALA 107 -25.046 18.148 -7.729 788 3HB ALA 107 HB3 ALA 107 -26.382 17.022 -7.428 789 H ARG 108 H ARG 108 -25.594 19.682 -10.509 790 HA ARG 108 HA ARG 108 -28.316 20.696 -9.894 791 1HB ARG 108 HB2 ARG 108 -25.706 22.100 -10.655 792 2HB ARG 108 HB3 ARG 108 -27.264 22.910 -10.536 793 1HG ARG 108 HG2 ARG 108 -26.357 23.358 -8.486 794 2HG ARG 108 HG3 ARG 108 -27.437 21.996 -8.151 795 1HD ARG 108 HD2 ARG 108 -25.457 20.470 -8.201 796 2HD ARG 108 HD3 ARG 108 -24.412 21.870 -8.510 797 HE ARG 108 HE ARG 108 -25.815 22.473 -6.190 798 1HH1 ARG 108 HH21 ARG 108 -23.536 19.933 -7.241 799 2HH1 ARG 108 HH22 ARG 108 -22.966 19.607 -5.642 800 1HH2 ARG 108 HH11 ARG 108 -25.037 22.030 -4.069 801 2HH2 ARG 108 HH12 ARG 108 -23.844 20.818 -3.803 802 H ALA 109 H ALA 109 -26.914 19.087 -12.485 803 HA ALA 109 HA ALA 109 -27.804 20.627 -14.687 804 1HB ALA 109 HB1 ALA 109 -26.283 18.642 -14.856 805 2HB ALA 109 HB2 ALA 109 -27.631 17.592 -14.354 806 3HB ALA 109 HB3 ALA 109 -27.726 18.473 -15.891 807 H GLN 110 H GLN 110 -29.825 20.558 -15.751 808 HA GLN 110 HA GLN 110 -32.093 19.217 -14.463 809 1HB GLN 110 HB2 GLN 110 -33.217 21.317 -13.834 810 2HB GLN 110 HB3 GLN 110 -31.722 21.058 -12.952 811 1HG GLN 110 HG2 GLN 110 -30.598 22.645 -14.670 812 2HG GLN 110 HG3 GLN 110 -32.236 23.041 -15.201 813 1HE2 GLN 110 HE22 GLN 110 -30.096 22.895 -12.310 814 2HE2 GLN 110 HE21 GLN 110 -30.860 24.224 -11.452 815 H GLY 111 H GLY 111 -34.155 19.824 -15.507 816 1HA GLY 111 HA1 GLY 111 -34.936 21.147 -17.636 817 2HA GLY 111 HA2 GLY 111 -33.876 19.965 -18.445 818 H THR 112 H THR 112 -34.170 17.708 -16.988 819 HA THR 112 HA THR 112 -36.707 17.050 -16.006 820 HB THR 112 HB THR 112 -37.487 16.972 -18.291 821 HG1 THR 112 HG1 THR 112 -38.349 15.316 -17.270 822 1HG2 THR 112 HG21 THR 112 -35.473 16.832 -19.601 823 2HG2 THR 112 HG22 THR 112 -35.094 15.227 -18.939 824 3HG2 THR 112 HG23 THR 112 -36.503 15.453 -19.996 825 H GLU 113 H GLU 113 -36.562 14.591 -15.397 826 HA GLU 113 HA GLU 113 -34.142 14.236 -13.963 827 1HB GLU 113 HB2 GLU 113 -36.245 13.251 -13.246 828 2HB GLU 113 HB3 GLU 113 -36.349 12.274 -14.718 829 1HG GLU 113 HG2 GLU 113 -34.377 10.989 -14.079 830 2HG GLU 113 HG3 GLU 113 -34.096 12.034 -12.679 831 H GLU 114 H GLU 114 -35.222 12.909 -17.086 832 HA GLU 114 HA GLU 114 -32.922 11.239 -17.383 833 1HB GLU 114 HB2 GLU 114 -33.643 10.878 -19.674 834 2HB GLU 114 HB3 GLU 114 -34.976 10.700 -18.535 835 1HG GLU 114 HG2 GLU 114 -35.819 12.943 -19.139 836 2HG GLU 114 HG3 GLU 114 -34.467 13.164 -20.259 837 H GLU 115 H GLU 115 -33.434 14.663 -18.018 838 HA GLU 115 HA GLU 115 -31.144 14.934 -19.756 839 1HB GLU 115 HB2 GLU 115 -33.098 16.501 -19.794 840 2HB GLU 115 HB3 GLU 115 -32.652 17.054 -18.178 841 1HG GLU 115 HG2 GLU 115 -31.843 18.663 -19.720 842 2HG GLU 115 HG3 GLU 115 -30.437 17.814 -19.097 843 H LYS 116 H LYS 116 -31.929 15.496 -16.300 844 HA LYS 116 HA LYS 116 -29.363 16.300 -15.425 845 1HB LYS 116 HB2 LYS 116 -31.292 16.613 -14.037 846 2HB LYS 116 HB3 LYS 116 -31.690 14.893 -14.070 847 1HG LYS 116 HG2 LYS 116 -29.758 14.326 -12.771 848 2HG LYS 116 HG3 LYS 116 -29.158 15.995 -12.793 849 1HD LYS 116 HD2 LYS 116 -31.911 15.432 -11.677 850 2HD LYS 116 HD3 LYS 116 -30.490 14.953 -10.730 851 1HE LYS 116 HE2 LYS 116 -29.637 17.346 -10.999 852 2HE LYS 116 HE3 LYS 116 -31.227 17.746 -11.653 853 1HZ LYS 116 HZ1 LYS 116 -32.203 17.033 -9.545 854 2HZ LYS 116 HZ2 LYS 116 -30.723 16.661 -8.944 855 3HZ LYS 116 HZ3 LYS 116 -31.092 18.203 -9.296 856 H TRP 117 H TRP 117 -30.782 13.002 -15.613 857 HA TRP 117 HA TRP 117 -28.389 11.699 -14.769 858 1HB TRP 117 HB2 TRP 117 -30.609 10.621 -14.765 859 2HB TRP 117 HB3 TRP 117 -30.615 10.610 -16.529 860 HD1 TRP 117 HD1 TRP 117 -29.077 8.831 -17.745 861 HE1 TRP 117 HE1 TRP 117 -27.955 6.639 -16.969 862 HE3 TRP 117 HE3 TRP 117 -29.183 9.601 -12.690 863 HZ2 TRP 117 HZ2 TRP 117 -27.089 5.468 -14.517 864 HZ3 TRP 117 HZ3 TRP 117 -28.059 8.009 -11.164 865 HH2 TRP 117 HH2 TRP 117 -27.021 5.931 -12.049 866 H ALA 118 H ALA 118 -29.538 12.587 -18.099 867 HA ALA 118 HA ALA 118 -27.410 11.353 -19.477 868 1HB ALA 118 HB1 ALA 118 -29.375 12.255 -20.626 869 2HB ALA 118 HB2 ALA 118 -28.929 13.910 -20.158 870 3HB ALA 118 HB3 ALA 118 -27.902 12.998 -21.276 871 H PHE 119 H PHE 119 -27.534 14.490 -17.760 872 HA PHE 119 HA PHE 119 -24.930 15.337 -18.591 873 1HB PHE 119 HB2 PHE 119 -26.929 16.632 -17.461 874 2HB PHE 119 HB3 PHE 119 -26.170 16.134 -15.959 875 HD1 PHE 119 HD1 PHE 119 -26.139 18.462 -18.727 876 HD2 PHE 119 HD2 PHE 119 -23.714 16.844 -15.549 877 HE1 PHE 119 HE1 PHE 119 -24.652 20.442 -18.850 878 HE2 PHE 119 HE2 PHE 119 -22.251 18.854 -15.646 879 HZ PHE 119 HZ PHE 119 -22.711 20.642 -17.315 880 H PHE 120 H PHE 120 -26.117 13.451 -15.729 881 HA PHE 120 HA PHE 120 -23.610 13.090 -14.446 882 1HB PHE 120 HB2 PHE 120 -25.786 10.991 -14.668 883 2HB PHE 120 HB3 PHE 120 -24.470 11.054 -13.518 884 HD1 PHE 120 HD1 PHE 120 -25.643 14.403 -13.476 885 HD2 PHE 120 HD2 PHE 120 -26.739 10.378 -12.352 886 HE1 PHE 120 HE1 PHE 120 -27.157 15.275 -11.739 887 HE2 PHE 120 HE2 PHE 120 -28.298 11.276 -10.658 888 HZ PHE 120 HZ PHE 120 -28.483 13.733 -10.321 889 H GLN 121 H GLN 121 -25.139 11.313 -17.209 890 HA GLN 121 HA GLN 121 -23.085 9.344 -17.499 891 1HB GLN 121 HB2 GLN 121 -25.030 10.496 -19.535 892 2HB GLN 121 HB3 GLN 121 -23.924 9.191 -19.888 893 1HG GLN 121 HG2 GLN 121 -26.022 9.071 -17.684 894 2HG GLN 121 HG3 GLN 121 -26.286 8.503 -19.324 895 1HE2 GLN 121 HE22 GLN 121 -25.599 7.369 -16.316 896 2HE2 GLN 121 HE21 GLN 121 -24.668 5.948 -16.735 897 H ARG 122 H ARG 122 -23.517 12.523 -19.121 898 HA ARG 122 HA ARG 122 -21.174 12.309 -20.715 899 1HB ARG 122 HB2 ARG 122 -22.865 14.648 -19.796 900 2HB ARG 122 HB3 ARG 122 -21.265 14.976 -20.446 901 1HG ARG 122 HG2 ARG 122 -22.761 15.170 -22.262 902 2HG ARG 122 HG3 ARG 122 -21.812 13.698 -22.508 903 1HD ARG 122 HD2 ARG 122 -23.753 12.383 -21.565 904 2HD ARG 122 HD3 ARG 122 -24.676 13.904 -21.504 905 HE ARG 122 HE ARG 122 -23.784 13.719 -24.114 906 1HH1 ARG 122 HH11 ARG 122 -25.746 11.706 -21.969 907 2HH1 ARG 122 HH12 ARG 122 -26.696 11.005 -23.234 908 1HH2 ARG 122 HH21 ARG 122 -25.049 12.807 -25.821 909 2HH2 ARG 122 HH22 ARG 122 -26.291 11.665 -25.478 910 H VAL 123 H VAL 123 -21.563 13.868 -17.476 911 HA VAL 123 HA VAL 123 -18.796 14.583 -17.414 912 HB VAL 123 HB VAL 123 -20.850 14.371 -15.169 913 1HG1 VAL 123 HG11 VAL 123 -18.093 15.688 -15.140 914 2HG1 VAL 123 HG12 VAL 123 -19.330 15.864 -13.878 915 3HG1 VAL 123 HG13 VAL 123 -18.591 14.286 -14.174 916 1HG2 VAL 123 HG21 VAL 123 -20.889 16.865 -15.390 917 2HG2 VAL 123 HG22 VAL 123 -19.768 16.762 -16.753 918 3HG2 VAL 123 HG23 VAL 123 -21.398 16.083 -16.890 919 H ARG 124 H ARG 124 -20.458 11.629 -15.912 920 HA ARG 124 HA ARG 124 -17.970 10.789 -14.852 921 1HB ARG 124 HB2 ARG 124 -18.911 8.615 -14.480 922 2HB ARG 124 HB3 ARG 124 -20.190 9.797 -14.168 923 1HG ARG 124 HG2 ARG 124 -21.045 9.234 -16.529 924 2HG ARG 124 HG3 ARG 124 -19.838 7.962 -16.581 925 1HD ARG 124 HD2 ARG 124 -21.681 6.794 -15.914 926 2HD ARG 124 HD3 ARG 124 -20.907 7.126 -14.354 927 HE ARG 124 HE ARG 124 -22.654 9.264 -14.848 928 1HH1 ARG 124 HH21 ARG 124 -22.860 5.789 -14.152 929 2HH1 ARG 124 HH22 ARG 124 -24.557 5.762 -13.885 930 1HH2 ARG 124 HH11 ARG 124 -24.936 9.276 -14.230 931 2HH2 ARG 124 HH12 ARG 124 -25.715 7.827 -13.732 932 H ASP 125 H ASP 125 -19.428 10.174 -18.050 933 HA ASP 125 HA ASP 125 -17.525 8.283 -18.929 934 1HB ASP 125 HB2 ASP 125 -19.596 8.676 -20.155 935 2HB ASP 125 HB3 ASP 125 -19.101 10.333 -20.530 936 H GLU 126 H GLU 126 -17.515 11.901 -19.173 937 HA GLU 126 HA GLU 126 -15.007 11.887 -20.514 938 1HB GLU 126 HB2 GLU 126 -16.777 14.009 -19.379 939 2HB GLU 126 HB3 GLU 126 -15.091 14.409 -19.732 940 1HG GLU 126 HG2 GLU 126 -16.801 13.038 -21.809 941 2HG GLU 126 HG3 GLU 126 -16.848 14.782 -21.573 942 H ILE 127 H ILE 127 -15.875 12.173 -17.030 943 HA ILE 127 HA ILE 127 -13.207 12.871 -16.248 944 HB ILE 127 HB ILE 127 -15.642 12.654 -14.924 945 1HG1 ILE 127 HG12 ILE 127 -14.322 13.208 -12.824 946 2HG1 ILE 127 HG13 ILE 127 -12.850 13.046 -13.800 947 1HG2 ILE 127 HG21 ILE 127 -13.893 10.570 -13.673 948 2HG2 ILE 127 HG22 ILE 127 -15.417 11.227 -13.029 949 3HG2 ILE 127 HG23 ILE 127 -15.439 10.322 -14.545 950 1HD1 ILE 127 HD11 ILE 127 -13.687 14.811 -15.308 951 2HD1 ILE 127 HD12 ILE 127 -15.222 14.875 -14.409 952 3HD1 ILE 127 HD13 ILE 127 -13.706 15.400 -13.628 953 H GLY 128 H GLY 128 -14.848 9.736 -16.745 954 1HA GLY 128 HA1 GLY 128 -12.650 8.050 -16.093 955 2HA GLY 128 HA2 GLY 128 -13.992 7.671 -17.200 956 H ASN 129 H ASN 129 -13.672 9.572 -19.190 957 HA ASN 129 HA ASN 129 -11.623 8.537 -20.812 958 1HB ASN 129 HB2 ASN 129 -13.772 9.637 -21.518 959 2HB ASN 129 HB3 ASN 129 -13.040 11.185 -21.086 960 1HD2 ASN 129 HD22 ASN 129 -13.386 11.923 -23.172 961 2HD2 ASN 129 HD21 ASN 129 -12.433 11.361 -24.549 962 H ARG 130 H ARG 130 -11.653 11.504 -18.803 963 HA ARG 130 HA ARG 130 -9.110 12.526 -19.556 964 1HB ARG 130 HB2 ARG 130 -10.201 12.540 -16.702 965 2HB ARG 130 HB3 ARG 130 -8.913 13.519 -17.345 966 1HG ARG 130 HG2 ARG 130 -11.878 13.877 -17.774 967 2HG ARG 130 HG3 ARG 130 -10.759 14.889 -16.938 968 1HD ARG 130 HD2 ARG 130 -11.189 16.044 -18.902 969 2HD ARG 130 HD3 ARG 130 -9.598 15.336 -19.148 970 HE ARG 130 HE ARG 130 -12.170 14.156 -20.194 971 1HH1 ARG 130 HH21 ARG 130 -8.769 15.012 -20.788 972 2HH1 ARG 130 HH22 ARG 130 -8.662 14.072 -22.254 973 1HH2 ARG 130 HH11 ARG 130 -12.135 13.324 -22.306 974 2HH2 ARG 130 HH12 ARG 130 -10.565 13.061 -23.086 975 H LEU 131 H LEU 131 -9.984 10.159 -16.977 976 HA LEU 131 HA LEU 131 -7.248 9.751 -16.283 977 1HB LEU 131 HB2 LEU 131 -9.829 8.451 -15.509 978 2HB LEU 131 HB3 LEU 131 -8.358 7.520 -15.252 979 HG LEU 131 HG LEU 131 -8.972 8.746 -13.302 980 1HD1 LEU 131 HD11 LEU 131 -6.572 8.185 -13.795 981 2HD1 LEU 131 HD12 LEU 131 -6.344 9.837 -14.410 982 3HD1 LEU 131 HD13 LEU 131 -6.758 9.579 -12.730 983 1HD2 LEU 131 HD21 LEU 131 -8.828 11.125 -13.057 984 2HD2 LEU 131 HD22 LEU 131 -8.363 11.333 -14.759 985 3HD2 LEU 131 HD23 LEU 131 -9.986 10.747 -14.331 986 H LYS 132 H LYS 132 -9.376 7.991 -18.532 987 HA LYS 132 HA LYS 132 -7.554 5.910 -19.123 988 1HB LYS 132 HB2 LYS 132 -9.708 5.548 -19.850 989 2HB LYS 132 HB3 LYS 132 -9.947 7.162 -20.444 990 1HG LYS 132 HG2 LYS 132 -8.091 5.239 -21.895 991 2HG LYS 132 HG3 LYS 132 -9.843 5.178 -22.085 992 1HD LYS 132 HD2 LYS 132 -9.443 7.858 -22.476 993 2HD LYS 132 HD3 LYS 132 -7.919 7.219 -23.110 994 1HE LYS 132 HE2 LYS 132 -9.077 5.853 -24.728 995 2HE LYS 132 HE3 LYS 132 -10.633 6.122 -23.928 996 1HZ LYS 132 HZ1 LYS 132 -10.493 8.457 -24.524 997 2HZ LYS 132 HZ2 LYS 132 -9.083 8.209 -25.338 998 3HZ LYS 132 HZ3 LYS 132 -10.460 7.511 -25.861 999 H GLU 133 H GLU 133 -7.894 9.135 -20.715 1000 HA GLU 133 HA GLU 133 -5.679 8.705 -22.508 1001 1HB GLU 133 HB2 GLU 133 -6.797 11.234 -21.219 1002 2HB GLU 133 HB3 GLU 133 -5.486 11.233 -22.409 1003 1HG GLU 133 HG2 GLU 133 -6.908 10.455 -24.157 1004 2HG GLU 133 HG3 GLU 133 -8.223 10.083 -23.033 1005 H PHE 134 H PHE 134 -5.867 10.219 -19.250 1006 HA PHE 134 HA PHE 134 -3.179 10.932 -19.059 1007 1HB PHE 134 HB2 PHE 134 -4.892 11.729 -17.589 1008 2HB PHE 134 HB3 PHE 134 -5.263 10.095 -17.036 1009 HD1 PHE 134 HD1 PHE 134 -2.765 12.826 -16.880 1010 HD2 PHE 134 HD2 PHE 134 -4.079 9.043 -15.277 1011 HE1 PHE 134 HE1 PHE 134 -1.112 13.029 -15.054 1012 HE2 PHE 134 HE2 PHE 134 -2.483 9.299 -13.384 1013 HZ PHE 134 HZ PHE 134 -0.996 11.274 -13.296 1014 H ALA 135 H ALA 135 -4.714 7.819 -18.284 1015 HA ALA 135 HA ALA 135 -2.352 6.594 -17.239 1016 1HB ALA 135 HB1 ALA 135 -3.665 4.503 -17.386 1017 2HB ALA 135 HB2 ALA 135 -4.585 5.814 -16.626 1018 3HB ALA 135 HB3 ALA 135 -4.917 5.356 -18.314 1019 H GLU 136 H GLU 136 -4.001 6.442 -20.399 1020 HA GLU 136 HA GLU 136 -2.230 4.485 -21.509 1021 1HB GLU 136 HB2 GLU 136 -4.310 6.322 -22.737 1022 2HB GLU 136 HB3 GLU 136 -3.387 5.174 -23.694 1023 1HG GLU 136 HG2 GLU 136 -5.105 4.343 -21.315 1024 2HG GLU 136 HG3 GLU 136 -5.664 4.368 -22.982 1025 H THR 137 H THR 137 -2.370 8.014 -21.749 1026 HA THR 137 HA THR 137 -0.268 8.069 -23.709 1027 HB THR 137 HB THR 137 -0.702 10.420 -23.838 1028 HG1 THR 137 HG1 THR 137 -2.603 10.041 -21.791 1029 1HG2 THR 137 HG21 THR 137 -2.172 8.907 -25.098 1030 2HG2 THR 137 HG22 THR 137 -3.283 8.786 -23.727 1031 3HG2 THR 137 HG23 THR 137 -3.064 10.345 -24.559 1032 H GLY 138 H GLY 138 -0.586 8.362 -20.243 1033 1HA GLY 138 HA1 GLY 138 0.862 8.835 -18.555 1034 2HA GLY 138 HA2 GLY 138 2.231 8.690 -19.685 1035 H LYS 139 H LYS 139 -0.647 10.792 -19.750 1036 HA LYS 139 HA LYS 139 0.475 13.041 -20.845 1037 1HB LYS 139 HB2 LYS 139 -1.943 12.498 -20.500 1038 2HB LYS 139 HB3 LYS 139 -1.778 12.994 -18.810 1039 1HG LYS 139 HG2 LYS 139 -1.228 15.263 -19.465 1040 2HG LYS 139 HG3 LYS 139 -1.188 14.815 -21.179 1041 1HD LYS 139 HD2 LYS 139 -3.650 14.744 -19.376 1042 2HD LYS 139 HD3 LYS 139 -3.265 15.999 -20.561 1043 1HE LYS 139 HE2 LYS 139 -3.361 14.275 -22.388 1044 2HE LYS 139 HE3 LYS 139 -3.844 13.065 -21.195 1045 1HZ LYS 139 HZ1 LYS 139 -5.804 13.959 -22.283 1046 2HZ LYS 139 HZ2 LYS 139 -5.804 14.457 -20.726 1047 3HZ LYS 139 HZ3 LYS 139 -5.373 15.494 -21.918 Start of MODEL 15 1 1H MET 1 H1 MET 1 3.138 3.688 3.135 2 2H MET 1 H2 MET 1 1.878 2.665 3.384 3 3H MET 1 H3 MET 1 3.375 2.276 3.948 4 HA MET 1 HA MET 1 4.243 2.141 1.740 5 1HB MET 1 HB2 MET 1 3.166 0.126 2.868 6 2HB MET 1 HB3 MET 1 1.736 0.412 1.877 7 1HG MET 1 HG2 MET 1 4.564 -0.052 0.830 8 2HG MET 1 HG3 MET 1 3.341 -1.304 1.005 9 1HE MET 1 HE1 MET 1 3.857 -2.065 -1.472 10 2HE MET 1 HE2 MET 1 3.779 -0.978 -2.875 11 3HE MET 1 HE3 MET 1 5.040 -0.747 -1.643 12 H GLU 2 H GLU 2 4.221 3.352 -0.064 13 HA GLU 2 HA GLU 2 1.894 3.759 -1.692 14 1HB GLU 2 HB2 GLU 2 2.121 6.281 -1.628 15 2HB GLU 2 HB3 GLU 2 1.311 5.549 -0.264 16 1HG GLU 2 HG2 GLU 2 4.266 6.162 -0.043 17 2HG GLU 2 HG3 GLU 2 3.093 7.471 0.050 18 H ASN 3 H ASN 3 2.680 5.319 -3.566 19 HA ASN 3 HA ASN 3 5.577 5.016 -4.101 20 1HB ASN 3 HB2 ASN 3 4.791 2.974 -4.989 21 2HB ASN 3 HB3 ASN 3 3.405 3.738 -5.748 22 1HD2 ASN 3 HD22 ASN 3 3.636 4.620 -7.800 23 2HD2 ASN 3 HD21 ASN 3 5.166 4.634 -8.681 24 H LYS 4 H LYS 4 2.443 6.205 -5.354 25 HA LYS 4 HA LYS 4 3.666 8.877 -5.743 26 1HB LYS 4 HB2 LYS 4 2.029 7.354 -7.816 27 2HB LYS 4 HB3 LYS 4 2.192 9.111 -7.846 28 1HG LYS 4 HG2 LYS 4 4.636 8.952 -8.006 29 2HG LYS 4 HG3 LYS 4 4.544 7.192 -7.989 30 1HD LYS 4 HD2 LYS 4 3.438 9.028 -10.149 31 2HD LYS 4 HD3 LYS 4 4.870 7.982 -10.242 32 1HE LYS 4 HE2 LYS 4 3.269 6.031 -9.702 33 2HE LYS 4 HE3 LYS 4 1.952 7.158 -10.028 34 1HZ LYS 4 HZ1 LYS 4 4.088 6.532 -11.993 35 2HZ LYS 4 HZ2 LYS 4 2.672 5.726 -11.932 36 3HZ LYS 4 HZ3 LYS 4 2.690 7.341 -12.281 37 H ILE 5 H ILE 5 1.753 10.485 -6.103 38 HA ILE 5 HA ILE 5 -0.680 9.736 -4.604 39 HB ILE 5 HB ILE 5 1.251 11.996 -3.901 40 1HG1 ILE 5 HG12 ILE 5 0.409 9.601 -2.240 41 2HG1 ILE 5 HG13 ILE 5 1.996 9.901 -2.935 42 1HG2 ILE 5 HG21 ILE 5 -1.502 11.396 -2.751 43 2HG2 ILE 5 HG22 ILE 5 -0.409 12.677 -2.145 44 3HG2 ILE 5 HG23 ILE 5 -1.097 12.795 -3.752 45 1HD1 ILE 5 HD11 ILE 5 2.152 10.425 -0.631 46 2HD1 ILE 5 HD12 ILE 5 2.191 11.966 -1.509 47 3HD1 ILE 5 HD13 ILE 5 0.711 11.446 -0.663 48 H ILE 6 H ILE 6 -2.408 10.636 -5.667 49 HA ILE 6 HA ILE 6 -1.932 12.953 -7.449 50 HB ILE 6 HB ILE 6 -2.090 11.215 -8.979 51 1HG1 ILE 6 HG12 ILE 6 -4.862 12.463 -8.728 52 2HG1 ILE 6 HG13 ILE 6 -3.443 13.192 -9.481 53 1HG2 ILE 6 HG21 ILE 6 -2.897 9.387 -7.535 54 2HG2 ILE 6 HG22 ILE 6 -4.519 10.105 -7.533 55 3HG2 ILE 6 HG23 ILE 6 -3.810 9.460 -9.030 56 1HD1 ILE 6 HD11 ILE 6 -4.814 12.377 -11.240 57 2HD1 ILE 6 HD12 ILE 6 -3.468 11.217 -11.124 58 3HD1 ILE 6 HD13 ILE 6 -5.059 10.810 -10.448 59 H TYR 7 H TYR 7 -3.407 14.611 -7.027 60 HA TYR 7 HA TYR 7 -5.571 14.013 -5.068 61 1HB TYR 7 HB2 TYR 7 -3.463 15.031 -4.171 62 2HB TYR 7 HB3 TYR 7 -3.855 16.503 -5.061 63 HD1 TYR 7 HD1 TYR 7 -3.345 16.903 -2.451 64 HD2 TYR 7 HD2 TYR 7 -7.051 15.328 -3.990 65 HE1 TYR 7 HE1 TYR 7 -4.484 17.566 -0.364 66 HE2 TYR 7 HE2 TYR 7 -8.151 15.874 -1.879 67 HH TYR 7 HH TYR 7 -6.424 17.329 0.907 68 H PHE 8 H PHE 8 -7.476 14.223 -6.200 69 HA PHE 8 HA PHE 8 -7.833 16.117 -8.388 70 1HB PHE 8 HB2 PHE 8 -9.715 14.245 -6.851 71 2HB PHE 8 HB3 PHE 8 -10.182 15.210 -8.238 72 HD1 PHE 8 HD1 PHE 8 -8.939 12.003 -7.253 73 HD2 PHE 8 HD2 PHE 8 -8.827 14.921 -10.405 74 HE1 PHE 8 HE1 PHE 8 -8.095 10.286 -8.843 75 HE2 PHE 8 HE2 PHE 8 -7.942 13.216 -11.975 76 HZ PHE 8 HZ PHE 8 -7.537 10.897 -11.166 77 H LEU 9 H LEU 9 -9.024 17.992 -8.340 78 HA LEU 9 HA LEU 9 -9.986 19.010 -5.722 79 1HB LEU 9 HB2 LEU 9 -7.534 19.475 -6.253 80 2HB LEU 9 HB3 LEU 9 -8.047 20.364 -7.666 81 HG LEU 9 HG LEU 9 -7.382 21.797 -5.822 82 1HD1 LEU 9 HD11 LEU 9 -10.378 22.208 -6.024 83 2HD1 LEU 9 HD12 LEU 9 -9.079 23.398 -5.884 84 3HD1 LEU 9 HD13 LEU 9 -9.283 22.507 -7.393 85 1HD2 LEU 9 HD21 LEU 9 -7.928 20.381 -3.942 86 2HD2 LEU 9 HD22 LEU 9 -8.704 21.978 -3.773 87 3HD2 LEU 9 HD23 LEU 9 -9.659 20.560 -4.238 88 H CYS 10 H CYS 10 -11.946 20.048 -5.965 89 HA CYS 10 HA CYS 10 -12.731 21.145 -8.637 90 1HB CYS 10 HB2 CYS 10 -14.532 19.580 -6.721 91 2HB CYS 10 HB3 CYS 10 -15.003 20.277 -8.284 92 HG CYS 10 HG CYS 10 -13.128 17.752 -7.471 93 H THR 11 H THR 11 -14.710 22.704 -8.393 94 HA THR 11 HA THR 11 -14.384 24.525 -6.196 95 HB THR 11 HB THR 11 -16.635 25.374 -7.221 96 HG1 THR 11 HG1 THR 11 -16.891 24.674 -9.359 97 1HG2 THR 11 HG21 THR 11 -14.323 26.332 -7.507 98 2HG2 THR 11 HG22 THR 11 -14.136 25.307 -8.946 99 3HG2 THR 11 HG23 THR 11 -15.399 26.558 -8.901 100 H GLY 12 H GLY 12 -16.084 21.546 -6.445 101 1HA GLY 12 HA1 GLY 12 -16.971 21.784 -3.701 102 2HA GLY 12 HA2 GLY 12 -18.288 21.561 -4.882 103 H ASN 13 H ASN 13 -16.030 19.990 -2.997 104 HA ASN 13 HA ASN 13 -14.919 17.960 -4.601 105 1HB ASN 13 HB2 ASN 13 -14.173 18.544 -2.318 106 2HB ASN 13 HB3 ASN 13 -15.715 18.061 -1.661 107 1HD2 ASN 13 HD22 ASN 13 -14.142 15.917 -4.132 108 2HD2 ASN 13 HD21 ASN 13 -13.819 14.693 -2.915 109 H SER 14 H SER 14 -17.989 18.138 -2.910 110 HA SER 14 HA SER 14 -18.771 15.752 -2.338 111 1HB SER 14 HB2 SER 14 -20.549 17.859 -3.583 112 2HB SER 14 HB3 SER 14 -21.017 16.662 -2.353 113 HG SER 14 HG SER 14 -20.404 18.910 -1.687 114 H CYS 15 H CYS 15 -18.407 16.395 -5.747 115 HA CYS 15 HA CYS 15 -19.316 13.663 -6.148 116 1HB CYS 15 HB2 CYS 15 -20.653 14.245 -8.218 117 2HB CYS 15 HB3 CYS 15 -21.410 14.660 -6.678 118 HG CYS 15 HG CYS 15 -20.770 17.165 -6.650 119 H ARG 16 H ARG 16 -18.145 16.513 -8.056 120 HA ARG 16 HA ARG 16 -17.181 14.977 -10.147 121 1HB ARG 16 HB2 ARG 16 -16.383 17.705 -9.108 122 2HB ARG 16 HB3 ARG 16 -15.559 17.009 -10.515 123 1HG ARG 16 HG2 ARG 16 -17.593 16.815 -11.760 124 2HG ARG 16 HG3 ARG 16 -18.584 17.234 -10.353 125 1HD ARG 16 HD2 ARG 16 -16.488 19.111 -11.493 126 2HD ARG 16 HD3 ARG 16 -18.153 19.084 -12.078 127 HE ARG 16 HE ARG 16 -18.627 19.372 -9.447 128 1HH1 ARG 16 HH21 ARG 16 -16.597 21.245 -11.667 129 2HH1 ARG 16 HH22 ARG 16 -16.497 22.613 -10.576 130 1HH2 ARG 16 HH12 ARG 16 -18.738 21.178 -8.254 131 2HH2 ARG 16 HH11 ARG 16 -17.706 22.576 -8.574 132 H SER 17 H SER 17 -15.021 16.077 -7.390 133 HA SER 17 HA SER 17 -12.868 14.566 -8.529 134 1HB SER 17 HB2 SER 17 -11.986 14.897 -6.042 135 2HB SER 17 HB3 SER 17 -11.965 16.156 -7.259 136 HG SER 17 HG SER 17 -12.796 17.044 -5.425 137 H GLN 18 H GLN 18 -15.408 13.745 -6.153 138 HA GLN 18 HA GLN 18 -14.321 11.277 -5.290 139 1HB GLN 18 HB2 GLN 18 -17.258 12.032 -5.712 140 2HB GLN 18 HB3 GLN 18 -16.688 10.661 -4.781 141 1HG GLN 18 HG2 GLN 18 -16.071 13.562 -4.114 142 2HG GLN 18 HG3 GLN 18 -17.364 12.628 -3.392 143 1HE2 GLN 18 HE22 GLN 18 -15.673 13.662 -1.618 144 2HE2 GLN 18 HE21 GLN 18 -14.548 12.475 -1.011 145 H MET 19 H MET 19 -16.361 12.020 -8.141 146 HA MET 19 HA MET 19 -16.566 9.314 -9.080 147 1HB MET 19 HB2 MET 19 -16.822 12.005 -10.498 148 2HB MET 19 HB3 MET 19 -17.183 10.450 -11.258 149 1HG MET 19 HG2 MET 19 -19.005 10.019 -9.769 150 2HG MET 19 HG3 MET 19 -18.524 11.312 -8.684 151 1HE MET 19 HE1 MET 19 -20.631 11.953 -12.760 152 2HE MET 19 HE2 MET 19 -18.954 11.377 -12.676 153 3HE MET 19 HE3 MET 19 -20.274 10.372 -12.032 154 H ALA 20 H ALA 20 -14.327 12.033 -9.918 155 HA ALA 20 HA ALA 20 -12.800 10.697 -11.861 156 1HB ALA 20 HB1 ALA 20 -11.075 12.342 -11.396 157 2HB ALA 20 HB2 ALA 20 -12.647 13.156 -11.263 158 3HB ALA 20 HB3 ALA 20 -11.754 12.694 -9.802 159 H GLU 21 H GLU 21 -12.399 10.754 -8.301 160 HA GLU 21 HA GLU 21 -10.025 9.262 -8.198 161 1HB GLU 21 HB2 GLU 21 -10.671 10.464 -6.315 162 2HB GLU 21 HB3 GLU 21 -12.280 9.723 -6.227 163 1HG GLU 21 HG2 GLU 21 -11.289 7.594 -5.553 164 2HG GLU 21 HG3 GLU 21 -9.672 8.264 -5.673 165 H GLY 22 H GLY 22 -13.453 8.113 -8.122 166 1HA GLY 22 HA1 GLY 22 -12.927 5.379 -7.753 167 2HA GLY 22 HA2 GLY 22 -14.335 6.057 -8.578 168 H TRP 23 H TRP 23 -13.174 7.206 -10.907 169 HA TRP 23 HA TRP 23 -12.631 4.834 -12.497 170 1HB TRP 23 HB2 TRP 23 -12.294 7.792 -13.116 171 2HB TRP 23 HB3 TRP 23 -12.010 6.514 -14.278 172 HD1 TRP 23 HD1 TRP 23 -14.715 8.524 -12.665 173 HE1 TRP 23 HE1 TRP 23 -16.907 8.232 -13.880 174 HE3 TRP 23 HE3 TRP 23 -13.420 4.621 -15.734 175 HZ2 TRP 23 HZ2 TRP 23 -18.018 6.516 -15.915 176 HZ3 TRP 23 HZ3 TRP 23 -15.070 3.745 -17.364 177 HH2 TRP 23 HH2 TRP 23 -17.384 4.717 -17.459 178 H ALA 24 H ALA 24 -10.537 7.469 -11.179 179 HA ALA 24 HA ALA 24 -8.232 6.664 -12.582 180 1HB ALA 24 HB1 ALA 24 -8.551 8.860 -11.397 181 2HB ALA 24 HB2 ALA 24 -8.342 8.021 -9.851 182 3HB ALA 24 HB3 ALA 24 -7.003 8.080 -11.021 183 H LYS 25 H LYS 25 -9.537 5.530 -9.446 184 HA LYS 25 HA LYS 25 -7.299 3.983 -8.659 185 1HB LYS 25 HB2 LYS 25 -10.276 3.640 -8.203 186 2HB LYS 25 HB3 LYS 25 -9.104 2.501 -7.536 187 1HG LYS 25 HG2 LYS 25 -8.038 4.178 -6.183 188 2HG LYS 25 HG3 LYS 25 -8.897 5.489 -6.991 189 1HD LYS 25 HD2 LYS 25 -11.061 4.618 -6.161 190 2HD LYS 25 HD3 LYS 25 -10.216 3.301 -5.312 191 1HE LYS 25 HE2 LYS 25 -9.051 4.891 -3.879 192 2HE LYS 25 HE3 LYS 25 -9.612 6.244 -4.865 193 1HZ LYS 25 HZ1 LYS 25 -11.231 4.619 -3.019 194 2HZ LYS 25 HZ2 LYS 25 -10.992 6.267 -3.070 195 3HZ LYS 25 HZ3 LYS 25 -11.924 5.565 -4.190 196 H GLN 26 H GLN 26 -9.747 3.288 -11.148 197 HA GLN 26 HA GLN 26 -8.932 0.513 -11.498 198 1HB GLN 26 HB2 GLN 26 -10.196 2.334 -13.565 199 2HB GLN 26 HB3 GLN 26 -10.065 0.585 -13.612 200 1HG GLN 26 HG2 GLN 26 -11.578 0.461 -11.600 201 2HG GLN 26 HG3 GLN 26 -11.806 2.222 -11.728 202 1HE2 GLN 26 HE22 GLN 26 -12.019 2.784 -14.329 203 2HE2 GLN 26 HE21 GLN 26 -13.343 1.923 -15.090 204 H TYR 27 H TYR 27 -8.404 3.499 -13.376 205 HA TYR 27 HA TYR 27 -6.649 2.267 -15.226 206 1HB TYR 27 HB2 TYR 27 -7.016 5.219 -14.583 207 2HB TYR 27 HB3 TYR 27 -6.183 4.585 -15.995 208 HD1 TYR 27 HD1 TYR 27 -9.241 5.922 -14.979 209 HD2 TYR 27 HD2 TYR 27 -7.615 2.714 -17.363 210 HE1 TYR 27 HE1 TYR 27 -11.325 5.854 -16.321 211 HE2 TYR 27 HE2 TYR 27 -9.717 2.598 -18.655 212 HH TYR 27 HH TYR 27 -11.856 3.492 -18.961 213 H LEU 28 H LEU 28 -5.889 4.023 -12.239 214 HA LEU 28 HA LEU 28 -3.026 4.137 -12.947 215 1HB LEU 28 HB2 LEU 28 -4.544 5.335 -10.597 216 2HB LEU 28 HB3 LEU 28 -2.898 5.671 -11.054 217 HG LEU 28 HG LEU 28 -5.379 6.461 -12.595 218 1HD1 LEU 28 HD11 LEU 28 -4.628 8.726 -12.128 219 2HD1 LEU 28 HD12 LEU 28 -4.720 7.821 -10.604 220 3HD1 LEU 28 HD13 LEU 28 -3.144 8.121 -11.357 221 1HD2 LEU 28 HD21 LEU 28 -3.902 7.541 -14.226 222 2HD2 LEU 28 HD22 LEU 28 -2.475 6.825 -13.442 223 3HD2 LEU 28 HD23 LEU 28 -3.682 5.804 -14.255 224 H GLY 29 H GLY 29 -5.116 2.700 -10.456 225 1HA GLY 29 HA1 GLY 29 -4.806 0.797 -9.223 226 2HA GLY 29 HA2 GLY 29 -3.299 0.510 -10.092 227 H ASP 30 H ASP 30 -2.897 -0.285 -7.843 228 HA ASP 30 HA ASP 30 -2.670 1.301 -5.545 229 1HB ASP 30 HB2 ASP 30 -2.798 -1.159 -5.617 230 2HB ASP 30 HB3 ASP 30 -1.185 -1.226 -6.336 231 H GLU 31 H GLU 31 -0.575 1.238 -8.248 232 HA GLU 31 HA GLU 31 1.924 2.114 -7.210 233 1HB GLU 31 HB2 GLU 31 1.427 1.238 -9.489 234 2HB GLU 31 HB3 GLU 31 0.438 2.642 -9.831 235 1HG GLU 31 HG2 GLU 31 2.519 4.068 -9.585 236 2HG GLU 31 HG3 GLU 31 3.447 2.570 -9.436 237 H TRP 32 H TRP 32 -1.147 3.670 -7.005 238 HA TRP 32 HA TRP 32 0.176 6.226 -6.299 239 1HB TRP 32 HB2 TRP 32 -2.430 6.118 -7.840 240 2HB TRP 32 HB3 TRP 32 -1.437 7.512 -7.481 241 HD1 TRP 32 HD1 TRP 32 -0.990 4.250 -9.519 242 HE1 TRP 32 HE1 TRP 32 -0.180 4.816 -11.861 243 HE3 TRP 32 HE3 TRP 32 -0.655 9.326 -9.020 244 HZ2 TRP 32 HZ2 TRP 32 0.250 7.173 -13.422 245 HZ3 TRP 32 HZ3 TRP 32 -0.175 10.730 -10.996 246 HH2 TRP 32 HH2 TRP 32 0.259 9.648 -13.226 247 H LYS 33 H LYS 33 -0.888 7.368 -4.684 248 HA LYS 33 HA LYS 33 -3.257 6.132 -3.336 249 1HB LYS 33 HB2 LYS 33 -1.450 8.462 -2.572 250 2HB LYS 33 HB3 LYS 33 -2.937 7.998 -1.733 251 1HG LYS 33 HG2 LYS 33 -1.871 5.597 -1.657 252 2HG LYS 33 HG3 LYS 33 -0.344 6.442 -1.960 253 1HD LYS 33 HD2 LYS 33 -2.333 7.027 0.261 254 2HD LYS 33 HD3 LYS 33 -0.881 6.027 0.462 255 1HE LYS 33 HE2 LYS 33 0.476 8.075 -0.341 256 2HE LYS 33 HE3 LYS 33 -1.012 9.015 -0.149 257 1HZ LYS 33 HZ1 LYS 33 -0.991 8.243 2.221 258 2HZ LYS 33 HZ2 LYS 33 0.515 7.609 1.965 259 3HZ LYS 33 HZ3 LYS 33 0.256 9.216 1.829 260 H VAL 34 H VAL 34 -5.242 7.250 -3.492 261 HA VAL 34 HA VAL 34 -5.277 9.494 -5.467 262 HB VAL 34 HB VAL 34 -7.289 7.221 -5.358 263 1HG1 VAL 34 HG11 VAL 34 -7.956 8.019 -7.525 264 2HG1 VAL 34 HG12 VAL 34 -7.884 9.438 -6.463 265 3HG1 VAL 34 HG13 VAL 34 -6.574 9.131 -7.617 266 1HG2 VAL 34 HG21 VAL 34 -4.830 7.402 -7.161 267 2HG2 VAL 34 HG22 VAL 34 -5.205 6.113 -5.994 268 3HG2 VAL 34 HG23 VAL 34 -6.206 6.313 -7.429 269 H TYR 35 H TYR 35 -6.267 11.241 -4.692 270 HA TYR 35 HA TYR 35 -8.231 10.955 -2.447 271 1HB TYR 35 HB2 TYR 35 -6.188 13.151 -2.884 272 2HB TYR 35 HB3 TYR 35 -7.310 13.038 -1.542 273 HD1 TYR 35 HD1 TYR 35 -7.077 10.536 -0.285 274 HD2 TYR 35 HD2 TYR 35 -4.019 12.815 -2.307 275 HE1 TYR 35 HE1 TYR 35 -5.364 9.543 1.198 276 HE2 TYR 35 HE2 TYR 35 -2.329 11.895 -0.816 277 HH TYR 35 HH TYR 35 -3.145 9.577 1.843 278 H SER 36 H SER 36 -9.702 12.677 -2.216 279 HA SER 36 HA SER 36 -10.198 14.446 -4.551 280 1HB SER 36 HB2 SER 36 -12.211 12.792 -2.935 281 2HB SER 36 HB3 SER 36 -12.596 13.918 -4.246 282 HG SER 36 HG SER 36 -11.234 11.455 -4.347 283 H ALA 37 H ALA 37 -10.373 16.544 -3.863 284 HA ALA 37 HA ALA 37 -11.876 17.096 -1.406 285 1HB ALA 37 HB1 ALA 37 -9.128 18.306 -1.893 286 2HB ALA 37 HB2 ALA 37 -10.285 18.704 -0.594 287 3HB ALA 37 HB3 ALA 37 -9.556 17.113 -0.623 288 H GLY 38 H GLY 38 -11.680 19.862 -1.502 289 1HA GLY 38 HA1 GLY 38 -11.785 20.939 -4.158 290 2HA GLY 38 HA2 GLY 38 -13.404 20.664 -3.500 291 H ILE 39 H ILE 39 -12.897 23.141 -4.049 292 HA ILE 39 HA ILE 39 -11.830 24.894 -2.088 293 HB ILE 39 HB ILE 39 -14.089 25.006 -4.098 294 1HG1 ILE 39 HG12 ILE 39 -12.805 26.862 -5.069 295 2HG1 ILE 39 HG13 ILE 39 -11.609 26.734 -3.775 296 1HG2 ILE 39 HG21 ILE 39 -15.053 26.334 -2.330 297 2HG2 ILE 39 HG22 ILE 39 -13.534 27.251 -2.138 298 3HG2 ILE 39 HG23 ILE 39 -14.506 27.391 -3.621 299 1HD1 ILE 39 HD11 ILE 39 -10.910 24.531 -4.641 300 2HD1 ILE 39 HD12 ILE 39 -12.183 24.614 -5.890 301 3HD1 ILE 39 HD13 ILE 39 -10.848 25.764 -5.908 302 H GLU 40 H GLU 40 -14.977 23.181 -2.309 303 HA GLU 40 HA GLU 40 -15.042 23.152 0.629 304 1HB GLU 40 HB2 GLU 40 -17.339 23.841 0.811 305 2HB GLU 40 HB3 GLU 40 -16.396 25.113 0.046 306 1HG GLU 40 HG2 GLU 40 -17.262 24.435 -2.184 307 2HG GLU 40 HG3 GLU 40 -18.199 23.131 -1.445 308 H ALA 41 H ALA 41 -17.065 21.737 1.262 309 HA ALA 41 HA ALA 41 -17.685 19.485 -0.521 310 1HB ALA 41 HB1 ALA 41 -15.594 18.769 0.591 311 2HB ALA 41 HB2 ALA 41 -16.275 19.196 2.177 312 3HB ALA 41 HB3 ALA 41 -16.987 17.878 1.239 313 H HIS 42 H HIS 42 -19.504 18.327 0.387 314 HA HIS 42 HA HIS 42 -20.855 19.540 2.761 315 1HB HIS 42 HB2 HIS 42 -21.849 20.458 0.683 316 2HB HIS 42 HB3 HIS 42 -22.160 18.821 0.102 317 HD1 HIS 42 HD1 HIS 42 -24.477 17.798 0.857 318 HD2 HIS 42 HD2 HIS 42 -23.209 21.156 3.062 319 HE1 HIS 42 HE1 HIS 42 -26.399 18.399 2.410 320 H GLY 43 H GLY 43 -20.466 16.732 0.540 321 1HA GLY 43 HA1 GLY 43 -20.126 14.845 2.570 322 2HA GLY 43 HA2 GLY 43 -21.838 14.798 2.084 323 H LEU 44 H LEU 44 -20.688 12.534 1.444 324 HA LEU 44 HA LEU 44 -19.598 12.627 -1.309 325 1HB LEU 44 HB2 LEU 44 -18.761 10.880 0.161 326 2HB LEU 44 HB3 LEU 44 -20.409 10.361 0.560 327 HG LEU 44 HG LEU 44 -20.792 9.639 -1.732 328 1HD1 LEU 44 HD11 LEU 44 -18.906 9.480 -3.349 329 2HD1 LEU 44 HD12 LEU 44 -19.368 11.153 -3.038 330 3HD1 LEU 44 HD13 LEU 44 -17.911 10.470 -2.264 331 1HD2 LEU 44 HD21 LEU 44 -19.767 8.119 -0.018 332 2HD2 LEU 44 HD22 LEU 44 -19.334 7.698 -1.684 333 3HD2 LEU 44 HD23 LEU 44 -18.172 8.547 -0.662 334 H ASN 45 H ASN 45 -21.169 13.407 -2.741 335 HA ASN 45 HA ASN 45 -23.889 13.421 -2.008 336 1HB ASN 45 HB2 ASN 45 -22.700 15.076 -3.475 337 2HB ASN 45 HB3 ASN 45 -22.703 13.868 -4.768 338 1HD2 ASN 45 HD22 ASN 45 -24.358 14.265 -6.205 339 2HD2 ASN 45 HD21 ASN 45 -25.934 14.898 -5.757 340 HA PRO 46 HA PRO 46 -25.064 9.292 -3.190 341 1HB PRO 46 HB2 PRO 46 -27.717 10.529 -3.940 342 2HB PRO 46 HB3 PRO 46 -27.390 9.060 -2.967 343 1HG PRO 46 HG2 PRO 46 -28.031 11.392 -1.743 344 2HG PRO 46 HG3 PRO 46 -26.709 10.370 -1.087 345 1HD PRO 46 HD2 PRO 46 -26.486 12.825 -2.846 346 2HD PRO 46 HD3 PRO 46 -25.555 12.390 -1.375 347 H ASN 47 H ASN 47 -25.805 11.956 -5.506 348 HA ASN 47 HA ASN 47 -26.213 10.275 -7.750 349 1HB ASN 47 HB2 ASN 47 -26.404 12.120 -8.937 350 2HB ASN 47 HB3 ASN 47 -26.343 13.001 -7.434 351 1HD2 ASN 47 HD22 ASN 47 -24.987 12.756 -10.566 352 2HD2 ASN 47 HD21 ASN 47 -23.477 13.577 -10.259 353 H ALA 48 H ALA 48 -23.192 11.369 -6.211 354 HA ALA 48 HA ALA 48 -21.499 10.541 -8.406 355 1HB ALA 48 HB1 ALA 48 -20.820 10.944 -5.448 356 2HB ALA 48 HB2 ALA 48 -19.677 10.867 -6.797 357 3HB ALA 48 HB3 ALA 48 -20.831 12.212 -6.689 358 H VAL 49 H VAL 49 -22.634 9.129 -5.310 359 HA VAL 49 HA VAL 49 -21.139 6.719 -5.495 360 HB VAL 49 HB VAL 49 -23.831 7.078 -4.126 361 1HG1 VAL 49 HG11 VAL 49 -23.010 5.222 -2.717 362 2HG1 VAL 49 HG12 VAL 49 -23.107 4.715 -4.413 363 3HG1 VAL 49 HG13 VAL 49 -21.533 5.118 -3.700 364 1HG2 VAL 49 HG21 VAL 49 -20.986 7.651 -3.223 365 2HG2 VAL 49 HG22 VAL 49 -22.350 8.783 -3.268 366 3HG2 VAL 49 HG23 VAL 49 -22.352 7.468 -2.093 367 H LYS 50 H LYS 50 -24.556 7.414 -6.531 368 HA LYS 50 HA LYS 50 -24.865 4.790 -7.576 369 1HB LYS 50 HB2 LYS 50 -26.718 6.420 -6.961 370 2HB LYS 50 HB3 LYS 50 -26.417 7.243 -8.504 371 1HG LYS 50 HG2 LYS 50 -26.851 5.070 -9.696 372 2HG LYS 50 HG3 LYS 50 -27.154 4.293 -8.135 373 1HD LYS 50 HD2 LYS 50 -29.067 5.821 -7.745 374 2HD LYS 50 HD3 LYS 50 -28.757 6.600 -9.312 375 1HE LYS 50 HE2 LYS 50 -29.123 4.432 -10.466 376 2HE LYS 50 HE3 LYS 50 -29.427 3.650 -8.909 377 1HZ LYS 50 HZ1 LYS 50 -31.485 4.233 -10.018 378 2HZ LYS 50 HZ2 LYS 50 -31.363 5.090 -8.640 379 3HZ LYS 50 HZ3 LYS 50 -31.086 5.810 -10.082 380 H ALA 51 H ALA 51 -23.870 7.869 -9.213 381 HA ALA 51 HA ALA 51 -23.915 6.856 -11.819 382 1HB ALA 51 HB1 ALA 51 -22.290 8.671 -12.360 383 2HB ALA 51 HB2 ALA 51 -23.616 9.260 -11.338 384 3HB ALA 51 HB3 ALA 51 -22.013 8.933 -10.628 385 H MET 52 H MET 52 -21.242 6.663 -9.402 386 HA MET 52 HA MET 52 -19.505 5.259 -11.257 387 1HB MET 52 HB2 MET 52 -19.475 5.698 -8.240 388 2HB MET 52 HB3 MET 52 -18.169 4.939 -9.147 389 1HG MET 52 HG2 MET 52 -19.176 7.794 -9.417 390 2HG MET 52 HG3 MET 52 -17.622 7.267 -8.785 391 1HE MET 52 HE1 MET 52 -15.597 6.410 -10.270 392 2HE MET 52 HE2 MET 52 -16.707 5.085 -10.681 393 3HE MET 52 HE3 MET 52 -15.814 5.895 -11.953 394 H LYS 53 H LYS 53 -21.708 4.261 -8.581 395 HA LYS 53 HA LYS 53 -20.883 1.570 -8.550 396 1HB LYS 53 HB2 LYS 53 -22.164 2.835 -6.810 397 2HB LYS 53 HB3 LYS 53 -23.611 2.708 -7.822 398 1HG LYS 53 HG2 LYS 53 -23.557 0.262 -7.622 399 2HG LYS 53 HG3 LYS 53 -22.018 0.326 -6.738 400 1HD LYS 53 HD2 LYS 53 -24.560 1.706 -5.783 401 2HD LYS 53 HD3 LYS 53 -24.125 0.044 -5.321 402 1HE LYS 53 HE2 LYS 53 -21.981 0.879 -4.349 403 2HE LYS 53 HE3 LYS 53 -22.430 2.529 -4.779 404 1HZ LYS 53 HZ1 LYS 53 -24.374 2.277 -3.293 405 2HZ LYS 53 HZ2 LYS 53 -23.830 0.803 -2.829 406 3HZ LYS 53 HZ3 LYS 53 -22.941 2.145 -2.517 407 H GLU 54 H GLU 54 -23.261 3.234 -10.602 408 HA GLU 54 HA GLU 54 -24.239 0.911 -11.917 409 1HB GLU 54 HB2 GLU 54 -24.129 3.868 -12.614 410 2HB GLU 54 HB3 GLU 54 -24.826 2.704 -13.736 411 1HG GLU 54 HG2 GLU 54 -25.751 3.011 -10.853 412 2HG GLU 54 HG3 GLU 54 -26.466 3.863 -12.217 413 H VAL 55 H VAL 55 -21.141 2.535 -12.266 414 HA VAL 55 HA VAL 55 -20.536 1.266 -14.861 415 HB VAL 55 HB VAL 55 -18.574 2.470 -12.857 416 1HG1 VAL 55 HG11 VAL 55 -17.171 2.884 -14.855 417 2HG1 VAL 55 HG12 VAL 55 -17.464 1.168 -14.612 418 3HG1 VAL 55 HG13 VAL 55 -18.368 2.046 -15.867 419 1HG2 VAL 55 HG21 VAL 55 -20.216 4.209 -13.422 420 2HG2 VAL 55 HG22 VAL 55 -18.653 4.562 -14.133 421 3HG2 VAL 55 HG23 VAL 55 -19.955 3.913 -15.157 422 H GLY 56 H GLY 56 -20.602 0.424 -11.479 423 1HA GLY 56 HA1 GLY 56 -20.204 -1.727 -10.598 424 2HA GLY 56 HA2 GLY 56 -19.068 -2.088 -11.909 425 H ILE 57 H ILE 57 -18.949 1.098 -10.324 426 HA ILE 57 HA ILE 57 -16.402 0.334 -8.962 427 HB ILE 57 HB ILE 57 -17.203 2.956 -10.277 428 1HG1 ILE 57 HG12 ILE 57 -15.032 0.980 -11.108 429 2HG1 ILE 57 HG13 ILE 57 -16.594 1.164 -11.910 430 1HG2 ILE 57 HG21 ILE 57 -14.937 3.737 -9.668 431 2HG2 ILE 57 HG22 ILE 57 -15.816 3.289 -8.220 432 3HG2 ILE 57 HG23 ILE 57 -14.591 2.187 -8.881 433 1HD1 ILE 57 HD11 ILE 57 -14.363 3.210 -11.811 434 2HD1 ILE 57 HD12 ILE 57 -15.083 2.400 -13.215 435 3HD1 ILE 57 HD13 ILE 57 -16.033 3.587 -12.333 436 H ASP 58 H ASP 58 -17.155 0.004 -6.904 437 HA ASP 58 HA ASP 58 -19.243 1.711 -5.752 438 1HB ASP 58 HB2 ASP 58 -19.058 -0.482 -4.781 439 2HB ASP 58 HB3 ASP 58 -17.320 -0.263 -4.458 440 H ILE 59 H ILE 59 -18.917 3.672 -4.938 441 HA ILE 59 HA ILE 59 -16.249 4.414 -3.934 442 HB ILE 59 HB ILE 59 -16.439 6.624 -4.688 443 1HG1 ILE 59 HG12 ILE 59 -19.101 6.135 -6.048 444 2HG1 ILE 59 HG13 ILE 59 -19.019 6.733 -4.396 445 1HG2 ILE 59 HG21 ILE 59 -17.213 4.913 -7.056 446 2HG2 ILE 59 HG22 ILE 59 -16.305 6.440 -7.075 447 3HG2 ILE 59 HG23 ILE 59 -15.593 5.003 -6.330 448 1HD1 ILE 59 HD11 ILE 59 -17.577 8.628 -5.168 449 2HD1 ILE 59 HD12 ILE 59 -17.950 8.166 -6.836 450 3HD1 ILE 59 HD13 ILE 59 -19.254 8.646 -5.726 451 H SER 60 H SER 60 -19.190 3.450 -2.862 452 HA SER 60 HA SER 60 -20.090 5.540 -1.206 453 1HB SER 60 HB2 SER 60 -20.188 2.632 -0.353 454 2HB SER 60 HB3 SER 60 -21.381 3.909 -0.083 455 HG SER 60 HG SER 60 -20.730 2.464 -2.434 456 H ASN 61 H ASN 61 -17.433 3.309 -0.931 457 HA ASN 61 HA ASN 61 -16.748 3.532 1.814 458 1HB ASN 61 HB2 ASN 61 -14.626 2.522 1.091 459 2HB ASN 61 HB3 ASN 61 -15.993 1.690 0.370 460 1HD2 ASN 61 HD22 ASN 61 -16.277 1.756 -1.957 461 2HD2 ASN 61 HD21 ASN 61 -15.088 2.489 -3.000 462 H GLN 62 H GLN 62 -16.410 5.900 -0.731 463 HA GLN 62 HA GLN 62 -14.047 7.165 0.375 464 1HB GLN 62 HB2 GLN 62 -15.928 8.076 -1.844 465 2HB GLN 62 HB3 GLN 62 -14.371 8.798 -1.406 466 1HG GLN 62 HG2 GLN 62 -13.211 6.685 -1.930 467 2HG GLN 62 HG3 GLN 62 -14.746 5.940 -2.387 468 1HE2 GLN 62 HE22 GLN 62 -14.609 9.233 -3.566 469 2HE2 GLN 62 HE21 GLN 62 -14.268 8.746 -5.221 470 H THR 63 H THR 63 -14.389 9.691 0.757 471 HA THR 63 HA THR 63 -16.977 10.515 1.704 472 HB THR 63 HB THR 63 -15.806 11.386 3.902 473 HG1 THR 63 HG1 THR 63 -13.742 10.530 3.481 474 1HG2 THR 63 HG21 THR 63 -17.733 9.733 3.735 475 2HG2 THR 63 HG22 THR 63 -16.528 8.438 3.855 476 3HG2 THR 63 HG23 THR 63 -16.709 9.605 5.179 477 H SER 64 H SER 64 -16.952 12.946 2.115 478 HA SER 64 HA SER 64 -14.954 14.164 0.335 479 1HB SER 64 HB2 SER 64 -17.701 15.078 1.258 480 2HB SER 64 HB3 SER 64 -16.659 15.966 0.138 481 HG SER 64 HG SER 64 -18.345 14.475 -0.733 482 H ASP 65 H ASP 65 -14.081 16.193 0.780 483 HA ASP 65 HA ASP 65 -13.952 17.252 3.503 484 1HB ASP 65 HB2 ASP 65 -12.324 15.262 3.394 485 2HB ASP 65 HB3 ASP 65 -11.472 16.147 2.115 486 H ILE 66 H ILE 66 -12.702 19.337 3.438 487 HA ILE 66 HA ILE 66 -12.611 20.489 0.715 488 HB ILE 66 HB ILE 66 -12.645 22.579 1.658 489 1HG1 ILE 66 HG12 ILE 66 -11.968 21.368 4.361 490 2HG1 ILE 66 HG13 ILE 66 -10.969 22.456 3.372 491 1HG2 ILE 66 HG21 ILE 66 -14.426 21.057 3.605 492 2HG2 ILE 66 HG22 ILE 66 -14.732 22.617 2.820 493 3HG2 ILE 66 HG23 ILE 66 -14.745 21.120 1.871 494 1HD1 ILE 66 HD11 ILE 66 -12.841 24.177 3.591 495 2HD1 ILE 66 HD12 ILE 66 -13.541 23.108 4.830 496 3HD1 ILE 66 HD13 ILE 66 -11.930 23.808 5.085 497 H ILE 67 H ILE 67 -10.608 21.692 0.170 498 HA ILE 67 HA ILE 67 -8.560 19.876 0.030 499 HB ILE 67 HB ILE 67 -8.976 21.506 -1.590 500 1HG1 ILE 67 HG12 ILE 67 -6.642 20.532 -1.259 501 2HG1 ILE 67 HG13 ILE 67 -6.872 21.851 -2.381 502 1HG2 ILE 67 HG21 ILE 67 -9.709 23.447 -0.388 503 2HG2 ILE 67 HG22 ILE 67 -8.104 23.673 0.342 504 3HG2 ILE 67 HG23 ILE 67 -8.342 23.882 -1.409 505 1HD1 ILE 67 HD11 ILE 67 -5.845 23.460 -0.994 506 2HD1 ILE 67 HD12 ILE 67 -5.834 22.397 0.417 507 3HD1 ILE 67 HD13 ILE 67 -4.800 22.029 -0.969 508 H ASP 68 H ASP 68 -6.619 19.531 0.817 509 HA ASP 68 HA ASP 68 -5.825 20.825 3.389 510 1HB ASP 68 HB2 ASP 68 -6.582 18.553 3.855 511 2HB ASP 68 HB3 ASP 68 -5.543 17.906 2.578 512 H SER 69 H SER 69 -4.163 22.130 2.857 513 HA SER 69 HA SER 69 -2.808 21.890 0.430 514 1HB SER 69 HB2 SER 69 -1.847 23.502 2.809 515 2HB SER 69 HB3 SER 69 -1.685 23.878 1.080 516 HG SER 69 HG SER 69 -3.379 25.051 2.192 517 H ASP 70 H ASP 70 -2.030 20.306 3.469 518 HA ASP 70 HA ASP 70 0.814 20.189 2.972 519 1HB ASP 70 HB2 ASP 70 0.018 20.019 5.259 520 2HB ASP 70 HB3 ASP 70 -0.939 18.590 4.862 521 H ILE 71 H ILE 71 -1.965 17.963 2.554 522 HA ILE 71 HA ILE 71 -0.351 15.920 1.266 523 HB ILE 71 HB ILE 71 -3.350 16.408 1.297 524 1HG1 ILE 71 HG12 ILE 71 -1.514 14.298 2.525 525 2HG1 ILE 71 HG13 ILE 71 -2.216 15.664 3.404 526 1HG2 ILE 71 HG21 ILE 71 -1.839 14.026 0.114 527 2HG2 ILE 71 HG22 ILE 71 -3.613 14.214 0.215 528 3HG2 ILE 71 HG23 ILE 71 -2.684 15.238 -0.853 529 1HD1 ILE 71 HD11 ILE 71 -4.512 14.736 2.875 530 2HD1 ILE 71 HD12 ILE 71 -3.701 13.276 2.245 531 3HD1 ILE 71 HD13 ILE 71 -3.512 13.729 3.943 532 H LEU 72 H LEU 72 -2.216 18.754 0.048 533 HA LEU 72 HA LEU 72 -1.840 18.307 -2.705 534 1HB LEU 72 HB2 LEU 72 -3.184 20.129 -1.517 535 2HB LEU 72 HB3 LEU 72 -1.651 20.994 -1.325 536 HG LEU 72 HG LEU 72 -1.476 20.658 -3.957 537 1HD1 LEU 72 HD11 LEU 72 -4.484 20.433 -3.406 538 2HD1 LEU 72 HD12 LEU 72 -3.762 20.732 -4.987 539 3HD1 LEU 72 HD13 LEU 72 -3.467 19.192 -4.160 540 1HD2 LEU 72 HD21 LEU 72 -1.644 22.840 -2.812 541 2HD2 LEU 72 HD22 LEU 72 -2.627 22.804 -4.285 542 3HD2 LEU 72 HD23 LEU 72 -3.406 22.640 -2.695 543 H ASN 73 H ASN 73 0.384 19.933 -0.386 544 HA ASN 73 HA ASN 73 2.407 20.325 -2.376 545 1HB ASN 73 HB2 ASN 73 2.276 20.713 0.621 546 2HB ASN 73 HB3 ASN 73 3.820 20.795 -0.213 547 1HD2 ASN 73 HD22 ASN 73 0.597 22.316 -0.071 548 2HD2 ASN 73 HD21 ASN 73 1.011 23.733 -1.022 549 H ASN 74 H ASN 74 1.493 17.417 -0.893 550 HA ASN 74 HA ASN 74 4.248 16.257 -1.085 551 1HB ASN 74 HB2 ASN 74 1.664 15.296 0.202 552 2HB ASN 74 HB3 ASN 74 2.906 14.160 -0.271 553 1HD2 ASN 74 HD22 ASN 74 2.140 16.746 1.962 554 2HD2 ASN 74 HD21 ASN 74 3.461 16.418 3.065 555 H ALA 75 H ALA 75 1.173 16.552 -2.754 556 HA ALA 75 HA ALA 75 1.080 14.004 -3.866 557 1HB ALA 75 HB1 ALA 75 -0.108 16.569 -4.971 558 2HB ALA 75 HB2 ALA 75 -0.631 14.908 -5.340 559 3HB ALA 75 HB3 ALA 75 -0.831 15.551 -3.700 560 H ASP 76 H ASP 76 1.736 13.156 -5.961 561 HA ASP 76 HA ASP 76 4.115 14.394 -7.162 562 1HB ASP 76 HB2 ASP 76 3.801 11.918 -7.188 563 2HB ASP 76 HB3 ASP 76 2.333 12.123 -8.152 564 H LEU 77 H LEU 77 0.629 14.250 -7.622 565 HA LEU 77 HA LEU 77 0.727 16.271 -9.770 566 1HB LEU 77 HB2 LEU 77 0.683 14.162 -10.917 567 2HB LEU 77 HB3 LEU 77 -0.552 13.527 -9.825 568 HG LEU 77 HG LEU 77 -2.209 15.149 -10.749 569 1HD1 LEU 77 HD11 LEU 77 -0.097 15.704 -12.884 570 2HD1 LEU 77 HD12 LEU 77 -1.754 16.293 -12.870 571 3HD1 LEU 77 HD13 LEU 77 -0.620 16.885 -11.665 572 1HD2 LEU 77 HD21 LEU 77 -2.537 13.924 -12.826 573 2HD2 LEU 77 HD22 LEU 77 -0.826 13.428 -12.813 574 3HD2 LEU 77 HD23 LEU 77 -1.938 12.819 -11.576 575 H VAL 78 H VAL 78 -0.976 17.562 -9.810 576 HA VAL 78 HA VAL 78 -3.317 17.113 -8.024 577 HB VAL 78 HB VAL 78 -1.702 19.645 -8.616 578 1HG1 VAL 78 HG11 VAL 78 -3.293 20.856 -7.181 579 2HG1 VAL 78 HG12 VAL 78 -4.135 20.175 -8.568 580 3HG1 VAL 78 HG13 VAL 78 -4.277 19.374 -6.990 581 1HG2 VAL 78 HG21 VAL 78 -1.345 19.736 -6.171 582 2HG2 VAL 78 HG22 VAL 78 -2.241 18.199 -5.976 583 3HG2 VAL 78 HG23 VAL 78 -0.698 18.245 -6.842 584 H VAL 79 H VAL 79 -5.289 17.478 -9.226 585 HA VAL 79 HA VAL 79 -4.924 18.959 -11.737 586 HB VAL 79 HB VAL 79 -6.291 17.637 -13.111 587 1HG1 VAL 79 HG11 VAL 79 -3.870 17.030 -12.898 588 2HG1 VAL 79 HG12 VAL 79 -4.329 15.705 -11.809 589 3HG1 VAL 79 HG13 VAL 79 -4.902 15.716 -13.490 590 1HG2 VAL 79 HG21 VAL 79 -7.871 16.701 -11.525 591 2HG2 VAL 79 HG22 VAL 79 -7.144 15.425 -12.501 592 3HG2 VAL 79 HG23 VAL 79 -6.597 15.668 -10.819 593 H THR 80 H THR 80 -6.227 20.557 -11.958 594 HA THR 80 HA THR 80 -8.375 20.920 -9.929 595 HB THR 80 HB THR 80 -8.204 23.337 -10.876 596 HG1 THR 80 HG1 THR 80 -6.850 22.880 -12.644 597 1HG2 THR 80 HG21 THR 80 -6.102 21.899 -9.190 598 2HG2 THR 80 HG22 THR 80 -6.060 23.654 -9.424 599 3HG2 THR 80 HG23 THR 80 -7.458 22.901 -8.655 600 H LEU 81 H LEU 81 -10.017 19.812 -10.619 601 HA LEU 81 HA LEU 81 -10.404 19.022 -13.316 602 1HB LEU 81 HB2 LEU 81 -12.117 18.821 -10.819 603 2HB LEU 81 HB3 LEU 81 -12.577 18.064 -12.336 604 HG LEU 81 HG LEU 81 -9.981 17.435 -10.865 605 1HD1 LEU 81 HD11 LEU 81 -11.122 15.232 -10.340 606 2HD1 LEU 81 HD12 LEU 81 -11.717 16.635 -9.466 607 3HD1 LEU 81 HD13 LEU 81 -12.652 15.983 -10.835 608 1HD2 LEU 81 HD21 LEU 81 -11.395 16.089 -13.203 609 2HD2 LEU 81 HD22 LEU 81 -9.823 16.932 -13.249 610 3HD2 LEU 81 HD23 LEU 81 -9.986 15.420 -12.362 611 H CYS 82 H CYS 82 -11.257 22.113 -12.076 612 HA CYS 82 HA CYS 82 -12.915 22.488 -14.403 613 1HB CYS 82 HB2 CYS 82 -14.533 21.615 -12.734 614 2HB CYS 82 HB3 CYS 82 -14.185 23.014 -11.689 615 HG CYS 82 HG CYS 82 -16.479 22.834 -13.405 616 H GLY 83 H GLY 83 -13.454 24.787 -14.701 617 1HA GLY 83 HA1 GLY 83 -11.237 26.285 -15.072 618 2HA GLY 83 HA2 GLY 83 -12.852 26.956 -14.949 619 H ASP 84 H ASP 84 -13.664 27.265 -12.604 620 HA ASP 84 HA ASP 84 -11.912 29.211 -11.470 621 1HB ASP 84 HB2 ASP 84 -14.355 29.405 -11.463 622 2HB ASP 84 HB3 ASP 84 -14.483 28.010 -10.396 623 H ALA 85 H ALA 85 -12.241 25.791 -10.821 624 HA ALA 85 HA ALA 85 -11.492 25.780 -8.073 625 1HB ALA 85 HB1 ALA 85 -11.144 23.437 -8.330 626 2HB ALA 85 HB2 ALA 85 -12.483 23.825 -9.419 627 3HB ALA 85 HB3 ALA 85 -10.850 23.573 -10.069 628 H ALA 86 H ALA 86 -9.631 26.137 -11.044 629 HA ALA 86 HA ALA 86 -7.077 25.409 -10.030 630 1HB ALA 86 HB1 ALA 86 -7.595 25.509 -12.402 631 2HB ALA 86 HB2 ALA 86 -7.819 27.276 -12.306 632 3HB ALA 86 HB3 ALA 86 -6.218 26.560 -12.020 633 H ASP 87 H ASP 87 -8.968 28.274 -9.354 634 HA ASP 87 HA ASP 87 -6.832 30.065 -8.756 635 1HB ASP 87 HB2 ASP 87 -9.191 30.764 -8.928 636 2HB ASP 87 HB3 ASP 87 -9.587 29.790 -7.504 637 H LYS 88 H LYS 88 -8.166 27.278 -7.054 638 HA LYS 88 HA LYS 88 -6.875 28.057 -4.519 639 1HB LYS 88 HB2 LYS 88 -9.260 27.242 -4.642 640 2HB LYS 88 HB3 LYS 88 -8.640 25.662 -5.126 641 1HG LYS 88 HG2 LYS 88 -9.184 25.641 -2.806 642 2HG LYS 88 HG3 LYS 88 -7.424 25.517 -2.947 643 1HD LYS 88 HD2 LYS 88 -7.153 27.862 -2.300 644 2HD LYS 88 HD3 LYS 88 -8.913 28.127 -2.389 645 1HE LYS 88 HE2 LYS 88 -9.251 26.460 -0.598 646 2HE LYS 88 HE3 LYS 88 -7.504 26.202 -0.490 647 1HZ LYS 88 HZ1 LYS 88 -8.893 28.760 0.099 648 2HZ LYS 88 HZ2 LYS 88 -8.276 27.744 1.209 649 3HZ LYS 88 HZ3 LYS 88 -7.277 28.533 0.194 650 H CYS 89 H CYS 89 -4.760 27.903 -5.606 651 HA CYS 89 HA CYS 89 -3.670 25.137 -5.340 652 1HB CYS 89 HB2 CYS 89 -1.901 25.885 -6.999 653 2HB CYS 89 HB3 CYS 89 -3.496 25.471 -7.631 654 HG CYS 89 HG CYS 89 -4.362 27.720 -8.201 655 HA PRO 90 HA PRO 90 -1.709 27.945 -2.202 656 1HB PRO 90 HB2 PRO 90 -2.046 26.403 0.021 657 2HB PRO 90 HB3 PRO 90 -3.323 27.467 -0.635 658 1HG PRO 90 HG2 PRO 90 -2.951 24.502 -1.155 659 2HG PRO 90 HG3 PRO 90 -4.437 25.348 -0.603 660 1HD PRO 90 HD2 PRO 90 -4.055 24.767 -3.221 661 2HD PRO 90 HD3 PRO 90 -4.780 26.320 -2.726 662 H MET 91 H MET 91 -0.096 27.284 -3.758 663 HA MET 91 HA MET 91 1.957 26.746 -4.323 664 1HB MET 91 HB2 MET 91 2.319 25.567 -1.548 665 2HB MET 91 HB3 MET 91 3.590 25.731 -2.756 666 1HG MET 91 HG2 MET 91 1.981 28.034 -1.603 667 2HG MET 91 HG3 MET 91 3.595 27.550 -1.086 668 1HE MET 91 HE1 MET 91 2.782 30.521 -1.906 669 2HE MET 91 HE2 MET 91 4.406 30.050 -1.354 670 3HE MET 91 HE3 MET 91 4.213 30.999 -2.844 671 H THR 92 H THR 92 2.545 25.358 -5.744 672 HA THR 92 HA THR 92 2.374 22.462 -5.279 673 HB THR 92 HB THR 92 1.500 22.130 -7.629 674 HG1 THR 92 HG1 THR 92 1.762 24.329 -8.297 675 1HG2 THR 92 HG21 THR 92 0.065 21.826 -5.589 676 2HG2 THR 92 HG22 THR 92 -0.524 23.485 -5.817 677 3HG2 THR 92 HG23 THR 92 -0.812 22.257 -7.065 678 HA PRO 93 HA PRO 93 6.513 24.175 -6.542 679 1HB PRO 93 HB2 PRO 93 7.187 21.570 -5.154 680 2HB PRO 93 HB3 PRO 93 8.054 23.135 -5.076 681 1HG PRO 93 HG2 PRO 93 6.438 22.388 -3.050 682 2HG PRO 93 HG3 PRO 93 6.390 24.078 -3.655 683 1HD PRO 93 HD2 PRO 93 4.493 21.809 -4.264 684 2HD PRO 93 HD3 PRO 93 4.140 23.519 -3.897 685 HA PRO 94 HA PRO 94 7.452 21.724 -10.166 686 1HB PRO 94 HB2 PRO 94 10.163 21.078 -8.988 687 2HB PRO 94 HB3 PRO 94 9.756 21.600 -10.653 688 1HG PRO 94 HG2 PRO 94 10.721 23.399 -8.880 689 2HG PRO 94 HG3 PRO 94 9.329 23.841 -9.921 690 1HD PRO 94 HD2 PRO 94 9.311 22.952 -7.034 691 2HD PRO 94 HD3 PRO 94 8.387 24.272 -7.814 692 H HIS 95 H HIS 95 8.212 20.138 -7.066 693 HA HIS 95 HA HIS 95 8.193 17.435 -8.036 694 1HB HIS 95 HB2 HIS 95 7.643 18.497 -5.235 695 2HB HIS 95 HB3 HIS 95 8.118 16.855 -5.660 696 HD1 HIS 95 HD1 HIS 95 10.712 16.922 -7.106 697 HD2 HIS 95 HD2 HIS 95 9.623 19.924 -4.356 698 HE1 HIS 95 HE1 HIS 95 12.871 18.074 -6.412 699 H VAL 96 H VAL 96 5.653 19.614 -7.917 700 HA VAL 96 HA VAL 96 3.517 17.604 -7.468 701 HB VAL 96 HB VAL 96 3.555 20.520 -6.564 702 1HG1 VAL 96 HG11 VAL 96 1.527 19.959 -5.350 703 2HG1 VAL 96 HG12 VAL 96 1.325 19.597 -7.071 704 3HG1 VAL 96 HG13 VAL 96 1.611 18.283 -5.919 705 1HG2 VAL 96 HG21 VAL 96 5.147 19.460 -5.128 706 2HG2 VAL 96 HG22 VAL 96 3.643 19.655 -4.229 707 3HG2 VAL 96 HG23 VAL 96 4.086 18.066 -4.868 708 H LYS 97 H LYS 97 3.513 17.336 -9.759 709 HA LYS 97 HA LYS 97 3.460 19.657 -11.508 710 1HB LYS 97 HB2 LYS 97 3.579 18.170 -13.285 711 2HB LYS 97 HB3 LYS 97 4.475 17.365 -12.008 712 1HG LYS 97 HG2 LYS 97 2.050 16.218 -11.603 713 2HG LYS 97 HG3 LYS 97 1.880 16.648 -13.316 714 1HD LYS 97 HD2 LYS 97 4.087 15.447 -13.733 715 2HD LYS 97 HD3 LYS 97 4.070 14.969 -12.022 716 1HE LYS 97 HE2 LYS 97 1.691 14.011 -12.570 717 2HE LYS 97 HE3 LYS 97 2.196 14.121 -14.264 718 1HZ LYS 97 HZ1 LYS 97 4.140 12.715 -13.587 719 2HZ LYS 97 HZ2 LYS 97 3.487 12.575 -12.075 720 3HZ LYS 97 HZ3 LYS 97 2.712 11.951 -13.377 721 H ARG 98 H ARG 98 1.608 19.774 -13.156 722 HA ARG 98 HA ARG 98 -0.997 19.475 -11.793 723 1HB ARG 98 HB2 ARG 98 0.320 22.035 -12.725 724 2HB ARG 98 HB3 ARG 98 -1.435 21.864 -12.778 725 1HG ARG 98 HG2 ARG 98 -1.459 21.247 -10.368 726 2HG ARG 98 HG3 ARG 98 0.281 21.482 -10.287 727 1HD ARG 98 HD2 ARG 98 -1.110 23.416 -9.416 728 2HD ARG 98 HD3 ARG 98 0.120 23.819 -10.607 729 HE ARG 98 HE ARG 98 -1.481 24.782 -11.831 730 1HH1 ARG 98 HH21 ARG 98 -3.168 22.138 -10.127 731 2HH1 ARG 98 HH22 ARG 98 -4.681 22.474 -10.940 732 1HH2 ARG 98 HH11 ARG 98 -3.555 25.198 -12.776 733 2HH2 ARG 98 HH12 ARG 98 -4.903 24.192 -12.331 734 H GLU 99 H GLU 99 -2.821 19.650 -13.067 735 HA GLU 99 HA GLU 99 -2.675 19.928 -15.941 736 1HB GLU 99 HB2 GLU 99 -2.714 17.302 -14.844 737 2HB GLU 99 HB3 GLU 99 -4.393 17.631 -15.273 738 1HG GLU 99 HG2 GLU 99 -1.987 17.858 -17.139 739 2HG GLU 99 HG3 GLU 99 -3.059 16.463 -17.010 740 H HIS 100 H HIS 100 -5.066 20.236 -16.678 741 HA HIS 100 HA HIS 100 -6.835 21.136 -14.474 742 1HB HIS 100 HB2 HIS 100 -5.206 22.948 -14.761 743 2HB HIS 100 HB3 HIS 100 -5.487 22.966 -16.500 744 HD1 HIS 100 HD1 HIS 100 -8.593 22.858 -14.211 745 HD2 HIS 100 HD2 HIS 100 -6.179 25.543 -16.402 746 HE1 HIS 100 HE1 HIS 100 -9.794 25.071 -14.219 747 H TRP 101 H TRP 101 -8.836 20.545 -15.030 748 HA TRP 101 HA TRP 101 -9.618 20.448 -17.914 749 1HB TRP 101 HB2 TRP 101 -10.581 18.636 -15.700 750 2HB TRP 101 HB3 TRP 101 -11.004 18.573 -17.411 751 HD1 TRP 101 HD1 TRP 101 -7.802 18.965 -18.297 752 HE1 TRP 101 HE1 TRP 101 -6.211 17.021 -18.152 753 HE3 TRP 101 HE3 TRP 101 -10.641 15.863 -15.376 754 HZ2 TRP 101 HZ2 TRP 101 -6.067 14.479 -16.781 755 HZ3 TRP 101 HZ3 TRP 101 -9.740 13.665 -14.671 756 HH2 TRP 101 HH2 TRP 101 -7.446 12.974 -15.344 757 H GLY 102 H GLY 102 -12.331 20.236 -17.745 758 1HA GLY 102 HA1 GLY 102 -13.156 22.810 -16.454 759 2HA GLY 102 HA2 GLY 102 -13.384 22.473 -18.159 760 H PHE 103 H PHE 103 -13.932 20.339 -15.288 761 HA PHE 103 HA PHE 103 -16.434 19.437 -16.460 762 1HB PHE 103 HB2 PHE 103 -14.851 18.634 -14.006 763 2HB PHE 103 HB3 PHE 103 -16.441 17.982 -14.373 764 HD1 PHE 103 HD1 PHE 103 -12.933 18.197 -15.662 765 HD2 PHE 103 HD2 PHE 103 -16.821 16.408 -16.133 766 HE1 PHE 103 HE1 PHE 103 -12.001 16.608 -17.332 767 HE2 PHE 103 HE2 PHE 103 -15.874 14.764 -17.698 768 HZ PHE 103 HZ PHE 103 -13.464 14.883 -18.353 769 H ASP 104 H ASP 104 -18.097 20.776 -16.354 770 HA ASP 104 HA ASP 104 -18.822 22.458 -14.143 771 1HB ASP 104 HB2 ASP 104 -19.654 22.756 -16.470 772 2HB ASP 104 HB3 ASP 104 -20.522 21.219 -16.332 773 H ASP 105 H ASP 105 -20.658 22.094 -12.692 774 HA ASP 105 HA ASP 105 -20.200 19.576 -11.384 775 1HB ASP 105 HB2 ASP 105 -20.439 21.827 -10.276 776 2HB ASP 105 HB3 ASP 105 -22.184 21.688 -10.529 777 HA PRO 106 HA PRO 106 -23.672 17.625 -13.395 778 1HB PRO 106 HB2 PRO 106 -23.537 15.116 -12.260 779 2HB PRO 106 HB3 PRO 106 -22.380 15.694 -13.495 780 1HG PRO 106 HG2 PRO 106 -22.067 15.664 -10.480 781 2HG PRO 106 HG3 PRO 106 -20.891 15.123 -11.719 782 1HD PRO 106 HD2 PRO 106 -20.766 17.596 -10.562 783 2HD PRO 106 HD3 PRO 106 -20.325 17.345 -12.281 784 H ALA 107 H ALA 107 -23.416 17.687 -9.823 785 HA ALA 107 HA ALA 107 -26.022 16.606 -9.386 786 1HB ALA 107 HB1 ALA 107 -24.255 16.568 -7.673 787 2HB ALA 107 HB2 ALA 107 -24.313 18.338 -7.556 788 3HB ALA 107 HB3 ALA 107 -25.718 17.374 -7.069 789 H ARG 108 H ARG 108 -24.986 19.753 -10.395 790 HA ARG 108 HA ARG 108 -27.608 20.982 -9.710 791 1HB ARG 108 HB2 ARG 108 -24.934 22.240 -10.486 792 2HB ARG 108 HB3 ARG 108 -26.439 23.124 -10.277 793 1HG ARG 108 HG2 ARG 108 -25.462 23.461 -8.243 794 2HG ARG 108 HG3 ARG 108 -26.545 22.106 -7.902 795 1HD ARG 108 HD2 ARG 108 -24.605 20.553 -8.102 796 2HD ARG 108 HD3 ARG 108 -23.548 21.938 -8.435 797 HE ARG 108 HE ARG 108 -24.816 22.511 -6.028 798 1HH1 ARG 108 HH21 ARG 108 -22.636 19.951 -7.242 799 2HH1 ARG 108 HH22 ARG 108 -21.955 19.628 -5.688 800 1HH2 ARG 108 HH11 ARG 108 -23.903 22.053 -3.971 801 2HH2 ARG 108 HH12 ARG 108 -22.707 20.831 -3.787 802 H ALA 109 H ALA 109 -26.584 19.153 -12.200 803 HA ALA 109 HA ALA 109 -27.164 20.752 -14.492 804 1HB ALA 109 HB1 ALA 109 -27.222 17.738 -14.117 805 2HB ALA 109 HB2 ALA 109 -27.083 18.617 -15.654 806 3HB ALA 109 HB3 ALA 109 -25.760 18.705 -14.470 807 H GLN 110 H GLN 110 -29.276 20.698 -12.400 808 HA GLN 110 HA GLN 110 -31.501 19.107 -12.943 809 1HB GLN 110 HB2 GLN 110 -31.572 21.921 -11.806 810 2HB GLN 110 HB3 GLN 110 -32.772 20.635 -11.616 811 1HG GLN 110 HG2 GLN 110 -30.650 19.298 -10.658 812 2HG GLN 110 HG3 GLN 110 -30.064 20.931 -10.329 813 1HE2 GLN 110 HE22 GLN 110 -32.157 22.344 -9.421 814 2HE2 GLN 110 HE21 GLN 110 -32.916 21.584 -8.042 815 H GLY 111 H GLY 111 -33.496 19.561 -13.946 816 1HA GLY 111 HA1 GLY 111 -34.394 21.771 -15.338 817 2HA GLY 111 HA2 GLY 111 -33.464 20.835 -16.538 818 H THR 112 H THR 112 -33.811 18.298 -15.957 819 HA THR 112 HA THR 112 -36.378 17.513 -15.016 820 HB THR 112 HB THR 112 -37.086 18.027 -17.274 821 HG1 THR 112 HG1 THR 112 -38.057 16.234 -16.576 822 1HG2 THR 112 HG21 THR 112 -34.858 16.227 -18.279 823 2HG2 THR 112 HG22 THR 112 -36.170 16.910 -19.260 824 3HG2 THR 112 HG23 THR 112 -34.990 17.990 -18.508 825 H GLU 113 H GLU 113 -36.280 15.106 -14.624 826 HA GLU 113 HA GLU 113 -33.766 14.594 -13.448 827 1HB GLU 113 HB2 GLU 113 -35.810 13.635 -12.567 828 2HB GLU 113 HB3 GLU 113 -36.072 12.700 -14.051 829 1HG GLU 113 HG2 GLU 113 -34.071 11.383 -13.659 830 2HG GLU 113 HG3 GLU 113 -33.597 12.400 -12.291 831 H GLU 114 H GLU 114 -35.122 13.463 -16.535 832 HA GLU 114 HA GLU 114 -32.965 11.714 -17.109 833 1HB GLU 114 HB2 GLU 114 -33.802 11.639 -19.386 834 2HB GLU 114 HB3 GLU 114 -35.124 11.514 -18.227 835 1HG GLU 114 HG2 GLU 114 -35.661 13.926 -18.602 836 2HG GLU 114 HG3 GLU 114 -34.353 14.022 -19.785 837 H GLU 115 H GLU 115 -33.278 15.220 -17.451 838 HA GLU 115 HA GLU 115 -31.036 15.503 -19.240 839 1HB GLU 115 HB2 GLU 115 -32.832 17.177 -19.173 840 2HB GLU 115 HB3 GLU 115 -32.455 17.537 -17.488 841 1HG GLU 115 HG2 GLU 115 -31.509 19.270 -18.746 842 2HG GLU 115 HG3 GLU 115 -30.151 18.281 -18.238 843 H LYS 116 H LYS 116 -31.683 15.979 -15.750 844 HA LYS 116 HA LYS 116 -29.156 16.631 -14.819 845 1HB LYS 116 HB2 LYS 116 -31.341 16.724 -13.646 846 2HB LYS 116 HB3 LYS 116 -31.348 14.958 -13.503 847 1HG LYS 116 HG2 LYS 116 -29.384 14.984 -12.146 848 2HG LYS 116 HG3 LYS 116 -29.132 16.726 -12.433 849 1HD LYS 116 HD2 LYS 116 -31.475 17.013 -11.299 850 2HD LYS 116 HD3 LYS 116 -31.245 15.334 -10.743 851 1HE LYS 116 HE2 LYS 116 -28.965 16.046 -9.882 852 2HE LYS 116 HE3 LYS 116 -29.365 17.700 -10.352 853 1HZ LYS 116 HZ1 LYS 116 -29.759 17.292 -7.991 854 2HZ LYS 116 HZ2 LYS 116 -31.169 17.673 -8.711 855 3HZ LYS 116 HZ3 LYS 116 -30.842 16.112 -8.313 856 H TRP 117 H TRP 117 -30.632 13.374 -15.138 857 HA TRP 117 HA TRP 117 -28.331 11.905 -14.346 858 1HB TRP 117 HB2 TRP 117 -30.636 10.993 -14.379 859 2HB TRP 117 HB3 TRP 117 -30.623 11.018 -16.142 860 HD1 TRP 117 HD1 TRP 117 -29.182 9.149 -17.374 861 HE1 TRP 117 HE1 TRP 117 -28.100 6.936 -16.610 862 HE3 TRP 117 HE3 TRP 117 -29.406 9.831 -12.312 863 HZ2 TRP 117 HZ2 TRP 117 -27.211 5.761 -14.161 864 HZ3 TRP 117 HZ3 TRP 117 -28.299 8.226 -10.789 865 HH2 TRP 117 HH2 TRP 117 -27.193 6.182 -11.697 866 H ALA 118 H ALA 118 -29.485 12.881 -17.667 867 HA ALA 118 HA ALA 118 -27.449 11.518 -19.070 868 1HB ALA 118 HB1 ALA 118 -28.795 14.164 -19.769 869 2HB ALA 118 HB2 ALA 118 -27.833 13.165 -20.876 870 3HB ALA 118 HB3 ALA 118 -29.356 12.537 -20.223 871 H PHE 119 H PHE 119 -27.372 14.695 -17.394 872 HA PHE 119 HA PHE 119 -24.757 15.360 -18.302 873 1HB PHE 119 HB2 PHE 119 -26.635 16.750 -17.041 874 2HB PHE 119 HB3 PHE 119 -25.726 16.266 -15.614 875 HD1 PHE 119 HD1 PHE 119 -25.859 18.416 -18.556 876 HD2 PHE 119 HD2 PHE 119 -23.247 16.924 -15.466 877 HE1 PHE 119 HE1 PHE 119 -24.258 20.253 -19.019 878 HE2 PHE 119 HE2 PHE 119 -21.667 18.791 -15.899 879 HZ PHE 119 HZ PHE 119 -22.165 20.444 -17.699 880 H PHE 120 H PHE 120 -25.897 13.444 -15.447 881 HA PHE 120 HA PHE 120 -23.364 13.042 -14.228 882 1HB PHE 120 HB2 PHE 120 -25.495 10.898 -14.453 883 2HB PHE 120 HB3 PHE 120 -24.202 11.009 -13.296 884 HD1 PHE 120 HD1 PHE 120 -26.604 10.295 -12.269 885 HD2 PHE 120 HD2 PHE 120 -25.365 14.322 -13.195 886 HE1 PHE 120 HE1 PHE 120 -28.247 11.185 -10.638 887 HE2 PHE 120 HE2 PHE 120 -26.945 15.188 -11.527 888 HZ PHE 120 HZ PHE 120 -28.414 13.632 -10.252 889 H GLN 121 H GLN 121 -25.063 11.269 -16.867 890 HA GLN 121 HA GLN 121 -23.094 9.286 -17.306 891 1HB GLN 121 HB2 GLN 121 -25.123 10.484 -19.241 892 2HB GLN 121 HB3 GLN 121 -24.127 9.088 -19.598 893 1HG GLN 121 HG2 GLN 121 -26.131 9.260 -17.306 894 2HG GLN 121 HG3 GLN 121 -26.416 8.473 -18.852 895 1HE2 GLN 121 HE22 GLN 121 -25.797 7.688 -15.743 896 2HE2 GLN 121 HE21 GLN 121 -24.825 6.254 -15.971 897 H ARG 122 H ARG 122 -23.510 12.443 -18.953 898 HA ARG 122 HA ARG 122 -21.242 12.181 -20.652 899 1HB ARG 122 HB2 ARG 122 -22.796 14.565 -19.597 900 2HB ARG 122 HB3 ARG 122 -21.232 14.831 -20.354 901 1HG ARG 122 HG2 ARG 122 -22.829 15.126 -22.055 902 2HG ARG 122 HG3 ARG 122 -21.980 13.615 -22.390 903 1HD ARG 122 HD2 ARG 122 -23.914 12.355 -21.411 904 2HD ARG 122 HD3 ARG 122 -24.744 13.890 -21.138 905 HE ARG 122 HE ARG 122 -24.270 12.505 -23.692 906 1HH1 ARG 122 HH21 ARG 122 -25.475 15.465 -22.135 907 2HH1 ARG 122 HH22 ARG 122 -26.407 15.966 -23.496 908 1HH2 ARG 122 HH11 ARG 122 -25.503 13.182 -25.502 909 2HH2 ARG 122 HH12 ARG 122 -26.416 14.641 -25.452 910 H VAL 123 H VAL 123 -21.480 13.671 -17.369 911 HA VAL 123 HA VAL 123 -18.725 14.364 -17.326 912 HB VAL 123 HB VAL 123 -20.831 14.026 -15.151 913 1HG1 VAL 123 HG11 VAL 123 -17.974 15.016 -14.773 914 2HG1 VAL 123 HG12 VAL 123 -19.294 15.260 -13.614 915 3HG1 VAL 123 HG13 VAL 123 -18.736 13.626 -13.981 916 1HG2 VAL 123 HG21 VAL 123 -19.446 16.484 -16.349 917 2HG2 VAL 123 HG22 VAL 123 -21.082 15.936 -16.746 918 3HG2 VAL 123 HG23 VAL 123 -20.712 16.507 -15.114 919 H ARG 124 H ARG 124 -20.328 11.330 -15.970 920 HA ARG 124 HA ARG 124 -17.798 10.454 -15.021 921 1HB ARG 124 HB2 ARG 124 -18.755 8.269 -14.674 922 2HB ARG 124 HB3 ARG 124 -19.976 9.462 -14.239 923 1HG ARG 124 HG2 ARG 124 -21.125 9.032 -16.396 924 2HG ARG 124 HG3 ARG 124 -19.886 7.839 -16.818 925 1HD ARG 124 HD2 ARG 124 -20.508 6.550 -14.753 926 2HD ARG 124 HD3 ARG 124 -21.883 7.654 -14.541 927 HE ARG 124 HE ARG 124 -22.082 6.804 -17.166 928 1HH1 ARG 124 HH21 ARG 124 -22.136 5.096 -14.026 929 2HH1 ARG 124 HH22 ARG 124 -22.885 3.690 -14.710 930 1HH2 ARG 124 HH11 ARG 124 -23.343 5.092 -17.899 931 2HH2 ARG 124 HH12 ARG 124 -23.530 3.648 -16.963 932 H ASP 125 H ASP 125 -19.400 9.933 -18.167 933 HA ASP 125 HA ASP 125 -17.512 8.095 -19.195 934 1HB ASP 125 HB2 ASP 125 -19.646 8.514 -20.304 935 2HB ASP 125 HB3 ASP 125 -19.177 10.183 -20.651 936 H GLU 126 H GLU 126 -17.541 11.705 -19.261 937 HA GLU 126 HA GLU 126 -15.110 11.812 -20.744 938 1HB GLU 126 HB2 GLU 126 -16.879 13.846 -19.421 939 2HB GLU 126 HB3 GLU 126 -15.278 14.313 -19.987 940 1HG GLU 126 HG2 GLU 126 -17.410 12.990 -21.699 941 2HG GLU 126 HG3 GLU 126 -17.050 14.719 -21.665 942 H ILE 127 H ILE 127 -15.802 11.971 -17.217 943 HA ILE 127 HA ILE 127 -13.124 12.702 -16.529 944 HB ILE 127 HB ILE 127 -15.460 12.355 -15.085 945 1HG1 ILE 127 HG12 ILE 127 -14.020 12.628 -13.001 946 2HG1 ILE 127 HG13 ILE 127 -12.608 12.611 -14.074 947 1HG2 ILE 127 HG21 ILE 127 -15.278 9.973 -14.933 948 2HG2 ILE 127 HG22 ILE 127 -13.705 10.131 -14.102 949 3HG2 ILE 127 HG23 ILE 127 -15.197 10.756 -13.358 950 1HD1 ILE 127 HD11 ILE 127 -15.012 14.472 -14.326 951 2HD1 ILE 127 HD12 ILE 127 -13.518 14.892 -13.454 952 3HD1 ILE 127 HD13 ILE 127 -13.461 14.592 -15.202 953 H GLY 128 H GLY 128 -14.748 9.531 -17.033 954 1HA GLY 128 HA1 GLY 128 -12.538 7.881 -16.442 955 2HA GLY 128 HA2 GLY 128 -13.924 7.459 -17.475 956 H ASN 129 H ASN 129 -13.712 9.175 -19.595 957 HA ASN 129 HA ASN 129 -11.707 8.192 -21.295 958 1HB ASN 129 HB2 ASN 129 -13.691 9.259 -22.181 959 2HB ASN 129 HB3 ASN 129 -13.353 10.735 -21.282 960 1HD2 ASN 129 HD22 ASN 129 -13.122 12.294 -22.863 961 2HD2 ASN 129 HD21 ASN 129 -11.926 12.165 -24.134 962 H ARG 130 H ARG 130 -11.655 11.204 -19.318 963 HA ARG 130 HA ARG 130 -9.164 12.037 -20.472 964 1HB ARG 130 HB2 ARG 130 -11.094 13.236 -18.780 965 2HB ARG 130 HB3 ARG 130 -9.696 13.069 -17.748 966 1HG ARG 130 HG2 ARG 130 -9.684 15.235 -18.828 967 2HG ARG 130 HG3 ARG 130 -8.316 14.288 -19.414 968 1HD ARG 130 HD2 ARG 130 -9.370 15.526 -21.255 969 2HD ARG 130 HD3 ARG 130 -9.539 13.801 -21.516 970 HE ARG 130 HE ARG 130 -11.818 13.922 -21.274 971 1HH1 ARG 130 HH11 ARG 130 -10.465 17.056 -20.274 972 2HH1 ARG 130 HH12 ARG 130 -11.965 17.895 -20.431 973 1HH2 ARG 130 HH21 ARG 130 -13.728 15.015 -21.580 974 2HH2 ARG 130 HH22 ARG 130 -13.902 16.692 -21.131 975 H LEU 131 H LEU 131 -10.028 10.204 -17.552 976 HA LEU 131 HA LEU 131 -7.327 10.025 -16.596 977 1HB LEU 131 HB2 LEU 131 -9.851 8.441 -15.998 978 2HB LEU 131 HB3 LEU 131 -8.335 8.168 -15.127 979 HG LEU 131 HG LEU 131 -9.528 10.972 -15.325 980 1HD1 LEU 131 HD11 LEU 131 -10.584 10.604 -13.156 981 2HD1 LEU 131 HD12 LEU 131 -11.271 9.569 -14.415 982 3HD1 LEU 131 HD13 LEU 131 -10.141 8.882 -13.224 983 1HD2 LEU 131 HD21 LEU 131 -7.640 9.663 -13.330 984 2HD2 LEU 131 HD22 LEU 131 -7.168 10.790 -14.606 985 3HD2 LEU 131 HD23 LEU 131 -8.225 11.348 -13.315 986 H LYS 132 H LYS 132 -9.281 7.941 -18.752 987 HA LYS 132 HA LYS 132 -7.358 5.884 -19.045 988 1HB LYS 132 HB2 LYS 132 -9.495 5.422 -19.827 989 2HB LYS 132 HB3 LYS 132 -9.684 6.938 -20.659 990 1HG LYS 132 HG2 LYS 132 -7.605 5.032 -21.738 991 2HG LYS 132 HG3 LYS 132 -9.312 4.607 -21.907 992 1HD LYS 132 HD2 LYS 132 -9.682 6.947 -22.901 993 2HD LYS 132 HD3 LYS 132 -7.928 7.067 -23.041 994 1HE LYS 132 HE2 LYS 132 -9.691 4.908 -24.287 995 2HE LYS 132 HE3 LYS 132 -9.062 6.323 -25.128 996 1HZ LYS 132 HZ1 LYS 132 -7.414 4.134 -24.002 997 2HZ LYS 132 HZ2 LYS 132 -7.710 4.408 -25.576 998 3HZ LYS 132 HZ3 LYS 132 -6.813 5.475 -24.741 999 H GLU 133 H GLU 133 -7.758 8.928 -20.954 1000 HA GLU 133 HA GLU 133 -5.423 8.400 -22.554 1001 1HB GLU 133 HB2 GLU 133 -6.752 11.024 -21.761 1002 2HB GLU 133 HB3 GLU 133 -5.406 10.884 -22.908 1003 1HG GLU 133 HG2 GLU 133 -6.776 9.393 -24.345 1004 2HG GLU 133 HG3 GLU 133 -8.153 9.602 -23.264 1005 H PHE 134 H PHE 134 -5.827 10.285 -19.499 1006 HA PHE 134 HA PHE 134 -3.160 11.108 -19.277 1007 1HB PHE 134 HB2 PHE 134 -4.829 12.006 -17.856 1008 2HB PHE 134 HB3 PHE 134 -5.305 10.408 -17.279 1009 HD1 PHE 134 HD1 PHE 134 -4.270 9.351 -15.449 1010 HD2 PHE 134 HD2 PHE 134 -2.637 12.991 -17.077 1011 HE1 PHE 134 HE1 PHE 134 -2.658 9.485 -13.549 1012 HE2 PHE 134 HE2 PHE 134 -1.011 13.099 -15.213 1013 HZ PHE 134 HZ PHE 134 -1.029 11.341 -13.456 1014 H ALA 135 H ALA 135 -4.627 7.997 -18.375 1015 HA ALA 135 HA ALA 135 -2.255 6.940 -17.164 1016 1HB ALA 135 HB1 ALA 135 -4.709 5.503 -18.252 1017 2HB ALA 135 HB2 ALA 135 -3.467 4.798 -17.196 1018 3HB ALA 135 HB3 ALA 135 -4.492 6.117 -16.597 1019 H GLU 136 H GLU 136 -3.793 6.444 -20.351 1020 HA GLU 136 HA GLU 136 -1.870 4.545 -21.258 1021 1HB GLU 136 HB2 GLU 136 -4.012 6.165 -22.673 1022 2HB GLU 136 HB3 GLU 136 -2.998 5.001 -23.519 1023 1HG GLU 136 HG2 GLU 136 -4.746 4.273 -21.125 1024 2HG GLU 136 HG3 GLU 136 -5.239 4.115 -22.805 1025 H THR 137 H THR 137 -2.153 8.048 -21.711 1026 HA THR 137 HA THR 137 0.078 8.074 -23.527 1027 HB THR 137 HB THR 137 -0.395 10.383 -23.826 1028 HG1 THR 137 HG1 THR 137 -2.381 10.132 -21.840 1029 1HG2 THR 137 HG21 THR 137 -1.800 8.750 -25.024 1030 2HG2 THR 137 HG22 THR 137 -2.976 8.751 -23.706 1031 3HG2 THR 137 HG23 THR 137 -2.710 10.232 -24.652 1032 H GLY 138 H GLY 138 -0.427 8.293 -20.113 1033 1HA GLY 138 HA1 GLY 138 0.850 8.794 -18.331 1034 2HA GLY 138 HA2 GLY 138 2.305 8.599 -19.345 1035 H LYS 139 H LYS 139 -0.474 10.807 -19.654 1036 HA LYS 139 HA LYS 139 0.886 12.914 -20.725 1037 1HB LYS 139 HB2 LYS 139 -1.627 12.438 -20.471 1038 2HB LYS 139 HB3 LYS 139 -1.540 13.311 -18.943 1039 1HG LYS 139 HG2 LYS 139 -0.819 15.330 -20.023 1040 2HG LYS 139 HG3 LYS 139 -0.545 14.504 -21.559 1041 1HD LYS 139 HD2 LYS 139 -3.224 15.052 -20.229 1042 2HD LYS 139 HD3 LYS 139 -2.595 15.797 -21.690 1043 1HE LYS 139 HE2 LYS 139 -3.567 12.929 -21.332 1044 2HE LYS 139 HE3 LYS 139 -4.282 14.209 -22.313 1045 1HZ LYS 139 HZ1 LYS 139 -1.828 12.666 -22.848 1046 2HZ LYS 139 HZ2 LYS 139 -3.147 12.818 -23.777 1047 3HZ LYS 139 HZ3 LYS 139 -2.136 14.090 -23.642 Start of MODEL 16 1 1H MET 1 H1 MET 1 0.457 -0.132 -0.116 2 2H MET 1 H2 MET 1 0.307 -0.550 -1.699 3 3H MET 1 H3 MET 1 1.227 -1.467 -0.694 4 HA MET 1 HA MET 1 2.844 0.198 -0.446 5 1HB MET 1 HB2 MET 1 2.937 -1.247 -2.501 6 2HB MET 1 HB3 MET 1 2.087 0.011 -3.402 7 1HG MET 1 HG2 MET 1 4.524 -0.008 -3.777 8 2HG MET 1 HG3 MET 1 3.945 1.532 -3.166 9 1HE MET 1 HE1 MET 1 6.478 2.220 -2.705 10 2HE MET 1 HE2 MET 1 7.606 1.241 -1.741 11 3HE MET 1 HE3 MET 1 7.013 0.633 -3.303 12 H GLU 2 H GLU 2 3.623 2.398 -0.976 13 HA GLU 2 HA GLU 2 1.610 4.330 -1.934 14 1HB GLU 2 HB2 GLU 2 3.355 4.723 0.549 15 2HB GLU 2 HB3 GLU 2 2.347 5.953 -0.229 16 1HG GLU 2 HG2 GLU 2 0.322 4.613 0.313 17 2HG GLU 2 HG3 GLU 2 1.328 3.408 1.115 18 H ASN 3 H ASN 3 2.657 5.553 -3.519 19 HA ASN 3 HA ASN 3 5.596 5.629 -3.612 20 1HB ASN 3 HB2 ASN 3 5.383 3.501 -4.550 21 2HB ASN 3 HB3 ASN 3 3.961 3.929 -5.479 22 1HD2 ASN 3 HD22 ASN 3 4.208 4.909 -7.508 23 2HD2 ASN 3 HD21 ASN 3 5.783 5.180 -8.248 24 H LYS 4 H LYS 4 2.566 6.359 -5.346 25 HA LYS 4 HA LYS 4 3.583 9.113 -5.855 26 1HB LYS 4 HB2 LYS 4 2.125 7.247 -7.781 27 2HB LYS 4 HB3 LYS 4 2.091 8.995 -7.980 28 1HG LYS 4 HG2 LYS 4 4.343 9.158 -8.539 29 2HG LYS 4 HG3 LYS 4 4.785 7.676 -7.705 30 1HD LYS 4 HD2 LYS 4 4.962 7.304 -10.091 31 2HD LYS 4 HD3 LYS 4 3.688 6.308 -9.399 32 1HE LYS 4 HE2 LYS 4 2.798 7.064 -11.410 33 2HE LYS 4 HE3 LYS 4 2.000 8.025 -10.169 34 1HZ LYS 4 HZ1 LYS 4 4.289 8.971 -11.804 35 2HZ LYS 4 HZ2 LYS 4 2.724 9.340 -12.077 36 3HZ LYS 4 HZ3 LYS 4 3.447 9.894 -10.730 37 H ILE 5 H ILE 5 1.681 10.633 -6.047 38 HA ILE 5 HA ILE 5 -0.769 9.710 -4.650 39 HB ILE 5 HB ILE 5 1.116 11.942 -3.808 40 1HG1 ILE 5 HG12 ILE 5 -0.106 9.692 -2.167 41 2HG1 ILE 5 HG13 ILE 5 1.518 9.673 -2.849 42 1HG2 ILE 5 HG21 ILE 5 -1.164 12.913 -3.832 43 2HG2 ILE 5 HG22 ILE 5 -1.768 11.540 -2.892 44 3HG2 ILE 5 HG23 ILE 5 -0.630 12.710 -2.177 45 1HD1 ILE 5 HD11 ILE 5 2.080 11.718 -1.510 46 2HD1 ILE 5 HD12 ILE 5 0.514 11.540 -0.678 47 3HD1 ILE 5 HD13 ILE 5 1.728 10.262 -0.558 48 H ILE 6 H ILE 6 -2.515 10.528 -5.707 49 HA ILE 6 HA ILE 6 -2.144 12.869 -7.499 50 HB ILE 6 HB ILE 6 -2.247 11.076 -8.985 51 1HG1 ILE 6 HG12 ILE 6 -5.063 12.224 -8.774 52 2HG1 ILE 6 HG13 ILE 6 -3.667 13.009 -9.517 53 1HG2 ILE 6 HG21 ILE 6 -3.924 9.275 -9.009 54 2HG2 ILE 6 HG22 ILE 6 -2.992 9.244 -7.529 55 3HG2 ILE 6 HG23 ILE 6 -4.636 9.920 -7.516 56 1HD1 ILE 6 HD11 ILE 6 -5.129 10.522 -10.483 57 2HD1 ILE 6 HD12 ILE 6 -4.962 12.086 -11.293 58 3HD1 ILE 6 HD13 ILE 6 -3.551 11.019 -11.131 59 H TYR 7 H TYR 7 -3.449 14.498 -6.949 60 HA TYR 7 HA TYR 7 -5.577 13.972 -4.942 61 1HB TYR 7 HB2 TYR 7 -3.385 14.893 -4.098 62 2HB TYR 7 HB3 TYR 7 -3.678 16.340 -5.047 63 HD1 TYR 7 HD1 TYR 7 -6.090 14.323 -2.910 64 HD2 TYR 7 HD2 TYR 7 -3.878 17.998 -3.400 65 HE1 TYR 7 HE1 TYR 7 -7.135 15.217 -0.867 66 HE2 TYR 7 HE2 TYR 7 -4.865 18.862 -1.294 67 HH TYR 7 HH TYR 7 -7.205 16.983 0.651 68 H PHE 8 H PHE 8 -7.424 14.140 -6.105 69 HA PHE 8 HA PHE 8 -7.720 16.048 -8.292 70 1HB PHE 8 HB2 PHE 8 -9.719 14.275 -6.833 71 2HB PHE 8 HB3 PHE 8 -10.133 15.312 -8.192 72 HD1 PHE 8 HD1 PHE 8 -8.951 15.003 -10.413 73 HD2 PHE 8 HD2 PHE 8 -8.733 12.101 -7.226 74 HE1 PHE 8 HE1 PHE 8 -8.074 13.319 -12.008 75 HE2 PHE 8 HE2 PHE 8 -7.885 10.415 -8.839 76 HZ PHE 8 HZ PHE 8 -7.518 11.027 -11.205 77 H LEU 9 H LEU 9 -8.970 17.898 -8.329 78 HA LEU 9 HA LEU 9 -9.913 19.105 -5.776 79 1HB LEU 9 HB2 LEU 9 -7.623 19.843 -7.518 80 2HB LEU 9 HB3 LEU 9 -8.815 21.114 -7.496 81 HG LEU 9 HG LEU 9 -7.079 21.533 -5.910 82 1HD1 LEU 9 HD11 LEU 9 -8.411 22.221 -4.093 83 2HD1 LEU 9 HD12 LEU 9 -9.505 22.209 -5.469 84 3HD1 LEU 9 HD13 LEU 9 -9.553 20.876 -4.282 85 1HD2 LEU 9 HD21 LEU 9 -6.622 20.168 -3.969 86 2HD2 LEU 9 HD22 LEU 9 -7.928 19.040 -4.378 87 3HD2 LEU 9 HD23 LEU 9 -6.490 19.152 -5.406 88 H CYS 10 H CYS 10 -11.799 20.399 -6.136 89 HA CYS 10 HA CYS 10 -12.337 21.415 -8.757 90 1HB CYS 10 HB2 CYS 10 -13.264 18.908 -8.666 91 2HB CYS 10 HB3 CYS 10 -14.613 19.666 -7.801 92 HG CYS 10 HG CYS 10 -13.201 20.473 -10.704 93 H THR 11 H THR 11 -14.691 22.625 -8.627 94 HA THR 11 HA THR 11 -14.400 24.366 -6.381 95 HB THR 11 HB THR 11 -16.550 25.357 -7.387 96 HG1 THR 11 HG1 THR 11 -16.986 24.692 -9.459 97 1HG2 THR 11 HG21 THR 11 -14.117 26.076 -7.729 98 2HG2 THR 11 HG22 THR 11 -14.132 25.111 -9.220 99 3HG2 THR 11 HG23 THR 11 -15.244 26.479 -9.039 100 H GLY 12 H GLY 12 -15.967 21.389 -6.593 101 1HA GLY 12 HA1 GLY 12 -16.759 21.621 -3.847 102 2HA GLY 12 HA2 GLY 12 -18.141 21.321 -4.941 103 H ASN 13 H ASN 13 -15.786 19.837 -3.146 104 HA ASN 13 HA ASN 13 -14.608 17.830 -4.716 105 1HB ASN 13 HB2 ASN 13 -13.976 18.274 -2.359 106 2HB ASN 13 HB3 ASN 13 -15.580 17.821 -1.818 107 1HD2 ASN 13 HD22 ASN 13 -12.797 16.396 -3.635 108 2HD2 ASN 13 HD21 ASN 13 -13.097 14.752 -3.052 109 H SER 14 H SER 14 -17.721 17.973 -3.147 110 HA SER 14 HA SER 14 -18.629 15.594 -2.689 111 1HB SER 14 HB2 SER 14 -20.404 17.598 -4.088 112 2HB SER 14 HB3 SER 14 -20.751 16.640 -2.639 113 HG SER 14 HG SER 14 -20.105 19.074 -2.645 114 H CYS 15 H CYS 15 -18.472 16.804 -6.038 115 HA CYS 15 HA CYS 15 -19.898 14.334 -6.934 116 1HB CYS 15 HB2 CYS 15 -19.894 16.996 -8.401 117 2HB CYS 15 HB3 CYS 15 -20.920 15.586 -8.678 118 HG CYS 15 HG CYS 15 -22.079 17.783 -7.695 119 H ARG 16 H ARG 16 -17.907 16.870 -8.530 120 HA ARG 16 HA ARG 16 -17.045 15.078 -10.554 121 1HB ARG 16 HB2 ARG 16 -16.099 17.832 -9.648 122 2HB ARG 16 HB3 ARG 16 -15.344 17.008 -11.011 123 1HG ARG 16 HG2 ARG 16 -17.274 17.020 -12.326 124 2HG ARG 16 HG3 ARG 16 -18.363 17.268 -10.963 125 1HD ARG 16 HD2 ARG 16 -16.363 19.362 -11.870 126 2HD ARG 16 HD3 ARG 16 -18.017 19.262 -12.481 127 HE ARG 16 HE ARG 16 -18.492 19.295 -9.811 128 1HH1 ARG 16 HH11 ARG 16 -16.839 21.567 -11.987 129 2HH1 ARG 16 HH12 ARG 16 -16.790 22.828 -10.771 130 1HH2 ARG 16 HH21 ARG 16 -18.601 20.948 -8.390 131 2HH2 ARG 16 HH22 ARG 16 -17.801 22.488 -8.704 132 H SER 17 H SER 17 -15.213 16.250 -7.645 133 HA SER 17 HA SER 17 -12.881 14.829 -8.417 134 1HB SER 17 HB2 SER 17 -13.505 15.581 -5.587 135 2HB SER 17 HB3 SER 17 -11.963 15.659 -6.477 136 HG SER 17 HG SER 17 -12.772 17.716 -6.165 137 H GLN 18 H GLN 18 -15.640 13.957 -6.295 138 HA GLN 18 HA GLN 18 -14.541 11.506 -5.321 139 1HB GLN 18 HB2 GLN 18 -17.409 12.463 -5.811 140 2HB GLN 18 HB3 GLN 18 -17.042 10.924 -5.053 141 1HG GLN 18 HG2 GLN 18 -16.161 13.627 -3.975 142 2HG GLN 18 HG3 GLN 18 -17.561 12.730 -3.413 143 1HE2 GLN 18 HE22 GLN 18 -15.259 13.571 -1.835 144 2HE2 GLN 18 HE21 GLN 18 -14.507 12.119 -1.208 145 H MET 19 H MET 19 -16.530 12.178 -8.291 146 HA MET 19 HA MET 19 -16.546 9.404 -9.091 147 1HB MET 19 HB2 MET 19 -16.939 11.939 -10.743 148 2HB MET 19 HB3 MET 19 -17.167 10.288 -11.336 149 1HG MET 19 HG2 MET 19 -18.807 9.974 -9.376 150 2HG MET 19 HG3 MET 19 -18.781 11.723 -9.219 151 1HE MET 19 HE1 MET 19 -18.494 12.383 -12.560 152 2HE MET 19 HE2 MET 19 -20.205 12.774 -12.813 153 3HE MET 19 HE3 MET 19 -19.370 13.351 -11.348 154 H ALA 20 H ALA 20 -14.383 12.179 -10.012 155 HA ALA 20 HA ALA 20 -12.765 10.781 -11.831 156 1HB ALA 20 HB1 ALA 20 -12.675 13.231 -11.435 157 2HB ALA 20 HB2 ALA 20 -11.909 12.936 -9.856 158 3HB ALA 20 HB3 ALA 20 -11.073 12.476 -11.351 159 H GLU 21 H GLU 21 -12.424 11.040 -8.256 160 HA GLU 21 HA GLU 21 -10.091 9.513 -7.941 161 1HB GLU 21 HB2 GLU 21 -11.079 10.903 -6.194 162 2HB GLU 21 HB3 GLU 21 -12.520 9.878 -6.128 163 1HG GLU 21 HG2 GLU 21 -11.108 7.979 -5.426 164 2HG GLU 21 HG3 GLU 21 -9.695 9.035 -5.400 165 H GLY 22 H GLY 22 -13.549 8.435 -7.979 166 1HA GLY 22 HA1 GLY 22 -13.165 5.681 -7.703 167 2HA GLY 22 HA2 GLY 22 -14.480 6.461 -8.593 168 H TRP 23 H TRP 23 -13.272 7.564 -10.874 169 HA TRP 23 HA TRP 23 -12.799 5.133 -12.381 170 1HB TRP 23 HB2 TRP 23 -12.445 8.049 -13.105 171 2HB TRP 23 HB3 TRP 23 -12.151 6.736 -14.230 172 HD1 TRP 23 HD1 TRP 23 -14.878 8.721 -12.624 173 HE1 TRP 23 HE1 TRP 23 -17.050 8.436 -13.884 174 HE3 TRP 23 HE3 TRP 23 -13.591 4.691 -15.518 175 HZ2 TRP 23 HZ2 TRP 23 -18.137 6.674 -15.892 176 HZ3 TRP 23 HZ3 TRP 23 -15.228 3.769 -17.135 177 HH2 TRP 23 HH2 TRP 23 -17.519 4.785 -17.321 178 H ALA 24 H ALA 24 -10.564 7.631 -11.028 179 HA ALA 24 HA ALA 24 -8.332 6.750 -12.514 180 1HB ALA 24 HB1 ALA 24 -8.441 8.925 -11.325 181 2HB ALA 24 HB2 ALA 24 -8.372 8.079 -9.772 182 3HB ALA 24 HB3 ALA 24 -6.982 8.018 -10.884 183 H LYS 25 H LYS 25 -9.631 5.521 -9.431 184 HA LYS 25 HA LYS 25 -7.425 3.818 -8.833 185 1HB LYS 25 HB2 LYS 25 -10.400 3.624 -8.214 186 2HB LYS 25 HB3 LYS 25 -9.217 2.488 -7.554 187 1HG LYS 25 HG2 LYS 25 -8.085 4.170 -6.309 188 2HG LYS 25 HG3 LYS 25 -8.868 5.485 -7.191 189 1HD LYS 25 HD2 LYS 25 -11.063 4.842 -6.250 190 2HD LYS 25 HD3 LYS 25 -10.271 3.564 -5.289 191 1HE LYS 25 HE2 LYS 25 -8.888 5.273 -4.141 192 2HE LYS 25 HE3 LYS 25 -9.571 6.530 -5.181 193 1HZ LYS 25 HZ1 LYS 25 -10.985 5.022 -3.076 194 2HZ LYS 25 HZ2 LYS 25 -10.760 6.663 -3.199 195 3HZ LYS 25 HZ3 LYS 25 -11.776 5.920 -4.219 196 H GLN 26 H GLN 26 -9.871 3.491 -11.336 197 HA GLN 26 HA GLN 26 -9.362 0.608 -11.729 198 1HB GLN 26 HB2 GLN 26 -11.153 2.699 -13.000 199 2HB GLN 26 HB3 GLN 26 -10.770 1.250 -13.888 200 1HG GLN 26 HG2 GLN 26 -12.941 1.364 -12.472 201 2HG GLN 26 HG3 GLN 26 -12.004 -0.122 -12.547 202 1HE2 GLN 26 HE22 GLN 26 -12.195 2.890 -10.419 203 2HE2 GLN 26 HE21 GLN 26 -12.045 1.966 -8.961 204 H TYR 27 H TYR 27 -8.736 3.712 -13.397 205 HA TYR 27 HA TYR 27 -7.266 2.453 -15.532 206 1HB TYR 27 HB2 TYR 27 -7.590 5.334 -14.634 207 2HB TYR 27 HB3 TYR 27 -6.659 4.875 -16.061 208 HD1 TYR 27 HD1 TYR 27 -9.823 5.981 -15.053 209 HD2 TYR 27 HD2 TYR 27 -7.956 3.119 -17.689 210 HE1 TYR 27 HE1 TYR 27 -11.869 5.914 -16.442 211 HE2 TYR 27 HE2 TYR 27 -10.016 3.014 -19.048 212 HH TYR 27 HH TYR 27 -12.190 3.825 -19.337 213 H LEU 28 H LEU 28 -6.262 3.878 -12.441 214 HA LEU 28 HA LEU 28 -3.394 3.570 -13.138 215 1HB LEU 28 HB2 LEU 28 -4.663 4.794 -10.663 216 2HB LEU 28 HB3 LEU 28 -2.975 4.880 -11.153 217 HG LEU 28 HG LEU 28 -5.311 6.173 -12.627 218 1HD1 LEU 28 HD11 LEU 28 -3.053 7.456 -11.054 219 2HD1 LEU 28 HD12 LEU 28 -4.410 8.275 -11.860 220 3HD1 LEU 28 HD13 LEU 28 -4.714 7.229 -10.465 221 1HD2 LEU 28 HD21 LEU 28 -3.547 5.516 -14.229 222 2HD2 LEU 28 HD22 LEU 28 -3.641 7.256 -14.038 223 3HD2 LEU 28 HD23 LEU 28 -2.334 6.357 -13.238 224 H GLY 29 H GLY 29 -3.079 3.158 -10.020 225 1HA GLY 29 HA1 GLY 29 -3.952 0.533 -9.434 226 2HA GLY 29 HA2 GLY 29 -2.365 0.446 -10.222 227 H ASP 30 H ASP 30 -2.148 -0.468 -7.834 228 HA ASP 30 HA ASP 30 -2.276 1.293 -5.651 229 1HB ASP 30 HB2 ASP 30 -2.376 -1.225 -5.625 230 2HB ASP 30 HB3 ASP 30 -0.619 -1.246 -5.838 231 H GLU 31 H GLU 31 0.169 1.072 -8.009 232 HA GLU 31 HA GLU 31 2.467 2.103 -6.661 233 1HB GLU 31 HB2 GLU 31 2.263 1.009 -8.957 234 2HB GLU 31 HB3 GLU 31 1.529 2.509 -9.547 235 1HG GLU 31 HG2 GLU 31 3.564 3.737 -9.168 236 2HG GLU 31 HG3 GLU 31 4.291 2.382 -8.285 237 H TRP 32 H TRP 32 -0.597 3.485 -7.144 238 HA TRP 32 HA TRP 32 0.413 6.213 -6.558 239 1HB TRP 32 HB2 TRP 32 -2.174 5.496 -7.989 240 2HB TRP 32 HB3 TRP 32 -1.544 7.098 -7.689 241 HD1 TRP 32 HD1 TRP 32 -0.557 3.977 -9.765 242 HE1 TRP 32 HE1 TRP 32 0.147 4.760 -12.106 243 HE3 TRP 32 HE3 TRP 32 -0.775 9.055 -9.063 244 HZ2 TRP 32 HZ2 TRP 32 0.439 7.196 -13.525 245 HZ3 TRP 32 HZ3 TRP 32 -0.336 10.582 -10.961 246 HH2 TRP 32 HH2 TRP 32 0.226 9.640 -13.221 247 H LYS 33 H LYS 33 -1.052 7.358 -5.135 248 HA LYS 33 HA LYS 33 -3.231 5.786 -3.851 249 1HB LYS 33 HB2 LYS 33 -1.312 7.813 -2.645 250 2HB LYS 33 HB3 LYS 33 -2.845 7.396 -1.886 251 1HG LYS 33 HG2 LYS 33 -0.669 5.360 -2.514 252 2HG LYS 33 HG3 LYS 33 -0.835 6.229 -0.992 253 1HD LYS 33 HD2 LYS 33 -1.855 4.232 -0.477 254 2HD LYS 33 HD3 LYS 33 -3.218 5.263 -0.839 255 1HE LYS 33 HE2 LYS 33 -3.538 3.027 -1.726 256 2HE LYS 33 HE3 LYS 33 -3.460 4.156 -3.077 257 1HZ LYS 33 HZ1 LYS 33 -1.443 3.309 -3.729 258 2HZ LYS 33 HZ2 LYS 33 -1.007 2.751 -2.232 259 3HZ LYS 33 HZ3 LYS 33 -2.113 1.953 -3.105 260 H VAL 34 H VAL 34 -5.171 6.809 -3.768 261 HA VAL 34 HA VAL 34 -5.342 9.226 -5.499 262 HB VAL 34 HB VAL 34 -7.315 6.923 -5.485 263 1HG1 VAL 34 HG11 VAL 34 -7.817 9.221 -6.562 264 2HG1 VAL 34 HG12 VAL 34 -6.614 8.771 -7.783 265 3HG1 VAL 34 HG13 VAL 34 -8.066 7.777 -7.547 266 1HG2 VAL 34 HG21 VAL 34 -6.229 6.002 -7.535 267 2HG2 VAL 34 HG22 VAL 34 -4.829 7.049 -7.234 268 3HG2 VAL 34 HG23 VAL 34 -5.261 5.767 -6.074 269 H TYR 35 H TYR 35 -6.182 10.856 -4.363 270 HA TYR 35 HA TYR 35 -8.570 10.323 -2.716 271 1HB TYR 35 HB2 TYR 35 -7.017 12.504 -1.557 272 2HB TYR 35 HB3 TYR 35 -7.856 11.188 -0.789 273 HD1 TYR 35 HD1 TYR 35 -4.689 12.649 -1.549 274 HD2 TYR 35 HD2 TYR 35 -6.594 8.889 -0.626 275 HE1 TYR 35 HE1 TYR 35 -2.541 11.781 -0.735 276 HE2 TYR 35 HE2 TYR 35 -4.422 7.984 0.162 277 HH TYR 35 HH TYR 35 -1.413 9.947 0.201 278 H SER 36 H SER 36 -9.632 12.550 -2.229 279 HA SER 36 HA SER 36 -9.108 14.519 -4.357 280 1HB SER 36 HB2 SER 36 -11.501 14.577 -4.859 281 2HB SER 36 HB3 SER 36 -10.799 13.012 -5.284 282 HG SER 36 HG SER 36 -11.755 12.089 -3.565 283 H ALA 37 H ALA 37 -9.954 16.572 -3.914 284 HA ALA 37 HA ALA 37 -11.389 17.046 -1.401 285 1HB ALA 37 HB1 ALA 37 -9.926 18.800 -0.747 286 2HB ALA 37 HB2 ALA 37 -8.965 17.336 -0.911 287 3HB ALA 37 HB3 ALA 37 -8.888 18.592 -2.186 288 H GLY 38 H GLY 38 -11.385 19.853 -1.680 289 1HA GLY 38 HA1 GLY 38 -11.814 20.748 -4.350 290 2HA GLY 38 HA2 GLY 38 -13.357 20.443 -3.536 291 H ILE 39 H ILE 39 -12.983 22.947 -4.226 292 HA ILE 39 HA ILE 39 -11.810 24.742 -2.325 293 HB ILE 39 HB ILE 39 -14.098 24.850 -4.300 294 1HG1 ILE 39 HG12 ILE 39 -12.781 26.672 -5.312 295 2HG1 ILE 39 HG13 ILE 39 -11.581 26.537 -4.028 296 1HG2 ILE 39 HG21 ILE 39 -15.022 26.204 -2.538 297 2HG2 ILE 39 HG22 ILE 39 -13.488 27.102 -2.362 298 3HG2 ILE 39 HG23 ILE 39 -14.470 27.251 -3.837 299 1HD1 ILE 39 HD11 ILE 39 -10.916 24.313 -4.862 300 2HD1 ILE 39 HD12 ILE 39 -12.217 24.370 -6.079 301 3HD1 ILE 39 HD13 ILE 39 -10.876 25.505 -6.164 302 H GLU 40 H GLU 40 -14.936 23.027 -2.476 303 HA GLU 40 HA GLU 40 -14.974 23.028 0.466 304 1HB GLU 40 HB2 GLU 40 -17.306 23.625 0.632 305 2HB GLU 40 HB3 GLU 40 -16.387 24.928 -0.111 306 1HG GLU 40 HG2 GLU 40 -17.198 24.255 -2.356 307 2HG GLU 40 HG3 GLU 40 -18.102 22.907 -1.654 308 H ALA 41 H ALA 41 -16.907 21.503 1.147 309 HA ALA 41 HA ALA 41 -17.355 19.216 -0.678 310 1HB ALA 41 HB1 ALA 41 -15.302 18.605 0.465 311 2HB ALA 41 HB2 ALA 41 -15.985 19.053 2.047 312 3HB ALA 41 HB3 ALA 41 -16.649 17.677 1.157 313 H HIS 42 H HIS 42 -19.519 19.124 -0.631 314 HA HIS 42 HA HIS 42 -21.124 20.002 1.657 315 1HB HIS 42 HB2 HIS 42 -21.883 20.266 -0.700 316 2HB HIS 42 HB3 HIS 42 -21.879 18.510 -0.896 317 HD1 HIS 42 HD1 HIS 42 -24.125 17.308 -0.214 318 HD2 HIS 42 HD2 HIS 42 -23.694 21.238 1.241 319 HE1 HIS 42 HE1 HIS 42 -26.339 17.910 0.882 320 H GLY 43 H GLY 43 -19.913 16.934 0.215 321 1HA GLY 43 HA1 GLY 43 -19.821 15.268 2.364 322 2HA GLY 43 HA2 GLY 43 -21.542 15.246 1.916 323 H LEU 44 H LEU 44 -20.560 12.872 1.536 324 HA LEU 44 HA LEU 44 -19.429 12.506 -1.155 325 1HB LEU 44 HB2 LEU 44 -18.975 10.875 0.677 326 2HB LEU 44 HB3 LEU 44 -20.707 10.574 0.836 327 HG LEU 44 HG LEU 44 -20.706 9.791 -1.577 328 1HD1 LEU 44 HD11 LEU 44 -18.622 10.781 -2.386 329 2HD1 LEU 44 HD12 LEU 44 -17.688 9.840 -1.200 330 3HD1 LEU 44 HD13 LEU 44 -18.546 9.023 -2.523 331 1HD2 LEU 44 HD21 LEU 44 -20.820 8.187 0.214 332 2HD2 LEU 44 HD22 LEU 44 -19.665 7.570 -0.983 333 3HD2 LEU 44 HD23 LEU 44 -19.081 8.311 0.516 334 H ASN 45 H ASN 45 -20.830 13.409 -2.698 335 HA ASN 45 HA ASN 45 -23.596 13.725 -2.271 336 1HB ASN 45 HB2 ASN 45 -22.183 15.008 -3.888 337 2HB ASN 45 HB3 ASN 45 -22.212 13.621 -4.981 338 1HD2 ASN 45 HD22 ASN 45 -23.372 16.446 -5.214 339 2HD2 ASN 45 HD21 ASN 45 -25.077 16.201 -5.515 340 HA PRO 46 HA PRO 46 -24.954 9.448 -3.003 341 1HB PRO 46 HB2 PRO 46 -27.531 10.895 -3.645 342 2HB PRO 46 HB3 PRO 46 -27.285 9.406 -2.679 343 1HG PRO 46 HG2 PRO 46 -27.672 11.785 -1.440 344 2HG PRO 46 HG3 PRO 46 -26.408 10.661 -0.840 345 1HD PRO 46 HD2 PRO 46 -26.067 13.098 -2.601 346 2HD PRO 46 HD3 PRO 46 -25.089 12.566 -1.198 347 H ASN 47 H ASN 47 -25.560 12.142 -5.324 348 HA ASN 47 HA ASN 47 -26.166 10.448 -7.549 349 1HB ASN 47 HB2 ASN 47 -26.427 12.343 -8.661 350 2HB ASN 47 HB3 ASN 47 -26.098 13.229 -7.196 351 1HD2 ASN 47 HD22 ASN 47 -25.158 12.768 -10.462 352 2HD2 ASN 47 HD21 ASN 47 -23.580 13.507 -10.375 353 H ALA 48 H ALA 48 -23.055 11.536 -6.149 354 HA ALA 48 HA ALA 48 -21.497 10.558 -8.373 355 1HB ALA 48 HB1 ALA 48 -20.643 11.124 -5.492 356 2HB ALA 48 HB2 ALA 48 -19.578 10.925 -6.896 357 3HB ALA 48 HB3 ALA 48 -20.680 12.311 -6.813 358 H VAL 49 H VAL 49 -22.567 9.266 -5.192 359 HA VAL 49 HA VAL 49 -21.094 6.836 -5.365 360 HB VAL 49 HB VAL 49 -23.734 7.209 -3.910 361 1HG1 VAL 49 HG11 VAL 49 -22.771 5.382 -2.486 362 2HG1 VAL 49 HG12 VAL 49 -23.046 4.852 -4.148 363 3HG1 VAL 49 HG13 VAL 49 -21.402 5.248 -3.617 364 1HG2 VAL 49 HG21 VAL 49 -22.260 7.645 -1.929 365 2HG2 VAL 49 HG22 VAL 49 -20.866 7.741 -3.035 366 3HG2 VAL 49 HG23 VAL 49 -22.184 8.923 -3.135 367 H LYS 50 H LYS 50 -24.566 7.542 -6.265 368 HA LYS 50 HA LYS 50 -24.945 4.905 -7.242 369 1HB LYS 50 HB2 LYS 50 -26.787 6.517 -6.643 370 2HB LYS 50 HB3 LYS 50 -26.443 7.410 -8.137 371 1HG LYS 50 HG2 LYS 50 -26.923 5.323 -9.455 372 2HG LYS 50 HG3 LYS 50 -27.275 4.471 -7.942 373 1HD LYS 50 HD2 LYS 50 -29.145 6.045 -7.508 374 2HD LYS 50 HD3 LYS 50 -28.773 6.890 -9.030 375 1HE LYS 50 HE2 LYS 50 -29.192 4.801 -10.299 376 2HE LYS 50 HE3 LYS 50 -29.549 3.948 -8.792 377 1HZ LYS 50 HZ1 LYS 50 -31.444 5.433 -8.478 378 2HZ LYS 50 HZ2 LYS 50 -31.117 6.220 -9.875 379 3HZ LYS 50 HZ3 LYS 50 -31.567 4.655 -9.902 380 H ALA 51 H ALA 51 -23.909 7.898 -8.938 381 HA ALA 51 HA ALA 51 -23.961 6.902 -11.532 382 1HB ALA 51 HB1 ALA 51 -22.106 8.599 -11.952 383 2HB ALA 51 HB2 ALA 51 -23.526 9.255 -11.124 384 3HB ALA 51 HB3 ALA 51 -22.036 8.875 -10.216 385 H MET 52 H MET 52 -21.233 6.710 -9.151 386 HA MET 52 HA MET 52 -19.611 5.219 -11.038 387 1HB MET 52 HB2 MET 52 -19.355 5.722 -8.058 388 2HB MET 52 HB3 MET 52 -18.122 4.953 -9.058 389 1HG MET 52 HG2 MET 52 -19.139 7.797 -9.280 390 2HG MET 52 HG3 MET 52 -17.542 7.273 -8.763 391 1HE MET 52 HE1 MET 52 -16.953 4.976 -10.925 392 2HE MET 52 HE2 MET 52 -16.054 5.848 -12.151 393 3HE MET 52 HE3 MET 52 -15.724 6.163 -10.436 394 H LYS 53 H LYS 53 -21.773 4.325 -8.322 395 HA LYS 53 HA LYS 53 -20.972 1.628 -8.149 396 1HB LYS 53 HB2 LYS 53 -22.468 3.061 -6.587 397 2HB LYS 53 HB3 LYS 53 -23.812 2.581 -7.636 398 1HG LYS 53 HG2 LYS 53 -23.182 0.162 -7.078 399 2HG LYS 53 HG3 LYS 53 -21.956 0.816 -5.969 400 1HD LYS 53 HD2 LYS 53 -23.923 2.159 -4.887 401 2HD LYS 53 HD3 LYS 53 -24.980 1.123 -5.844 402 1HE LYS 53 HE2 LYS 53 -24.945 -0.041 -3.862 403 2HE LYS 53 HE3 LYS 53 -23.650 -0.859 -4.737 404 1HZ LYS 53 HZ1 LYS 53 -23.299 1.275 -2.696 405 2HZ LYS 53 HZ2 LYS 53 -22.994 -0.310 -2.480 406 3HZ LYS 53 HZ3 LYS 53 -22.058 0.574 -3.486 407 H GLU 54 H GLU 54 -23.340 3.223 -10.281 408 HA GLU 54 HA GLU 54 -24.237 0.841 -11.560 409 1HB GLU 54 HB2 GLU 54 -24.323 3.794 -12.270 410 2HB GLU 54 HB3 GLU 54 -24.951 2.579 -13.381 411 1HG GLU 54 HG2 GLU 54 -25.865 2.901 -10.492 412 2HG GLU 54 HG3 GLU 54 -26.674 3.600 -11.888 413 H VAL 55 H VAL 55 -21.280 2.702 -12.023 414 HA VAL 55 HA VAL 55 -20.624 1.385 -14.566 415 HB VAL 55 HB VAL 55 -18.793 2.881 -12.627 416 1HG1 VAL 55 HG11 VAL 55 -17.332 3.191 -14.600 417 2HG1 VAL 55 HG12 VAL 55 -17.473 1.499 -14.148 418 3HG1 VAL 55 HG13 VAL 55 -18.383 2.116 -15.546 419 1HG2 VAL 55 HG21 VAL 55 -19.021 4.796 -14.149 420 2HG2 VAL 55 HG22 VAL 55 -20.161 3.885 -15.171 421 3HG2 VAL 55 HG23 VAL 55 -20.603 4.353 -13.523 422 H GLY 56 H GLY 56 -20.541 0.595 -11.168 423 1HA GLY 56 HA1 GLY 56 -20.130 -1.597 -10.355 424 2HA GLY 56 HA2 GLY 56 -18.989 -1.902 -11.673 425 H ILE 57 H ILE 57 -18.971 1.194 -9.942 426 HA ILE 57 HA ILE 57 -16.369 0.517 -8.650 427 HB ILE 57 HB ILE 57 -17.229 3.027 -10.115 428 1HG1 ILE 57 HG12 ILE 57 -15.028 1.031 -10.815 429 2HG1 ILE 57 HG13 ILE 57 -16.602 1.099 -11.606 430 1HG2 ILE 57 HG21 ILE 57 -14.581 2.394 -8.720 431 2HG2 ILE 57 HG22 ILE 57 -14.965 3.890 -9.597 432 3HG2 ILE 57 HG23 ILE 57 -15.810 3.511 -8.110 433 1HD1 ILE 57 HD11 ILE 57 -15.031 2.214 -13.009 434 2HD1 ILE 57 HD12 ILE 57 -16.156 3.407 -12.357 435 3HD1 ILE 57 HD13 ILE 57 -14.503 3.283 -11.695 436 H ASP 58 H ASP 58 -17.186 0.147 -6.671 437 HA ASP 58 HA ASP 58 -19.463 1.620 -5.628 438 1HB ASP 58 HB2 ASP 58 -19.250 -0.755 -5.204 439 2HB ASP 58 HB3 ASP 58 -17.695 -0.519 -4.393 440 H ILE 59 H ILE 59 -18.522 3.816 -5.674 441 HA ILE 59 HA ILE 59 -16.280 4.361 -3.951 442 HB ILE 59 HB ILE 59 -16.480 6.634 -4.493 443 1HG1 ILE 59 HG12 ILE 59 -19.100 6.223 -5.942 444 2HG1 ILE 59 HG13 ILE 59 -19.012 6.793 -4.280 445 1HG2 ILE 59 HG21 ILE 59 -17.124 5.078 -6.999 446 2HG2 ILE 59 HG22 ILE 59 -16.223 6.604 -6.880 447 3HG2 ILE 59 HG23 ILE 59 -15.540 5.126 -6.193 448 1HD1 ILE 59 HD11 ILE 59 -19.195 8.740 -5.599 449 2HD1 ILE 59 HD12 ILE 59 -17.531 8.677 -5.016 450 3HD1 ILE 59 HD13 ILE 59 -17.894 8.236 -6.699 451 H SER 60 H SER 60 -19.231 3.404 -2.920 452 HA SER 60 HA SER 60 -20.160 5.331 -1.163 453 1HB SER 60 HB2 SER 60 -20.057 2.347 -0.562 454 2HB SER 60 HB3 SER 60 -21.253 3.526 -0.001 455 HG SER 60 HG SER 60 -20.950 2.247 -2.473 456 H ASN 61 H ASN 61 -17.278 3.334 -0.878 457 HA ASN 61 HA ASN 61 -16.831 3.695 1.940 458 1HB ASN 61 HB2 ASN 61 -15.986 1.749 0.669 459 2HB ASN 61 HB3 ASN 61 -14.986 2.817 -0.324 460 1HD2 ASN 61 HD22 ASN 61 -15.526 1.858 3.139 461 2HD2 ASN 61 HD21 ASN 61 -13.860 2.056 3.602 462 H GLN 62 H GLN 62 -16.277 5.799 -0.805 463 HA GLN 62 HA GLN 62 -13.927 7.122 0.217 464 1HB GLN 62 HB2 GLN 62 -15.923 8.028 -1.905 465 2HB GLN 62 HB3 GLN 62 -14.350 8.760 -1.545 466 1HG GLN 62 HG2 GLN 62 -13.240 6.604 -2.121 467 2HG GLN 62 HG3 GLN 62 -14.801 5.950 -2.612 468 1HE2 GLN 62 HE22 GLN 62 -14.911 9.186 -3.701 469 2HE2 GLN 62 HE21 GLN 62 -14.383 8.845 -5.335 470 H THR 63 H THR 63 -14.121 9.565 0.644 471 HA THR 63 HA THR 63 -16.585 10.473 1.874 472 HB THR 63 HB THR 63 -15.123 11.249 3.909 473 HG1 THR 63 HG1 THR 63 -13.121 10.491 3.180 474 1HG2 THR 63 HG21 THR 63 -15.827 8.290 3.764 475 2HG2 THR 63 HG22 THR 63 -15.705 9.310 5.212 476 3HG2 THR 63 HG23 THR 63 -17.000 9.596 4.038 477 H SER 64 H SER 64 -16.468 12.855 2.283 478 HA SER 64 HA SER 64 -14.751 14.095 0.227 479 1HB SER 64 HB2 SER 64 -17.432 14.906 1.424 480 2HB SER 64 HB3 SER 64 -16.587 15.745 0.116 481 HG SER 64 HG SER 64 -18.169 14.308 -0.667 482 H ASP 65 H ASP 65 -13.744 16.069 0.612 483 HA ASP 65 HA ASP 65 -13.724 17.295 3.259 484 1HB ASP 65 HB2 ASP 65 -12.094 15.323 3.379 485 2HB ASP 65 HB3 ASP 65 -11.173 16.110 2.088 486 H ILE 66 H ILE 66 -12.366 19.308 3.167 487 HA ILE 66 HA ILE 66 -12.354 20.442 0.437 488 HB ILE 66 HB ILE 66 -12.502 22.537 1.379 489 1HG1 ILE 66 HG12 ILE 66 -11.698 21.371 4.066 490 2HG1 ILE 66 HG13 ILE 66 -10.788 22.517 3.055 491 1HG2 ILE 66 HG21 ILE 66 -14.520 20.980 1.642 492 2HG2 ILE 66 HG22 ILE 66 -14.154 20.923 3.367 493 3HG2 ILE 66 HG23 ILE 66 -14.558 22.470 2.602 494 1HD1 ILE 66 HD11 ILE 66 -13.354 23.024 4.581 495 2HD1 ILE 66 HD12 ILE 66 -11.772 23.791 4.814 496 3HD1 ILE 66 HD13 ILE 66 -12.724 24.139 3.344 497 H ILE 67 H ILE 67 -10.402 21.780 -0.087 498 HA ILE 67 HA ILE 67 -8.269 20.051 -0.213 499 HB ILE 67 HB ILE 67 -8.744 21.678 -1.840 500 1HG1 ILE 67 HG12 ILE 67 -6.399 20.745 -1.509 501 2HG1 ILE 67 HG13 ILE 67 -6.645 22.076 -2.621 502 1HG2 ILE 67 HG21 ILE 67 -9.511 23.602 -0.634 503 2HG2 ILE 67 HG22 ILE 67 -7.897 23.863 0.085 504 3HG2 ILE 67 HG23 ILE 67 -8.145 24.061 -1.655 505 1HD1 ILE 67 HD11 ILE 67 -4.578 22.298 -1.270 506 2HD1 ILE 67 HD12 ILE 67 -5.672 23.685 -1.135 507 3HD1 ILE 67 HD13 ILE 67 -5.561 22.509 0.184 508 H ASP 68 H ASP 68 -6.547 19.524 0.816 509 HA ASP 68 HA ASP 68 -5.715 21.028 3.251 510 1HB ASP 68 HB2 ASP 68 -6.465 18.758 3.762 511 2HB ASP 68 HB3 ASP 68 -5.380 18.088 2.534 512 H SER 69 H SER 69 -4.029 22.291 2.770 513 HA SER 69 HA SER 69 -2.662 22.117 0.351 514 1HB SER 69 HB2 SER 69 -1.648 23.647 2.749 515 2HB SER 69 HB3 SER 69 -1.593 24.089 1.025 516 HG SER 69 HG SER 69 -3.216 25.217 2.236 517 H ASP 70 H ASP 70 -1.989 20.279 3.253 518 HA ASP 70 HA ASP 70 0.874 20.121 2.729 519 1HB ASP 70 HB2 ASP 70 0.178 20.063 5.048 520 2HB ASP 70 HB3 ASP 70 -0.860 18.670 4.746 521 H ILE 71 H ILE 71 -2.075 18.107 2.319 522 HA ILE 71 HA ILE 71 -0.634 15.889 1.135 523 HB ILE 71 HB ILE 71 -3.546 16.745 0.845 524 1HG1 ILE 71 HG12 ILE 71 -2.145 14.472 2.335 525 2HG1 ILE 71 HG13 ILE 71 -2.786 15.937 3.089 526 1HG2 ILE 71 HG21 ILE 71 -2.857 15.495 -1.193 527 2HG2 ILE 71 HG22 ILE 71 -2.132 14.232 -0.178 528 3HG2 ILE 71 HG23 ILE 71 -3.898 14.501 -0.206 529 1HD1 ILE 71 HD11 ILE 71 -5.089 15.262 2.265 530 2HD1 ILE 71 HD12 ILE 71 -4.378 13.694 1.797 531 3HD1 ILE 71 HD13 ILE 71 -4.368 14.198 3.491 532 H LEU 72 H LEU 72 -2.226 18.790 -0.224 533 HA LEU 72 HA LEU 72 -1.707 18.455 -2.940 534 1HB LEU 72 HB2 LEU 72 -3.042 20.236 -1.903 535 2HB LEU 72 HB3 LEU 72 -1.602 20.879 -1.141 536 HG LEU 72 HG LEU 72 -0.825 21.089 -3.749 537 1HD1 LEU 72 HD11 LEU 72 -2.703 21.882 -5.080 538 2HD1 LEU 72 HD12 LEU 72 -3.075 20.240 -4.516 539 3HD1 LEU 72 HD13 LEU 72 -3.835 21.632 -3.733 540 1HD2 LEU 72 HD21 LEU 72 -0.733 22.864 -2.084 541 2HD2 LEU 72 HD22 LEU 72 -1.539 23.467 -3.543 542 3HD2 LEU 72 HD23 LEU 72 -2.493 23.031 -2.094 543 H ASN 73 H ASN 73 0.534 19.944 -0.496 544 HA ASN 73 HA ASN 73 2.649 20.271 -2.396 545 1HB ASN 73 HB2 ASN 73 2.430 20.461 0.624 546 2HB ASN 73 HB3 ASN 73 4.017 20.420 -0.118 547 1HD2 ASN 73 HD22 ASN 73 1.061 22.361 0.153 548 2HD2 ASN 73 HD21 ASN 73 1.762 23.804 -0.557 549 H ASN 74 H ASN 74 1.627 17.385 -0.701 550 HA ASN 74 HA ASN 74 4.316 16.112 -0.899 551 1HB ASN 74 HB2 ASN 74 1.633 15.253 0.270 552 2HB ASN 74 HB3 ASN 74 2.886 14.084 -0.075 553 1HD2 ASN 74 HD22 ASN 74 1.878 16.537 2.110 554 2HD2 ASN 74 HD21 ASN 74 3.149 16.298 3.287 555 H ALA 75 H ALA 75 1.405 16.563 -2.763 556 HA ALA 75 HA ALA 75 1.174 13.976 -3.734 557 1HB ALA 75 HB1 ALA 75 -0.636 15.620 -3.762 558 2HB ALA 75 HB2 ALA 75 0.217 16.558 -5.009 559 3HB ALA 75 HB3 ALA 75 -0.381 14.922 -5.367 560 H ASP 76 H ASP 76 1.492 13.181 -5.985 561 HA ASP 76 HA ASP 76 4.075 14.039 -7.182 562 1HB ASP 76 HB2 ASP 76 3.413 11.581 -7.071 563 2HB ASP 76 HB3 ASP 76 2.057 11.967 -8.152 564 H LEU 77 H LEU 77 0.562 14.112 -7.582 565 HA LEU 77 HA LEU 77 0.703 16.167 -9.687 566 1HB LEU 77 HB2 LEU 77 0.595 14.087 -10.888 567 2HB LEU 77 HB3 LEU 77 -0.613 13.446 -9.769 568 HG LEU 77 HG LEU 77 -2.275 15.074 -10.612 569 1HD1 LEU 77 HD11 LEU 77 -1.938 16.300 -12.674 570 2HD1 LEU 77 HD12 LEU 77 -0.675 16.814 -11.563 571 3HD1 LEU 77 HD13 LEU 77 -0.305 15.662 -12.862 572 1HD2 LEU 77 HD21 LEU 77 -2.626 13.861 -12.734 573 2HD2 LEU 77 HD22 LEU 77 -0.928 13.324 -12.678 574 3HD2 LEU 77 HD23 LEU 77 -2.075 12.764 -11.456 575 H VAL 78 H VAL 78 -1.026 17.504 -9.707 576 HA VAL 78 HA VAL 78 -3.344 17.027 -7.899 577 HB VAL 78 HB VAL 78 -1.893 19.641 -8.514 578 1HG1 VAL 78 HG11 VAL 78 -4.326 20.044 -8.381 579 2HG1 VAL 78 HG12 VAL 78 -4.399 19.169 -6.832 580 3HG1 VAL 78 HG13 VAL 78 -3.510 20.703 -6.970 581 1HG2 VAL 78 HG21 VAL 78 -2.275 18.247 -5.826 582 2HG2 VAL 78 HG22 VAL 78 -0.785 18.206 -6.774 583 3HG2 VAL 78 HG23 VAL 78 -1.355 19.745 -6.156 584 H VAL 79 H VAL 79 -5.337 17.385 -8.967 585 HA VAL 79 HA VAL 79 -5.190 18.288 -11.811 586 HB VAL 79 HB VAL 79 -6.849 15.927 -10.840 587 1HG1 VAL 79 HG11 VAL 79 -7.160 15.537 -13.259 588 2HG1 VAL 79 HG12 VAL 79 -7.773 17.120 -12.765 589 3HG1 VAL 79 HG13 VAL 79 -6.207 17.009 -13.605 590 1HG2 VAL 79 HG21 VAL 79 -4.558 15.171 -10.737 591 2HG2 VAL 79 HG22 VAL 79 -5.317 14.488 -12.172 592 3HG2 VAL 79 HG23 VAL 79 -4.212 15.870 -12.341 593 H THR 80 H THR 80 -6.371 20.184 -11.833 594 HA THR 80 HA THR 80 -8.664 20.370 -9.956 595 HB THR 80 HB THR 80 -8.709 22.700 -10.367 596 HG1 THR 80 HG1 THR 80 -8.083 22.609 -12.575 597 1HG2 THR 80 HG21 THR 80 -5.753 22.035 -10.105 598 2HG2 THR 80 HG22 THR 80 -6.671 23.354 -9.344 599 3HG2 THR 80 HG23 THR 80 -6.909 21.698 -8.805 600 H LEU 81 H LEU 81 -10.440 19.469 -10.733 601 HA LEU 81 HA LEU 81 -10.677 18.787 -13.503 602 1HB LEU 81 HB2 LEU 81 -12.619 18.601 -11.181 603 2HB LEU 81 HB3 LEU 81 -12.929 17.883 -12.757 604 HG LEU 81 HG LEU 81 -10.455 17.185 -11.112 605 1HD1 LEU 81 HD11 LEU 81 -11.636 15.255 -10.284 606 2HD1 LEU 81 HD12 LEU 81 -12.481 16.726 -9.793 607 3HD1 LEU 81 HD13 LEU 81 -13.125 15.741 -11.132 608 1HD2 LEU 81 HD21 LEU 81 -11.898 15.716 -13.366 609 2HD2 LEU 81 HD22 LEU 81 -10.336 16.543 -13.500 610 3HD2 LEU 81 HD23 LEU 81 -10.486 15.116 -12.473 611 H CYS 82 H CYS 82 -11.200 21.888 -12.256 612 HA CYS 82 HA CYS 82 -12.742 22.511 -14.590 613 1HB CYS 82 HB2 CYS 82 -14.538 21.902 -13.004 614 2HB CYS 82 HB3 CYS 82 -13.978 23.169 -11.885 615 HG CYS 82 HG CYS 82 -16.200 23.802 -13.293 616 H GLY 83 H GLY 83 -12.580 24.766 -15.099 617 1HA GLY 83 HA1 GLY 83 -9.994 25.712 -14.627 618 2HA GLY 83 HA2 GLY 83 -11.302 26.615 -15.413 619 H ASP 84 H ASP 84 -13.100 26.750 -13.089 620 HA ASP 84 HA ASP 84 -11.904 29.011 -11.776 621 1HB ASP 84 HB2 ASP 84 -14.342 28.750 -12.157 622 2HB ASP 84 HB3 ASP 84 -14.376 27.447 -10.968 623 H ALA 85 H ALA 85 -11.886 25.563 -11.053 624 HA ALA 85 HA ALA 85 -11.079 25.929 -8.268 625 1HB ALA 85 HB1 ALA 85 -10.732 23.509 -8.261 626 2HB ALA 85 HB2 ALA 85 -12.308 23.883 -8.977 627 3HB ALA 85 HB3 ALA 85 -10.943 23.432 -10.018 628 H ALA 86 H ALA 86 -9.501 26.040 -11.372 629 HA ALA 86 HA ALA 86 -6.989 24.943 -10.718 630 1HB ALA 86 HB1 ALA 86 -6.191 26.094 -12.693 631 2HB ALA 86 HB2 ALA 86 -7.807 25.410 -13.001 632 3HB ALA 86 HB3 ALA 86 -7.593 27.161 -12.692 633 H ASP 87 H ASP 87 -8.348 28.079 -9.875 634 HA ASP 87 HA ASP 87 -5.924 29.401 -9.169 635 1HB ASP 87 HB2 ASP 87 -8.054 30.582 -9.453 636 2HB ASP 87 HB3 ASP 87 -8.754 29.688 -8.098 637 H LYS 88 H LYS 88 -7.893 26.960 -7.519 638 HA LYS 88 HA LYS 88 -6.682 27.558 -4.901 639 1HB LYS 88 HB2 LYS 88 -9.177 27.009 -5.359 640 2HB LYS 88 HB3 LYS 88 -8.639 25.334 -5.538 641 1HG LYS 88 HG2 LYS 88 -9.366 25.537 -3.315 642 2HG LYS 88 HG3 LYS 88 -7.602 25.585 -3.197 643 1HD LYS 88 HD2 LYS 88 -7.640 28.021 -2.917 644 2HD LYS 88 HD3 LYS 88 -9.393 28.058 -3.225 645 1HE LYS 88 HE2 LYS 88 -9.775 26.624 -1.256 646 2HE LYS 88 HE3 LYS 88 -8.037 26.574 -0.934 647 1HZ LYS 88 HZ1 LYS 88 -9.141 28.231 0.441 648 2HZ LYS 88 HZ2 LYS 88 -8.104 28.980 -0.565 649 3HZ LYS 88 HZ3 LYS 88 -9.711 29.025 -0.859 650 H CYS 89 H CYS 89 -4.627 27.025 -6.253 651 HA CYS 89 HA CYS 89 -3.754 24.355 -5.238 652 1HB CYS 89 HB2 CYS 89 -2.899 25.704 -7.833 653 2HB CYS 89 HB3 CYS 89 -2.036 24.360 -7.067 654 HG CYS 89 HG CYS 89 -4.191 22.783 -6.904 655 HA PRO 90 HA PRO 90 -2.300 28.076 -2.924 656 1HB PRO 90 HB2 PRO 90 -1.479 25.837 -1.080 657 2HB PRO 90 HB3 PRO 90 -2.162 27.446 -0.681 658 1HG PRO 90 HG2 PRO 90 -3.663 25.126 -0.772 659 2HG PRO 90 HG3 PRO 90 -4.339 26.734 -1.159 660 1HD PRO 90 HD2 PRO 90 -3.775 24.514 -2.999 661 2HD PRO 90 HD3 PRO 90 -4.739 25.986 -3.231 662 H MET 91 H MET 91 -0.293 25.104 -3.123 663 HA MET 91 HA MET 91 1.788 26.510 -4.532 664 1HB MET 91 HB2 MET 91 2.398 25.165 -1.848 665 2HB MET 91 HB3 MET 91 3.607 25.577 -3.061 666 1HG MET 91 HG2 MET 91 2.995 27.986 -2.817 667 2HG MET 91 HG3 MET 91 1.873 27.531 -1.530 668 1HE MET 91 HE1 MET 91 6.499 27.381 -1.216 669 2HE MET 91 HE2 MET 91 5.642 26.229 -2.255 670 3HE MET 91 HE3 MET 91 5.588 27.970 -2.622 671 H THR 92 H THR 92 2.638 25.021 -6.023 672 HA THR 92 HA THR 92 2.447 22.129 -5.395 673 HB THR 92 HB THR 92 1.741 21.687 -7.754 674 HG1 THR 92 HG1 THR 92 2.188 23.789 -8.575 675 1HG2 THR 92 HG21 THR 92 -0.610 22.054 -7.392 676 2HG2 THR 92 HG22 THR 92 0.156 21.565 -5.871 677 3HG2 THR 92 HG23 THR 92 -0.279 23.263 -6.131 678 HA PRO 93 HA PRO 93 6.627 23.781 -6.607 679 1HB PRO 93 HB2 PRO 93 8.119 22.483 -4.688 680 2HB PRO 93 HB3 PRO 93 7.240 24.011 -4.383 681 1HG PRO 93 HG2 PRO 93 6.325 21.177 -3.790 682 2HG PRO 93 HG3 PRO 93 6.321 22.595 -2.691 683 1HD PRO 93 HD2 PRO 93 4.099 21.844 -4.051 684 2HD PRO 93 HD3 PRO 93 4.489 23.572 -3.814 685 HA PRO 94 HA PRO 94 7.853 20.779 -9.377 686 1HB PRO 94 HB2 PRO 94 10.544 20.464 -8.028 687 2HB PRO 94 HB3 PRO 94 10.181 20.600 -9.782 688 1HG PRO 94 HG2 PRO 94 10.963 22.793 -8.416 689 2HG PRO 94 HG3 PRO 94 9.577 22.908 -9.549 690 1HD PRO 94 HD2 PRO 94 9.542 22.693 -6.543 691 2HD PRO 94 HD3 PRO 94 8.519 23.683 -7.625 692 H HIS 95 H HIS 95 8.185 19.406 -6.117 693 HA HIS 95 HA HIS 95 8.536 16.649 -6.926 694 1HB HIS 95 HB2 HIS 95 8.753 17.401 -4.579 695 2HB HIS 95 HB3 HIS 95 7.053 17.874 -4.549 696 HD1 HIS 95 HD1 HIS 95 5.242 15.649 -4.833 697 HD2 HIS 95 HD2 HIS 95 9.317 14.920 -3.982 698 HE1 HIS 95 HE1 HIS 95 5.388 13.266 -4.001 699 H VAL 96 H VAL 96 5.823 18.861 -6.567 700 HA VAL 96 HA VAL 96 3.724 17.006 -7.408 701 HB VAL 96 HB VAL 96 3.493 20.009 -6.913 702 1HG1 VAL 96 HG11 VAL 96 1.497 18.920 -7.739 703 2HG1 VAL 96 HG12 VAL 96 1.630 17.651 -6.500 704 3HG1 VAL 96 HG13 VAL 96 1.257 19.324 -6.043 705 1HG2 VAL 96 HG21 VAL 96 2.999 19.687 -4.561 706 2HG2 VAL 96 HG22 VAL 96 3.519 18.002 -4.647 707 3HG2 VAL 96 HG23 VAL 96 4.681 19.321 -4.903 708 H LYS 97 H LYS 97 2.487 17.497 -9.286 709 HA LYS 97 HA LYS 97 3.460 19.531 -11.173 710 1HB LYS 97 HB2 LYS 97 3.582 18.120 -13.023 711 2HB LYS 97 HB3 LYS 97 4.378 17.187 -11.762 712 1HG LYS 97 HG2 LYS 97 2.006 16.069 -11.446 713 2HG LYS 97 HG3 LYS 97 1.657 16.802 -13.021 714 1HD LYS 97 HD2 LYS 97 3.751 15.645 -13.884 715 2HD LYS 97 HD3 LYS 97 3.808 14.762 -12.335 716 1HE LYS 97 HE2 LYS 97 1.809 13.585 -12.768 717 2HE LYS 97 HE3 LYS 97 1.256 14.784 -13.960 718 1HZ LYS 97 HZ1 LYS 97 3.158 14.011 -15.377 719 2HZ LYS 97 HZ2 LYS 97 3.288 12.704 -14.399 720 3HZ LYS 97 HZ3 LYS 97 1.908 13.001 -15.266 721 H ARG 98 H ARG 98 1.508 19.862 -12.856 722 HA ARG 98 HA ARG 98 -1.021 19.541 -11.317 723 1HB ARG 98 HB2 ARG 98 0.300 21.649 -10.735 724 2HB ARG 98 HB3 ARG 98 -0.007 22.196 -12.389 725 1HG ARG 98 HG2 ARG 98 -2.447 22.136 -11.949 726 2HG ARG 98 HG3 ARG 98 -2.156 21.432 -10.350 727 1HD ARG 98 HD2 ARG 98 -2.565 23.812 -10.108 728 2HD ARG 98 HD3 ARG 98 -0.899 23.443 -9.664 729 HE ARG 98 HE ARG 98 -1.643 24.451 -12.390 730 1HH1 ARG 98 HH21 ARG 98 0.368 24.862 -9.449 731 2HH1 ARG 98 HH22 ARG 98 1.080 26.328 -10.011 732 1HH2 ARG 98 HH11 ARG 98 -0.615 26.328 -13.130 733 2HH2 ARG 98 HH12 ARG 98 0.565 27.138 -12.173 734 H GLU 99 H GLU 99 -2.893 19.593 -12.538 735 HA GLU 99 HA GLU 99 -2.718 20.048 -15.438 736 1HB GLU 99 HB2 GLU 99 -2.266 17.624 -14.995 737 2HB GLU 99 HB3 GLU 99 -3.789 17.509 -14.113 738 1HG GLU 99 HG2 GLU 99 -3.944 16.593 -16.383 739 2HG GLU 99 HG3 GLU 99 -5.050 17.942 -16.142 740 H HIS 100 H HIS 100 -4.939 20.304 -16.355 741 HA HIS 100 HA HIS 100 -6.922 21.302 -14.376 742 1HB HIS 100 HB2 HIS 100 -5.723 22.951 -16.645 743 2HB HIS 100 HB3 HIS 100 -6.975 23.469 -15.524 744 HD1 HIS 100 HD1 HIS 100 -5.937 23.319 -12.766 745 HD2 HIS 100 HD2 HIS 100 -3.375 23.925 -16.042 746 HE1 HIS 100 HE1 HIS 100 -3.906 24.516 -11.854 747 H TRP 101 H TRP 101 -9.032 21.120 -15.133 748 HA TRP 101 HA TRP 101 -9.566 20.701 -18.026 749 1HB TRP 101 HB2 TRP 101 -10.837 19.033 -15.870 750 2HB TRP 101 HB3 TRP 101 -10.968 18.867 -17.620 751 HD1 TRP 101 HD1 TRP 101 -8.896 17.864 -14.688 752 HE1 TRP 101 HE1 TRP 101 -6.957 16.354 -15.355 753 HE3 TRP 101 HE3 TRP 101 -9.091 18.478 -19.775 754 HZ2 TRP 101 HZ2 TRP 101 -5.694 15.431 -17.774 755 HZ3 TRP 101 HZ3 TRP 101 -7.484 17.272 -21.231 756 HH2 TRP 101 HH2 TRP 101 -5.796 15.720 -20.236 757 H GLY 102 H GLY 102 -12.427 20.452 -17.707 758 1HA GLY 102 HA1 GLY 102 -13.181 23.113 -16.573 759 2HA GLY 102 HA2 GLY 102 -13.358 22.776 -18.285 760 H PHE 103 H PHE 103 -14.067 20.569 -15.494 761 HA PHE 103 HA PHE 103 -16.592 19.904 -16.764 762 1HB PHE 103 HB2 PHE 103 -15.171 18.826 -14.305 763 2HB PHE 103 HB3 PHE 103 -16.731 18.241 -14.880 764 HD1 PHE 103 HD1 PHE 103 -13.115 18.065 -15.430 765 HD2 PHE 103 HD2 PHE 103 -16.966 17.357 -17.234 766 HE1 PHE 103 HE1 PHE 103 -12.009 16.876 -17.275 767 HE2 PHE 103 HE2 PHE 103 -15.881 16.098 -19.042 768 HZ PHE 103 HZ PHE 103 -13.402 15.845 -19.096 769 H ASP 104 H ASP 104 -18.414 20.935 -16.451 770 HA ASP 104 HA ASP 104 -18.990 22.614 -14.141 771 1HB ASP 104 HB2 ASP 104 -19.946 23.041 -16.406 772 2HB ASP 104 HB3 ASP 104 -20.790 21.486 -16.316 773 H ASP 105 H ASP 105 -20.766 22.093 -12.608 774 HA ASP 105 HA ASP 105 -20.192 19.463 -11.581 775 1HB ASP 105 HB2 ASP 105 -20.480 21.578 -10.206 776 2HB ASP 105 HB3 ASP 105 -22.220 21.368 -10.414 777 HA PRO 106 HA PRO 106 -23.648 17.649 -13.658 778 1HB PRO 106 HB2 PRO 106 -23.534 15.063 -12.685 779 2HB PRO 106 HB3 PRO 106 -22.372 15.725 -13.871 780 1HG PRO 106 HG2 PRO 106 -22.065 15.484 -10.868 781 2HG PRO 106 HG3 PRO 106 -20.888 15.046 -12.149 782 1HD PRO 106 HD2 PRO 106 -20.759 17.414 -10.806 783 2HD PRO 106 HD3 PRO 106 -20.329 17.296 -12.541 784 H ALA 107 H ALA 107 -23.484 17.547 -10.092 785 HA ALA 107 HA ALA 107 -26.080 16.403 -9.763 786 1HB ALA 107 HB1 ALA 107 -24.361 16.320 -8.017 787 2HB ALA 107 HB2 ALA 107 -24.449 18.087 -7.823 788 3HB ALA 107 HB3 ALA 107 -25.851 17.077 -7.418 789 H ARG 108 H ARG 108 -25.060 19.629 -10.545 790 HA ARG 108 HA ARG 108 -27.620 20.855 -9.695 791 1HB ARG 108 HB2 ARG 108 -24.978 21.992 -10.738 792 2HB ARG 108 HB3 ARG 108 -26.433 22.957 -10.525 793 1HG ARG 108 HG2 ARG 108 -25.253 23.356 -8.590 794 2HG ARG 108 HG3 ARG 108 -26.511 22.208 -8.112 795 1HD ARG 108 HD2 ARG 108 -24.821 20.378 -8.140 796 2HD ARG 108 HD3 ARG 108 -23.587 21.545 -8.655 797 HE ARG 108 HE ARG 108 -24.794 22.495 -6.282 798 1HH1 ARG 108 HH11 ARG 108 -22.660 19.835 -7.337 799 2HH1 ARG 108 HH12 ARG 108 -21.911 19.658 -5.792 800 1HH2 ARG 108 HH21 ARG 108 -23.788 22.247 -4.235 801 2HH2 ARG 108 HH22 ARG 108 -22.575 21.053 -3.986 802 H ALA 109 H ALA 109 -26.569 19.155 -12.418 803 HA ALA 109 HA ALA 109 -27.509 20.775 -14.536 804 1HB ALA 109 HB1 ALA 109 -27.609 18.635 -15.761 805 2HB ALA 109 HB2 ALA 109 -26.108 18.731 -14.798 806 3HB ALA 109 HB3 ALA 109 -27.471 17.733 -14.238 807 H GLN 110 H GLN 110 -29.556 20.931 -15.435 808 HA GLN 110 HA GLN 110 -31.870 19.649 -14.092 809 1HB GLN 110 HB2 GLN 110 -31.218 22.625 -14.203 810 2HB GLN 110 HB3 GLN 110 -32.883 22.067 -14.055 811 1HG GLN 110 HG2 GLN 110 -32.541 21.108 -11.924 812 2HG GLN 110 HG3 GLN 110 -30.790 21.123 -12.076 813 1HE2 GLN 110 HE22 GLN 110 -29.594 22.999 -11.705 814 2HE2 GLN 110 HE21 GLN 110 -30.302 24.444 -10.996 815 H GLY 111 H GLY 111 -33.859 20.044 -15.300 816 1HA GLY 111 HA1 GLY 111 -34.554 21.323 -17.502 817 2HA GLY 111 HA2 GLY 111 -33.505 20.081 -18.229 818 H THR 112 H THR 112 -33.878 17.878 -16.801 819 HA THR 112 HA THR 112 -36.447 17.303 -15.807 820 HB THR 112 HB THR 112 -37.213 17.186 -18.075 821 HG1 THR 112 HG1 THR 112 -37.975 15.169 -18.062 822 1HG2 THR 112 HG21 THR 112 -36.247 15.641 -19.766 823 2HG2 THR 112 HG22 THR 112 -35.171 16.982 -19.367 824 3HG2 THR 112 HG23 THR 112 -34.860 15.368 -18.693 825 H GLU 113 H GLU 113 -36.363 14.891 -15.095 826 HA GLU 113 HA GLU 113 -33.937 14.555 -13.651 827 1HB GLU 113 HB2 GLU 113 -36.054 13.685 -12.839 828 2HB GLU 113 HB3 GLU 113 -36.222 12.627 -14.249 829 1HG GLU 113 HG2 GLU 113 -34.285 11.310 -13.570 830 2HG GLU 113 HG3 GLU 113 -33.936 12.425 -12.242 831 H GLU 114 H GLU 114 -35.104 13.080 -16.674 832 HA GLU 114 HA GLU 114 -32.878 11.310 -16.913 833 1HB GLU 114 HB2 GLU 114 -33.629 10.899 -19.192 834 2HB GLU 114 HB3 GLU 114 -34.958 10.816 -18.038 835 1HG GLU 114 HG2 GLU 114 -35.708 13.076 -18.714 836 2HG GLU 114 HG3 GLU 114 -34.365 13.190 -19.858 837 H GLU 115 H GLU 115 -33.274 14.719 -17.735 838 HA GLU 115 HA GLU 115 -30.946 14.803 -19.443 839 1HB GLU 115 HB2 GLU 115 -32.786 16.419 -19.713 840 2HB GLU 115 HB3 GLU 115 -32.490 17.044 -18.091 841 1HG GLU 115 HG2 GLU 115 -31.533 18.534 -19.736 842 2HG GLU 115 HG3 GLU 115 -30.256 17.826 -18.762 843 H LYS 116 H LYS 116 -31.759 15.555 -16.030 844 HA LYS 116 HA LYS 116 -29.190 16.388 -15.194 845 1HB LYS 116 HB2 LYS 116 -31.120 16.773 -13.817 846 2HB LYS 116 HB3 LYS 116 -31.500 15.049 -13.743 847 1HG LYS 116 HG2 LYS 116 -29.531 14.585 -12.456 848 2HG LYS 116 HG3 LYS 116 -28.968 16.263 -12.575 849 1HD LYS 116 HD2 LYS 116 -31.696 15.814 -11.393 850 2HD LYS 116 HD3 LYS 116 -30.312 15.206 -10.464 851 1HE LYS 116 HE2 LYS 116 -29.268 17.535 -10.729 852 2HE LYS 116 HE3 LYS 116 -30.840 18.065 -11.331 853 1HZ LYS 116 HZ1 LYS 116 -30.357 16.889 -8.656 854 2HZ LYS 116 HZ2 LYS 116 -30.599 18.464 -8.967 855 3HZ LYS 116 HZ3 LYS 116 -31.813 17.397 -9.211 856 H TRP 117 H TRP 117 -30.628 13.093 -15.207 857 HA TRP 117 HA TRP 117 -28.237 11.789 -14.349 858 1HB TRP 117 HB2 TRP 117 -30.437 10.700 -14.288 859 2HB TRP 117 HB3 TRP 117 -30.516 10.709 -16.049 860 HD1 TRP 117 HD1 TRP 117 -29.033 8.944 -17.358 861 HE1 TRP 117 HE1 TRP 117 -27.914 6.730 -16.674 862 HE3 TRP 117 HE3 TRP 117 -28.938 9.611 -12.287 863 HZ2 TRP 117 HZ2 TRP 117 -26.994 5.480 -14.280 864 HZ3 TRP 117 HZ3 TRP 117 -27.766 7.975 -10.841 865 HH2 TRP 117 HH2 TRP 117 -26.800 5.900 -11.810 866 H ALA 118 H ALA 118 -29.413 12.599 -17.687 867 HA ALA 118 HA ALA 118 -27.278 11.308 -19.013 868 1HB ALA 118 HB1 ALA 118 -29.312 12.113 -20.149 869 2HB ALA 118 HB2 ALA 118 -28.800 13.796 -19.880 870 3HB ALA 118 HB3 ALA 118 -27.840 12.717 -20.918 871 H PHE 119 H PHE 119 -27.422 14.539 -17.445 872 HA PHE 119 HA PHE 119 -24.838 15.361 -18.328 873 1HB PHE 119 HB2 PHE 119 -26.822 16.628 -17.083 874 2HB PHE 119 HB3 PHE 119 -25.909 16.197 -15.648 875 HD1 PHE 119 HD1 PHE 119 -26.385 18.650 -18.136 876 HD2 PHE 119 HD2 PHE 119 -23.283 16.815 -15.766 877 HE1 PHE 119 HE1 PHE 119 -24.952 20.647 -18.457 878 HE2 PHE 119 HE2 PHE 119 -21.888 18.854 -16.019 879 HZ PHE 119 HZ PHE 119 -22.709 20.753 -17.403 880 H PHE 120 H PHE 120 -25.935 13.487 -15.419 881 HA PHE 120 HA PHE 120 -23.394 13.108 -14.212 882 1HB PHE 120 HB2 PHE 120 -25.522 10.968 -14.371 883 2HB PHE 120 HB3 PHE 120 -24.202 11.105 -13.240 884 HD1 PHE 120 HD1 PHE 120 -26.429 10.359 -12.043 885 HD2 PHE 120 HD2 PHE 120 -25.543 14.407 -13.262 886 HE1 PHE 120 HE1 PHE 120 -28.047 11.224 -10.380 887 HE2 PHE 120 HE2 PHE 120 -27.083 15.249 -11.550 888 HZ PHE 120 HZ PHE 120 -28.362 13.677 -10.113 889 H GLN 121 H GLN 121 -25.024 11.334 -16.934 890 HA GLN 121 HA GLN 121 -22.985 9.360 -17.305 891 1HB GLN 121 HB2 GLN 121 -25.077 10.488 -19.198 892 2HB GLN 121 HB3 GLN 121 -23.978 9.217 -19.660 893 1HG GLN 121 HG2 GLN 121 -25.749 8.915 -17.208 894 2HG GLN 121 HG3 GLN 121 -26.368 8.622 -18.824 895 1HE2 GLN 121 HE22 GLN 121 -24.878 7.063 -16.212 896 2HE2 GLN 121 HE21 GLN 121 -24.281 5.666 -17.070 897 H ARG 122 H ARG 122 -23.493 12.494 -19.007 898 HA ARG 122 HA ARG 122 -21.251 12.278 -20.726 899 1HB ARG 122 HB2 ARG 122 -22.776 14.651 -19.598 900 2HB ARG 122 HB3 ARG 122 -21.223 14.936 -20.349 901 1HG ARG 122 HG2 ARG 122 -22.251 15.127 -22.289 902 2HG ARG 122 HG3 ARG 122 -22.375 13.376 -22.291 903 1HD ARG 122 HD2 ARG 122 -24.516 14.318 -22.824 904 2HD ARG 122 HD3 ARG 122 -24.615 13.564 -21.227 905 HE ARG 122 HE ARG 122 -23.962 16.320 -20.918 906 1HH1 ARG 122 HH21 ARG 122 -26.762 14.409 -22.075 907 2HH1 ARG 122 HH22 ARG 122 -27.908 15.594 -21.450 908 1HH2 ARG 122 HH11 ARG 122 -25.634 17.844 -20.215 909 2HH2 ARG 122 HH12 ARG 122 -27.312 17.384 -20.472 910 H VAL 123 H VAL 123 -21.420 13.809 -17.460 911 HA VAL 123 HA VAL 123 -18.630 14.449 -17.552 912 HB VAL 123 HB VAL 123 -20.566 14.343 -15.202 913 1HG1 VAL 123 HG11 VAL 123 -17.811 15.646 -15.436 914 2HG1 VAL 123 HG12 VAL 123 -18.955 15.900 -14.098 915 3HG1 VAL 123 HG13 VAL 123 -18.246 14.300 -14.363 916 1HG2 VAL 123 HG21 VAL 123 -19.587 16.655 -16.964 917 2HG2 VAL 123 HG22 VAL 123 -21.219 15.969 -16.993 918 3HG2 VAL 123 HG23 VAL 123 -20.644 16.817 -15.551 919 H ARG 124 H ARG 124 -20.378 11.562 -16.185 920 HA ARG 124 HA ARG 124 -18.140 10.289 -15.061 921 1HB ARG 124 HB2 ARG 124 -20.779 9.470 -16.175 922 2HB ARG 124 HB3 ARG 124 -19.584 8.267 -16.495 923 1HG ARG 124 HG2 ARG 124 -19.038 7.973 -14.188 924 2HG ARG 124 HG3 ARG 124 -20.113 9.307 -13.696 925 1HD ARG 124 HD2 ARG 124 -20.998 6.778 -15.171 926 2HD ARG 124 HD3 ARG 124 -21.054 6.993 -13.418 927 HE ARG 124 HE ARG 124 -22.406 9.166 -14.710 928 1HH1 ARG 124 HH22 ARG 124 -22.828 5.763 -13.737 929 2HH1 ARG 124 HH21 ARG 124 -24.541 5.774 -13.849 930 1HH2 ARG 124 HH11 ARG 124 -24.774 9.225 -14.644 931 2HH2 ARG 124 HH12 ARG 124 -25.642 7.864 -14.063 932 H ASP 125 H ASP 125 -19.354 10.018 -18.399 933 HA ASP 125 HA ASP 125 -17.386 8.234 -19.301 934 1HB ASP 125 HB2 ASP 125 -19.470 8.627 -20.517 935 2HB ASP 125 HB3 ASP 125 -18.999 10.295 -20.856 936 H GLU 126 H GLU 126 -17.448 11.838 -19.415 937 HA GLU 126 HA GLU 126 -14.951 11.867 -20.796 938 1HB GLU 126 HB2 GLU 126 -16.665 14.048 -19.629 939 2HB GLU 126 HB3 GLU 126 -15.136 14.379 -20.457 940 1HG GLU 126 HG2 GLU 126 -17.429 12.843 -21.747 941 2HG GLU 126 HG3 GLU 126 -17.233 14.586 -21.851 942 H ILE 127 H ILE 127 -15.745 11.986 -17.320 943 HA ILE 127 HA ILE 127 -13.073 12.838 -16.573 944 HB ILE 127 HB ILE 127 -15.508 12.196 -15.194 945 1HG1 ILE 127 HG12 ILE 127 -14.222 13.051 -13.169 946 2HG1 ILE 127 HG13 ILE 127 -12.838 13.259 -14.247 947 1HG2 ILE 127 HG21 ILE 127 -14.835 10.909 -13.293 948 2HG2 ILE 127 HG22 ILE 127 -14.792 9.984 -14.792 949 3HG2 ILE 127 HG23 ILE 127 -13.267 10.550 -14.052 950 1HD1 ILE 127 HD11 ILE 127 -15.634 14.450 -14.634 951 2HD1 ILE 127 HD12 ILE 127 -14.219 15.343 -14.030 952 3HD1 ILE 127 HD13 ILE 127 -14.246 14.735 -15.707 953 H GLY 128 H GLY 128 -14.722 9.672 -17.076 954 1HA GLY 128 HA1 GLY 128 -12.515 8.043 -16.484 955 2HA GLY 128 HA2 GLY 128 -13.881 7.598 -17.535 956 H ASN 129 H ASN 129 -13.622 9.353 -19.642 957 HA ASN 129 HA ASN 129 -11.591 8.357 -21.310 958 1HB ASN 129 HB2 ASN 129 -13.712 9.476 -22.008 959 2HB ASN 129 HB3 ASN 129 -13.056 11.011 -21.438 960 1HD2 ASN 129 HD22 ASN 129 -13.539 11.762 -23.597 961 2HD2 ASN 129 HD21 ASN 129 -12.506 11.315 -24.953 962 H ARG 130 H ARG 130 -11.608 11.313 -19.280 963 HA ARG 130 HA ARG 130 -9.084 12.331 -20.144 964 1HB ARG 130 HB2 ARG 130 -11.033 12.982 -18.073 965 2HB ARG 130 HB3 ARG 130 -9.487 12.797 -17.295 966 1HG ARG 130 HG2 ARG 130 -9.654 15.052 -17.798 967 2HG ARG 130 HG3 ARG 130 -8.505 14.411 -18.977 968 1HD ARG 130 HD2 ARG 130 -11.468 14.876 -19.503 969 2HD ARG 130 HD3 ARG 130 -10.229 16.058 -19.874 970 HE ARG 130 HE ARG 130 -9.212 14.440 -21.441 971 1HH1 ARG 130 HH21 ARG 130 -12.604 13.831 -20.576 972 2HH1 ARG 130 HH22 ARG 130 -13.103 13.442 -22.186 973 1HH2 ARG 130 HH11 ARG 130 -9.714 13.253 -23.333 974 2HH2 ARG 130 HH12 ARG 130 -11.372 12.889 -23.710 975 H LEU 131 H LEU 131 -9.977 10.136 -17.499 976 HA LEU 131 HA LEU 131 -7.275 9.900 -16.585 977 1HB LEU 131 HB2 LEU 131 -9.812 8.364 -15.965 978 2HB LEU 131 HB3 LEU 131 -8.293 8.099 -15.094 979 HG LEU 131 HG LEU 131 -9.498 10.900 -15.354 980 1HD1 LEU 131 HD11 LEU 131 -10.548 10.607 -13.189 981 2HD1 LEU 131 HD12 LEU 131 -11.212 9.516 -14.415 982 3HD1 LEU 131 HD13 LEU 131 -10.086 8.889 -13.183 983 1HD2 LEU 131 HD21 LEU 131 -7.153 10.828 -14.656 984 2HD2 LEU 131 HD22 LEU 131 -8.204 11.350 -13.350 985 3HD2 LEU 131 HD23 LEU 131 -7.556 9.688 -13.356 986 H LYS 132 H LYS 132 -9.237 7.964 -18.820 987 HA LYS 132 HA LYS 132 -7.367 5.881 -19.226 988 1HB LYS 132 HB2 LYS 132 -9.425 5.425 -20.110 989 2HB LYS 132 HB3 LYS 132 -9.704 7.039 -20.700 990 1HG LYS 132 HG2 LYS 132 -7.530 5.529 -22.107 991 2HG LYS 132 HG3 LYS 132 -9.161 4.882 -22.277 992 1HD LYS 132 HD2 LYS 132 -10.035 6.886 -23.191 993 2HD LYS 132 HD3 LYS 132 -8.648 7.834 -22.693 994 1HE LYS 132 HE2 LYS 132 -8.811 7.410 -25.141 995 2HE LYS 132 HE3 LYS 132 -7.259 7.003 -24.400 996 1HZ LYS 132 HZ1 LYS 132 -8.141 5.335 -25.994 997 2HZ LYS 132 HZ2 LYS 132 -7.715 4.738 -24.541 998 3HZ LYS 132 HZ3 LYS 132 -9.319 4.950 -24.930 999 H GLU 133 H GLU 133 -7.675 9.036 -20.993 1000 HA GLU 133 HA GLU 133 -5.324 8.568 -22.598 1001 1HB GLU 133 HB2 GLU 133 -6.574 11.190 -21.641 1002 2HB GLU 133 HB3 GLU 133 -5.223 11.069 -22.775 1003 1HG GLU 133 HG2 GLU 133 -6.650 9.791 -24.350 1004 2HG GLU 133 HG3 GLU 133 -8.027 9.987 -23.264 1005 H PHE 134 H PHE 134 -5.756 10.271 -19.465 1006 HA PHE 134 HA PHE 134 -3.085 11.025 -19.123 1007 1HB PHE 134 HB2 PHE 134 -4.828 11.876 -17.754 1008 2HB PHE 134 HB3 PHE 134 -5.309 10.254 -17.242 1009 HD1 PHE 134 HD1 PHE 134 -4.327 9.143 -15.388 1010 HD2 PHE 134 HD2 PHE 134 -2.683 12.840 -16.888 1011 HE1 PHE 134 HE1 PHE 134 -2.824 9.294 -13.400 1012 HE2 PHE 134 HE2 PHE 134 -1.165 12.957 -14.941 1013 HZ PHE 134 HZ PHE 134 -1.268 11.194 -13.186 1014 H ALA 135 H ALA 135 -4.619 7.867 -18.513 1015 HA ALA 135 HA ALA 135 -2.281 6.762 -17.246 1016 1HB ALA 135 HB1 ALA 135 -4.510 5.896 -16.731 1017 2HB ALA 135 HB2 ALA 135 -4.728 5.382 -18.421 1018 3HB ALA 135 HB3 ALA 135 -3.491 4.613 -17.407 1019 H GLU 136 H GLU 136 -3.727 6.487 -20.510 1020 HA GLU 136 HA GLU 136 -1.798 4.615 -21.487 1021 1HB GLU 136 HB2 GLU 136 -3.818 6.389 -22.912 1022 2HB GLU 136 HB3 GLU 136 -2.709 5.303 -23.759 1023 1HG GLU 136 HG2 GLU 136 -3.593 3.424 -22.241 1024 2HG GLU 136 HG3 GLU 136 -4.886 4.536 -21.796 1025 H THR 137 H THR 137 -2.066 8.136 -21.757 1026 HA THR 137 HA THR 137 0.243 8.300 -23.431 1027 HB THR 137 HB THR 137 -0.192 10.645 -23.515 1028 HG1 THR 137 HG1 THR 137 -2.251 10.202 -21.631 1029 1HG2 THR 137 HG21 THR 137 -1.541 9.153 -24.924 1030 2HG2 THR 137 HG22 THR 137 -2.757 8.985 -23.655 1031 3HG2 THR 137 HG23 THR 137 -2.492 10.569 -24.423 1032 H GLY 138 H GLY 138 -0.386 8.238 -20.053 1033 1HA GLY 138 HA1 GLY 138 0.812 8.542 -18.165 1034 2HA GLY 138 HA2 GLY 138 2.306 8.390 -19.126 1035 H LYS 139 H LYS 139 -0.377 10.744 -19.365 1036 HA LYS 139 HA LYS 139 1.203 12.894 -20.049 1037 1HB LYS 139 HB2 LYS 139 -1.435 12.449 -19.961 1038 2HB LYS 139 HB3 LYS 139 -1.318 13.453 -18.513 1039 1HG LYS 139 HG2 LYS 139 -0.291 15.261 -19.801 1040 2HG LYS 139 HG3 LYS 139 -0.216 14.250 -21.245 1041 1HD LYS 139 HD2 LYS 139 -2.739 15.245 -19.858 1042 2HD LYS 139 HD3 LYS 139 -2.075 15.850 -21.368 1043 1HE LYS 139 HE2 LYS 139 -3.320 13.106 -20.877 1044 2HE LYS 139 HE3 LYS 139 -3.984 14.438 -21.826 1045 1HZ LYS 139 HZ1 LYS 139 -1.952 14.132 -23.289 1046 2HZ LYS 139 HZ2 LYS 139 -1.707 12.695 -22.500 1047 3HZ LYS 139 HZ3 LYS 139 -3.070 12.945 -23.344 Start of MODEL 17 1 1H MET 1 H1 MET 1 1.526 -2.763 -2.612 2 2H MET 1 H2 MET 1 0.552 -1.610 -3.268 3 3H MET 1 H3 MET 1 2.042 -1.874 -3.904 4 HA MET 1 HA MET 1 1.432 -0.785 -1.263 5 1HB MET 1 HB2 MET 1 3.731 -0.533 -0.805 6 2HB MET 1 HB3 MET 1 3.506 -2.207 -1.275 7 1HG MET 1 HG2 MET 1 4.709 0.022 -2.971 8 2HG MET 1 HG3 MET 1 5.574 -1.273 -2.163 9 1HE MET 1 HE1 MET 1 6.131 -0.512 -5.143 10 2HE MET 1 HE2 MET 1 6.941 -1.854 -4.304 11 3HE MET 1 HE3 MET 1 6.214 -2.116 -5.904 12 H GLU 2 H GLU 2 1.630 1.485 -1.058 13 HA GLU 2 HA GLU 2 1.123 3.017 -3.421 14 1HB GLU 2 HB2 GLU 2 1.056 4.889 -1.981 15 2HB GLU 2 HB3 GLU 2 0.263 3.561 -1.148 16 1HG GLU 2 HG2 GLU 2 3.042 4.682 -0.616 17 2HG GLU 2 HG3 GLU 2 1.602 4.965 0.344 18 H ASN 3 H ASN 3 2.389 4.616 -4.395 19 HA ASN 3 HA ASN 3 5.223 4.908 -3.656 20 1HB ASN 3 HB2 ASN 3 4.425 4.383 -6.548 21 2HB ASN 3 HB3 ASN 3 6.036 4.705 -5.935 22 1HD2 ASN 3 HD22 ASN 3 3.381 2.404 -5.915 23 2HD2 ASN 3 HD21 ASN 3 4.298 0.983 -5.477 24 H LYS 4 H LYS 4 2.461 5.871 -5.665 25 HA LYS 4 HA LYS 4 3.452 8.697 -5.812 26 1HB LYS 4 HB2 LYS 4 1.947 6.935 -7.795 27 2HB LYS 4 HB3 LYS 4 2.111 8.677 -7.999 28 1HG LYS 4 HG2 LYS 4 4.211 8.546 -8.771 29 2HG LYS 4 HG3 LYS 4 4.739 7.466 -7.494 30 1HD LYS 4 HD2 LYS 4 5.047 6.455 -9.681 31 2HD LYS 4 HD3 LYS 4 3.907 5.511 -8.710 32 1HE LYS 4 HE2 LYS 4 2.019 6.339 -9.928 33 2HE LYS 4 HE3 LYS 4 2.975 7.598 -10.720 34 1HZ LYS 4 HZ1 LYS 4 3.203 4.663 -11.199 35 2HZ LYS 4 HZ2 LYS 4 2.601 5.780 -12.225 36 3HZ LYS 4 HZ3 LYS 4 4.190 5.794 -11.872 37 H ILE 5 H ILE 5 1.597 10.269 -6.168 38 HA ILE 5 HA ILE 5 -0.941 9.486 -4.861 39 HB ILE 5 HB ILE 5 0.985 11.678 -3.990 40 1HG1 ILE 5 HG12 ILE 5 -0.420 9.565 -2.319 41 2HG1 ILE 5 HG13 ILE 5 1.227 9.425 -2.928 42 1HG2 ILE 5 HG21 ILE 5 -1.245 12.749 -4.155 43 2HG2 ILE 5 HG22 ILE 5 -1.957 11.440 -3.206 44 3HG2 ILE 5 HG23 ILE 5 -0.800 12.581 -2.469 45 1HD1 ILE 5 HD11 ILE 5 1.373 10.108 -0.656 46 2HD1 ILE 5 HD12 ILE 5 1.855 11.490 -1.658 47 3HD1 ILE 5 HD13 ILE 5 0.248 11.449 -0.889 48 H ILE 6 H ILE 6 -2.640 10.481 -5.874 49 HA ILE 6 HA ILE 6 -2.071 12.805 -7.643 50 HB ILE 6 HB ILE 6 -2.299 11.027 -9.173 51 1HG1 ILE 6 HG12 ILE 6 -5.036 12.373 -8.992 52 2HG1 ILE 6 HG13 ILE 6 -3.568 13.189 -9.529 53 1HG2 ILE 6 HG21 ILE 6 -4.210 9.453 -9.235 54 2HG2 ILE 6 HG22 ILE 6 -3.245 9.261 -7.772 55 3HG2 ILE 6 HG23 ILE 6 -4.797 10.121 -7.701 56 1HD1 ILE 6 HD11 ILE 6 -4.815 12.536 -11.463 57 2HD1 ILE 6 HD12 ILE 6 -3.363 11.528 -11.398 58 3HD1 ILE 6 HD13 ILE 6 -4.938 10.854 -10.913 59 H TYR 7 H TYR 7 -3.534 14.460 -7.214 60 HA TYR 7 HA TYR 7 -5.584 13.949 -5.106 61 1HB TYR 7 HB2 TYR 7 -3.420 14.825 -4.277 62 2HB TYR 7 HB3 TYR 7 -3.587 16.224 -5.328 63 HD1 TYR 7 HD1 TYR 7 -3.857 18.090 -3.915 64 HD2 TYR 7 HD2 TYR 7 -6.016 14.469 -3.009 65 HE1 TYR 7 HE1 TYR 7 -4.831 19.166 -1.897 66 HE2 TYR 7 HE2 TYR 7 -6.993 15.539 -1.010 67 HH TYR 7 HH TYR 7 -6.996 17.426 0.354 68 H PHE 8 H PHE 8 -7.517 14.236 -6.138 69 HA PHE 8 HA PHE 8 -7.861 16.047 -8.376 70 1HB PHE 8 HB2 PHE 8 -9.755 14.357 -6.675 71 2HB PHE 8 HB3 PHE 8 -10.273 15.328 -8.041 72 HD1 PHE 8 HD1 PHE 8 -8.957 14.968 -10.276 73 HD2 PHE 8 HD2 PHE 8 -9.058 12.099 -7.069 74 HE1 PHE 8 HE1 PHE 8 -8.156 13.212 -11.837 75 HE2 PHE 8 HE2 PHE 8 -8.248 10.349 -8.646 76 HZ PHE 8 HZ PHE 8 -7.750 10.908 -10.989 77 H LEU 9 H LEU 9 -8.833 18.030 -8.394 78 HA LEU 9 HA LEU 9 -9.775 19.210 -5.823 79 1HB LEU 9 HB2 LEU 9 -7.402 19.865 -7.419 80 2HB LEU 9 HB3 LEU 9 -8.540 21.175 -7.550 81 HG LEU 9 HG LEU 9 -7.001 21.627 -5.779 82 1HD1 LEU 9 HD11 LEU 9 -8.494 22.272 -4.072 83 2HD1 LEU 9 HD12 LEU 9 -9.487 22.226 -5.521 84 3HD1 LEU 9 HD13 LEU 9 -9.564 20.887 -4.342 85 1HD2 LEU 9 HD21 LEU 9 -7.898 19.068 -4.403 86 2HD2 LEU 9 HD22 LEU 9 -6.370 19.284 -5.268 87 3HD2 LEU 9 HD23 LEU 9 -6.698 20.234 -3.819 88 H CYS 10 H CYS 10 -11.695 20.444 -6.069 89 HA CYS 10 HA CYS 10 -12.405 21.468 -8.699 90 1HB CYS 10 HB2 CYS 10 -13.145 18.918 -8.408 91 2HB CYS 10 HB3 CYS 10 -14.463 19.620 -7.455 92 HG CYS 10 HG CYS 10 -15.155 19.146 -9.980 93 H THR 11 H THR 11 -14.753 22.647 -8.476 94 HA THR 11 HA THR 11 -14.526 24.362 -6.201 95 HB THR 11 HB THR 11 -16.808 25.181 -7.121 96 HG1 THR 11 HG1 THR 11 -17.148 24.601 -9.251 97 1HG2 THR 11 HG21 THR 11 -15.608 26.406 -8.896 98 2HG2 THR 11 HG22 THR 11 -14.655 26.325 -7.402 99 3HG2 THR 11 HG23 THR 11 -14.243 25.276 -8.761 100 H GLY 12 H GLY 12 -15.907 21.275 -6.439 101 1HA GLY 12 HA1 GLY 12 -16.664 21.431 -3.685 102 2HA GLY 12 HA2 GLY 12 -18.053 21.082 -4.747 103 H ASN 13 H ASN 13 -15.753 19.624 -2.946 104 HA ASN 13 HA ASN 13 -14.520 17.632 -4.545 105 1HB ASN 13 HB2 ASN 13 -13.989 18.224 -2.173 106 2HB ASN 13 HB3 ASN 13 -15.504 17.515 -1.649 107 1HD2 ASN 13 HD22 ASN 13 -13.008 16.766 -0.655 108 2HD2 ASN 13 HD21 ASN 13 -12.609 15.139 -1.156 109 H SER 14 H SER 14 -17.590 17.712 -2.845 110 HA SER 14 HA SER 14 -18.506 15.348 -2.483 111 1HB SER 14 HB2 SER 14 -20.252 17.492 -3.703 112 2HB SER 14 HB3 SER 14 -20.665 16.366 -2.400 113 HG SER 14 HG SER 14 -20.014 18.697 -1.985 114 H CYS 15 H CYS 15 -18.319 16.528 -5.799 115 HA CYS 15 HA CYS 15 -19.761 14.083 -6.705 116 1HB CYS 15 HB2 CYS 15 -19.937 16.772 -8.111 117 2HB CYS 15 HB3 CYS 15 -20.875 15.309 -8.427 118 HG CYS 15 HG CYS 15 -22.089 17.478 -7.330 119 H ARG 16 H ARG 16 -17.948 16.754 -8.314 120 HA ARG 16 HA ARG 16 -17.002 15.028 -10.333 121 1HB ARG 16 HB2 ARG 16 -16.187 17.806 -9.420 122 2HB ARG 16 HB3 ARG 16 -15.363 17.034 -10.774 123 1HG ARG 16 HG2 ARG 16 -17.290 16.921 -12.112 124 2HG ARG 16 HG3 ARG 16 -18.394 17.159 -10.757 125 1HD ARG 16 HD2 ARG 16 -16.471 19.295 -11.746 126 2HD ARG 16 HD3 ARG 16 -18.147 19.144 -12.276 127 HE ARG 16 HE ARG 16 -18.500 19.194 -9.588 128 1HH1 ARG 16 HH21 ARG 16 -16.982 21.497 -11.833 129 2HH1 ARG 16 HH22 ARG 16 -16.833 22.730 -10.602 130 1HH2 ARG 16 HH11 ARG 16 -18.539 20.827 -8.146 131 2HH2 ARG 16 HH12 ARG 16 -17.795 22.387 -8.504 132 H SER 17 H SER 17 -15.159 16.179 -7.409 133 HA SER 17 HA SER 17 -12.802 14.777 -8.201 134 1HB SER 17 HB2 SER 17 -13.621 15.530 -5.390 135 2HB SER 17 HB3 SER 17 -11.982 15.291 -6.031 136 HG SER 17 HG SER 17 -12.472 17.487 -5.866 137 H GLN 18 H GLN 18 -15.495 13.865 -5.977 138 HA GLN 18 HA GLN 18 -14.474 11.359 -5.208 139 1HB GLN 18 HB2 GLN 18 -17.358 12.298 -5.622 140 2HB GLN 18 HB3 GLN 18 -16.929 10.785 -4.837 141 1HG GLN 18 HG2 GLN 18 -16.089 13.539 -3.863 142 2HG GLN 18 HG3 GLN 18 -17.428 12.615 -3.223 143 1HE2 GLN 18 HE22 GLN 18 -14.519 13.511 -2.309 144 2HE2 GLN 18 HE21 GLN 18 -14.090 12.108 -1.321 145 H MET 19 H MET 19 -16.458 12.150 -8.104 146 HA MET 19 HA MET 19 -16.668 9.442 -9.052 147 1HB MET 19 HB2 MET 19 -16.867 12.139 -10.471 148 2HB MET 19 HB3 MET 19 -17.233 10.588 -11.241 149 1HG MET 19 HG2 MET 19 -19.093 10.178 -9.812 150 2HG MET 19 HG3 MET 19 -18.600 11.427 -8.681 151 1HE MET 19 HE1 MET 19 -20.647 12.269 -12.753 152 2HE MET 19 HE2 MET 19 -19.005 11.596 -12.668 153 3HE MET 19 HE3 MET 19 -20.390 10.652 -12.062 154 H ALA 20 H ALA 20 -14.352 12.126 -9.855 155 HA ALA 20 HA ALA 20 -12.848 10.739 -11.779 156 1HB ALA 20 HB1 ALA 20 -11.103 12.370 -11.330 157 2HB ALA 20 HB2 ALA 20 -12.669 13.193 -11.250 158 3HB ALA 20 HB3 ALA 20 -11.811 12.773 -9.758 159 H GLU 21 H GLU 21 -12.454 10.840 -8.231 160 HA GLU 21 HA GLU 21 -10.099 9.301 -8.042 161 1HB GLU 21 HB2 GLU 21 -10.845 10.583 -6.228 162 2HB GLU 21 HB3 GLU 21 -12.426 9.781 -6.151 163 1HG GLU 21 HG2 GLU 21 -11.331 7.701 -5.456 164 2HG GLU 21 HG3 GLU 21 -9.752 8.476 -5.521 165 H GLY 22 H GLY 22 -13.543 8.215 -8.067 166 1HA GLY 22 HA1 GLY 22 -13.081 5.469 -7.732 167 2HA GLY 22 HA2 GLY 22 -14.440 6.189 -8.601 168 H TRP 23 H TRP 23 -13.117 7.372 -10.870 169 HA TRP 23 HA TRP 23 -12.654 4.972 -12.446 170 1HB TRP 23 HB2 TRP 23 -12.202 7.916 -13.060 171 2HB TRP 23 HB3 TRP 23 -11.935 6.627 -14.220 172 HD1 TRP 23 HD1 TRP 23 -14.629 8.664 -12.599 173 HE1 TRP 23 HE1 TRP 23 -16.838 8.340 -13.778 174 HE3 TRP 23 HE3 TRP 23 -13.342 4.745 -15.642 175 HZ2 TRP 23 HZ2 TRP 23 -17.941 6.629 -15.812 176 HZ3 TRP 23 HZ3 TRP 23 -14.998 3.841 -17.254 177 HH2 TRP 23 HH2 TRP 23 -17.303 4.797 -17.352 178 H ALA 24 H ALA 24 -10.469 7.514 -11.107 179 HA ALA 24 HA ALA 24 -8.207 6.642 -12.540 180 1HB ALA 24 HB1 ALA 24 -8.454 8.831 -11.315 181 2HB ALA 24 HB2 ALA 24 -8.220 7.967 -9.791 182 3HB ALA 24 HB3 ALA 24 -6.911 8.013 -10.994 183 H LYS 25 H LYS 25 -9.542 5.489 -9.437 184 HA LYS 25 HA LYS 25 -7.360 3.862 -8.652 185 1HB LYS 25 HB2 LYS 25 -10.358 3.597 -8.241 186 2HB LYS 25 HB3 LYS 25 -9.214 2.438 -7.550 187 1HG LYS 25 HG2 LYS 25 -8.116 4.108 -6.229 188 2HG LYS 25 HG3 LYS 25 -8.946 5.428 -7.063 189 1HD LYS 25 HD2 LYS 25 -11.125 4.618 -6.184 190 2HD LYS 25 HD3 LYS 25 -10.276 3.346 -5.269 191 1HE LYS 25 HE2 LYS 25 -9.038 5.036 -3.991 192 2HE LYS 25 HE3 LYS 25 -9.662 6.319 -5.031 193 1HZ LYS 25 HZ1 LYS 25 -11.923 5.695 -4.209 194 2HZ LYS 25 HZ2 LYS 25 -11.193 4.764 -3.049 195 3HZ LYS 25 HZ3 LYS 25 -10.946 6.406 -3.128 196 H GLN 26 H GLN 26 -9.833 3.267 -11.145 197 HA GLN 26 HA GLN 26 -9.094 0.480 -11.538 198 1HB GLN 26 HB2 GLN 26 -10.337 2.372 -13.552 199 2HB GLN 26 HB3 GLN 26 -10.253 0.621 -13.640 200 1HG GLN 26 HG2 GLN 26 -11.736 0.495 -11.604 201 2HG GLN 26 HG3 GLN 26 -11.921 2.264 -11.692 202 1HE2 GLN 26 HE22 GLN 26 -12.172 2.907 -14.246 203 2HE2 GLN 26 HE21 GLN 26 -13.524 2.096 -15.019 204 H TYR 27 H TYR 27 -8.502 3.480 -13.369 205 HA TYR 27 HA TYR 27 -6.826 2.245 -15.289 206 1HB TYR 27 HB2 TYR 27 -7.111 5.177 -14.513 207 2HB TYR 27 HB3 TYR 27 -6.213 4.613 -15.912 208 HD1 TYR 27 HD1 TYR 27 -9.335 5.884 -14.948 209 HD2 TYR 27 HD2 TYR 27 -7.546 2.900 -17.502 210 HE1 TYR 27 HE1 TYR 27 -11.334 5.930 -16.401 211 HE2 TYR 27 HE2 TYR 27 -9.566 2.904 -18.930 212 HH TYR 27 HH TYR 27 -12.385 5.036 -18.291 213 H LEU 28 H LEU 28 -5.933 3.931 -12.286 214 HA LEU 28 HA LEU 28 -3.103 3.954 -13.079 215 1HB LEU 28 HB2 LEU 28 -4.507 5.097 -10.636 216 2HB LEU 28 HB3 LEU 28 -2.851 5.378 -11.098 217 HG LEU 28 HG LEU 28 -5.295 6.326 -12.614 218 1HD1 LEU 28 HD11 LEU 28 -4.640 7.570 -10.560 219 2HD1 LEU 28 HD12 LEU 28 -3.033 7.849 -11.257 220 3HD1 LEU 28 HD13 LEU 28 -4.474 8.543 -12.035 221 1HD2 LEU 28 HD21 LEU 28 -2.362 6.609 -13.394 222 2HD2 LEU 28 HD22 LEU 28 -3.612 5.715 -14.289 223 3HD2 LEU 28 HD23 LEU 28 -3.725 7.458 -14.150 224 H GLY 29 H GLY 29 -5.087 2.376 -10.577 225 1HA GLY 29 HA1 GLY 29 -4.655 0.353 -9.548 226 2HA GLY 29 HA2 GLY 29 -3.063 0.288 -10.301 227 H ASP 30 H ASP 30 -3.043 -0.587 -7.875 228 HA ASP 30 HA ASP 30 -3.163 1.222 -5.714 229 1HB ASP 30 HB2 ASP 30 -3.541 -1.206 -5.559 230 2HB ASP 30 HB3 ASP 30 -1.832 -1.498 -5.918 231 H GLU 31 H GLU 31 -0.536 0.713 -7.917 232 HA GLU 31 HA GLU 31 1.618 1.478 -6.214 233 1HB GLU 31 HB2 GLU 31 2.930 1.911 -8.099 234 2HB GLU 31 HB3 GLU 31 1.994 0.427 -8.386 235 1HG GLU 31 HG2 GLU 31 0.353 1.753 -9.642 236 2HG GLU 31 HG3 GLU 31 1.294 3.208 -9.265 237 H TRP 32 H TRP 32 -1.109 3.229 -7.177 238 HA TRP 32 HA TRP 32 0.188 5.775 -6.347 239 1HB TRP 32 HB2 TRP 32 -2.427 5.442 -7.864 240 2HB TRP 32 HB3 TRP 32 -1.600 6.941 -7.505 241 HD1 TRP 32 HD1 TRP 32 -0.975 3.768 -9.610 242 HE1 TRP 32 HE1 TRP 32 -0.203 4.471 -11.940 243 HE3 TRP 32 HE3 TRP 32 -0.622 8.817 -8.856 244 HZ2 TRP 32 HZ2 TRP 32 0.395 6.879 -13.336 245 HZ3 TRP 32 HZ3 TRP 32 -0.013 10.293 -10.731 246 HH2 TRP 32 HH2 TRP 32 0.453 9.335 -13.001 247 H LYS 33 H LYS 33 -1.288 7.131 -5.066 248 HA LYS 33 HA LYS 33 -3.588 5.740 -3.798 249 1HB LYS 33 HB2 LYS 33 -1.575 7.641 -2.553 250 2HB LYS 33 HB3 LYS 33 -3.168 7.357 -1.847 251 1HG LYS 33 HG2 LYS 33 -1.167 5.145 -2.413 252 2HG LYS 33 HG3 LYS 33 -1.259 6.034 -0.893 253 1HD LYS 33 HD2 LYS 33 -2.441 4.153 -0.351 254 2HD LYS 33 HD3 LYS 33 -3.724 5.264 -0.770 255 1HE LYS 33 HE2 LYS 33 -4.206 3.048 -1.605 256 2HE LYS 33 HE3 LYS 33 -3.993 4.118 -2.985 257 1HZ LYS 33 HZ1 LYS 33 -2.030 3.073 -3.551 258 2HZ LYS 33 HZ2 LYS 33 -1.726 2.499 -2.021 259 3HZ LYS 33 HZ3 LYS 33 -2.859 1.806 -2.949 260 H VAL 34 H VAL 34 -5.411 7.018 -3.598 261 HA VAL 34 HA VAL 34 -5.420 9.329 -5.477 262 HB VAL 34 HB VAL 34 -7.477 7.087 -5.422 263 1HG1 VAL 34 HG11 VAL 34 -8.163 7.918 -7.518 264 2HG1 VAL 34 HG12 VAL 34 -7.922 9.363 -6.516 265 3HG1 VAL 34 HG13 VAL 34 -6.700 8.904 -7.719 266 1HG2 VAL 34 HG21 VAL 34 -4.992 7.143 -7.184 267 2HG2 VAL 34 HG22 VAL 34 -5.461 5.871 -6.025 268 3HG2 VAL 34 HG23 VAL 34 -6.422 6.134 -7.480 269 H TYR 35 H TYR 35 -6.244 11.026 -4.409 270 HA TYR 35 HA TYR 35 -8.557 10.563 -2.612 271 1HB TYR 35 HB2 TYR 35 -6.823 12.769 -1.721 272 2HB TYR 35 HB3 TYR 35 -7.766 11.633 -0.804 273 HD1 TYR 35 HD1 TYR 35 -6.750 9.233 -0.450 274 HD2 TYR 35 HD2 TYR 35 -4.505 12.638 -1.853 275 HE1 TYR 35 HE1 TYR 35 -4.650 8.185 0.359 276 HE2 TYR 35 HE2 TYR 35 -2.435 11.657 -0.995 277 HH TYR 35 HH TYR 35 -1.458 9.815 0.112 278 H SER 36 H SER 36 -9.657 12.641 -2.114 279 HA SER 36 HA SER 36 -9.733 14.488 -4.449 280 1HB SER 36 HB2 SER 36 -11.984 13.071 -2.935 281 2HB SER 36 HB3 SER 36 -12.210 14.301 -4.177 282 HG SER 36 HG SER 36 -11.247 11.677 -4.355 283 H ALA 37 H ALA 37 -10.032 16.605 -3.921 284 HA ALA 37 HA ALA 37 -11.279 17.320 -1.352 285 1HB ALA 37 HB1 ALA 37 -8.710 18.594 -2.279 286 2HB ALA 37 HB2 ALA 37 -9.704 18.926 -0.829 287 3HB ALA 37 HB3 ALA 37 -8.876 17.383 -0.970 288 H GLY 38 H GLY 38 -11.401 19.983 -1.592 289 1HA GLY 38 HA1 GLY 38 -11.766 20.961 -4.244 290 2HA GLY 38 HA2 GLY 38 -13.323 20.581 -3.492 291 H ILE 39 H ILE 39 -13.021 23.088 -4.126 292 HA ILE 39 HA ILE 39 -11.984 24.949 -2.238 293 HB ILE 39 HB ILE 39 -14.344 24.882 -4.131 294 1HG1 ILE 39 HG12 ILE 39 -13.238 26.649 -5.328 295 2HG1 ILE 39 HG13 ILE 39 -12.055 26.859 -4.054 296 1HG2 ILE 39 HG21 ILE 39 -15.258 26.234 -2.357 297 2HG2 ILE 39 HG22 ILE 39 -13.770 27.213 -2.280 298 3HG2 ILE 39 HG23 ILE 39 -14.827 27.271 -3.708 299 1HD1 ILE 39 HD11 ILE 39 -12.274 24.477 -5.935 300 2HD1 ILE 39 HD12 ILE 39 -11.076 25.763 -5.997 301 3HD1 ILE 39 HD13 ILE 39 -11.047 24.647 -4.641 302 H GLU 40 H GLU 40 -14.980 22.995 -2.313 303 HA GLU 40 HA GLU 40 -15.007 23.029 0.609 304 1HB GLU 40 HB2 GLU 40 -17.345 23.600 0.814 305 2HB GLU 40 HB3 GLU 40 -16.475 24.913 0.037 306 1HG GLU 40 HG2 GLU 40 -17.329 24.196 -2.181 307 2HG GLU 40 HG3 GLU 40 -18.181 22.841 -1.435 308 H ALA 41 H ALA 41 -16.983 21.524 1.252 309 HA ALA 41 HA ALA 41 -17.598 19.348 -0.615 310 1HB ALA 41 HB1 ALA 41 -15.572 18.527 0.545 311 2HB ALA 41 HB2 ALA 41 -16.291 18.931 2.120 312 3HB ALA 41 HB3 ALA 41 -17.017 17.663 1.118 313 H HIS 42 H HIS 42 -19.587 18.376 0.063 314 HA HIS 42 HA HIS 42 -20.896 19.501 2.493 315 1HB HIS 42 HB2 HIS 42 -23.012 19.674 1.335 316 2HB HIS 42 HB3 HIS 42 -21.800 20.706 0.602 317 HD1 HIS 42 HD1 HIS 42 -23.413 17.229 -0.161 318 HD2 HIS 42 HD2 HIS 42 -21.766 20.643 -1.988 319 HE1 HIS 42 HE1 HIS 42 -23.761 16.939 -2.656 320 H GLY 43 H GLY 43 -20.067 16.717 0.602 321 1HA GLY 43 HA1 GLY 43 -20.208 14.885 2.576 322 2HA GLY 43 HA2 GLY 43 -21.863 14.865 1.925 323 H LEU 44 H LEU 44 -20.886 12.559 1.425 324 HA LEU 44 HA LEU 44 -19.521 12.535 -1.225 325 1HB LEU 44 HB2 LEU 44 -18.789 10.804 0.284 326 2HB LEU 44 HB3 LEU 44 -20.458 10.337 0.664 327 HG LEU 44 HG LEU 44 -20.835 9.459 -1.505 328 1HD1 LEU 44 HD11 LEU 44 -18.089 10.506 -2.272 329 2HD1 LEU 44 HD12 LEU 44 -19.019 9.349 -3.243 330 3HD1 LEU 44 HD13 LEU 44 -19.638 10.981 -3.004 331 1HD2 LEU 44 HD21 LEU 44 -18.071 8.605 -0.591 332 2HD2 LEU 44 HD22 LEU 44 -19.586 8.064 0.152 333 3HD2 LEU 44 HD23 LEU 44 -19.213 7.636 -1.529 334 H ASN 45 H ASN 45 -20.953 13.215 -2.803 335 HA ASN 45 HA ASN 45 -23.710 13.469 -2.286 336 1HB ASN 45 HB2 ASN 45 -22.318 14.768 -3.932 337 2HB ASN 45 HB3 ASN 45 -22.417 13.402 -5.043 338 1HD2 ASN 45 HD22 ASN 45 -23.574 16.266 -5.038 339 2HD2 ASN 45 HD21 ASN 45 -25.295 16.050 -5.267 340 HA PRO 46 HA PRO 46 -25.044 9.191 -3.071 341 1HB PRO 46 HB2 PRO 46 -27.642 10.630 -3.643 342 2HB PRO 46 HB3 PRO 46 -27.370 9.121 -2.714 343 1HG PRO 46 HG2 PRO 46 -27.755 11.469 -1.416 344 2HG PRO 46 HG3 PRO 46 -26.474 10.341 -0.861 345 1HD PRO 46 HD2 PRO 46 -26.180 12.824 -2.566 346 2HD PRO 46 HD3 PRO 46 -25.174 12.263 -1.195 347 H ASN 47 H ASN 47 -25.728 11.925 -5.327 348 HA ASN 47 HA ASN 47 -26.357 10.270 -7.576 349 1HB ASN 47 HB2 ASN 47 -26.638 12.165 -8.681 350 2HB ASN 47 HB3 ASN 47 -26.399 13.013 -7.172 351 1HD2 ASN 47 HD22 ASN 47 -25.385 12.806 -10.412 352 2HD2 ASN 47 HD21 ASN 47 -23.817 13.562 -10.244 353 H ALA 48 H ALA 48 -23.247 11.398 -6.210 354 HA ALA 48 HA ALA 48 -21.673 10.495 -8.449 355 1HB ALA 48 HB1 ALA 48 -19.768 10.827 -6.909 356 2HB ALA 48 HB2 ALA 48 -20.871 12.219 -6.880 357 3HB ALA 48 HB3 ALA 48 -20.869 11.041 -5.547 358 H VAL 49 H VAL 49 -22.667 9.112 -5.281 359 HA VAL 49 HA VAL 49 -21.180 6.704 -5.523 360 HB VAL 49 HB VAL 49 -23.817 7.094 -4.056 361 1HG1 VAL 49 HG11 VAL 49 -23.231 4.709 -4.352 362 2HG1 VAL 49 HG12 VAL 49 -21.583 5.023 -3.774 363 3HG1 VAL 49 HG13 VAL 49 -22.973 5.194 -2.673 364 1HG2 VAL 49 HG21 VAL 49 -22.155 8.716 -3.245 365 2HG2 VAL 49 HG22 VAL 49 -22.345 7.434 -2.054 366 3HG2 VAL 49 HG23 VAL 49 -20.930 7.445 -3.129 367 H LYS 50 H LYS 50 -24.625 7.417 -6.466 368 HA LYS 50 HA LYS 50 -24.946 4.799 -7.513 369 1HB LYS 50 HB2 LYS 50 -26.784 6.461 -6.869 370 2HB LYS 50 HB3 LYS 50 -26.534 7.216 -8.456 371 1HG LYS 50 HG2 LYS 50 -26.977 4.976 -9.528 372 2HG LYS 50 HG3 LYS 50 -27.240 4.283 -7.921 373 1HD LYS 50 HD2 LYS 50 -29.151 5.828 -7.573 374 2HD LYS 50 HD3 LYS 50 -28.885 6.507 -9.193 375 1HE LYS 50 HE2 LYS 50 -29.263 4.270 -10.199 376 2HE LYS 50 HE3 LYS 50 -29.526 3.586 -8.589 377 1HZ LYS 50 HZ1 LYS 50 -31.464 5.030 -8.365 378 2HZ LYS 50 HZ2 LYS 50 -31.225 5.660 -9.855 379 3HZ LYS 50 HZ3 LYS 50 -31.613 4.087 -9.682 380 H ALA 51 H ALA 51 -23.959 7.863 -9.166 381 HA ALA 51 HA ALA 51 -24.007 6.883 -11.784 382 1HB ALA 51 HB1 ALA 51 -22.035 8.866 -10.541 383 2HB ALA 51 HB2 ALA 51 -22.318 8.651 -12.278 384 3HB ALA 51 HB3 ALA 51 -23.624 9.271 -11.244 385 H MET 52 H MET 52 -21.308 6.697 -9.384 386 HA MET 52 HA MET 52 -19.600 5.264 -11.220 387 1HB MET 52 HB2 MET 52 -19.541 5.751 -8.220 388 2HB MET 52 HB3 MET 52 -18.233 5.008 -9.140 389 1HG MET 52 HG2 MET 52 -19.298 7.838 -9.435 390 2HG MET 52 HG3 MET 52 -17.731 7.351 -8.807 391 1HE MET 52 HE1 MET 52 -16.715 5.215 -10.625 392 2HE MET 52 HE2 MET 52 -15.890 6.005 -11.958 393 3HE MET 52 HE3 MET 52 -15.663 6.610 -10.305 394 H LYS 53 H LYS 53 -21.824 4.296 -8.556 395 HA LYS 53 HA LYS 53 -20.983 1.600 -8.474 396 1HB LYS 53 HB2 LYS 53 -22.258 2.785 -6.703 397 2HB LYS 53 HB3 LYS 53 -23.702 2.758 -7.733 398 1HG LYS 53 HG2 LYS 53 -23.708 0.287 -7.657 399 2HG LYS 53 HG3 LYS 53 -22.203 0.302 -6.709 400 1HD LYS 53 HD2 LYS 53 -23.361 1.577 -4.913 401 2HD LYS 53 HD3 LYS 53 -24.870 1.520 -5.829 402 1HE LYS 53 HE2 LYS 53 -23.313 -0.914 -4.819 403 2HE LYS 53 HE3 LYS 53 -24.684 -0.182 -3.984 404 1HZ LYS 53 HZ1 LYS 53 -25.389 -2.069 -5.275 405 2HZ LYS 53 HZ2 LYS 53 -26.073 -0.731 -5.897 406 3HZ LYS 53 HZ3 LYS 53 -24.811 -1.445 -6.661 407 H GLU 54 H GLU 54 -23.420 3.208 -10.510 408 HA GLU 54 HA GLU 54 -24.444 0.860 -11.737 409 1HB GLU 54 HB2 GLU 54 -24.303 3.785 -12.548 410 2HB GLU 54 HB3 GLU 54 -25.013 2.583 -13.622 411 1HG GLU 54 HG2 GLU 54 -25.932 3.009 -10.752 412 2HG GLU 54 HG3 GLU 54 -26.640 3.821 -12.143 413 H VAL 55 H VAL 55 -21.347 2.441 -12.166 414 HA VAL 55 HA VAL 55 -20.784 0.969 -14.669 415 HB VAL 55 HB VAL 55 -19.112 2.924 -13.028 416 1HG1 VAL 55 HG11 VAL 55 -18.572 1.783 -15.799 417 2HG1 VAL 55 HG12 VAL 55 -17.699 3.140 -15.052 418 3HG1 VAL 55 HG13 VAL 55 -17.584 1.543 -14.339 419 1HG2 VAL 55 HG21 VAL 55 -19.583 4.493 -14.876 420 2HG2 VAL 55 HG22 VAL 55 -20.655 3.297 -15.636 421 3HG2 VAL 55 HG23 VAL 55 -21.080 4.023 -14.078 422 H GLY 56 H GLY 56 -20.846 0.271 -11.354 423 1HA GLY 56 HA1 GLY 56 -20.204 -1.714 -10.357 424 2HA GLY 56 HA2 GLY 56 -19.051 -2.048 -11.656 425 H ILE 57 H ILE 57 -19.060 1.165 -10.178 426 HA ILE 57 HA ILE 57 -16.507 0.541 -8.765 427 HB ILE 57 HB ILE 57 -17.347 3.105 -10.158 428 1HG1 ILE 57 HG12 ILE 57 -15.302 1.016 -11.029 429 2HG1 ILE 57 HG13 ILE 57 -16.858 1.334 -11.803 430 1HG2 ILE 57 HG21 ILE 57 -15.854 3.391 -8.143 431 2HG2 ILE 57 HG22 ILE 57 -14.671 2.306 -8.898 432 3HG2 ILE 57 HG23 ILE 57 -15.063 3.871 -9.634 433 1HD1 ILE 57 HD11 ILE 57 -15.267 2.432 -13.132 434 2HD1 ILE 57 HD12 ILE 57 -16.098 3.696 -12.236 435 3HD1 ILE 57 HD13 ILE 57 -14.456 3.179 -11.741 436 H ASP 58 H ASP 58 -17.414 0.122 -6.808 437 HA ASP 58 HA ASP 58 -19.567 1.773 -5.714 438 1HB ASP 58 HB2 ASP 58 -19.611 -0.576 -5.216 439 2HB ASP 58 HB3 ASP 58 -17.982 -0.520 -4.524 440 H ILE 59 H ILE 59 -18.557 3.851 -5.745 441 HA ILE 59 HA ILE 59 -16.252 4.368 -4.071 442 HB ILE 59 HB ILE 59 -16.518 6.648 -4.627 443 1HG1 ILE 59 HG12 ILE 59 -19.151 6.137 -6.029 444 2HG1 ILE 59 HG13 ILE 59 -19.059 6.720 -4.369 445 1HG2 ILE 59 HG21 ILE 59 -17.193 5.081 -7.125 446 2HG2 ILE 59 HG22 ILE 59 -16.310 6.616 -7.018 447 3HG2 ILE 59 HG23 ILE 59 -15.590 5.144 -6.356 448 1HD1 ILE 59 HD11 ILE 59 -17.662 8.652 -5.145 449 2HD1 ILE 59 HD12 ILE 59 -18.040 8.190 -6.814 450 3HD1 ILE 59 HD13 ILE 59 -19.341 8.648 -5.698 451 H SER 60 H SER 60 -19.260 3.426 -2.971 452 HA SER 60 HA SER 60 -20.021 5.551 -1.296 453 1HB SER 60 HB2 SER 60 -21.296 3.428 -1.971 454 2HB SER 60 HB3 SER 60 -20.441 2.619 -0.641 455 HG SER 60 HG SER 60 -22.486 3.445 -0.024 456 H ASN 61 H ASN 61 -17.395 3.253 -0.932 457 HA ASN 61 HA ASN 61 -16.990 3.526 1.892 458 1HB ASN 61 HB2 ASN 61 -16.142 1.628 0.528 459 2HB ASN 61 HB3 ASN 61 -15.063 2.732 -0.329 460 1HD2 ASN 61 HD22 ASN 61 -12.960 2.591 0.446 461 2HD2 ASN 61 HD21 ASN 61 -12.530 2.276 2.105 462 H GLN 62 H GLN 62 -16.366 5.738 -0.736 463 HA GLN 62 HA GLN 62 -14.012 6.978 0.356 464 1HB GLN 62 HB2 GLN 62 -15.949 7.955 -1.777 465 2HB GLN 62 HB3 GLN 62 -14.379 8.669 -1.367 466 1HG GLN 62 HG2 GLN 62 -13.229 6.596 -1.986 467 2HG GLN 62 HG3 GLN 62 -14.762 5.853 -2.438 468 1HE2 GLN 62 HE22 GLN 62 -14.909 9.141 -3.482 469 2HE2 GLN 62 HE21 GLN 62 -14.466 8.799 -5.151 470 H THR 63 H THR 63 -14.243 9.509 0.694 471 HA THR 63 HA THR 63 -16.750 10.482 1.695 472 HB THR 63 HB THR 63 -15.485 11.378 3.824 473 HG1 THR 63 HG1 THR 63 -13.460 10.453 3.376 474 1HG2 THR 63 HG21 THR 63 -16.391 9.665 5.190 475 2HG2 THR 63 HG22 THR 63 -17.462 9.781 3.780 476 3HG2 THR 63 HG23 THR 63 -16.290 8.453 3.900 477 H SER 64 H SER 64 -16.574 12.900 2.089 478 HA SER 64 HA SER 64 -14.605 14.055 0.204 479 1HB SER 64 HB2 SER 64 -17.287 15.100 1.177 480 2HB SER 64 HB3 SER 64 -16.280 15.794 -0.108 481 HG SER 64 HG SER 64 -18.124 14.332 -0.654 482 H ASP 65 H ASP 65 -13.721 16.108 0.705 483 HA ASP 65 HA ASP 65 -13.716 17.249 3.391 484 1HB ASP 65 HB2 ASP 65 -11.964 15.343 3.356 485 2HB ASP 65 HB3 ASP 65 -11.119 16.291 2.118 486 H ILE 66 H ILE 66 -12.378 19.335 3.308 487 HA ILE 66 HA ILE 66 -12.459 20.503 0.584 488 HB ILE 66 HB ILE 66 -12.621 22.584 1.558 489 1HG1 ILE 66 HG12 ILE 66 -11.783 21.380 4.222 490 2HG1 ILE 66 HG13 ILE 66 -10.882 22.542 3.226 491 1HG2 ILE 66 HG21 ILE 66 -14.612 20.964 1.831 492 2HG2 ILE 66 HG22 ILE 66 -14.225 20.927 3.550 493 3HG2 ILE 66 HG23 ILE 66 -14.669 22.461 2.781 494 1HD1 ILE 66 HD11 ILE 66 -13.446 23.018 4.762 495 2HD1 ILE 66 HD12 ILE 66 -11.869 23.793 5.000 496 3HD1 ILE 66 HD13 ILE 66 -12.828 24.151 3.536 497 H ILE 67 H ILE 67 -10.527 21.944 0.081 498 HA ILE 67 HA ILE 67 -8.369 20.240 -0.109 499 HB ILE 67 HB ILE 67 -8.926 21.923 -1.711 500 1HG1 ILE 67 HG12 ILE 67 -6.617 20.859 -1.489 501 2HG1 ILE 67 HG13 ILE 67 -6.845 22.219 -2.572 502 1HG2 ILE 67 HG21 ILE 67 -8.225 24.264 -1.542 503 2HG2 ILE 67 HG22 ILE 67 -9.539 23.848 -0.429 504 3HG2 ILE 67 HG23 ILE 67 -7.870 24.038 0.179 505 1HD1 ILE 67 HD11 ILE 67 -5.781 23.758 -1.073 506 2HD1 ILE 67 HD12 ILE 67 -5.627 22.539 0.186 507 3HD1 ILE 67 HD13 ILE 67 -4.723 22.356 -1.327 508 H ASP 68 H ASP 68 -6.571 19.779 0.801 509 HA ASP 68 HA ASP 68 -5.665 21.268 3.214 510 1HB ASP 68 HB2 ASP 68 -6.583 19.145 3.947 511 2HB ASP 68 HB3 ASP 68 -5.649 18.272 2.722 512 H SER 69 H SER 69 -4.058 22.464 2.274 513 HA SER 69 HA SER 69 -2.719 21.777 -0.028 514 1HB SER 69 HB2 SER 69 -1.480 23.645 1.979 515 2HB SER 69 HB3 SER 69 -1.597 23.803 0.210 516 HG SER 69 HG SER 69 -3.039 25.185 1.391 517 H ASP 70 H ASP 70 -2.104 20.440 3.128 518 HA ASP 70 HA ASP 70 0.699 19.918 2.786 519 1HB ASP 70 HB2 ASP 70 -0.352 19.784 4.991 520 2HB ASP 70 HB3 ASP 70 -1.401 18.474 4.428 521 H ILE 71 H ILE 71 -2.292 18.167 1.864 522 HA ILE 71 HA ILE 71 -0.819 15.832 0.914 523 HB ILE 71 HB ILE 71 -3.680 16.751 0.422 524 1HG1 ILE 71 HG12 ILE 71 -2.453 14.429 1.990 525 2HG1 ILE 71 HG13 ILE 71 -3.062 15.927 2.715 526 1HG2 ILE 71 HG21 ILE 71 -2.276 14.190 -0.498 527 2HG2 ILE 71 HG22 ILE 71 -4.024 14.523 -0.638 528 3HG2 ILE 71 HG23 ILE 71 -2.888 15.473 -1.563 529 1HD1 ILE 71 HD11 ILE 71 -4.690 13.772 1.323 530 2HD1 ILE 71 HD12 ILE 71 -4.745 14.265 3.021 531 3HD1 ILE 71 HD13 ILE 71 -5.342 15.374 1.767 532 H LEU 72 H LEU 72 -2.170 18.819 -0.554 533 HA LEU 72 HA LEU 72 -1.510 18.329 -3.219 534 1HB LEU 72 HB2 LEU 72 -2.865 20.180 -2.437 535 2HB LEU 72 HB3 LEU 72 -1.525 20.877 -1.559 536 HG LEU 72 HG LEU 72 -0.886 20.523 -4.390 537 1HD1 LEU 72 HD11 LEU 72 -2.386 22.355 -5.195 538 2HD1 LEU 72 HD12 LEU 72 -3.292 20.915 -4.688 539 3HD1 LEU 72 HD13 LEU 72 -3.216 22.320 -3.624 540 1HD2 LEU 72 HD21 LEU 72 -0.182 22.880 -4.167 541 2HD2 LEU 72 HD22 LEU 72 -0.888 22.938 -2.542 542 3HD2 LEU 72 HD23 LEU 72 0.485 21.870 -2.878 543 H ASN 73 H ASN 73 0.602 19.727 -0.645 544 HA ASN 73 HA ASN 73 2.871 20.040 -2.359 545 1HB ASN 73 HB2 ASN 73 2.439 20.033 0.654 546 2HB ASN 73 HB3 ASN 73 4.071 19.991 0.015 547 1HD2 ASN 73 HD22 ASN 73 1.068 21.977 -0.044 548 2HD2 ASN 73 HD21 ASN 73 1.901 23.460 -0.472 549 H ASN 74 H ASN 74 1.560 17.128 -0.961 550 HA ASN 74 HA ASN 74 4.192 15.717 -1.059 551 1HB ASN 74 HB2 ASN 74 1.452 15.010 0.078 552 2HB ASN 74 HB3 ASN 74 2.654 13.778 -0.235 553 1HD2 ASN 74 HD22 ASN 74 1.728 16.308 1.922 554 2HD2 ASN 74 HD21 ASN 74 2.985 16.017 3.106 555 H ALA 75 H ALA 75 1.333 16.318 -2.975 556 HA ALA 75 HA ALA 75 0.947 13.731 -3.943 557 1HB ALA 75 HB1 ALA 75 -0.515 14.754 -5.575 558 2HB ALA 75 HB2 ALA 75 -0.720 15.581 -4.027 559 3HB ALA 75 HB3 ALA 75 0.241 16.345 -5.322 560 H ASP 76 H ASP 76 1.383 12.852 -6.186 561 HA ASP 76 HA ASP 76 4.031 13.668 -7.220 562 1HB ASP 76 HB2 ASP 76 3.254 11.264 -7.383 563 2HB ASP 76 HB3 ASP 76 1.988 11.808 -8.505 564 H LEU 77 H LEU 77 0.532 13.961 -7.898 565 HA LEU 77 HA LEU 77 1.047 16.496 -9.172 566 1HB LEU 77 HB2 LEU 77 -0.017 16.172 -11.207 567 2HB LEU 77 HB3 LEU 77 1.123 14.832 -11.076 568 HG LEU 77 HG LEU 77 -1.846 14.555 -10.485 569 1HD1 LEU 77 HD11 LEU 77 -2.052 13.681 -12.769 570 2HD1 LEU 77 HD12 LEU 77 -1.544 15.372 -12.775 571 3HD1 LEU 77 HD13 LEU 77 -0.347 14.100 -13.087 572 1HD2 LEU 77 HD21 LEU 77 -0.515 12.738 -9.556 573 2HD2 LEU 77 HD22 LEU 77 -1.291 12.152 -11.031 574 3HD2 LEU 77 HD23 LEU 77 0.426 12.599 -11.056 575 H VAL 78 H VAL 78 -0.900 17.636 -9.700 576 HA VAL 78 HA VAL 78 -3.296 16.924 -8.084 577 HB VAL 78 HB VAL 78 -1.998 19.637 -8.657 578 1HG1 VAL 78 HG11 VAL 78 -3.669 20.584 -7.096 579 2HG1 VAL 78 HG12 VAL 78 -4.475 19.820 -8.461 580 3HG1 VAL 78 HG13 VAL 78 -4.413 18.979 -6.896 581 1HG2 VAL 78 HG21 VAL 78 -1.659 19.748 -6.195 582 2HG2 VAL 78 HG22 VAL 78 -2.035 18.013 -6.090 583 3HG2 VAL 78 HG23 VAL 78 -0.628 18.607 -7.022 584 H VAL 79 H VAL 79 -5.268 17.292 -9.327 585 HA VAL 79 HA VAL 79 -4.882 18.703 -11.871 586 HB VAL 79 HB VAL 79 -6.197 17.316 -13.217 587 1HG1 VAL 79 HG11 VAL 79 -3.747 16.784 -12.970 588 2HG1 VAL 79 HG12 VAL 79 -4.191 15.444 -11.899 589 3HG1 VAL 79 HG13 VAL 79 -4.741 15.460 -13.595 590 1HG2 VAL 79 HG21 VAL 79 -6.968 15.070 -12.589 591 2HG2 VAL 79 HG22 VAL 79 -6.530 15.401 -10.892 592 3HG2 VAL 79 HG23 VAL 79 -7.796 16.356 -11.717 593 H THR 80 H THR 80 -6.363 20.219 -12.191 594 HA THR 80 HA THR 80 -8.491 20.442 -10.161 595 HB THR 80 HB THR 80 -8.725 22.668 -10.762 596 HG1 THR 80 HG1 THR 80 -8.838 22.963 -12.834 597 1HG2 THR 80 HG21 THR 80 -6.480 22.153 -9.701 598 2HG2 THR 80 HG22 THR 80 -5.756 22.197 -11.320 599 3HG2 THR 80 HG23 THR 80 -6.507 23.644 -10.656 600 H LEU 81 H LEU 81 -10.635 20.165 -10.747 601 HA LEU 81 HA LEU 81 -11.069 18.786 -13.349 602 1HB LEU 81 HB2 LEU 81 -12.536 18.669 -10.704 603 2HB LEU 81 HB3 LEU 81 -13.020 17.790 -12.153 604 HG LEU 81 HG LEU 81 -10.358 17.441 -10.679 605 1HD1 LEU 81 HD11 LEU 81 -12.209 16.654 -9.341 606 2HD1 LEU 81 HD12 LEU 81 -12.869 15.730 -10.718 607 3HD1 LEU 81 HD13 LEU 81 -11.319 15.271 -9.988 608 1HD2 LEU 81 HD21 LEU 81 -10.037 16.863 -13.000 609 2HD2 LEU 81 HD22 LEU 81 -10.201 15.356 -12.103 610 3HD2 LEU 81 HD23 LEU 81 -11.571 15.960 -13.047 611 H CYS 82 H CYS 82 -11.466 21.878 -12.191 612 HA CYS 82 HA CYS 82 -13.192 22.404 -14.376 613 1HB CYS 82 HB2 CYS 82 -14.969 23.584 -13.240 614 2HB CYS 82 HB3 CYS 82 -14.882 21.925 -12.611 615 HG CYS 82 HG CYS 82 -13.510 22.423 -10.535 616 H GLY 83 H GLY 83 -13.084 24.748 -14.899 617 1HA GLY 83 HA1 GLY 83 -10.396 25.604 -14.606 618 2HA GLY 83 HA2 GLY 83 -11.723 26.529 -15.335 619 H ASP 84 H ASP 84 -13.430 26.696 -13.007 620 HA ASP 84 HA ASP 84 -12.306 29.041 -11.862 621 1HB ASP 84 HB2 ASP 84 -14.733 28.631 -12.136 622 2HB ASP 84 HB3 ASP 84 -14.663 27.399 -10.871 623 H ALA 85 H ALA 85 -12.265 25.658 -10.745 624 HA ALA 85 HA ALA 85 -11.549 26.208 -8.036 625 1HB ALA 85 HB1 ALA 85 -12.289 23.967 -8.722 626 2HB ALA 85 HB2 ALA 85 -10.872 23.790 -9.784 627 3HB ALA 85 HB3 ALA 85 -10.661 23.868 -8.025 628 H ALA 86 H ALA 86 -9.671 26.085 -11.035 629 HA ALA 86 HA ALA 86 -7.166 25.504 -9.938 630 1HB ALA 86 HB1 ALA 86 -6.294 26.254 -12.091 631 2HB ALA 86 HB2 ALA 86 -7.830 25.383 -12.349 632 3HB ALA 86 HB3 ALA 86 -7.780 27.165 -12.409 633 H ASP 87 H ASP 87 -8.860 28.552 -10.001 634 HA ASP 87 HA ASP 87 -6.679 30.332 -9.545 635 1HB ASP 87 HB2 ASP 87 -8.956 31.065 -10.189 636 2HB ASP 87 HB3 ASP 87 -9.580 30.472 -8.639 637 H LYS 88 H LYS 88 -8.651 28.309 -7.418 638 HA LYS 88 HA LYS 88 -7.492 29.439 -4.930 639 1HB LYS 88 HB2 LYS 88 -9.844 28.873 -4.838 640 2HB LYS 88 HB3 LYS 88 -9.550 27.295 -5.563 641 1HG LYS 88 HG2 LYS 88 -10.059 27.027 -3.253 642 2HG LYS 88 HG3 LYS 88 -8.405 26.528 -3.537 643 1HD LYS 88 HD2 LYS 88 -7.598 28.681 -2.565 644 2HD LYS 88 HD3 LYS 88 -9.286 29.214 -2.367 645 1HE LYS 88 HE2 LYS 88 -9.744 27.254 -0.940 646 2HE LYS 88 HE3 LYS 88 -8.085 26.688 -1.142 647 1HZ LYS 88 HZ1 LYS 88 -7.334 28.708 0.005 648 2HZ LYS 88 HZ2 LYS 88 -8.874 29.223 0.193 649 3HZ LYS 88 HZ3 LYS 88 -8.365 27.877 0.953 650 H CYS 89 H CYS 89 -7.293 26.512 -6.917 651 HA CYS 89 HA CYS 89 -6.081 24.736 -5.235 652 1HB CYS 89 HB2 CYS 89 -5.528 25.182 -8.181 653 2HB CYS 89 HB3 CYS 89 -4.995 23.757 -7.270 654 HG CYS 89 HG CYS 89 -8.122 24.893 -7.426 655 HA PRO 90 HA PRO 90 -2.666 27.403 -4.207 656 1HB PRO 90 HB2 PRO 90 -1.527 25.970 -2.133 657 2HB PRO 90 HB3 PRO 90 -2.945 27.067 -2.058 658 1HG PRO 90 HG2 PRO 90 -2.923 24.067 -2.182 659 2HG PRO 90 HG3 PRO 90 -4.016 25.154 -1.272 660 1HD PRO 90 HD2 PRO 90 -4.710 23.976 -3.657 661 2HD PRO 90 HD3 PRO 90 -5.355 25.537 -3.096 662 H MET 91 H MET 91 -0.262 27.377 -3.964 663 HA MET 91 HA MET 91 0.733 26.533 -6.460 664 1HB MET 91 HB2 MET 91 2.185 27.615 -4.011 665 2HB MET 91 HB3 MET 91 2.925 27.394 -5.604 666 1HG MET 91 HG2 MET 91 1.225 28.901 -6.601 667 2HG MET 91 HG3 MET 91 0.548 29.202 -5.003 668 1HE MET 91 HE1 MET 91 1.660 30.631 -3.130 669 2HE MET 91 HE2 MET 91 3.085 29.565 -3.080 670 3HE MET 91 HE3 MET 91 3.295 31.320 -3.221 671 H THR 92 H THR 92 1.162 24.492 -7.027 672 HA THR 92 HA THR 92 2.092 22.436 -5.235 673 HB THR 92 HB THR 92 2.292 21.271 -7.573 674 HG1 THR 92 HG1 THR 92 2.370 23.212 -8.814 675 1HG2 THR 92 HG21 THR 92 0.419 20.936 -6.111 676 2HG2 THR 92 HG22 THR 92 -0.371 22.419 -6.705 677 3HG2 THR 92 HG23 THR 92 -0.097 21.039 -7.798 678 HA PRO 93 HA PRO 93 6.343 23.986 -5.758 679 1HB PRO 93 HB2 PRO 93 7.707 22.182 -4.210 680 2HB PRO 93 HB3 PRO 93 6.676 23.469 -3.517 681 1HG PRO 93 HG2 PRO 93 5.969 20.574 -4.025 682 2HG PRO 93 HG3 PRO 93 5.714 21.517 -2.535 683 1HD PRO 93 HD2 PRO 93 3.727 21.164 -4.395 684 2HD PRO 93 HD3 PRO 93 3.881 22.688 -3.473 685 HA PRO 94 HA PRO 94 8.052 21.721 -9.112 686 1HB PRO 94 HB2 PRO 94 10.614 21.303 -7.555 687 2HB PRO 94 HB3 PRO 94 10.406 21.837 -9.254 688 1HG PRO 94 HG2 PRO 94 10.894 23.664 -7.322 689 2HG PRO 94 HG3 PRO 94 9.632 23.993 -8.554 690 1HD PRO 94 HD2 PRO 94 9.283 23.023 -5.715 691 2HD PRO 94 HD3 PRO 94 8.342 24.245 -6.620 692 H HIS 95 H HIS 95 8.273 20.018 -6.022 693 HA HIS 95 HA HIS 95 8.889 17.408 -7.038 694 1HB HIS 95 HB2 HIS 95 7.336 18.156 -4.528 695 2HB HIS 95 HB3 HIS 95 8.203 16.654 -4.831 696 HD1 HIS 95 HD1 HIS 95 8.713 19.555 -2.813 697 HD2 HIS 95 HD2 HIS 95 11.062 17.419 -5.581 698 HE1 HIS 95 HE1 HIS 95 11.133 20.155 -2.309 699 H VAL 96 H VAL 96 6.148 19.290 -7.614 700 HA VAL 96 HA VAL 96 4.267 17.006 -7.939 701 HB VAL 96 HB VAL 96 3.615 19.797 -6.890 702 1HG1 VAL 96 HG11 VAL 96 1.686 18.693 -7.863 703 2HG1 VAL 96 HG12 VAL 96 2.029 17.206 -6.951 704 3HG1 VAL 96 HG13 VAL 96 1.528 18.683 -6.111 705 1HG2 VAL 96 HG21 VAL 96 4.978 19.013 -5.176 706 2HG2 VAL 96 HG22 VAL 96 3.322 18.760 -4.635 707 3HG2 VAL 96 HG23 VAL 96 4.300 17.398 -5.213 708 H LYS 97 H LYS 97 2.725 17.445 -9.736 709 HA LYS 97 HA LYS 97 3.250 19.921 -11.274 710 1HB LYS 97 HB2 LYS 97 3.210 18.941 -13.386 711 2HB LYS 97 HB3 LYS 97 4.463 18.145 -12.477 712 1HG LYS 97 HG2 LYS 97 1.748 16.803 -12.638 713 2HG LYS 97 HG3 LYS 97 2.736 16.885 -14.089 714 1HD LYS 97 HD2 LYS 97 4.630 15.817 -12.877 715 2HD LYS 97 HD3 LYS 97 3.575 15.598 -11.471 716 1HE LYS 97 HE2 LYS 97 2.061 14.173 -12.757 717 2HE LYS 97 HE3 LYS 97 2.941 14.534 -14.255 718 1HZ LYS 97 HZ1 LYS 97 4.884 13.407 -13.179 719 2HZ LYS 97 HZ2 LYS 97 3.881 12.928 -11.955 720 3HZ LYS 97 HZ3 LYS 97 3.619 12.422 -13.478 721 H ARG 98 H ARG 98 1.413 20.130 -13.025 722 HA ARG 98 HA ARG 98 -1.172 19.781 -11.603 723 1HB ARG 98 HB2 ARG 98 0.122 22.261 -12.783 724 2HB ARG 98 HB3 ARG 98 -1.624 22.146 -12.640 725 1HG ARG 98 HG2 ARG 98 0.057 21.581 -10.204 726 2HG ARG 98 HG3 ARG 98 -0.151 23.254 -10.723 727 1HD ARG 98 HD2 ARG 98 -2.507 21.389 -10.249 728 2HD ARG 98 HD3 ARG 98 -1.800 22.380 -8.977 729 HE ARG 98 HE ARG 98 -3.120 23.390 -11.472 730 1HH1 ARG 98 HH21 ARG 98 -2.007 24.118 -8.156 731 2HH1 ARG 98 HH22 ARG 98 -2.894 25.592 -8.047 732 1HH2 ARG 98 HH11 ARG 98 -4.088 25.357 -11.410 733 2HH2 ARG 98 HH12 ARG 98 -4.148 26.338 -9.969 734 H GLU 99 H GLU 99 -2.999 19.803 -12.962 735 HA GLU 99 HA GLU 99 -2.771 20.087 -15.826 736 1HB GLU 99 HB2 GLU 99 -2.697 17.459 -14.762 737 2HB GLU 99 HB3 GLU 99 -4.381 17.687 -15.239 738 1HG GLU 99 HG2 GLU 99 -1.949 18.134 -17.033 739 2HG GLU 99 HG3 GLU 99 -2.866 16.633 -16.930 740 H HIS 100 H HIS 100 -5.110 20.275 -16.641 741 HA HIS 100 HA HIS 100 -6.962 21.237 -14.519 742 1HB HIS 100 HB2 HIS 100 -5.962 23.032 -16.772 743 2HB HIS 100 HB3 HIS 100 -7.098 23.452 -15.497 744 HD1 HIS 100 HD1 HIS 100 -3.355 23.217 -16.170 745 HD2 HIS 100 HD2 HIS 100 -6.044 23.993 -13.042 746 HE1 HIS 100 HE1 HIS 100 -1.987 24.235 -14.281 747 H TRP 101 H TRP 101 -8.814 20.237 -15.043 748 HA TRP 101 HA TRP 101 -9.664 20.096 -17.906 749 1HB TRP 101 HB2 TRP 101 -10.517 18.284 -15.640 750 2HB TRP 101 HB3 TRP 101 -10.915 18.144 -17.353 751 HD1 TRP 101 HD1 TRP 101 -7.804 18.681 -18.319 752 HE1 TRP 101 HE1 TRP 101 -6.048 16.891 -18.050 753 HE3 TRP 101 HE3 TRP 101 -10.308 15.619 -15.065 754 HZ2 TRP 101 HZ2 TRP 101 -5.690 14.455 -16.520 755 HZ3 TRP 101 HZ3 TRP 101 -9.228 13.551 -14.228 756 HH2 TRP 101 HH2 TRP 101 -6.906 12.978 -14.924 757 H GLY 102 H GLY 102 -12.278 19.895 -17.870 758 1HA GLY 102 HA1 GLY 102 -13.267 22.296 -16.371 759 2HA GLY 102 HA2 GLY 102 -13.327 22.184 -18.111 760 H PHE 103 H PHE 103 -14.696 20.900 -15.083 761 HA PHE 103 HA PHE 103 -17.034 19.961 -16.655 762 1HB PHE 103 HB2 PHE 103 -15.721 18.636 -14.252 763 2HB PHE 103 HB3 PHE 103 -17.268 18.161 -14.947 764 HD1 PHE 103 HD1 PHE 103 -17.390 17.408 -17.356 765 HD2 PHE 103 HD2 PHE 103 -13.637 17.915 -15.293 766 HE1 PHE 103 HE1 PHE 103 -16.251 16.138 -19.127 767 HE2 PHE 103 HE2 PHE 103 -12.491 16.614 -17.067 768 HZ PHE 103 HZ PHE 103 -13.787 15.718 -18.989 769 H ASP 104 H ASP 104 -18.895 20.774 -16.117 770 HA ASP 104 HA ASP 104 -19.285 22.483 -13.768 771 1HB ASP 104 HB2 ASP 104 -20.416 22.941 -15.944 772 2HB ASP 104 HB3 ASP 104 -21.209 21.360 -15.835 773 H ASP 105 H ASP 105 -20.937 21.896 -12.124 774 HA ASP 105 HA ASP 105 -20.279 19.250 -11.198 775 1HB ASP 105 HB2 ASP 105 -20.544 21.360 -9.789 776 2HB ASP 105 HB3 ASP 105 -22.281 21.089 -9.904 777 HA PRO 106 HA PRO 106 -23.696 17.523 -13.335 778 1HB PRO 106 HB2 PRO 106 -23.577 14.876 -12.502 779 2HB PRO 106 HB3 PRO 106 -22.443 15.608 -13.673 780 1HG PRO 106 HG2 PRO 106 -22.067 15.189 -10.699 781 2HG PRO 106 HG3 PRO 106 -20.910 14.854 -12.028 782 1HD PRO 106 HD2 PRO 106 -20.786 17.132 -10.534 783 2HD PRO 106 HD3 PRO 106 -20.401 17.140 -12.284 784 H ALA 107 H ALA 107 -23.570 17.155 -9.805 785 HA ALA 107 HA ALA 107 -26.057 15.866 -9.502 786 1HB ALA 107 HB1 ALA 107 -24.301 16.021 -7.763 787 2HB ALA 107 HB2 ALA 107 -24.660 17.746 -7.554 788 3HB ALA 107 HB3 ALA 107 -25.894 16.530 -7.164 789 H ARG 108 H ARG 108 -25.433 19.190 -10.279 790 HA ARG 108 HA ARG 108 -28.231 19.881 -9.649 791 1HB ARG 108 HB2 ARG 108 -27.518 22.250 -9.317 792 2HB ARG 108 HB3 ARG 108 -27.240 21.095 -8.047 793 1HG ARG 108 HG2 ARG 108 -25.031 21.829 -9.982 794 2HG ARG 108 HG3 ARG 108 -25.409 22.849 -8.594 795 1HD ARG 108 HD2 ARG 108 -24.691 19.908 -8.393 796 2HD ARG 108 HD3 ARG 108 -23.549 21.245 -8.178 797 HE ARG 108 HE ARG 108 -25.713 21.614 -6.395 798 1HH1 ARG 108 HH21 ARG 108 -22.909 19.431 -6.873 799 2HH1 ARG 108 HH22 ARG 108 -22.710 19.161 -5.158 800 1HH2 ARG 108 HH11 ARG 108 -25.429 21.117 -4.129 801 2HH2 ARG 108 HH12 ARG 108 -24.147 20.048 -3.644 802 H ALA 109 H ALA 109 -26.756 18.842 -12.166 803 HA ALA 109 HA ALA 109 -27.136 20.781 -14.220 804 1HB ALA 109 HB1 ALA 109 -27.340 18.744 -15.650 805 2HB ALA 109 HB2 ALA 109 -25.944 18.613 -14.550 806 3HB ALA 109 HB3 ALA 109 -27.456 17.733 -14.200 807 H GLN 110 H GLN 110 -29.083 21.136 -15.419 808 HA GLN 110 HA GLN 110 -31.617 20.004 -14.343 809 1HB GLN 110 HB2 GLN 110 -30.754 22.925 -14.378 810 2HB GLN 110 HB3 GLN 110 -32.459 22.481 -14.398 811 1HG GLN 110 HG2 GLN 110 -32.408 21.538 -12.244 812 2HG GLN 110 HG3 GLN 110 -30.661 21.362 -12.233 813 1HE2 GLN 110 HE22 GLN 110 -29.333 23.033 -11.580 814 2HE2 GLN 110 HE21 GLN 110 -29.940 24.570 -10.985 815 H GLY 111 H GLY 111 -33.401 20.355 -15.760 816 1HA GLY 111 HA1 GLY 111 -33.788 21.744 -18.014 817 2HA GLY 111 HA2 GLY 111 -32.782 20.408 -18.625 818 H THR 112 H THR 112 -33.454 18.227 -17.377 819 HA THR 112 HA THR 112 -36.256 17.908 -16.804 820 HB THR 112 HB THR 112 -36.823 16.327 -18.383 821 HG1 THR 112 HG1 THR 112 -35.359 15.089 -19.527 822 1HG2 THR 112 HG21 THR 112 -36.375 18.377 -19.726 823 2HG2 THR 112 HG22 THR 112 -34.713 17.772 -20.021 824 3HG2 THR 112 HG23 THR 112 -36.117 16.883 -20.646 825 H GLU 113 H GLU 113 -36.421 15.512 -15.853 826 HA GLU 113 HA GLU 113 -34.235 15.219 -14.036 827 1HB GLU 113 HB2 GLU 113 -36.487 14.566 -13.376 828 2HB GLU 113 HB3 GLU 113 -36.591 13.396 -14.701 829 1HG GLU 113 HG2 GLU 113 -34.850 12.017 -13.707 830 2HG GLU 113 HG3 GLU 113 -34.546 13.222 -12.450 831 H GLU 114 H GLU 114 -35.160 13.544 -17.041 832 HA GLU 114 HA GLU 114 -33.011 11.649 -16.798 833 1HB GLU 114 HB2 GLU 114 -33.548 10.924 -19.049 834 2HB GLU 114 HB3 GLU 114 -34.966 10.977 -18.008 835 1HG GLU 114 HG2 GLU 114 -35.722 13.051 -19.063 836 2HG GLU 114 HG3 GLU 114 -34.260 13.114 -20.062 837 H GLU 115 H GLU 115 -33.296 14.884 -18.208 838 HA GLU 115 HA GLU 115 -30.823 14.809 -19.626 839 1HB GLU 115 HB2 GLU 115 -32.658 16.481 -19.970 840 2HB GLU 115 HB3 GLU 115 -32.221 17.214 -18.423 841 1HG GLU 115 HG2 GLU 115 -31.213 18.508 -20.166 842 2HG GLU 115 HG3 GLU 115 -29.922 17.662 -19.327 843 H LYS 116 H LYS 116 -31.743 15.876 -16.297 844 HA LYS 116 HA LYS 116 -29.183 16.571 -15.349 845 1HB LYS 116 HB2 LYS 116 -31.115 17.166 -14.083 846 2HB LYS 116 HB3 LYS 116 -31.699 15.508 -14.039 847 1HG LYS 116 HG2 LYS 116 -29.877 14.832 -12.573 848 2HG LYS 116 HG3 LYS 116 -29.203 16.469 -12.580 849 1HD LYS 116 HD2 LYS 116 -32.079 16.022 -11.742 850 2HD LYS 116 HD3 LYS 116 -30.771 15.542 -10.640 851 1HE LYS 116 HE2 LYS 116 -29.864 17.886 -10.803 852 2HE LYS 116 HE3 LYS 116 -31.299 18.325 -11.735 853 1HZ LYS 116 HZ1 LYS 116 -31.312 17.309 -8.948 854 2HZ LYS 116 HZ2 LYS 116 -31.593 18.847 -9.401 855 3HZ LYS 116 HZ3 LYS 116 -32.654 17.680 -9.809 856 H TRP 117 H TRP 117 -30.844 13.385 -15.213 857 HA TRP 117 HA TRP 117 -28.654 11.990 -14.053 858 1HB TRP 117 HB2 TRP 117 -30.876 10.988 -14.174 859 2HB TRP 117 HB3 TRP 117 -30.820 10.976 -15.937 860 HD1 TRP 117 HD1 TRP 117 -29.342 9.120 -17.122 861 HE1 TRP 117 HE1 TRP 117 -28.267 6.929 -16.336 862 HE3 TRP 117 HE3 TRP 117 -29.586 9.864 -12.069 863 HZ2 TRP 117 HZ2 TRP 117 -27.363 5.789 -13.874 864 HZ3 TRP 117 HZ3 TRP 117 -28.448 8.293 -10.530 865 HH2 TRP 117 HH2 TRP 117 -27.329 6.247 -11.417 866 H ALA 118 H ALA 118 -29.487 12.533 -17.528 867 HA ALA 118 HA ALA 118 -27.337 11.050 -18.587 868 1HB ALA 118 HB1 ALA 118 -29.232 11.791 -19.949 869 2HB ALA 118 HB2 ALA 118 -28.748 13.488 -19.747 870 3HB ALA 118 HB3 ALA 118 -27.704 12.361 -20.642 871 H PHE 119 H PHE 119 -27.444 14.458 -17.404 872 HA PHE 119 HA PHE 119 -24.821 15.151 -18.229 873 1HB PHE 119 HB2 PHE 119 -26.785 16.563 -17.183 874 2HB PHE 119 HB3 PHE 119 -26.001 16.171 -15.661 875 HD1 PHE 119 HD1 PHE 119 -25.952 18.246 -18.642 876 HD2 PHE 119 HD2 PHE 119 -23.540 16.859 -15.352 877 HE1 PHE 119 HE1 PHE 119 -24.400 20.152 -18.971 878 HE2 PHE 119 HE2 PHE 119 -22.041 18.824 -15.612 879 HZ PHE 119 HZ PHE 119 -22.449 20.447 -17.468 880 H PHE 120 H PHE 120 -25.957 13.351 -15.306 881 HA PHE 120 HA PHE 120 -23.414 13.124 -14.034 882 1HB PHE 120 HB2 PHE 120 -25.384 10.839 -14.131 883 2HB PHE 120 HB3 PHE 120 -24.171 11.187 -12.941 884 HD1 PHE 120 HD1 PHE 120 -25.664 14.365 -13.148 885 HD2 PHE 120 HD2 PHE 120 -26.560 10.303 -11.975 886 HE1 PHE 120 HE1 PHE 120 -27.409 15.178 -11.630 887 HE2 PHE 120 HE2 PHE 120 -28.328 11.147 -10.460 888 HZ PHE 120 HZ PHE 120 -28.761 13.589 -10.284 889 H GLN 121 H GLN 121 -25.051 11.145 -16.574 890 HA GLN 121 HA GLN 121 -22.982 9.255 -16.879 891 1HB GLN 121 HB2 GLN 121 -24.926 10.059 -19.054 892 2HB GLN 121 HB3 GLN 121 -24.000 8.574 -18.934 893 1HG GLN 121 HG2 GLN 121 -26.300 9.437 -17.145 894 2HG GLN 121 HG3 GLN 121 -26.281 8.121 -18.297 895 1HE2 GLN 121 HE22 GLN 121 -25.770 8.936 -14.993 896 2HE2 GLN 121 HE21 GLN 121 -25.023 7.433 -14.502 897 H ARG 122 H ARG 122 -23.492 12.306 -18.700 898 HA ARG 122 HA ARG 122 -21.250 11.982 -20.439 899 1HB ARG 122 HB2 ARG 122 -22.550 14.545 -19.394 900 2HB ARG 122 HB3 ARG 122 -21.138 14.549 -20.424 901 1HG ARG 122 HG2 ARG 122 -22.800 14.917 -21.928 902 2HG ARG 122 HG3 ARG 122 -22.460 13.192 -22.137 903 1HD ARG 122 HD2 ARG 122 -24.476 12.576 -21.008 904 2HD ARG 122 HD3 ARG 122 -24.599 14.166 -20.245 905 HE ARG 122 HE ARG 122 -25.039 13.789 -23.167 906 1HH1 ARG 122 HH21 ARG 122 -26.175 15.149 -20.039 907 2HH1 ARG 122 HH22 ARG 122 -27.682 15.702 -20.747 908 1HH2 ARG 122 HH11 ARG 122 -27.087 14.683 -23.975 909 2HH2 ARG 122 HH12 ARG 122 -28.138 15.486 -22.825 910 H VAL 123 H VAL 123 -21.459 13.655 -17.223 911 HA VAL 123 HA VAL 123 -18.702 14.380 -17.365 912 HB VAL 123 HB VAL 123 -20.620 14.256 -14.996 913 1HG1 VAL 123 HG11 VAL 123 -17.831 15.494 -15.163 914 2HG1 VAL 123 HG12 VAL 123 -18.998 15.783 -13.853 915 3HG1 VAL 123 HG13 VAL 123 -18.335 14.164 -14.097 916 1HG2 VAL 123 HG21 VAL 123 -19.573 16.586 -16.692 917 2HG2 VAL 123 HG22 VAL 123 -21.214 15.925 -16.760 918 3HG2 VAL 123 HG23 VAL 123 -20.653 16.736 -15.295 919 H ARG 124 H ARG 124 -20.258 11.441 -15.779 920 HA ARG 124 HA ARG 124 -17.717 10.597 -14.822 921 1HB ARG 124 HB2 ARG 124 -18.616 8.353 -14.563 922 2HB ARG 124 HB3 ARG 124 -19.795 9.524 -13.991 923 1HG ARG 124 HG2 ARG 124 -21.123 9.218 -15.989 924 2HG ARG 124 HG3 ARG 124 -19.908 8.173 -16.719 925 1HD ARG 124 HD2 ARG 124 -20.243 6.562 -14.806 926 2HD ARG 124 HD3 ARG 124 -21.598 7.557 -14.288 927 HE ARG 124 HE ARG 124 -22.899 6.649 -15.922 928 1HH1 ARG 124 HH21 ARG 124 -19.549 5.972 -16.966 929 2HH1 ARG 124 HH22 ARG 124 -20.058 5.039 -18.324 930 1HH2 ARG 124 HH11 ARG 124 -23.512 5.514 -17.684 931 2HH2 ARG 124 HH12 ARG 124 -22.368 4.728 -18.734 932 H ASP 125 H ASP 125 -19.295 10.016 -17.975 933 HA ASP 125 HA ASP 125 -17.400 8.143 -18.914 934 1HB ASP 125 HB2 ASP 125 -19.531 8.487 -20.045 935 2HB ASP 125 HB3 ASP 125 -19.087 10.146 -20.463 936 H GLU 126 H GLU 126 -17.485 11.743 -19.224 937 HA GLU 126 HA GLU 126 -14.995 11.771 -20.631 938 1HB GLU 126 HB2 GLU 126 -16.661 13.941 -19.397 939 2HB GLU 126 HB3 GLU 126 -15.139 14.256 -20.247 940 1HG GLU 126 HG2 GLU 126 -17.556 12.873 -21.476 941 2HG GLU 126 HG3 GLU 126 -17.157 14.575 -21.657 942 H ILE 127 H ILE 127 -15.757 12.079 -17.116 943 HA ILE 127 HA ILE 127 -13.101 12.883 -16.435 944 HB ILE 127 HB ILE 127 -15.458 12.469 -15.005 945 1HG1 ILE 127 HG12 ILE 127 -14.162 13.048 -12.964 946 2HG1 ILE 127 HG13 ILE 127 -12.673 12.948 -13.920 947 1HG2 ILE 127 HG21 ILE 127 -13.566 10.406 -13.932 948 2HG2 ILE 127 HG22 ILE 127 -15.076 10.987 -13.185 949 3HG2 ILE 127 HG23 ILE 127 -15.141 10.138 -14.727 950 1HD1 ILE 127 HD11 ILE 127 -15.080 14.709 -14.615 951 2HD1 ILE 127 HD12 ILE 127 -13.688 15.278 -13.670 952 3HD1 ILE 127 HD13 ILE 127 -13.462 14.765 -15.356 953 H GLY 128 H GLY 128 -14.617 9.657 -16.848 954 1HA GLY 128 HA1 GLY 128 -12.341 8.081 -16.292 955 2HA GLY 128 HA2 GLY 128 -13.710 7.631 -17.336 956 H ASN 129 H ASN 129 -13.519 9.529 -19.365 957 HA ASN 129 HA ASN 129 -11.542 8.507 -21.072 958 1HB ASN 129 HB2 ASN 129 -13.719 9.652 -21.661 959 2HB ASN 129 HB3 ASN 129 -12.939 11.188 -21.276 960 1HD2 ASN 129 HD22 ASN 129 -13.624 11.721 -23.423 961 2HD2 ASN 129 HD21 ASN 129 -12.724 11.141 -24.831 962 H ARG 130 H ARG 130 -11.490 11.540 -19.138 963 HA ARG 130 HA ARG 130 -8.940 12.428 -20.130 964 1HB ARG 130 HB2 ARG 130 -10.151 12.919 -17.370 965 2HB ARG 130 HB3 ARG 130 -8.758 13.748 -18.036 966 1HG ARG 130 HG2 ARG 130 -11.610 14.015 -19.011 967 2HG ARG 130 HG3 ARG 130 -10.729 15.138 -18.022 968 1HD ARG 130 HD2 ARG 130 -10.831 16.000 -20.239 969 2HD ARG 130 HD3 ARG 130 -9.151 15.584 -19.870 970 HE ARG 130 HE ARG 130 -9.165 14.131 -21.654 971 1HH1 ARG 130 HH21 ARG 130 -12.572 14.606 -20.742 972 2HH1 ARG 130 HH22 ARG 130 -13.195 13.727 -22.097 973 1HH2 ARG 130 HH11 ARG 130 -9.900 13.022 -23.317 974 2HH2 ARG 130 HH12 ARG 130 -11.614 12.764 -23.630 975 H LEU 131 H LEU 131 -9.857 10.304 -17.415 976 HA LEU 131 HA LEU 131 -7.146 10.077 -16.478 977 1HB LEU 131 HB2 LEU 131 -9.687 8.512 -15.906 978 2HB LEU 131 HB3 LEU 131 -8.167 8.175 -15.065 979 HG LEU 131 HG LEU 131 -9.271 11.022 -15.173 980 1HD1 LEU 131 HD11 LEU 131 -10.341 10.641 -13.012 981 2HD1 LEU 131 HD12 LEU 131 -11.074 9.691 -14.313 982 3HD1 LEU 131 HD13 LEU 131 -9.990 8.901 -13.143 983 1HD2 LEU 131 HD21 LEU 131 -7.444 9.598 -13.198 984 2HD2 LEU 131 HD22 LEU 131 -6.911 10.700 -14.469 985 3HD2 LEU 131 HD23 LEU 131 -7.934 11.314 -13.181 986 H LYS 132 H LYS 132 -9.126 8.111 -18.689 987 HA LYS 132 HA LYS 132 -7.211 6.084 -19.183 988 1HB LYS 132 HB2 LYS 132 -9.250 5.574 -20.017 989 2HB LYS 132 HB3 LYS 132 -9.632 7.187 -20.536 990 1HG LYS 132 HG2 LYS 132 -7.553 5.564 -22.046 991 2HG LYS 132 HG3 LYS 132 -9.281 5.269 -22.253 992 1HD LYS 132 HD2 LYS 132 -9.317 7.955 -22.567 993 2HD LYS 132 HD3 LYS 132 -7.669 7.641 -23.131 994 1HE LYS 132 HE2 LYS 132 -8.488 6.151 -24.859 995 2HE LYS 132 HE3 LYS 132 -10.106 6.129 -24.143 996 1HZ LYS 132 HZ1 LYS 132 -8.841 8.484 -25.409 997 2HZ LYS 132 HZ2 LYS 132 -10.081 7.609 -26.007 998 3HZ LYS 132 HZ3 LYS 132 -10.299 8.501 -24.647 999 H GLU 133 H GLU 133 -7.597 9.288 -20.785 1000 HA GLU 133 HA GLU 133 -5.268 8.961 -22.429 1001 1HB GLU 133 HB2 GLU 133 -6.542 11.474 -21.271 1002 2HB GLU 133 HB3 GLU 133 -5.174 11.478 -22.392 1003 1HG GLU 133 HG2 GLU 133 -6.518 10.320 -24.095 1004 2HG GLU 133 HG3 GLU 133 -7.918 10.313 -23.019 1005 H PHE 134 H PHE 134 -5.568 10.493 -19.153 1006 HA PHE 134 HA PHE 134 -2.854 11.152 -18.955 1007 1HB PHE 134 HB2 PHE 134 -4.471 12.024 -17.433 1008 2HB PHE 134 HB3 PHE 134 -4.932 10.415 -16.879 1009 HD1 PHE 134 HD1 PHE 134 -3.937 9.489 -14.966 1010 HD2 PHE 134 HD2 PHE 134 -2.011 12.776 -16.978 1011 HE1 PHE 134 HE1 PHE 134 -2.221 9.576 -13.165 1012 HE2 PHE 134 HE2 PHE 134 -0.323 12.893 -15.170 1013 HZ PHE 134 HZ PHE 134 -0.444 11.334 -13.249 1014 H ALA 135 H ALA 135 -4.448 8.057 -18.265 1015 HA ALA 135 HA ALA 135 -2.124 6.797 -17.156 1016 1HB ALA 135 HB1 ALA 135 -4.415 6.044 -16.659 1017 2HB ALA 135 HB2 ALA 135 -4.639 5.569 -18.358 1018 3HB ALA 135 HB3 ALA 135 -3.445 4.727 -17.349 1019 H GLU 136 H GLU 136 -3.532 6.924 -20.423 1020 HA GLU 136 HA GLU 136 -1.780 4.890 -21.499 1021 1HB GLU 136 HB2 GLU 136 -3.830 6.770 -22.709 1022 2HB GLU 136 HB3 GLU 136 -2.848 5.706 -23.704 1023 1HG GLU 136 HG2 GLU 136 -4.622 4.679 -21.446 1024 2HG GLU 136 HG3 GLU 136 -5.138 4.820 -23.122 1025 H THR 137 H THR 137 -1.952 8.417 -21.605 1026 HA THR 137 HA THR 137 0.219 8.603 -23.472 1027 HB THR 137 HB THR 137 -0.229 10.975 -23.424 1028 HG1 THR 137 HG1 THR 137 -2.223 10.414 -21.506 1029 1HG2 THR 137 HG21 THR 137 -1.627 9.570 -24.865 1030 2HG2 THR 137 HG22 THR 137 -2.777 9.280 -23.556 1031 3HG2 THR 137 HG23 THR 137 -2.581 10.920 -24.219 1032 H GLY 138 H GLY 138 -0.252 8.764 -19.991 1033 1HA GLY 138 HA1 GLY 138 1.149 9.113 -18.228 1034 2HA GLY 138 HA2 GLY 138 2.538 8.884 -19.309 1035 H LYS 139 H LYS 139 -0.146 11.274 -19.500 1036 HA LYS 139 HA LYS 139 1.387 13.287 -20.577 1037 1HB LYS 139 HB2 LYS 139 -1.157 13.164 -20.382 1038 2HB LYS 139 HB3 LYS 139 -0.980 13.873 -18.767 1039 1HG LYS 139 HG2 LYS 139 0.322 15.776 -19.867 1040 2HG LYS 139 HG3 LYS 139 -0.113 15.082 -21.432 1041 1HD LYS 139 HD2 LYS 139 -2.006 16.158 -19.305 1042 2HD LYS 139 HD3 LYS 139 -1.571 16.945 -20.828 1043 1HE LYS 139 HE2 LYS 139 -2.604 14.985 -22.059 1044 2HE LYS 139 HE3 LYS 139 -3.143 14.353 -20.496 1045 1HZ LYS 139 HZ1 LYS 139 -3.966 16.910 -21.731 1046 2HZ LYS 139 HZ2 LYS 139 -4.914 15.615 -21.439 1047 3HZ LYS 139 HZ3 LYS 139 -4.328 16.513 -20.186 Start of MODEL 18 1 1H MET 1 H1 MET 1 -0.446 -0.058 -0.994 2 2H MET 1 H2 MET 1 0.478 -0.694 -2.187 3 3H MET 1 H3 MET 1 0.408 -1.436 -0.712 4 HA MET 1 HA MET 1 1.453 0.415 0.337 5 1HB MET 1 HB2 MET 1 2.785 -1.498 -0.693 6 2HB MET 1 HB3 MET 1 3.152 -0.432 -2.045 7 1HG MET 1 HG2 MET 1 4.943 -0.518 -0.345 8 2HG MET 1 HG3 MET 1 4.320 1.113 -0.524 9 1HE MET 1 HE1 MET 1 6.194 0.325 1.840 10 2HE MET 1 HE2 MET 1 5.469 1.939 1.653 11 3HE MET 1 HE3 MET 1 5.371 1.095 3.215 12 H GLU 2 H GLU 2 3.386 1.792 -1.962 13 HA GLU 2 HA GLU 2 1.618 3.783 -3.047 14 1HB GLU 2 HB2 GLU 2 2.567 5.669 -1.753 15 2HB GLU 2 HB3 GLU 2 1.644 4.567 -0.741 16 1HG GLU 2 HG2 GLU 2 3.750 3.553 0.107 17 2HG GLU 2 HG3 GLU 2 4.677 4.672 -0.900 18 H ASN 3 H ASN 3 2.973 5.444 -4.196 19 HA ASN 3 HA ASN 3 5.788 5.154 -4.458 20 1HB ASN 3 HB2 ASN 3 5.492 3.211 -5.784 21 2HB ASN 3 HB3 ASN 3 4.079 3.860 -6.586 22 1HD2 ASN 3 HD22 ASN 3 4.344 5.009 -8.498 23 2HD2 ASN 3 HD21 ASN 3 5.920 5.316 -9.226 24 H LYS 4 H LYS 4 2.771 6.277 -5.944 25 HA LYS 4 HA LYS 4 3.886 9.032 -6.041 26 1HB LYS 4 HB2 LYS 4 2.249 7.624 -8.199 27 2HB LYS 4 HB3 LYS 4 2.334 9.378 -8.079 28 1HG LYS 4 HG2 LYS 4 4.757 9.373 -8.357 29 2HG LYS 4 HG3 LYS 4 4.778 7.612 -8.439 30 1HD LYS 4 HD2 LYS 4 3.427 9.482 -10.437 31 2HD LYS 4 HD3 LYS 4 4.947 8.597 -10.663 32 1HE LYS 4 HE2 LYS 4 3.586 6.456 -10.211 33 2HE LYS 4 HE3 LYS 4 2.138 7.451 -10.372 34 1HZ LYS 4 HZ1 LYS 4 2.865 6.272 -12.431 35 2HZ LYS 4 HZ2 LYS 4 2.724 7.904 -12.637 36 3HZ LYS 4 HZ3 LYS 4 4.201 7.204 -12.493 37 H ILE 5 H ILE 5 1.914 10.564 -6.208 38 HA ILE 5 HA ILE 5 -0.499 9.562 -4.825 39 HB ILE 5 HB ILE 5 1.271 11.894 -3.984 40 1HG1 ILE 5 HG12 ILE 5 0.296 9.572 -2.294 41 2HG1 ILE 5 HG13 ILE 5 1.887 9.667 -3.057 42 1HG2 ILE 5 HG21 ILE 5 -1.542 11.242 -3.000 43 2HG2 ILE 5 HG22 ILE 5 -0.489 12.506 -2.315 44 3HG2 ILE 5 HG23 ILE 5 -1.085 12.667 -3.950 45 1HD1 ILE 5 HD11 ILE 5 2.367 11.752 -1.788 46 2HD1 ILE 5 HD12 ILE 5 0.854 11.510 -0.878 47 3HD1 ILE 5 HD13 ILE 5 2.149 10.310 -0.778 48 H ILE 6 H ILE 6 -2.307 10.582 -5.679 49 HA ILE 6 HA ILE 6 -1.875 12.936 -7.408 50 HB ILE 6 HB ILE 6 -2.174 11.268 -9.001 51 1HG1 ILE 6 HG12 ILE 6 -4.891 12.579 -8.525 52 2HG1 ILE 6 HG13 ILE 6 -3.495 13.300 -9.342 53 1HG2 ILE 6 HG21 ILE 6 -3.961 9.565 -9.014 54 2HG2 ILE 6 HG22 ILE 6 -2.925 9.392 -7.614 55 3HG2 ILE 6 HG23 ILE 6 -4.523 10.155 -7.435 56 1HD1 ILE 6 HD11 ILE 6 -5.223 10.987 -10.266 57 2HD1 ILE 6 HD12 ILE 6 -4.993 12.564 -11.034 58 3HD1 ILE 6 HD13 ILE 6 -3.662 11.382 -11.017 59 H TYR 7 H TYR 7 -3.388 14.551 -7.059 60 HA TYR 7 HA TYR 7 -5.409 14.070 -4.934 61 1HB TYR 7 HB2 TYR 7 -3.195 15.034 -4.160 62 2HB TYR 7 HB3 TYR 7 -3.547 16.469 -5.111 63 HD1 TYR 7 HD1 TYR 7 -5.747 14.358 -2.844 64 HD2 TYR 7 HD2 TYR 7 -3.821 18.160 -3.515 65 HE1 TYR 7 HE1 TYR 7 -6.704 15.205 -0.736 66 HE2 TYR 7 HE2 TYR 7 -4.727 18.994 -1.367 67 HH TYR 7 HH TYR 7 -6.804 16.987 0.758 68 H PHE 8 H PHE 8 -7.257 14.170 -6.086 69 HA PHE 8 HA PHE 8 -7.647 16.046 -8.289 70 1HB PHE 8 HB2 PHE 8 -9.552 14.260 -6.725 71 2HB PHE 8 HB3 PHE 8 -10.063 15.297 -8.048 72 HD1 PHE 8 HD1 PHE 8 -8.767 12.035 -7.235 73 HD2 PHE 8 HD2 PHE 8 -8.865 15.059 -10.307 74 HE1 PHE 8 HE1 PHE 8 -8.075 10.355 -8.928 75 HE2 PHE 8 HE2 PHE 8 -8.083 13.399 -11.970 76 HZ PHE 8 HZ PHE 8 -7.701 11.035 -11.285 77 H LEU 9 H LEU 9 -8.951 17.898 -8.285 78 HA LEU 9 HA LEU 9 -9.767 19.075 -5.673 79 1HB LEU 9 HB2 LEU 9 -7.632 19.912 -7.552 80 2HB LEU 9 HB3 LEU 9 -8.866 21.139 -7.423 81 HG LEU 9 HG LEU 9 -7.048 21.603 -5.933 82 1HD1 LEU 9 HD11 LEU 9 -9.384 20.782 -4.180 83 2HD1 LEU 9 HD12 LEU 9 -8.287 22.164 -4.003 84 3HD1 LEU 9 HD13 LEU 9 -9.460 22.157 -5.314 85 1HD2 LEU 9 HD21 LEU 9 -7.672 19.039 -4.421 86 2HD2 LEU 9 HD22 LEU 9 -6.310 19.250 -5.534 87 3HD2 LEU 9 HD23 LEU 9 -6.406 20.226 -4.063 88 H CYS 10 H CYS 10 -11.762 20.169 -5.840 89 HA CYS 10 HA CYS 10 -12.628 21.168 -8.416 90 1HB CYS 10 HB2 CYS 10 -13.378 18.604 -8.050 91 2HB CYS 10 HB3 CYS 10 -14.668 19.373 -7.109 92 HG CYS 10 HG CYS 10 -13.635 19.972 -10.207 93 H THR 11 H THR 11 -14.962 22.305 -8.053 94 HA THR 11 HA THR 11 -14.421 24.110 -5.895 95 HB THR 11 HB THR 11 -16.623 25.149 -6.850 96 HG1 THR 11 HG1 THR 11 -16.983 24.509 -8.975 97 1HG2 THR 11 HG21 THR 11 -14.072 24.878 -8.505 98 2HG2 THR 11 HG22 THR 11 -15.291 26.161 -8.645 99 3HG2 THR 11 HG23 THR 11 -14.320 26.008 -7.172 100 H GLY 12 H GLY 12 -16.090 21.181 -5.716 101 1HA GLY 12 HA1 GLY 12 -16.850 21.753 -3.010 102 2HA GLY 12 HA2 GLY 12 -18.280 21.636 -4.060 103 H ASN 13 H ASN 13 -15.684 19.934 -2.523 104 HA ASN 13 HA ASN 13 -15.603 17.525 -4.015 105 1HB ASN 13 HB2 ASN 13 -13.891 18.274 -2.386 106 2HB ASN 13 HB3 ASN 13 -14.999 17.932 -1.061 107 1HD2 ASN 13 HD22 ASN 13 -12.782 16.639 -0.772 108 2HD2 ASN 13 HD21 ASN 13 -12.747 15.005 -1.420 109 H SER 14 H SER 14 -17.478 16.577 -4.480 110 HA SER 14 HA SER 14 -19.071 15.336 -2.372 111 1HB SER 14 HB2 SER 14 -21.143 16.539 -3.054 112 2HB SER 14 HB3 SER 14 -19.923 17.651 -2.406 113 HG SER 14 HG SER 14 -19.410 18.317 -4.467 114 H CYS 15 H CYS 15 -18.839 16.233 -5.816 115 HA CYS 15 HA CYS 15 -19.568 13.452 -6.545 116 1HB CYS 15 HB2 CYS 15 -20.742 14.541 -8.547 117 2HB CYS 15 HB3 CYS 15 -21.540 14.701 -6.981 118 HG CYS 15 HG CYS 15 -20.740 17.097 -6.406 119 H ARG 16 H ARG 16 -18.403 16.354 -8.347 120 HA ARG 16 HA ARG 16 -17.100 14.895 -10.291 121 1HB ARG 16 HB2 ARG 16 -16.508 17.675 -9.196 122 2HB ARG 16 HB3 ARG 16 -15.663 17.040 -10.610 123 1HG ARG 16 HG2 ARG 16 -17.686 16.784 -11.861 124 2HG ARG 16 HG3 ARG 16 -18.705 17.114 -10.459 125 1HD ARG 16 HD2 ARG 16 -16.752 19.146 -11.593 126 2HD ARG 16 HD3 ARG 16 -18.423 19.007 -12.146 127 HE ARG 16 HE ARG 16 -18.853 19.258 -9.499 128 1HH1 ARG 16 HH21 ARG 16 -16.995 21.283 -11.754 129 2HH1 ARG 16 HH22 ARG 16 -16.771 22.559 -10.583 130 1HH2 ARG 16 HH11 ARG 16 -18.975 21.058 -8.246 131 2HH2 ARG 16 HH12 ARG 16 -17.883 22.424 -8.507 132 H SER 17 H SER 17 -15.411 16.151 -7.322 133 HA SER 17 HA SER 17 -12.941 14.984 -7.949 134 1HB SER 17 HB2 SER 17 -13.671 15.241 -5.079 135 2HB SER 17 HB3 SER 17 -12.278 15.867 -5.976 136 HG SER 17 HG SER 17 -13.437 17.596 -5.409 137 H GLN 18 H GLN 18 -15.731 13.657 -6.154 138 HA GLN 18 HA GLN 18 -14.386 11.300 -5.200 139 1HB GLN 18 HB2 GLN 18 -17.355 11.939 -5.613 140 2HB GLN 18 HB3 GLN 18 -16.736 10.531 -4.763 141 1HG GLN 18 HG2 GLN 18 -16.232 13.409 -3.909 142 2HG GLN 18 HG3 GLN 18 -17.473 12.361 -3.242 143 1HE2 GLN 18 HE22 GLN 18 -14.837 13.607 -2.145 144 2HE2 GLN 18 HE21 GLN 18 -14.140 12.242 -1.263 145 H MET 19 H MET 19 -16.387 12.014 -8.080 146 HA MET 19 HA MET 19 -16.559 9.334 -9.064 147 1HB MET 19 HB2 MET 19 -16.753 12.048 -10.458 148 2HB MET 19 HB3 MET 19 -17.119 10.507 -11.244 149 1HG MET 19 HG2 MET 19 -19.000 10.100 -9.859 150 2HG MET 19 HG3 MET 19 -18.507 11.309 -8.688 151 1HE MET 19 HE1 MET 19 -20.204 10.622 -12.124 152 2HE MET 19 HE2 MET 19 -20.469 12.252 -12.779 153 3HE MET 19 HE3 MET 19 -18.821 11.597 -12.679 154 H ALA 20 H ALA 20 -14.302 12.069 -9.823 155 HA ALA 20 HA ALA 20 -12.673 10.667 -11.645 156 1HB ALA 20 HB1 ALA 20 -10.973 12.338 -11.115 157 2HB ALA 20 HB2 ALA 20 -12.561 13.115 -11.226 158 3HB ALA 20 HB3 ALA 20 -11.833 12.797 -9.633 159 H GLU 21 H GLU 21 -12.438 10.899 -8.062 160 HA GLU 21 HA GLU 21 -10.087 9.382 -7.774 161 1HB GLU 21 HB2 GLU 21 -11.040 10.695 -5.972 162 2HB GLU 21 HB3 GLU 21 -12.475 9.666 -5.899 163 1HG GLU 21 HG2 GLU 21 -11.076 7.746 -5.271 164 2HG GLU 21 HG3 GLU 21 -9.632 8.752 -5.318 165 H GLY 22 H GLY 22 -13.514 8.264 -7.902 166 1HA GLY 22 HA1 GLY 22 -13.008 5.518 -7.533 167 2HA GLY 22 HA2 GLY 22 -14.406 6.218 -8.347 168 H TRP 23 H TRP 23 -13.224 7.374 -10.711 169 HA TRP 23 HA TRP 23 -12.782 4.942 -12.246 170 1HB TRP 23 HB2 TRP 23 -12.387 7.866 -12.986 171 2HB TRP 23 HB3 TRP 23 -12.107 6.543 -14.092 172 HD1 TRP 23 HD1 TRP 23 -14.835 8.559 -12.506 173 HE1 TRP 23 HE1 TRP 23 -17.032 8.224 -13.706 174 HE3 TRP 23 HE3 TRP 23 -13.517 4.623 -15.510 175 HZ2 TRP 23 HZ2 TRP 23 -18.124 6.483 -15.722 176 HZ3 TRP 23 HZ3 TRP 23 -15.168 3.694 -17.113 177 HH2 TRP 23 HH2 TRP 23 -17.485 4.651 -17.222 178 H ALA 24 H ALA 24 -10.590 7.429 -10.868 179 HA ALA 24 HA ALA 24 -8.313 6.631 -12.330 180 1HB ALA 24 HB1 ALA 24 -7.041 7.845 -10.550 181 2HB ALA 24 HB2 ALA 24 -8.437 8.775 -11.118 182 3HB ALA 24 HB3 ALA 24 -8.522 7.917 -9.570 183 H LYS 25 H LYS 25 -9.621 5.380 -9.251 184 HA LYS 25 HA LYS 25 -7.395 3.730 -8.628 185 1HB LYS 25 HB2 LYS 25 -10.372 3.454 -8.048 186 2HB LYS 25 HB3 LYS 25 -9.175 2.332 -7.389 187 1HG LYS 25 HG2 LYS 25 -8.083 4.014 -6.110 188 2HG LYS 25 HG3 LYS 25 -8.880 5.331 -6.977 189 1HD LYS 25 HD2 LYS 25 -11.075 4.620 -6.075 190 2HD LYS 25 HD3 LYS 25 -10.272 3.335 -5.137 191 1HE LYS 25 HE2 LYS 25 -8.968 5.014 -3.895 192 2HE LYS 25 HE3 LYS 25 -9.586 6.296 -4.942 193 1HZ LYS 25 HZ1 LYS 25 -11.119 4.769 -2.936 194 2HZ LYS 25 HZ2 LYS 25 -10.861 6.407 -3.016 195 3HZ LYS 25 HZ3 LYS 25 -11.845 5.703 -4.095 196 H GLN 26 H GLN 26 -9.854 3.308 -11.137 197 HA GLN 26 HA GLN 26 -9.220 0.479 -11.575 198 1HB GLN 26 HB2 GLN 26 -10.500 2.425 -13.508 199 2HB GLN 26 HB3 GLN 26 -10.443 0.676 -13.625 200 1HG GLN 26 HG2 GLN 26 -11.862 0.534 -11.545 201 2HG GLN 26 HG3 GLN 26 -12.027 2.306 -11.597 202 1HE2 GLN 26 HE22 GLN 26 -12.338 2.987 -14.136 203 2HE2 GLN 26 HE21 GLN 26 -13.735 2.216 -14.872 204 H TYR 27 H TYR 27 -8.644 3.530 -13.341 205 HA TYR 27 HA TYR 27 -6.975 2.289 -15.291 206 1HB TYR 27 HB2 TYR 27 -7.327 5.228 -14.591 207 2HB TYR 27 HB3 TYR 27 -6.463 4.642 -16.005 208 HD1 TYR 27 HD1 TYR 27 -7.840 2.772 -17.428 209 HD2 TYR 27 HD2 TYR 27 -9.570 5.888 -14.995 210 HE1 TYR 27 HE1 TYR 27 -9.938 2.611 -18.727 211 HE2 TYR 27 HE2 TYR 27 -11.646 5.771 -16.324 212 HH TYR 27 HH TYR 27 -12.780 4.714 -18.083 213 H LEU 28 H LEU 28 -6.141 3.841 -12.253 214 HA LEU 28 HA LEU 28 -3.233 3.692 -12.806 215 1HB LEU 28 HB2 LEU 28 -4.674 4.748 -10.349 216 2HB LEU 28 HB3 LEU 28 -2.978 4.947 -10.767 217 HG LEU 28 HG LEU 28 -5.352 6.196 -12.212 218 1HD1 LEU 28 HD11 LEU 28 -3.094 7.465 -10.627 219 2HD1 LEU 28 HD12 LEU 28 -4.450 8.301 -11.406 220 3HD1 LEU 28 HD13 LEU 28 -4.752 7.211 -10.044 221 1HD2 LEU 28 HD21 LEU 28 -2.415 6.536 -12.902 222 2HD2 LEU 28 HD22 LEU 28 -3.605 5.651 -13.876 223 3HD2 LEU 28 HD23 LEU 28 -3.791 7.380 -13.633 224 H GLY 29 H GLY 29 -3.002 3.151 -9.703 225 1HA GLY 29 HA1 GLY 29 -3.804 0.593 -9.042 226 2HA GLY 29 HA2 GLY 29 -2.405 0.365 -10.108 227 H ASP 30 H ASP 30 -1.496 -0.572 -8.084 228 HA ASP 30 HA ASP 30 -0.916 0.810 -5.715 229 1HB ASP 30 HB2 ASP 30 -0.724 -1.608 -6.012 230 2HB ASP 30 HB3 ASP 30 0.602 -1.387 -7.159 231 H GLU 31 H GLU 31 0.561 1.180 -8.837 232 HA GLU 31 HA GLU 31 3.026 2.399 -8.161 233 1HB GLU 31 HB2 GLU 31 2.296 1.534 -10.388 234 2HB GLU 31 HB3 GLU 31 1.182 2.878 -10.536 235 1HG GLU 31 HG2 GLU 31 3.233 4.420 -10.372 236 2HG GLU 31 HG3 GLU 31 4.223 2.969 -10.487 237 H TRP 32 H TRP 32 -0.161 3.460 -7.428 238 HA TRP 32 HA TRP 32 0.739 6.217 -6.847 239 1HB TRP 32 HB2 TRP 32 -1.924 5.540 -8.141 240 2HB TRP 32 HB3 TRP 32 -1.304 7.133 -7.780 241 HD1 TRP 32 HD1 TRP 32 -0.459 4.189 -10.117 242 HE1 TRP 32 HE1 TRP 32 0.226 5.101 -12.411 243 HE3 TRP 32 HE3 TRP 32 -0.689 9.204 -9.095 244 HZ2 TRP 32 HZ2 TRP 32 0.181 7.629 -13.741 245 HZ3 TRP 32 HZ3 TRP 32 -0.500 10.842 -10.945 246 HH2 TRP 32 HH2 TRP 32 -0.143 10.061 -13.284 247 H LYS 33 H LYS 33 -0.873 7.311 -5.491 248 HA LYS 33 HA LYS 33 -2.848 5.673 -3.956 249 1HB LYS 33 HB2 LYS 33 -0.917 7.781 -2.931 250 2HB LYS 33 HB3 LYS 33 -2.433 7.354 -2.118 251 1HG LYS 33 HG2 LYS 33 -1.591 4.878 -2.335 252 2HG LYS 33 HG3 LYS 33 0.002 5.612 -2.589 253 1HD LYS 33 HD2 LYS 33 -1.880 6.078 -0.246 254 2HD LYS 33 HD3 LYS 33 -0.487 4.988 -0.213 255 1HE LYS 33 HE2 LYS 33 0.972 7.033 -0.806 256 2HE LYS 33 HE3 LYS 33 -0.462 8.023 -0.536 257 1HZ LYS 33 HZ1 LYS 33 0.748 8.024 1.460 258 2HZ LYS 33 HZ2 LYS 33 -0.481 6.999 1.767 259 3HZ LYS 33 HZ3 LYS 33 1.043 6.425 1.440 260 H VAL 34 H VAL 34 -4.856 6.793 -3.790 261 HA VAL 34 HA VAL 34 -5.033 9.261 -5.464 262 HB VAL 34 HB VAL 34 -7.048 6.987 -5.464 263 1HG1 VAL 34 HG11 VAL 34 -7.692 9.353 -6.257 264 2HG1 VAL 34 HG12 VAL 34 -6.571 9.096 -7.600 265 3HG1 VAL 34 HG13 VAL 34 -7.972 8.024 -7.384 266 1HG2 VAL 34 HG21 VAL 34 -6.186 6.284 -7.683 267 2HG2 VAL 34 HG22 VAL 34 -4.778 7.353 -7.461 268 3HG2 VAL 34 HG23 VAL 34 -5.040 5.959 -6.388 269 H TYR 35 H TYR 35 -5.962 10.894 -4.403 270 HA TYR 35 HA TYR 35 -8.273 10.316 -2.672 271 1HB TYR 35 HB2 TYR 35 -6.742 12.580 -1.628 272 2HB TYR 35 HB3 TYR 35 -7.579 11.308 -0.793 273 HD1 TYR 35 HD1 TYR 35 -6.325 9.051 -0.427 274 HD2 TYR 35 HD2 TYR 35 -4.405 12.681 -1.746 275 HE1 TYR 35 HE1 TYR 35 -4.154 8.228 0.456 276 HE2 TYR 35 HE2 TYR 35 -2.268 11.907 -0.821 277 HH TYR 35 HH TYR 35 -1.177 10.247 0.388 278 H SER 36 H SER 36 -9.478 12.458 -2.259 279 HA SER 36 HA SER 36 -9.090 14.433 -4.416 280 1HB SER 36 HB2 SER 36 -11.499 14.264 -4.929 281 2HB SER 36 HB3 SER 36 -10.618 12.795 -5.341 282 HG SER 36 HG SER 36 -11.443 11.778 -3.558 283 H ALA 37 H ALA 37 -9.725 16.476 -3.889 284 HA ALA 37 HA ALA 37 -11.013 16.991 -1.278 285 1HB ALA 37 HB1 ALA 37 -9.411 18.654 -0.780 286 2HB ALA 37 HB2 ALA 37 -8.587 17.117 -1.015 287 3HB ALA 37 HB3 ALA 37 -8.515 18.361 -2.296 288 H GLY 38 H GLY 38 -11.140 19.716 -1.397 289 1HA GLY 38 HA1 GLY 38 -11.645 20.728 -4.028 290 2HA GLY 38 HA2 GLY 38 -13.152 20.419 -3.155 291 H ILE 39 H ILE 39 -12.766 22.888 -3.866 292 HA ILE 39 HA ILE 39 -11.451 24.734 -2.147 293 HB ILE 39 HB ILE 39 -13.927 24.757 -3.893 294 1HG1 ILE 39 HG12 ILE 39 -12.699 26.493 -5.148 295 2HG1 ILE 39 HG13 ILE 39 -11.384 26.427 -3.981 296 1HG2 ILE 39 HG21 ILE 39 -13.092 27.123 -2.191 297 2HG2 ILE 39 HG22 ILE 39 -14.231 27.177 -3.557 298 3HG2 ILE 39 HG23 ILE 39 -14.640 26.237 -2.130 299 1HD1 ILE 39 HD11 ILE 39 -10.843 25.271 -6.078 300 2HD1 ILE 39 HD12 ILE 39 -10.826 24.130 -4.741 301 3HD1 ILE 39 HD13 ILE 39 -12.204 24.177 -5.871 302 H GLU 40 H GLU 40 -14.510 22.995 -1.905 303 HA GLU 40 HA GLU 40 -14.402 23.069 0.989 304 1HB GLU 40 HB2 GLU 40 -16.709 23.721 1.303 305 2HB GLU 40 HB3 GLU 40 -15.829 25.016 0.504 306 1HG GLU 40 HG2 GLU 40 -16.798 24.320 -1.691 307 2HG GLU 40 HG3 GLU 40 -17.699 23.026 -0.892 308 H ALA 41 H ALA 41 -16.535 21.560 1.581 309 HA ALA 41 HA ALA 41 -16.753 19.326 -0.370 310 1HB ALA 41 HB1 ALA 41 -16.531 17.767 1.577 311 2HB ALA 41 HB2 ALA 41 -15.040 18.675 1.263 312 3HB ALA 41 HB3 ALA 41 -16.106 19.138 2.610 313 H HIS 42 H HIS 42 -18.616 17.945 0.148 314 HA HIS 42 HA HIS 42 -20.696 19.236 1.882 315 1HB HIS 42 HB2 HIS 42 -21.362 17.759 -0.677 316 2HB HIS 42 HB3 HIS 42 -22.437 18.680 0.352 317 HD1 HIS 42 HD1 HIS 42 -20.258 21.316 0.288 318 HD2 HIS 42 HD2 HIS 42 -22.107 19.167 -2.823 319 HE1 HIS 42 HE1 HIS 42 -20.334 22.880 -1.726 320 H GLY 43 H GLY 43 -19.410 16.273 0.375 321 1HA GLY 43 HA1 GLY 43 -19.189 14.301 1.998 322 2HA GLY 43 HA2 GLY 43 -20.934 14.534 2.231 323 H LEU 44 H LEU 44 -20.172 12.141 1.167 324 HA LEU 44 HA LEU 44 -19.885 11.986 -1.655 325 1HB LEU 44 HB2 LEU 44 -20.688 10.110 0.532 326 2HB LEU 44 HB3 LEU 44 -21.205 9.682 -1.085 327 HG LEU 44 HG LEU 44 -19.049 8.705 -0.367 328 1HD1 LEU 44 HD11 LEU 44 -19.047 10.341 -2.921 329 2HD1 LEU 44 HD12 LEU 44 -17.883 9.056 -2.528 330 3HD1 LEU 44 HD13 LEU 44 -19.590 8.660 -2.663 331 1HD2 LEU 44 HD21 LEU 44 -16.988 10.010 -0.465 332 2HD2 LEU 44 HD22 LEU 44 -17.883 11.500 -0.765 333 3HD2 LEU 44 HD23 LEU 44 -18.066 10.652 0.787 334 H ASN 45 H ASN 45 -21.224 12.940 -3.066 335 HA ASN 45 HA ASN 45 -23.972 13.534 -2.494 336 1HB ASN 45 HB2 ASN 45 -22.462 14.776 -4.081 337 2HB ASN 45 HB3 ASN 45 -22.609 13.433 -5.217 338 1HD2 ASN 45 HD22 ASN 45 -23.680 16.429 -4.950 339 2HD2 ASN 45 HD21 ASN 45 -25.348 16.249 -5.433 340 HA PRO 46 HA PRO 46 -25.419 9.335 -3.350 341 1HB PRO 46 HB2 PRO 46 -28.014 10.775 -3.941 342 2HB PRO 46 HB3 PRO 46 -27.745 9.293 -2.970 343 1HG PRO 46 HG2 PRO 46 -28.133 11.686 -1.747 344 2HG PRO 46 HG3 PRO 46 -26.876 10.558 -1.142 345 1HD PRO 46 HD2 PRO 46 -26.519 12.990 -2.911 346 2HD PRO 46 HD3 PRO 46 -25.548 12.455 -1.503 347 H ASN 47 H ASN 47 -26.016 12.095 -5.592 348 HA ASN 47 HA ASN 47 -26.694 10.478 -7.857 349 1HB ASN 47 HB2 ASN 47 -26.813 12.385 -8.995 350 2HB ASN 47 HB3 ASN 47 -26.642 13.219 -7.468 351 1HD2 ASN 47 HD22 ASN 47 -25.354 12.783 -10.646 352 2HD2 ASN 47 HD21 ASN 47 -23.816 13.571 -10.396 353 H ALA 48 H ALA 48 -23.564 11.584 -6.529 354 HA ALA 48 HA ALA 48 -22.031 10.556 -8.740 355 1HB ALA 48 HB1 ALA 48 -21.224 12.336 -7.303 356 2HB ALA 48 HB2 ALA 48 -21.216 11.265 -5.880 357 3HB ALA 48 HB3 ALA 48 -20.111 10.951 -7.227 358 H VAL 49 H VAL 49 -23.046 9.321 -5.557 359 HA VAL 49 HA VAL 49 -21.536 6.903 -5.597 360 HB VAL 49 HB VAL 49 -24.168 7.559 -4.231 361 1HG1 VAL 49 HG11 VAL 49 -22.358 5.116 -4.055 362 2HG1 VAL 49 HG12 VAL 49 -23.611 5.519 -2.848 363 3HG1 VAL 49 HG13 VAL 49 -24.074 5.143 -4.513 364 1HG2 VAL 49 HG21 VAL 49 -22.124 8.831 -3.467 365 2HG2 VAL 49 HG22 VAL 49 -22.782 7.746 -2.232 366 3HG2 VAL 49 HG23 VAL 49 -21.338 7.271 -3.147 367 H LYS 50 H LYS 50 -24.964 7.571 -6.730 368 HA LYS 50 HA LYS 50 -25.172 4.914 -7.745 369 1HB LYS 50 HB2 LYS 50 -27.107 6.438 -7.218 370 2HB LYS 50 HB3 LYS 50 -26.763 7.317 -8.720 371 1HG LYS 50 HG2 LYS 50 -27.065 5.200 -10.006 372 2HG LYS 50 HG3 LYS 50 -27.363 4.319 -8.504 373 1HD LYS 50 HD2 LYS 50 -29.405 5.597 -8.102 374 2HD LYS 50 HD3 LYS 50 -29.055 6.654 -9.467 375 1HE LYS 50 HE2 LYS 50 -30.794 5.085 -10.062 376 2HE LYS 50 HE3 LYS 50 -29.366 4.823 -11.062 377 1HZ LYS 50 HZ1 LYS 50 -30.508 2.804 -10.135 378 2HZ LYS 50 HZ2 LYS 50 -28.903 2.820 -9.934 379 3HZ LYS 50 HZ3 LYS 50 -29.913 3.173 -8.666 380 H ALA 51 H ALA 51 -24.214 7.999 -9.353 381 HA ALA 51 HA ALA 51 -24.057 7.104 -11.960 382 1HB ALA 51 HB1 ALA 51 -23.701 9.461 -11.314 383 2HB ALA 51 HB2 ALA 51 -22.178 9.026 -10.501 384 3HB ALA 51 HB3 ALA 51 -22.318 8.885 -12.267 385 H MET 52 H MET 52 -21.479 6.807 -9.452 386 HA MET 52 HA MET 52 -19.709 5.365 -11.231 387 1HB MET 52 HB2 MET 52 -19.812 5.883 -8.234 388 2HB MET 52 HB3 MET 52 -18.453 5.126 -9.061 389 1HG MET 52 HG2 MET 52 -19.513 7.941 -9.531 390 2HG MET 52 HG3 MET 52 -18.032 7.515 -8.691 391 1HE MET 52 HE1 MET 52 -16.749 5.319 -10.296 392 2HE MET 52 HE2 MET 52 -15.721 6.150 -11.455 393 3HE MET 52 HE3 MET 52 -15.842 6.757 -9.789 394 H LYS 53 H LYS 53 -22.033 4.442 -8.621 395 HA LYS 53 HA LYS 53 -21.152 1.759 -8.452 396 1HB LYS 53 HB2 LYS 53 -22.433 3.040 -6.769 397 2HB LYS 53 HB3 LYS 53 -23.878 2.935 -7.787 398 1HG LYS 53 HG2 LYS 53 -23.905 0.497 -7.527 399 2HG LYS 53 HG3 LYS 53 -22.372 0.535 -6.636 400 1HD LYS 53 HD2 LYS 53 -24.907 1.975 -5.745 401 2HD LYS 53 HD3 LYS 53 -24.453 0.345 -5.198 402 1HE LYS 53 HE2 LYS 53 -22.319 1.267 -4.271 403 2HE LYS 53 HE3 LYS 53 -22.806 2.885 -4.772 404 1HZ LYS 53 HZ1 LYS 53 -24.141 1.220 -2.732 405 2HZ LYS 53 HZ2 LYS 53 -23.305 2.610 -2.499 406 3HZ LYS 53 HZ3 LYS 53 -24.746 2.643 -3.271 407 H GLU 54 H GLU 54 -23.498 3.323 -10.612 408 HA GLU 54 HA GLU 54 -24.450 0.931 -11.828 409 1HB GLU 54 HB2 GLU 54 -24.332 3.825 -12.746 410 2HB GLU 54 HB3 GLU 54 -25.072 2.572 -13.731 411 1HG GLU 54 HG2 GLU 54 -25.899 3.299 -10.900 412 2HG GLU 54 HG3 GLU 54 -26.698 3.850 -12.370 413 H VAL 55 H VAL 55 -21.331 2.531 -12.145 414 HA VAL 55 HA VAL 55 -20.660 1.154 -14.668 415 HB VAL 55 HB VAL 55 -18.757 2.478 -12.686 416 1HG1 VAL 55 HG11 VAL 55 -17.619 1.092 -14.359 417 2HG1 VAL 55 HG12 VAL 55 -18.490 1.924 -15.668 418 3HG1 VAL 55 HG13 VAL 55 -17.313 2.799 -14.663 419 1HG2 VAL 55 HG21 VAL 55 -20.405 4.177 -13.354 420 2HG2 VAL 55 HG22 VAL 55 -18.832 4.509 -14.056 421 3HG2 VAL 55 HG23 VAL 55 -20.112 3.801 -15.070 422 H GLY 56 H GLY 56 -20.698 0.571 -11.215 423 1HA GLY 56 HA1 GLY 56 -20.371 -1.618 -10.285 424 2HA GLY 56 HA2 GLY 56 -19.098 -1.937 -11.473 425 H ILE 57 H ILE 57 -19.148 1.303 -10.089 426 HA ILE 57 HA ILE 57 -16.720 0.640 -8.493 427 HB ILE 57 HB ILE 57 -17.439 3.216 -9.923 428 1HG1 ILE 57 HG12 ILE 57 -15.370 1.128 -10.740 429 2HG1 ILE 57 HG13 ILE 57 -16.911 1.409 -11.550 430 1HG2 ILE 57 HG21 ILE 57 -14.836 2.329 -8.566 431 2HG2 ILE 57 HG22 ILE 57 -15.134 3.905 -9.316 432 3HG2 ILE 57 HG23 ILE 57 -16.006 3.456 -7.858 433 1HD1 ILE 57 HD11 ILE 57 -16.184 3.812 -11.935 434 2HD1 ILE 57 HD12 ILE 57 -14.541 3.290 -11.449 435 3HD1 ILE 57 HD13 ILE 57 -15.352 2.567 -12.851 436 H ASP 58 H ASP 58 -17.635 0.330 -6.532 437 HA ASP 58 HA ASP 58 -19.831 2.003 -5.543 438 1HB ASP 58 HB2 ASP 58 -19.855 -0.309 -4.907 439 2HB ASP 58 HB3 ASP 58 -18.215 -0.212 -4.246 440 H ILE 59 H ILE 59 -18.929 4.118 -5.585 441 HA ILE 59 HA ILE 59 -16.536 4.662 -4.034 442 HB ILE 59 HB ILE 59 -16.831 6.964 -4.632 443 1HG1 ILE 59 HG12 ILE 59 -19.398 6.351 -6.124 444 2HG1 ILE 59 HG13 ILE 59 -19.416 6.899 -4.457 445 1HG2 ILE 59 HG21 ILE 59 -16.572 6.822 -7.027 446 2HG2 ILE 59 HG22 ILE 59 -15.813 5.419 -6.266 447 3HG2 ILE 59 HG23 ILE 59 -17.390 5.246 -7.066 448 1HD1 ILE 59 HD11 ILE 59 -18.217 8.473 -6.762 449 2HD1 ILE 59 HD12 ILE 59 -19.709 8.818 -5.859 450 3HD1 ILE 59 HD13 ILE 59 -18.150 8.916 -5.051 451 H SER 60 H SER 60 -19.603 3.894 -2.903 452 HA SER 60 HA SER 60 -20.221 6.097 -1.286 453 1HB SER 60 HB2 SER 60 -20.720 3.277 -0.277 454 2HB SER 60 HB3 SER 60 -21.766 4.697 -0.179 455 HG SER 60 HG SER 60 -21.199 2.969 -2.356 456 H ASN 61 H ASN 61 -17.837 3.564 -0.869 457 HA ASN 61 HA ASN 61 -17.312 3.776 1.921 458 1HB ASN 61 HB2 ASN 61 -16.722 1.821 0.518 459 2HB ASN 61 HB3 ASN 61 -15.597 2.815 -0.416 460 1HD2 ASN 61 HD22 ASN 61 -16.251 1.712 2.968 461 2HD2 ASN 61 HD21 ASN 61 -14.573 1.659 3.435 462 H GLN 62 H GLN 62 -16.452 5.908 -0.719 463 HA GLN 62 HA GLN 62 -13.956 6.855 0.353 464 1HB GLN 62 HB2 GLN 62 -15.810 8.110 -1.705 465 2HB GLN 62 HB3 GLN 62 -14.126 8.564 -1.377 466 1HG GLN 62 HG2 GLN 62 -13.423 6.255 -2.034 467 2HG GLN 62 HG3 GLN 62 -15.085 5.911 -2.512 468 1HE2 GLN 62 HE22 GLN 62 -14.906 9.070 -3.522 469 2HE2 GLN 62 HE21 GLN 62 -14.376 8.733 -5.167 470 H THR 63 H THR 63 -13.904 9.421 0.661 471 HA THR 63 HA THR 63 -16.196 10.459 2.125 472 HB THR 63 HB THR 63 -14.424 11.312 3.873 473 HG1 THR 63 HG1 THR 63 -12.589 10.390 2.915 474 1HG2 THR 63 HG21 THR 63 -16.331 9.826 4.408 475 2HG2 THR 63 HG22 THR 63 -15.344 8.409 3.979 476 3HG2 THR 63 HG23 THR 63 -14.884 9.439 5.352 477 H SER 64 H SER 64 -16.248 12.770 2.125 478 HA SER 64 HA SER 64 -14.421 14.055 0.199 479 1HB SER 64 HB2 SER 64 -16.865 15.141 1.652 480 2HB SER 64 HB3 SER 64 -15.915 15.961 0.400 481 HG SER 64 HG SER 64 -17.464 15.100 -0.750 482 H ASP 65 H ASP 65 -13.285 15.920 0.783 483 HA ASP 65 HA ASP 65 -13.173 16.926 3.494 484 1HB ASP 65 HB2 ASP 65 -11.422 15.037 3.411 485 2HB ASP 65 HB3 ASP 65 -10.592 15.990 2.171 486 H ILE 66 H ILE 66 -11.891 19.020 3.435 487 HA ILE 66 HA ILE 66 -12.040 20.278 0.762 488 HB ILE 66 HB ILE 66 -12.052 22.340 1.846 489 1HG1 ILE 66 HG12 ILE 66 -11.281 20.938 4.429 490 2HG1 ILE 66 HG13 ILE 66 -10.299 22.086 3.493 491 1HG2 ILE 66 HG21 ILE 66 -13.711 20.639 3.754 492 2HG2 ILE 66 HG22 ILE 66 -14.088 22.241 3.095 493 3HG2 ILE 66 HG23 ILE 66 -14.110 20.810 2.047 494 1HD1 ILE 66 HD11 ILE 66 -12.098 23.821 3.919 495 2HD1 ILE 66 HD12 ILE 66 -12.822 22.665 5.065 496 3HD1 ILE 66 HD13 ILE 66 -11.188 23.283 5.357 497 H ILE 67 H ILE 67 -10.119 21.644 0.187 498 HA ILE 67 HA ILE 67 -7.938 19.947 -0.075 499 HB ILE 67 HB ILE 67 -8.565 21.570 -1.681 500 1HG1 ILE 67 HG12 ILE 67 -6.200 20.696 -1.481 501 2HG1 ILE 67 HG13 ILE 67 -6.516 22.039 -2.555 502 1HG2 ILE 67 HG21 ILE 67 -8.060 23.966 -1.520 503 2HG2 ILE 67 HG22 ILE 67 -9.314 23.468 -0.383 504 3HG2 ILE 67 HG23 ILE 67 -7.659 23.779 0.197 505 1HD1 ILE 67 HD11 ILE 67 -4.391 22.243 -1.248 506 2HD1 ILE 67 HD12 ILE 67 -5.481 23.636 -1.126 507 3HD1 ILE 67 HD13 ILE 67 -5.349 22.489 0.215 508 H ASP 68 H ASP 68 -6.151 19.509 0.903 509 HA ASP 68 HA ASP 68 -5.275 21.111 3.258 510 1HB ASP 68 HB2 ASP 68 -6.023 18.905 3.943 511 2HB ASP 68 HB3 ASP 68 -5.006 18.137 2.718 512 H SER 69 H SER 69 -3.667 22.377 2.524 513 HA SER 69 HA SER 69 -2.254 22.039 0.183 514 1HB SER 69 HB2 SER 69 -1.184 23.575 2.556 515 2HB SER 69 HB3 SER 69 -1.073 23.975 0.828 516 HG SER 69 HG SER 69 -2.657 25.206 2.005 517 H ASP 70 H ASP 70 -1.648 20.403 3.250 518 HA ASP 70 HA ASP 70 1.157 19.933 2.794 519 1HB ASP 70 HB2 ASP 70 0.197 19.707 5.031 520 2HB ASP 70 HB3 ASP 70 -0.856 18.401 4.469 521 H ILE 71 H ILE 71 -1.833 18.110 2.039 522 HA ILE 71 HA ILE 71 -0.361 15.872 0.884 523 HB ILE 71 HB ILE 71 -3.303 16.656 0.706 524 1HG1 ILE 71 HG12 ILE 71 -1.793 14.431 2.160 525 2HG1 ILE 71 HG13 ILE 71 -2.429 15.893 2.926 526 1HG2 ILE 71 HG21 ILE 71 -3.624 14.384 -0.301 527 2HG2 ILE 71 HG22 ILE 71 -2.674 15.414 -1.344 528 3HG2 ILE 71 HG23 ILE 71 -1.850 14.186 -0.362 529 1HD1 ILE 71 HD11 ILE 71 -4.749 15.175 2.219 530 2HD1 ILE 71 HD12 ILE 71 -4.037 13.612 1.730 531 3HD1 ILE 71 HD13 ILE 71 -3.953 14.132 3.418 532 H LEU 72 H LEU 72 -1.975 18.817 -0.352 533 HA LEU 72 HA LEU 72 -1.580 18.481 -3.094 534 1HB LEU 72 HB2 LEU 72 -2.780 20.345 -1.937 535 2HB LEU 72 HB3 LEU 72 -1.219 20.965 -1.394 536 HG LEU 72 HG LEU 72 -0.605 21.154 -3.901 537 1HD1 LEU 72 HD11 LEU 72 -2.536 21.498 -5.392 538 2HD1 LEU 72 HD12 LEU 72 -2.561 19.845 -4.752 539 3HD1 LEU 72 HD13 LEU 72 -3.662 21.064 -4.090 540 1HD2 LEU 72 HD21 LEU 72 -2.754 22.911 -2.666 541 2HD2 LEU 72 HD22 LEU 72 -1.004 23.068 -2.408 542 3HD2 LEU 72 HD23 LEU 72 -1.687 23.372 -4.013 543 H ASN 73 H ASN 73 0.773 19.835 -0.695 544 HA ASN 73 HA ASN 73 2.859 20.149 -2.611 545 1HB ASN 73 HB2 ASN 73 2.715 20.219 0.409 546 2HB ASN 73 HB3 ASN 73 4.285 20.152 -0.372 547 1HD2 ASN 73 HD22 ASN 73 1.408 22.161 0.046 548 2HD2 ASN 73 HD21 ASN 73 2.103 23.602 -0.673 549 H ASN 74 H ASN 74 1.696 17.204 -1.243 550 HA ASN 74 HA ASN 74 4.353 15.855 -1.482 551 1HB ASN 74 HB2 ASN 74 1.712 15.097 -0.174 552 2HB ASN 74 HB3 ASN 74 2.864 13.868 -0.654 553 1HD2 ASN 74 HD22 ASN 74 2.296 16.486 1.628 554 2HD2 ASN 74 HD21 ASN 74 3.632 16.074 2.678 555 H ALA 75 H ALA 75 1.331 16.419 -3.162 556 HA ALA 75 HA ALA 75 1.099 13.882 -4.347 557 1HB ALA 75 HB1 ALA 75 -0.608 14.902 -5.730 558 2HB ALA 75 HB2 ALA 75 -0.749 15.484 -4.061 559 3HB ALA 75 HB3 ALA 75 -0.023 16.531 -5.308 560 H ASP 76 H ASP 76 1.791 13.075 -6.424 561 HA ASP 76 HA ASP 76 4.082 14.393 -7.707 562 1HB ASP 76 HB2 ASP 76 3.769 11.913 -7.816 563 2HB ASP 76 HB3 ASP 76 2.266 12.158 -8.722 564 H LEU 77 H LEU 77 0.589 14.215 -8.050 565 HA LEU 77 HA LEU 77 0.563 16.213 -10.218 566 1HB LEU 77 HB2 LEU 77 0.601 14.118 -11.353 567 2HB LEU 77 HB3 LEU 77 -0.555 13.400 -10.224 568 HG LEU 77 HG LEU 77 -2.321 14.898 -11.084 569 1HD1 LEU 77 HD11 LEU 77 -0.442 15.563 -13.379 570 2HD1 LEU 77 HD12 LEU 77 -2.097 16.122 -13.141 571 3HD1 LEU 77 HD13 LEU 77 -0.830 16.704 -12.069 572 1HD2 LEU 77 HD21 LEU 77 -2.010 12.582 -11.923 573 2HD2 LEU 77 HD22 LEU 77 -2.704 13.646 -13.154 574 3HD2 LEU 77 HD23 LEU 77 -0.987 13.191 -13.230 575 H VAL 78 H VAL 78 -1.161 17.467 -10.188 576 HA VAL 78 HA VAL 78 -3.360 16.989 -8.237 577 HB VAL 78 HB VAL 78 -2.086 19.650 -9.017 578 1HG1 VAL 78 HG11 VAL 78 -4.511 19.813 -8.459 579 2HG1 VAL 78 HG12 VAL 78 -4.195 19.017 -6.901 580 3HG1 VAL 78 HG13 VAL 78 -3.504 20.618 -7.264 581 1HG2 VAL 78 HG21 VAL 78 -1.192 19.794 -6.759 582 2HG2 VAL 78 HG22 VAL 78 -1.862 18.179 -6.360 583 3HG2 VAL 78 HG23 VAL 78 -0.564 18.363 -7.551 584 H VAL 79 H VAL 79 -5.424 17.326 -9.190 585 HA VAL 79 HA VAL 79 -5.427 18.215 -12.035 586 HB VAL 79 HB VAL 79 -6.882 15.767 -11.006 587 1HG1 VAL 79 HG11 VAL 79 -8.034 16.991 -12.833 588 2HG1 VAL 79 HG12 VAL 79 -6.550 16.928 -13.806 589 3HG1 VAL 79 HG13 VAL 79 -7.427 15.428 -13.399 590 1HG2 VAL 79 HG21 VAL 79 -4.555 15.164 -11.162 591 2HG2 VAL 79 HG22 VAL 79 -5.393 14.480 -12.552 592 3HG2 VAL 79 HG23 VAL 79 -4.407 15.943 -12.759 593 H THR 80 H THR 80 -6.584 20.043 -11.996 594 HA THR 80 HA THR 80 -8.714 20.356 -9.963 595 HB THR 80 HB THR 80 -8.595 22.729 -10.588 596 HG1 THR 80 HG1 THR 80 -7.889 22.409 -12.730 597 1HG2 THR 80 HG21 THR 80 -5.826 21.547 -10.016 598 2HG2 THR 80 HG22 THR 80 -6.354 23.190 -9.653 599 3HG2 THR 80 HG23 THR 80 -7.084 21.844 -8.799 600 H LEU 81 H LEU 81 -10.494 19.359 -10.637 601 HA LEU 81 HA LEU 81 -10.947 18.662 -13.363 602 1HB LEU 81 HB2 LEU 81 -12.767 18.534 -10.939 603 2HB LEU 81 HB3 LEU 81 -13.105 17.734 -12.469 604 HG LEU 81 HG LEU 81 -10.650 17.149 -10.747 605 1HD1 LEU 81 HD11 LEU 81 -13.244 15.587 -10.979 606 2HD1 LEU 81 HD12 LEU 81 -11.814 15.166 -10.004 607 3HD1 LEU 81 HD13 LEU 81 -12.764 16.602 -9.596 608 1HD2 LEU 81 HD21 LEU 81 -10.289 16.515 -13.087 609 2HD2 LEU 81 HD22 LEU 81 -10.539 15.061 -12.118 610 3HD2 LEU 81 HD23 LEU 81 -11.846 15.682 -13.143 611 H CYS 82 H CYS 82 -11.494 21.756 -12.094 612 HA CYS 82 HA CYS 82 -13.209 22.300 -14.340 613 1HB CYS 82 HB2 CYS 82 -15.013 23.392 -13.157 614 2HB CYS 82 HB3 CYS 82 -14.870 21.715 -12.591 615 HG CYS 82 HG CYS 82 -13.487 22.221 -10.477 616 H GLY 83 H GLY 83 -13.334 24.661 -14.752 617 1HA GLY 83 HA1 GLY 83 -10.725 25.627 -14.818 618 2HA GLY 83 HA2 GLY 83 -12.177 26.561 -15.215 619 H ASP 84 H ASP 84 -13.443 26.690 -12.672 620 HA ASP 84 HA ASP 84 -11.932 28.825 -11.497 621 1HB ASP 84 HB2 ASP 84 -14.395 28.717 -11.449 622 2HB ASP 84 HB3 ASP 84 -14.316 27.318 -10.375 623 H ALA 85 H ALA 85 -12.210 25.347 -10.713 624 HA ALA 85 HA ALA 85 -10.968 25.564 -8.142 625 1HB ALA 85 HB1 ALA 85 -10.597 23.124 -8.323 626 2HB ALA 85 HB2 ALA 85 -12.258 23.563 -8.731 627 3HB ALA 85 HB3 ALA 85 -11.096 23.168 -10.024 628 H ALA 86 H ALA 86 -9.649 25.740 -11.377 629 HA ALA 86 HA ALA 86 -7.050 24.762 -10.809 630 1HB ALA 86 HB1 ALA 86 -7.810 26.865 -12.850 631 2HB ALA 86 HB2 ALA 86 -6.388 25.806 -12.869 632 3HB ALA 86 HB3 ALA 86 -8.008 25.104 -13.084 633 H ASP 87 H ASP 87 -8.561 27.761 -9.847 634 HA ASP 87 HA ASP 87 -6.129 29.224 -9.373 635 1HB ASP 87 HB2 ASP 87 -8.315 30.330 -9.591 636 2HB ASP 87 HB3 ASP 87 -8.905 29.472 -8.162 637 H LYS 88 H LYS 88 -7.906 26.719 -7.619 638 HA LYS 88 HA LYS 88 -6.731 27.522 -5.056 639 1HB LYS 88 HB2 LYS 88 -9.158 26.812 -5.386 640 2HB LYS 88 HB3 LYS 88 -8.557 25.160 -5.565 641 1HG LYS 88 HG2 LYS 88 -9.256 25.403 -3.317 642 2HG LYS 88 HG3 LYS 88 -7.494 25.422 -3.256 643 1HD LYS 88 HD2 LYS 88 -7.473 27.855 -2.979 644 2HD LYS 88 HD3 LYS 88 -9.228 27.938 -3.268 645 1HE LYS 88 HE2 LYS 88 -9.629 26.544 -1.276 646 2HE LYS 88 HE3 LYS 88 -7.888 26.443 -0.975 647 1HZ LYS 88 HZ1 LYS 88 -7.874 28.852 -0.635 648 2HZ LYS 88 HZ2 LYS 88 -9.482 28.947 -0.913 649 3HZ LYS 88 HZ3 LYS 88 -8.923 28.151 0.391 650 H CYS 89 H CYS 89 -4.592 27.087 -6.218 651 HA CYS 89 HA CYS 89 -3.619 24.451 -5.200 652 1HB CYS 89 HB2 CYS 89 -2.723 25.874 -7.730 653 2HB CYS 89 HB3 CYS 89 -1.865 24.530 -6.970 654 HG CYS 89 HG CYS 89 -4.033 22.920 -6.916 655 HA PRO 90 HA PRO 90 -2.231 28.203 -2.921 656 1HB PRO 90 HB2 PRO 90 -1.498 26.663 -0.604 657 2HB PRO 90 HB3 PRO 90 -2.892 27.751 -0.855 658 1HG PRO 90 HG2 PRO 90 -2.723 24.777 -1.152 659 2HG PRO 90 HG3 PRO 90 -4.133 25.769 -0.677 660 1HD PRO 90 HD2 PRO 90 -3.966 24.678 -3.135 661 2HD PRO 90 HD3 PRO 90 -4.622 26.319 -2.913 662 H MET 91 H MET 91 -0.356 25.173 -3.170 663 HA MET 91 HA MET 91 1.826 26.648 -4.262 664 1HB MET 91 HB2 MET 91 2.408 27.003 -1.893 665 2HB MET 91 HB3 MET 91 2.251 25.285 -1.559 666 1HG MET 91 HG2 MET 91 4.603 26.097 -1.765 667 2HG MET 91 HG3 MET 91 4.198 24.759 -2.817 668 1HE MET 91 HE1 MET 91 3.399 28.653 -3.361 669 2HE MET 91 HE2 MET 91 4.991 28.586 -2.569 670 3HE MET 91 HE3 MET 91 4.858 29.126 -4.256 671 H THR 92 H THR 92 2.611 25.344 -5.852 672 HA THR 92 HA THR 92 2.608 22.402 -5.541 673 HB THR 92 HB THR 92 1.680 22.235 -7.899 674 HG1 THR 92 HG1 THR 92 1.839 24.479 -8.416 675 1HG2 THR 92 HG21 THR 92 -0.254 23.364 -5.857 676 2HG2 THR 92 HG22 THR 92 -0.624 22.299 -7.231 677 3HG2 THR 92 HG23 THR 92 0.343 21.697 -5.881 678 HA PRO 93 HA PRO 93 6.702 24.087 -6.915 679 1HB PRO 93 HB2 PRO 93 7.416 21.397 -5.736 680 2HB PRO 93 HB3 PRO 93 8.284 22.957 -5.581 681 1HG PRO 93 HG2 PRO 93 6.769 22.044 -3.539 682 2HG PRO 93 HG3 PRO 93 6.687 23.776 -4.006 683 1HD PRO 93 HD2 PRO 93 4.791 21.540 -4.753 684 2HD PRO 93 HD3 PRO 93 4.412 23.178 -4.171 685 HA PRO 94 HA PRO 94 7.295 21.801 -10.724 686 1HB PRO 94 HB2 PRO 94 10.075 21.048 -9.798 687 2HB PRO 94 HB3 PRO 94 9.552 21.677 -11.393 688 1HG PRO 94 HG2 PRO 94 10.697 23.344 -9.597 689 2HG PRO 94 HG3 PRO 94 9.243 23.878 -10.503 690 1HD PRO 94 HD2 PRO 94 9.415 22.821 -7.677 691 2HD PRO 94 HD3 PRO 94 8.472 24.205 -8.311 692 H HIS 95 H HIS 95 8.230 20.056 -7.767 693 HA HIS 95 HA HIS 95 8.110 17.402 -8.853 694 1HB HIS 95 HB2 HIS 95 7.710 18.340 -5.984 695 2HB HIS 95 HB3 HIS 95 8.145 16.716 -6.505 696 HD1 HIS 95 HD1 HIS 95 10.666 16.840 -8.084 697 HD2 HIS 95 HD2 HIS 95 9.749 19.689 -5.119 698 HE1 HIS 95 HE1 HIS 95 12.870 17.931 -7.434 699 H VAL 96 H VAL 96 5.612 19.606 -8.538 700 HA VAL 96 HA VAL 96 3.469 17.600 -8.062 701 HB VAL 96 HB VAL 96 3.600 20.480 -7.046 702 1HG1 VAL 96 HG11 VAL 96 1.340 19.667 -7.462 703 2HG1 VAL 96 HG12 VAL 96 1.647 18.233 -6.464 704 3HG1 VAL 96 HG13 VAL 96 1.640 19.845 -5.727 705 1HG2 VAL 96 HG21 VAL 96 5.241 19.367 -5.729 706 2HG2 VAL 96 HG22 VAL 96 3.776 19.477 -4.749 707 3HG2 VAL 96 HG23 VAL 96 4.217 17.943 -5.509 708 H LYS 97 H LYS 97 3.324 17.415 -10.354 709 HA LYS 97 HA LYS 97 3.114 19.800 -12.019 710 1HB LYS 97 HB2 LYS 97 3.031 18.366 -13.855 711 2HB LYS 97 HB3 LYS 97 4.101 17.565 -12.717 712 1HG LYS 97 HG2 LYS 97 1.767 16.326 -12.065 713 2HG LYS 97 HG3 LYS 97 1.407 16.770 -13.745 714 1HD LYS 97 HD2 LYS 97 3.628 15.672 -14.384 715 2HD LYS 97 HD3 LYS 97 3.779 15.169 -12.689 716 1HE LYS 97 HE2 LYS 97 1.389 14.114 -13.085 717 2HE LYS 97 HE3 LYS 97 1.801 14.235 -14.801 718 1HZ LYS 97 HZ1 LYS 97 3.259 12.757 -12.669 719 2HZ LYS 97 HZ2 LYS 97 2.455 12.099 -13.934 720 3HZ LYS 97 HZ3 LYS 97 3.840 12.922 -14.208 721 H ARG 98 H ARG 98 1.099 20.081 -13.393 722 HA ARG 98 HA ARG 98 -1.350 19.460 -11.825 723 1HB ARG 98 HB2 ARG 98 -0.739 22.207 -12.980 724 2HB ARG 98 HB3 ARG 98 -2.229 21.679 -12.194 725 1HG ARG 98 HG2 ARG 98 -0.733 21.155 -10.129 726 2HG ARG 98 HG3 ARG 98 0.478 22.173 -10.914 727 1HD ARG 98 HD2 ARG 98 -2.383 22.967 -10.220 728 2HD ARG 98 HD3 ARG 98 -0.958 23.409 -9.278 729 HE ARG 98 HE ARG 98 -0.248 24.467 -11.613 730 1HH1 ARG 98 HH11 ARG 98 -3.330 24.707 -9.864 731 2HH1 ARG 98 HH12 ARG 98 -3.815 26.195 -10.577 732 1HH2 ARG 98 HH21 ARG 98 -0.822 26.520 -12.510 733 2HH2 ARG 98 HH22 ARG 98 -2.295 27.289 -12.060 734 H GLU 99 H GLU 99 -3.267 19.407 -13.001 735 HA GLU 99 HA GLU 99 -3.206 19.891 -15.879 736 1HB GLU 99 HB2 GLU 99 -3.420 17.202 -14.670 737 2HB GLU 99 HB3 GLU 99 -4.862 17.608 -15.599 738 1HG GLU 99 HG2 GLU 99 -1.987 17.584 -16.569 739 2HG GLU 99 HG3 GLU 99 -3.265 16.448 -16.995 740 H HIS 100 H HIS 100 -5.478 20.107 -16.674 741 HA HIS 100 HA HIS 100 -7.301 21.128 -14.565 742 1HB HIS 100 HB2 HIS 100 -6.417 22.865 -16.899 743 2HB HIS 100 HB3 HIS 100 -7.391 23.332 -15.511 744 HD1 HIS 100 HD1 HIS 100 -5.693 22.837 -13.060 745 HD2 HIS 100 HD2 HIS 100 -4.027 23.802 -16.803 746 HE1 HIS 100 HE1 HIS 100 -3.356 23.719 -12.601 747 H TRP 101 H TRP 101 -9.431 21.043 -15.189 748 HA TRP 101 HA TRP 101 -10.128 20.606 -18.038 749 1HB TRP 101 HB2 TRP 101 -11.263 18.889 -15.840 750 2HB TRP 101 HB3 TRP 101 -11.486 18.748 -17.584 751 HD1 TRP 101 HD1 TRP 101 -9.341 17.610 -14.788 752 HE1 TRP 101 HE1 TRP 101 -7.403 16.151 -15.568 753 HE3 TRP 101 HE3 TRP 101 -9.614 18.517 -19.826 754 HZ2 TRP 101 HZ2 TRP 101 -6.210 15.336 -18.059 755 HZ3 TRP 101 HZ3 TRP 101 -8.022 17.410 -21.373 756 HH2 TRP 101 HH2 TRP 101 -6.326 15.791 -20.493 757 H GLY 102 H GLY 102 -12.911 20.361 -17.659 758 1HA GLY 102 HA1 GLY 102 -13.652 22.957 -16.375 759 2HA GLY 102 HA2 GLY 102 -13.894 22.686 -18.096 760 H PHE 103 H PHE 103 -14.413 20.326 -15.392 761 HA PHE 103 HA PHE 103 -16.972 19.642 -16.570 762 1HB PHE 103 HB2 PHE 103 -15.514 18.609 -14.113 763 2HB PHE 103 HB3 PHE 103 -17.074 18.004 -14.675 764 HD1 PHE 103 HD1 PHE 103 -13.472 17.857 -15.222 765 HD2 PHE 103 HD2 PHE 103 -17.303 17.161 -17.070 766 HE1 PHE 103 HE1 PHE 103 -12.355 16.711 -17.090 767 HE2 PHE 103 HE2 PHE 103 -16.194 15.978 -18.921 768 HZ PHE 103 HZ PHE 103 -13.704 15.749 -18.956 769 H ASP 104 H ASP 104 -18.664 20.841 -16.330 770 HA ASP 104 HA ASP 104 -19.276 22.564 -14.100 771 1HB ASP 104 HB2 ASP 104 -20.222 22.845 -16.393 772 2HB ASP 104 HB3 ASP 104 -21.046 21.288 -16.210 773 H ASP 105 H ASP 105 -21.066 22.153 -12.582 774 HA ASP 105 HA ASP 105 -20.497 19.637 -11.316 775 1HB ASP 105 HB2 ASP 105 -20.770 21.860 -10.181 776 2HB ASP 105 HB3 ASP 105 -22.514 21.694 -10.417 777 HA PRO 106 HA PRO 106 -23.859 17.630 -13.393 778 1HB PRO 106 HB2 PRO 106 -23.705 15.100 -12.301 779 2HB PRO 106 HB3 PRO 106 -22.542 15.730 -13.505 780 1HG PRO 106 HG2 PRO 106 -22.257 15.651 -10.487 781 2HG PRO 106 HG3 PRO 106 -21.058 15.163 -11.728 782 1HD PRO 106 HD2 PRO 106 -20.985 17.609 -10.526 783 2HD PRO 106 HD3 PRO 106 -20.554 17.408 -12.253 784 H ALA 107 H ALA 107 -23.721 17.707 -9.827 785 HA ALA 107 HA ALA 107 -26.346 16.627 -9.463 786 1HB ALA 107 HB1 ALA 107 -24.631 16.627 -7.705 787 2HB ALA 107 HB2 ALA 107 -24.703 18.400 -7.608 788 3HB ALA 107 HB3 ALA 107 -26.123 17.433 -7.161 789 H ARG 108 H ARG 108 -25.220 19.775 -10.444 790 HA ARG 108 HA ARG 108 -27.846 21.038 -9.874 791 1HB ARG 108 HB2 ARG 108 -25.137 22.205 -10.666 792 2HB ARG 108 HB3 ARG 108 -26.626 23.133 -10.555 793 1HG ARG 108 HG2 ARG 108 -25.644 23.562 -8.529 794 2HG ARG 108 HG3 ARG 108 -26.841 22.322 -8.134 795 1HD ARG 108 HD2 ARG 108 -25.052 20.620 -8.056 796 2HD ARG 108 HD3 ARG 108 -23.870 21.840 -8.569 797 HE ARG 108 HE ARG 108 -25.130 22.796 -6.247 798 1HH1 ARG 108 HH21 ARG 108 -22.927 20.129 -7.163 799 2HH1 ARG 108 HH22 ARG 108 -22.139 20.096 -5.624 800 1HH2 ARG 108 HH11 ARG 108 -24.045 22.745 -4.228 801 2HH2 ARG 108 HH12 ARG 108 -22.743 21.643 -3.946 802 H ALA 109 H ALA 109 -26.778 19.104 -12.292 803 HA ALA 109 HA ALA 109 -27.358 20.643 -14.623 804 1HB ALA 109 HB1 ALA 109 -25.905 18.627 -14.555 805 2HB ALA 109 HB2 ALA 109 -27.348 17.628 -14.226 806 3HB ALA 109 HB3 ALA 109 -27.201 18.501 -15.763 807 H GLN 110 H GLN 110 -29.545 20.354 -12.446 808 HA GLN 110 HA GLN 110 -31.743 18.887 -13.337 809 1HB GLN 110 HB2 GLN 110 -33.103 20.320 -11.929 810 2HB GLN 110 HB3 GLN 110 -31.619 19.821 -11.127 811 1HG GLN 110 HG2 GLN 110 -30.623 22.070 -11.592 812 2HG GLN 110 HG3 GLN 110 -32.120 22.558 -12.393 813 1HE2 GLN 110 HE22 GLN 110 -31.014 21.126 -9.249 814 2HE2 GLN 110 HE21 GLN 110 -32.120 22.045 -8.260 815 H GLY 111 H GLY 111 -33.694 19.508 -14.325 816 1HA GLY 111 HA1 GLY 111 -34.446 21.768 -15.718 817 2HA GLY 111 HA2 GLY 111 -33.445 20.834 -16.867 818 H THR 112 H THR 112 -33.850 18.302 -16.376 819 HA THR 112 HA THR 112 -36.464 17.509 -15.581 820 HB THR 112 HB THR 112 -37.055 18.073 -17.859 821 HG1 THR 112 HG1 THR 112 -38.063 16.271 -17.241 822 1HG2 THR 112 HG21 THR 112 -34.803 16.269 -18.799 823 2HG2 THR 112 HG22 THR 112 -36.048 17.009 -19.823 824 3HG2 THR 112 HG23 THR 112 -34.888 18.041 -18.979 825 H GLU 113 H GLU 113 -36.385 15.116 -15.181 826 HA GLU 113 HA GLU 113 -33.909 14.590 -13.928 827 1HB GLU 113 HB2 GLU 113 -35.985 13.650 -13.101 828 2HB GLU 113 HB3 GLU 113 -36.212 12.711 -14.589 829 1HG GLU 113 HG2 GLU 113 -34.235 11.379 -14.138 830 2HG GLU 113 HG3 GLU 113 -33.790 12.398 -12.761 831 H GLU 114 H GLU 114 -35.181 13.464 -17.048 832 HA GLU 114 HA GLU 114 -33.032 11.687 -17.560 833 1HB GLU 114 HB2 GLU 114 -33.796 11.644 -19.868 834 2HB GLU 114 HB3 GLU 114 -35.152 11.522 -18.751 835 1HG GLU 114 HG2 GLU 114 -35.652 13.945 -19.117 836 2HG GLU 114 HG3 GLU 114 -34.310 14.036 -20.263 837 H GLU 115 H GLU 115 -33.292 15.199 -17.912 838 HA GLU 115 HA GLU 115 -30.977 15.462 -19.607 839 1HB GLU 115 HB2 GLU 115 -32.739 17.165 -19.600 840 2HB GLU 115 HB3 GLU 115 -32.439 17.498 -17.894 841 1HG GLU 115 HG2 GLU 115 -31.417 19.236 -19.066 842 2HG GLU 115 HG3 GLU 115 -30.091 18.220 -18.528 843 H LYS 116 H LYS 116 -31.748 15.894 -16.134 844 HA LYS 116 HA LYS 116 -29.239 16.522 -15.135 845 1HB LYS 116 HB2 LYS 116 -31.476 16.636 -14.035 846 2HB LYS 116 HB3 LYS 116 -31.473 14.874 -13.855 847 1HG LYS 116 HG2 LYS 116 -29.558 14.941 -12.442 848 2HG LYS 116 HG3 LYS 116 -29.291 16.674 -12.765 849 1HD LYS 116 HD2 LYS 116 -31.671 16.990 -11.711 850 2HD LYS 116 HD3 LYS 116 -31.449 15.328 -11.104 851 1HE LYS 116 HE2 LYS 116 -29.207 16.079 -10.176 852 2HE LYS 116 HE3 LYS 116 -29.591 17.718 -10.703 853 1HZ LYS 116 HZ1 LYS 116 -31.077 16.163 -8.654 854 2HZ LYS 116 HZ2 LYS 116 -30.109 17.449 -8.383 855 3HZ LYS 116 HZ3 LYS 116 -31.523 17.646 -9.174 856 H TRP 117 H TRP 117 -30.735 13.279 -15.468 857 HA TRP 117 HA TRP 117 -28.454 11.803 -14.625 858 1HB TRP 117 HB2 TRP 117 -30.760 10.888 -14.730 859 2HB TRP 117 HB3 TRP 117 -30.689 10.919 -16.493 860 HD1 TRP 117 HD1 TRP 117 -29.217 9.050 -17.685 861 HE1 TRP 117 HE1 TRP 117 -28.135 6.845 -16.891 862 HE3 TRP 117 HE3 TRP 117 -29.549 9.742 -12.626 863 HZ2 TRP 117 HZ2 TRP 117 -27.273 5.694 -14.429 864 HZ3 TRP 117 HZ3 TRP 117 -28.448 8.151 -11.081 865 HH2 TRP 117 HH2 TRP 117 -27.288 6.132 -11.973 866 H ALA 118 H ALA 118 -29.514 12.811 -17.965 867 HA ALA 118 HA ALA 118 -27.446 11.456 -19.326 868 1HB ALA 118 HB1 ALA 118 -29.306 12.485 -20.531 869 2HB ALA 118 HB2 ALA 118 -28.782 14.108 -20.024 870 3HB ALA 118 HB3 ALA 118 -27.773 13.151 -21.120 871 H PHE 119 H PHE 119 -27.392 14.595 -17.601 872 HA PHE 119 HA PHE 119 -24.750 15.269 -18.426 873 1HB PHE 119 HB2 PHE 119 -26.693 16.645 -17.217 874 2HB PHE 119 HB3 PHE 119 -25.810 16.176 -15.771 875 HD1 PHE 119 HD1 PHE 119 -25.808 18.179 -18.855 876 HD2 PHE 119 HD2 PHE 119 -23.445 16.994 -15.448 877 HE1 PHE 119 HE1 PHE 119 -24.223 20.035 -19.304 878 HE2 PHE 119 HE2 PHE 119 -21.902 18.897 -15.852 879 HZ PHE 119 HZ PHE 119 -22.273 20.393 -17.820 880 H PHE 120 H PHE 120 -26.001 13.389 -15.593 881 HA PHE 120 HA PHE 120 -23.533 12.957 -14.259 882 1HB PHE 120 HB2 PHE 120 -25.682 10.849 -14.605 883 2HB PHE 120 HB3 PHE 120 -24.420 10.906 -13.410 884 HD1 PHE 120 HD1 PHE 120 -25.556 14.254 -13.339 885 HD2 PHE 120 HD2 PHE 120 -26.791 10.229 -12.386 886 HE1 PHE 120 HE1 PHE 120 -27.199 15.128 -11.736 887 HE2 PHE 120 HE2 PHE 120 -28.478 11.129 -10.808 888 HZ PHE 120 HZ PHE 120 -28.693 13.583 -10.485 889 H GLN 121 H GLN 121 -25.120 11.180 -16.977 890 HA GLN 121 HA GLN 121 -23.132 9.213 -17.344 891 1HB GLN 121 HB2 GLN 121 -25.077 10.415 -19.356 892 2HB GLN 121 HB3 GLN 121 -24.063 9.026 -19.684 893 1HG GLN 121 HG2 GLN 121 -26.155 9.169 -17.471 894 2HG GLN 121 HG3 GLN 121 -26.382 8.407 -19.039 895 1HE2 GLN 121 HE22 GLN 121 -25.891 7.573 -15.923 896 2HE2 GLN 121 HE21 GLN 121 -24.923 6.133 -16.138 897 H ARG 122 H ARG 122 -23.474 12.373 -19.008 898 HA ARG 122 HA ARG 122 -21.167 12.050 -20.647 899 1HB ARG 122 HB2 ARG 122 -22.770 14.454 -19.729 900 2HB ARG 122 HB3 ARG 122 -21.174 14.720 -20.419 901 1HG ARG 122 HG2 ARG 122 -22.708 14.938 -22.202 902 2HG ARG 122 HG3 ARG 122 -21.806 13.438 -22.450 903 1HD ARG 122 HD2 ARG 122 -23.762 12.184 -21.465 904 2HD ARG 122 HD3 ARG 122 -24.642 13.730 -21.387 905 HE ARG 122 HE ARG 122 -23.804 13.513 -24.015 906 1HH1 ARG 122 HH11 ARG 122 -25.801 11.572 -21.833 907 2HH1 ARG 122 HH12 ARG 122 -26.805 10.918 -23.080 908 1HH2 ARG 122 HH21 ARG 122 -25.136 12.653 -25.696 909 2HH2 ARG 122 HH22 ARG 122 -26.415 11.561 -25.330 910 H VAL 123 H VAL 123 -21.485 13.644 -17.420 911 HA VAL 123 HA VAL 123 -18.706 14.294 -17.370 912 HB VAL 123 HB VAL 123 -20.774 14.133 -15.132 913 1HG1 VAL 123 HG11 VAL 123 -19.212 15.569 -13.821 914 2HG1 VAL 123 HG12 VAL 123 -18.541 13.960 -14.106 915 3HG1 VAL 123 HG13 VAL 123 -17.967 15.338 -15.070 916 1HG2 VAL 123 HG21 VAL 123 -19.585 16.508 -16.666 917 2HG2 VAL 123 HG22 VAL 123 -21.227 15.881 -16.864 918 3HG2 VAL 123 HG23 VAL 123 -20.747 16.622 -15.336 919 H ARG 124 H ARG 124 -20.421 11.350 -15.920 920 HA ARG 124 HA ARG 124 -17.970 10.461 -14.810 921 1HB ARG 124 HB2 ARG 124 -18.911 8.275 -14.530 922 2HB ARG 124 HB3 ARG 124 -20.166 9.459 -14.157 923 1HG ARG 124 HG2 ARG 124 -21.190 9.012 -16.373 924 2HG ARG 124 HG3 ARG 124 -19.920 7.830 -16.722 925 1HD ARG 124 HD2 ARG 124 -20.643 6.548 -14.683 926 2HD ARG 124 HD3 ARG 124 -22.040 7.638 -14.558 927 HE ARG 124 HE ARG 124 -22.057 6.749 -17.189 928 1HH1 ARG 124 HH21 ARG 124 -22.314 5.116 -14.026 929 2HH1 ARG 124 HH22 ARG 124 -23.053 3.704 -14.711 930 1HH2 ARG 124 HH11 ARG 124 -23.299 5.030 -17.960 931 2HH2 ARG 124 HH12 ARG 124 -23.538 3.604 -17.007 932 H ASP 125 H ASP 125 -19.351 9.893 -18.048 933 HA ASP 125 HA ASP 125 -17.420 8.009 -18.883 934 1HB ASP 125 HB2 ASP 125 -19.481 8.389 -20.133 935 2HB ASP 125 HB3 ASP 125 -18.989 10.043 -20.514 936 H GLU 126 H GLU 126 -17.444 11.620 -19.182 937 HA GLU 126 HA GLU 126 -14.914 11.608 -20.490 938 1HB GLU 126 HB2 GLU 126 -16.739 13.735 -19.458 939 2HB GLU 126 HB3 GLU 126 -15.062 14.150 -19.823 940 1HG GLU 126 HG2 GLU 126 -16.698 12.636 -21.849 941 2HG GLU 126 HG3 GLU 126 -16.845 14.384 -21.681 942 H ILE 127 H ILE 127 -15.843 11.927 -17.031 943 HA ILE 127 HA ILE 127 -13.217 12.735 -16.214 944 HB ILE 127 HB ILE 127 -15.657 12.349 -14.895 945 1HG1 ILE 127 HG12 ILE 127 -14.393 13.027 -12.815 946 2HG1 ILE 127 HG13 ILE 127 -12.913 12.975 -13.782 947 1HG2 ILE 127 HG21 ILE 127 -15.299 10.046 -14.499 948 2HG2 ILE 127 HG22 ILE 127 -13.751 10.379 -13.662 949 3HG2 ILE 127 HG23 ILE 127 -15.288 10.954 -12.984 950 1HD1 ILE 127 HD11 ILE 127 -15.420 14.596 -14.485 951 2HD1 ILE 127 HD12 ILE 127 -14.017 15.264 -13.632 952 3HD1 ILE 127 HD13 ILE 127 -13.844 14.679 -15.304 953 H GLY 128 H GLY 128 -14.737 9.502 -16.687 954 1HA GLY 128 HA1 GLY 128 -12.472 7.945 -16.009 955 2HA GLY 128 HA2 GLY 128 -13.756 7.491 -17.157 956 H ASN 129 H ASN 129 -13.479 9.415 -19.119 957 HA ASN 129 HA ASN 129 -11.367 8.438 -20.692 958 1HB ASN 129 HB2 ASN 129 -13.582 9.470 -21.395 959 2HB ASN 129 HB3 ASN 129 -12.857 11.040 -21.045 960 1HD2 ASN 129 HD21 ASN 129 -13.329 11.599 -23.194 961 2HD2 ASN 129 HD22 ASN 129 -12.368 10.996 -24.550 962 H ARG 130 H ARG 130 -11.557 11.501 -18.828 963 HA ARG 130 HA ARG 130 -9.066 12.624 -19.617 964 1HB ARG 130 HB2 ARG 130 -10.278 12.701 -16.816 965 2HB ARG 130 HB3 ARG 130 -8.986 13.717 -17.402 966 1HG ARG 130 HG2 ARG 130 -11.942 13.940 -17.929 967 2HG ARG 130 HG3 ARG 130 -10.831 15.043 -17.180 968 1HD ARG 130 HD2 ARG 130 -11.295 16.026 -19.242 969 2HD ARG 130 HD3 ARG 130 -9.691 15.317 -19.399 970 HE ARG 130 HE ARG 130 -12.194 13.999 -20.415 971 1HH1 ARG 130 HH21 ARG 130 -8.810 14.974 -20.958 972 2HH1 ARG 130 HH22 ARG 130 -8.625 13.998 -22.387 973 1HH2 ARG 130 HH11 ARG 130 -12.064 13.069 -22.471 974 2HH2 ARG 130 HH12 ARG 130 -10.468 12.836 -23.208 975 H LEU 131 H LEU 131 -9.864 10.331 -16.998 976 HA LEU 131 HA LEU 131 -7.172 10.233 -16.006 977 1HB LEU 131 HB2 LEU 131 -9.735 8.700 -15.535 978 2HB LEU 131 HB3 LEU 131 -8.236 8.179 -14.776 979 HG LEU 131 HG LEU 131 -8.048 9.999 -13.404 980 1HD1 LEU 131 HD11 LEU 131 -9.164 12.140 -13.469 981 2HD1 LEU 131 HD12 LEU 131 -8.344 11.934 -15.016 982 3HD1 LEU 131 HD13 LEU 131 -10.093 11.694 -14.881 983 1HD2 LEU 131 HD21 LEU 131 -10.197 10.298 -12.326 984 2HD2 LEU 131 HD22 LEU 131 -11.064 9.799 -13.793 985 3HD2 LEU 131 HD23 LEU 131 -10.065 8.632 -12.918 986 H LYS 132 H LYS 132 -9.074 8.064 -18.120 987 HA LYS 132 HA LYS 132 -7.060 6.146 -18.593 988 1HB LYS 132 HB2 LYS 132 -9.267 5.678 -19.274 989 2HB LYS 132 HB3 LYS 132 -9.468 7.195 -20.111 990 1HG LYS 132 HG2 LYS 132 -7.457 5.237 -21.222 991 2HG LYS 132 HG3 LYS 132 -9.179 4.883 -21.377 992 1HD LYS 132 HD2 LYS 132 -9.524 7.177 -22.371 993 2HD LYS 132 HD3 LYS 132 -7.776 7.366 -22.467 994 1HE LYS 132 HE2 LYS 132 -9.300 5.045 -23.728 995 2HE LYS 132 HE3 LYS 132 -9.028 6.578 -24.559 996 1HZ LYS 132 HZ1 LYS 132 -7.363 4.949 -25.145 997 2HZ LYS 132 HZ2 LYS 132 -6.651 6.204 -24.391 998 3HZ LYS 132 HZ3 LYS 132 -6.867 4.778 -23.599 999 H GLU 133 H GLU 133 -7.652 9.261 -20.290 1000 HA GLU 133 HA GLU 133 -5.465 8.903 -22.086 1001 1HB GLU 133 HB2 GLU 133 -6.834 11.396 -20.999 1002 2HB GLU 133 HB3 GLU 133 -5.429 11.483 -22.073 1003 1HG GLU 133 HG2 GLU 133 -6.577 10.385 -23.861 1004 2HG GLU 133 HG3 GLU 133 -7.961 9.992 -22.832 1005 H PHE 134 H PHE 134 -5.468 10.738 -18.886 1006 HA PHE 134 HA PHE 134 -2.709 11.187 -19.326 1007 1HB PHE 134 HB2 PHE 134 -2.521 12.249 -17.326 1008 2HB PHE 134 HB3 PHE 134 -4.163 12.568 -17.838 1009 HD1 PHE 134 HD1 PHE 134 -5.777 12.503 -16.134 1010 HD2 PHE 134 HD2 PHE 134 -2.162 10.195 -15.648 1011 HE1 PHE 134 HE1 PHE 134 -6.465 11.858 -13.833 1012 HE2 PHE 134 HE2 PHE 134 -2.913 9.489 -13.406 1013 HZ PHE 134 HZ PHE 134 -5.116 10.246 -12.537 1014 H ALA 135 H ALA 135 -4.322 8.372 -17.946 1015 HA ALA 135 HA ALA 135 -1.960 7.247 -16.806 1016 1HB ALA 135 HB1 ALA 135 -4.235 6.506 -16.173 1017 2HB ALA 135 HB2 ALA 135 -4.496 5.885 -17.819 1018 3HB ALA 135 HB3 ALA 135 -3.265 5.148 -16.776 1019 H GLU 136 H GLU 136 -3.545 6.802 -19.999 1020 HA GLU 136 HA GLU 136 -1.507 4.881 -20.745 1021 1HB GLU 136 HB2 GLU 136 -3.867 5.987 -22.300 1022 2HB GLU 136 HB3 GLU 136 -2.756 4.736 -22.881 1023 1HG GLU 136 HG2 GLU 136 -3.317 3.460 -20.689 1024 2HG GLU 136 HG3 GLU 136 -4.689 4.557 -20.550 1025 H THR 137 H THR 137 -2.150 8.277 -21.492 1026 HA THR 137 HA THR 137 -0.154 8.251 -23.570 1027 HB THR 137 HB THR 137 -0.927 10.413 -24.145 1028 HG1 THR 137 HG1 THR 137 -2.618 10.265 -21.887 1029 1HG2 THR 137 HG21 THR 137 -2.262 8.482 -24.916 1030 2HG2 THR 137 HG22 THR 137 -3.302 8.609 -23.489 1031 3HG2 THR 137 HG23 THR 137 -3.268 9.926 -24.685 1032 H GLY 138 H GLY 138 -0.236 8.897 -20.201 1033 1HA GLY 138 HA1 GLY 138 1.357 9.657 -18.740 1034 2HA GLY 138 HA2 GLY 138 2.534 9.709 -20.065 1035 H LYS 139 H LYS 139 -0.570 11.382 -20.151 1036 HA LYS 139 HA LYS 139 0.373 13.832 -21.035 1037 1HB LYS 139 HB2 LYS 139 -1.980 12.862 -21.041 1038 2HB LYS 139 HB3 LYS 139 -2.142 13.430 -19.375 1039 1HG LYS 139 HG2 LYS 139 -2.010 15.694 -19.998 1040 2HG LYS 139 HG3 LYS 139 -1.354 15.333 -21.600 1041 1HD LYS 139 HD2 LYS 139 -4.179 14.570 -20.722 1042 2HD LYS 139 HD3 LYS 139 -3.761 16.049 -21.606 1043 1HE LYS 139 HE2 LYS 139 -2.714 14.595 -23.398 1044 2HE LYS 139 HE3 LYS 139 -3.379 13.176 -22.588 1045 1HZ LYS 139 HZ1 LYS 139 -4.746 14.033 -24.431 1046 2HZ LYS 139 HZ2 LYS 139 -5.611 13.985 -23.065 1047 3HZ LYS 139 HZ3 LYS 139 -5.024 15.417 -23.631 Start of MODEL 19 1 1H MET 1 H1 MET 1 0.098 -0.643 -1.822 2 2H MET 1 H2 MET 1 0.598 -1.609 -0.582 3 3H MET 1 H3 MET 1 -0.165 -0.188 -0.267 4 HA MET 1 HA MET 1 2.220 -0.040 0.119 5 1HB MET 1 HB2 MET 1 2.349 -0.439 -2.911 6 2HB MET 1 HB3 MET 1 3.694 0.055 -1.885 7 1HG MET 1 HG2 MET 1 3.531 -2.069 -0.622 8 2HG MET 1 HG3 MET 1 2.254 -2.609 -1.721 9 1HE MET 1 HE1 MET 1 3.586 -4.837 -2.182 10 2HE MET 1 HE2 MET 1 5.285 -4.883 -2.704 11 3HE MET 1 HE3 MET 1 4.872 -4.292 -1.079 12 H GLU 2 H GLU 2 3.531 1.942 -1.219 13 HA GLU 2 HA GLU 2 1.652 4.055 -2.036 14 1HB GLU 2 HB2 GLU 2 3.788 4.296 0.146 15 2HB GLU 2 HB3 GLU 2 3.019 5.671 -0.652 16 1HG GLU 2 HG2 GLU 2 0.833 5.018 0.234 17 2HG GLU 2 HG3 GLU 2 1.529 3.586 0.998 18 H ASN 3 H ASN 3 2.795 5.479 -3.545 19 HA ASN 3 HA ASN 3 5.610 5.095 -4.091 20 1HB ASN 3 HB2 ASN 3 5.016 3.087 -5.175 21 2HB ASN 3 HB3 ASN 3 3.598 3.794 -5.917 22 1HD2 ASN 3 HD22 ASN 3 3.811 4.755 -7.928 23 2HD2 ASN 3 HD21 ASN 3 5.357 4.920 -8.769 24 H LYS 4 H LYS 4 2.498 6.250 -5.417 25 HA LYS 4 HA LYS 4 3.689 8.960 -5.727 26 1HB LYS 4 HB2 LYS 4 2.051 7.438 -7.800 27 2HB LYS 4 HB3 LYS 4 2.138 9.197 -7.794 28 1HG LYS 4 HG2 LYS 4 4.563 9.172 -8.041 29 2HG LYS 4 HG3 LYS 4 4.585 7.409 -8.007 30 1HD LYS 4 HD2 LYS 4 3.250 9.133 -10.141 31 2HD LYS 4 HD3 LYS 4 4.788 8.258 -10.285 32 1HE LYS 4 HE2 LYS 4 3.464 6.128 -9.725 33 2HE LYS 4 HE3 LYS 4 1.998 7.081 -9.953 34 1HZ LYS 4 HZ1 LYS 4 2.769 5.792 -11.929 35 2HZ LYS 4 HZ2 LYS 4 2.589 7.405 -12.236 36 3HZ LYS 4 HZ3 LYS 4 4.082 6.751 -12.042 37 H ILE 5 H ILE 5 1.810 10.581 -5.965 38 HA ILE 5 HA ILE 5 -0.666 9.747 -4.573 39 HB ILE 5 HB ILE 5 1.188 12.031 -3.791 40 1HG1 ILE 5 HG12 ILE 5 0.108 9.773 -2.067 41 2HG1 ILE 5 HG13 ILE 5 1.723 9.823 -2.770 42 1HG2 ILE 5 HG21 ILE 5 -1.126 12.895 -3.826 43 2HG2 ILE 5 HG22 ILE 5 -1.674 11.505 -2.883 44 3HG2 ILE 5 HG23 ILE 5 -0.602 12.736 -2.163 45 1HD1 ILE 5 HD11 ILE 5 2.178 11.940 -1.502 46 2HD1 ILE 5 HD12 ILE 5 0.634 11.697 -0.647 47 3HD1 ILE 5 HD13 ILE 5 1.921 10.498 -0.501 48 H ILE 6 H ILE 6 -2.371 10.563 -5.696 49 HA ILE 6 HA ILE 6 -1.950 12.875 -7.505 50 HB ILE 6 HB ILE 6 -2.070 11.091 -8.996 51 1HG1 ILE 6 HG12 ILE 6 -4.889 12.233 -8.774 52 2HG1 ILE 6 HG13 ILE 6 -3.500 13.015 -9.530 53 1HG2 ILE 6 HG21 ILE 6 -3.741 9.284 -8.992 54 2HG2 ILE 6 HG22 ILE 6 -2.828 9.276 -7.502 55 3HG2 ILE 6 HG23 ILE 6 -4.468 9.950 -7.513 56 1HD1 ILE 6 HD11 ILE 6 -4.965 10.518 -10.461 57 2HD1 ILE 6 HD12 ILE 6 -4.823 12.072 -11.286 58 3HD1 ILE 6 HD13 ILE 6 -3.397 11.024 -11.137 59 H TYR 7 H TYR 7 -3.409 14.505 -7.071 60 HA TYR 7 HA TYR 7 -5.516 13.953 -5.040 61 1HB TYR 7 HB2 TYR 7 -3.364 14.916 -4.202 62 2HB TYR 7 HB3 TYR 7 -3.641 16.333 -5.205 63 HD1 TYR 7 HD1 TYR 7 -3.788 18.015 -3.590 64 HD2 TYR 7 HD2 TYR 7 -6.147 14.444 -3.052 65 HE1 TYR 7 HE1 TYR 7 -4.696 18.911 -1.454 66 HE2 TYR 7 HE2 TYR 7 -7.084 15.374 -0.958 67 HH TYR 7 HH TYR 7 -5.743 18.413 0.425 68 H PHE 8 H PHE 8 -7.449 14.210 -6.024 69 HA PHE 8 HA PHE 8 -7.769 16.020 -8.306 70 1HB PHE 8 HB2 PHE 8 -9.715 14.257 -6.759 71 2HB PHE 8 HB3 PHE 8 -10.175 15.278 -8.118 72 HD1 PHE 8 HD1 PHE 8 -9.048 14.951 -10.372 73 HD2 PHE 8 HD2 PHE 8 -8.683 12.099 -7.159 74 HE1 PHE 8 HE1 PHE 8 -8.204 13.254 -11.977 75 HE2 PHE 8 HE2 PHE 8 -7.829 10.412 -8.774 76 HZ PHE 8 HZ PHE 8 -7.574 10.996 -11.167 77 H LEU 9 H LEU 9 -8.840 17.947 -8.342 78 HA LEU 9 HA LEU 9 -9.732 19.204 -5.802 79 1HB LEU 9 HB2 LEU 9 -7.328 19.765 -7.401 80 2HB LEU 9 HB3 LEU 9 -8.426 21.107 -7.552 81 HG LEU 9 HG LEU 9 -6.858 21.521 -5.793 82 1HD1 LEU 9 HD11 LEU 9 -9.491 20.973 -4.393 83 2HD1 LEU 9 HD12 LEU 9 -8.333 22.282 -4.111 84 3HD1 LEU 9 HD13 LEU 9 -9.289 22.283 -5.586 85 1HD2 LEU 9 HD21 LEU 9 -6.601 20.164 -3.817 86 2HD2 LEU 9 HD22 LEU 9 -7.923 19.087 -4.305 87 3HD2 LEU 9 HD23 LEU 9 -6.409 19.118 -5.220 88 H CYS 10 H CYS 10 -11.644 20.394 -6.133 89 HA CYS 10 HA CYS 10 -12.261 21.416 -8.802 90 1HB CYS 10 HB2 CYS 10 -13.054 18.893 -8.511 91 2HB CYS 10 HB3 CYS 10 -14.376 19.619 -7.581 92 HG CYS 10 HG CYS 10 -15.005 19.116 -10.132 93 H THR 11 H THR 11 -14.487 22.718 -8.674 94 HA THR 11 HA THR 11 -14.299 24.402 -6.371 95 HB THR 11 HB THR 11 -16.488 25.350 -7.452 96 HG1 THR 11 HG1 THR 11 -16.657 24.859 -9.607 97 1HG2 THR 11 HG21 THR 11 -14.279 26.421 -7.478 98 2HG2 THR 11 HG22 THR 11 -13.767 25.400 -8.822 99 3HG2 THR 11 HG23 THR 11 -15.076 26.581 -9.052 100 H GLY 12 H GLY 12 -15.868 21.429 -6.711 101 1HA GLY 12 HA1 GLY 12 -16.842 21.638 -4.010 102 2HA GLY 12 HA2 GLY 12 -18.133 21.336 -5.203 103 H ASN 13 H ASN 13 -15.870 19.866 -3.253 104 HA ASN 13 HA ASN 13 -14.708 17.806 -4.837 105 1HB ASN 13 HB2 ASN 13 -13.830 18.166 -2.644 106 2HB ASN 13 HB3 ASN 13 -15.402 18.134 -1.890 107 1HD2 ASN 13 HD22 ASN 13 -16.458 16.138 -1.491 108 2HD2 ASN 13 HD21 ASN 13 -15.656 14.613 -1.578 109 H SER 14 H SER 14 -17.787 18.015 -3.131 110 HA SER 14 HA SER 14 -18.614 15.617 -2.556 111 1HB SER 14 HB2 SER 14 -20.370 17.717 -3.840 112 2HB SER 14 HB3 SER 14 -20.839 16.538 -2.597 113 HG SER 14 HG SER 14 -20.203 18.827 -1.998 114 H CYS 15 H CYS 15 -18.402 16.494 -5.965 115 HA CYS 15 HA CYS 15 -19.286 13.750 -6.551 116 1HB CYS 15 HB2 CYS 15 -20.499 14.582 -8.622 117 2HB CYS 15 HB3 CYS 15 -21.315 14.852 -7.082 118 HG CYS 15 HG CYS 15 -20.665 17.321 -6.753 119 H ARG 16 H ARG 16 -18.082 16.659 -8.340 120 HA ARG 16 HA ARG 16 -16.929 15.176 -10.369 121 1HB ARG 16 HB2 ARG 16 -16.234 17.928 -9.284 122 2HB ARG 16 HB3 ARG 16 -15.413 17.272 -10.707 123 1HG ARG 16 HG2 ARG 16 -17.438 17.056 -11.948 124 2HG ARG 16 HG3 ARG 16 -18.450 17.377 -10.538 125 1HD ARG 16 HD2 ARG 16 -16.507 19.411 -11.692 126 2HD ARG 16 HD3 ARG 16 -18.193 19.288 -12.182 127 HE ARG 16 HE ARG 16 -18.474 19.473 -9.490 128 1HH1 ARG 16 HH21 ARG 16 -16.790 21.561 -11.851 129 2HH1 ARG 16 HH22 ARG 16 -16.725 22.897 -10.729 130 1HH2 ARG 16 HH11 ARG 16 -18.776 21.356 -8.337 131 2HH2 ARG 16 HH12 ARG 16 -17.796 22.775 -8.691 132 H SER 17 H SER 17 -15.054 16.309 -7.457 133 HA SER 17 HA SER 17 -12.675 14.988 -8.265 134 1HB SER 17 HB2 SER 17 -13.560 15.571 -5.426 135 2HB SER 17 HB3 SER 17 -11.903 15.413 -6.051 136 HG SER 17 HG SER 17 -12.423 17.574 -5.821 137 H GLN 18 H GLN 18 -15.352 13.908 -6.138 138 HA GLN 18 HA GLN 18 -14.189 11.470 -5.331 139 1HB GLN 18 HB2 GLN 18 -17.112 12.297 -5.656 140 2HB GLN 18 HB3 GLN 18 -16.591 10.852 -4.802 141 1HG GLN 18 HG2 GLN 18 -15.700 13.671 -4.041 142 2HG GLN 18 HG3 GLN 18 -17.097 12.874 -3.344 143 1HE2 GLN 18 HE22 GLN 18 -14.143 13.723 -2.375 144 2HE2 GLN 18 HE21 GLN 18 -13.891 12.358 -1.283 145 H MET 19 H MET 19 -16.216 12.188 -8.198 146 HA MET 19 HA MET 19 -16.459 9.466 -9.106 147 1HB MET 19 HB2 MET 19 -16.663 12.148 -10.551 148 2HB MET 19 HB3 MET 19 -17.040 10.590 -11.298 149 1HG MET 19 HG2 MET 19 -18.876 10.199 -9.811 150 2HG MET 19 HG3 MET 19 -18.394 11.515 -8.755 151 1HE MET 19 HE1 MET 19 -18.777 11.490 -12.757 152 2HE MET 19 HE2 MET 19 -20.105 10.500 -12.102 153 3HE MET 19 HE3 MET 19 -20.452 12.066 -12.870 154 H ALA 20 H ALA 20 -14.173 12.156 -9.963 155 HA ALA 20 HA ALA 20 -12.716 10.737 -11.904 156 1HB ALA 20 HB1 ALA 20 -10.985 12.391 -11.568 157 2HB ALA 20 HB2 ALA 20 -12.558 13.202 -11.447 158 3HB ALA 20 HB3 ALA 20 -11.636 12.826 -9.976 159 H GLU 21 H GLU 21 -12.250 10.902 -8.369 160 HA GLU 21 HA GLU 21 -9.898 9.354 -8.186 161 1HB GLU 21 HB2 GLU 21 -10.601 10.608 -6.346 162 2HB GLU 21 HB3 GLU 21 -12.213 9.872 -6.296 163 1HG GLU 21 HG2 GLU 21 -11.198 7.727 -5.603 164 2HG GLU 21 HG3 GLU 21 -9.603 8.470 -5.606 165 H GLY 22 H GLY 22 -13.363 8.248 -8.036 166 1HA GLY 22 HA1 GLY 22 -12.837 5.531 -7.719 167 2HA GLY 22 HA2 GLY 22 -14.260 6.203 -8.507 168 H TRP 23 H TRP 23 -13.064 7.352 -10.914 169 HA TRP 23 HA TRP 23 -12.590 4.894 -12.412 170 1HB TRP 23 HB2 TRP 23 -12.198 7.798 -13.222 171 2HB TRP 23 HB3 TRP 23 -11.970 6.428 -14.287 172 HD1 TRP 23 HD1 TRP 23 -14.662 8.484 -12.638 173 HE1 TRP 23 HE1 TRP 23 -16.872 8.181 -13.824 174 HE3 TRP 23 HE3 TRP 23 -13.403 4.584 -15.727 175 HZ2 TRP 23 HZ2 TRP 23 -17.975 6.531 -15.901 176 HZ3 TRP 23 HZ3 TRP 23 -15.058 3.735 -17.363 177 HH2 TRP 23 HH2 TRP 23 -17.362 4.736 -17.453 178 H ALA 24 H ALA 24 -10.437 7.487 -11.129 179 HA ALA 24 HA ALA 24 -8.125 6.628 -12.474 180 1HB ALA 24 HB1 ALA 24 -8.379 8.809 -11.221 181 2HB ALA 24 HB2 ALA 24 -8.280 7.912 -9.706 182 3HB ALA 24 HB3 ALA 24 -6.888 7.944 -10.807 183 H LYS 25 H LYS 25 -9.500 5.476 -9.384 184 HA LYS 25 HA LYS 25 -7.316 3.853 -8.606 185 1HB LYS 25 HB2 LYS 25 -10.307 3.557 -8.182 186 2HB LYS 25 HB3 LYS 25 -9.141 2.436 -7.469 187 1HG LYS 25 HG2 LYS 25 -8.085 4.151 -6.165 188 2HG LYS 25 HG3 LYS 25 -8.930 5.440 -7.029 189 1HD LYS 25 HD2 LYS 25 -11.103 4.616 -6.176 190 2HD LYS 25 HD3 LYS 25 -10.262 3.347 -5.249 191 1HE LYS 25 HE2 LYS 25 -9.085 5.021 -3.919 192 2HE LYS 25 HE3 LYS 25 -9.647 6.314 -4.983 193 1HZ LYS 25 HZ1 LYS 25 -11.006 6.422 -3.149 194 2HZ LYS 25 HZ2 LYS 25 -11.949 5.721 -4.258 195 3HZ LYS 25 HZ3 LYS 25 -11.280 4.782 -3.065 196 H GLN 26 H GLN 26 -9.757 3.260 -11.113 197 HA GLN 26 HA GLN 26 -9.066 0.457 -11.471 198 1HB GLN 26 HB2 GLN 26 -10.253 2.335 -13.529 199 2HB GLN 26 HB3 GLN 26 -10.224 0.582 -13.563 200 1HG GLN 26 HG2 GLN 26 -11.724 0.567 -11.533 201 2HG GLN 26 HG3 GLN 26 -11.849 2.337 -11.676 202 1HE2 GLN 26 HE22 GLN 26 -12.055 2.897 -14.265 203 2HE2 GLN 26 HE21 GLN 26 -13.437 2.112 -15.011 204 H TYR 27 H TYR 27 -8.416 3.417 -13.351 205 HA TYR 27 HA TYR 27 -6.705 2.092 -15.197 206 1HB TYR 27 HB2 TYR 27 -7.064 5.056 -14.614 207 2HB TYR 27 HB3 TYR 27 -6.174 4.414 -15.984 208 HD1 TYR 27 HD1 TYR 27 -7.448 2.686 -17.530 209 HD2 TYR 27 HD2 TYR 27 -9.378 5.542 -14.938 210 HE1 TYR 27 HE1 TYR 27 -9.493 2.550 -18.913 211 HE2 TYR 27 HE2 TYR 27 -11.392 5.484 -16.371 212 HH TYR 27 HH TYR 27 -11.672 3.338 -19.233 213 H LEU 28 H LEU 28 -5.883 3.912 -12.250 214 HA LEU 28 HA LEU 28 -3.051 4.046 -13.042 215 1HB LEU 28 HB2 LEU 28 -4.504 5.157 -10.607 216 2HB LEU 28 HB3 LEU 28 -2.866 5.503 -11.086 217 HG LEU 28 HG LEU 28 -5.380 6.361 -12.527 218 1HD1 LEU 28 HD11 LEU 28 -3.053 7.941 -11.353 219 2HD1 LEU 28 HD12 LEU 28 -4.544 8.600 -12.057 220 3HD1 LEU 28 HD13 LEU 28 -4.608 7.670 -10.547 221 1HD2 LEU 28 HD21 LEU 28 -2.509 6.668 -13.496 222 2HD2 LEU 28 HD22 LEU 28 -3.794 5.723 -14.287 223 3HD2 LEU 28 HD23 LEU 28 -3.944 7.463 -14.180 224 H GLY 29 H GLY 29 -4.990 2.498 -10.507 225 1HA GLY 29 HA1 GLY 29 -4.559 0.586 -9.306 226 2HA GLY 29 HA2 GLY 29 -3.042 0.386 -10.188 227 H ASP 30 H ASP 30 -2.636 -0.342 -7.856 228 HA ASP 30 HA ASP 30 -2.513 1.475 -5.712 229 1HB ASP 30 HB2 ASP 30 -2.670 -1.030 -5.598 230 2HB ASP 30 HB3 ASP 30 -0.952 -1.112 -6.015 231 H GLU 31 H GLU 31 -0.406 1.291 -8.328 232 HA GLU 31 HA GLU 31 2.107 2.153 -7.293 233 1HB GLU 31 HB2 GLU 31 1.611 1.268 -9.581 234 2HB GLU 31 HB3 GLU 31 0.646 2.694 -9.926 235 1HG GLU 31 HG2 GLU 31 2.750 4.085 -9.646 236 2HG GLU 31 HG3 GLU 31 3.653 2.575 -9.496 237 H TRP 32 H TRP 32 -0.966 3.684 -7.151 238 HA TRP 32 HA TRP 32 0.304 6.261 -6.423 239 1HB TRP 32 HB2 TRP 32 -2.316 6.089 -7.934 240 2HB TRP 32 HB3 TRP 32 -1.344 7.503 -7.594 241 HD1 TRP 32 HD1 TRP 32 -0.908 4.250 -9.659 242 HE1 TRP 32 HE1 TRP 32 -0.183 4.848 -12.019 243 HE3 TRP 32 HE3 TRP 32 -0.560 9.318 -9.108 244 HZ2 TRP 32 HZ2 TRP 32 0.237 7.225 -13.557 245 HZ3 TRP 32 HZ3 TRP 32 -0.144 10.749 -11.072 246 HH2 TRP 32 HH2 TRP 32 0.236 9.703 -13.335 247 H LYS 33 H LYS 33 -0.849 7.368 -4.809 248 HA LYS 33 HA LYS 33 -3.200 5.995 -3.578 249 1HB LYS 33 HB2 LYS 33 -1.429 8.243 -2.534 250 2HB LYS 33 HB3 LYS 33 -2.852 7.611 -1.712 251 1HG LYS 33 HG2 LYS 33 -0.325 6.021 -2.310 252 2HG LYS 33 HG3 LYS 33 -0.746 6.779 -0.778 253 1HD LYS 33 HD2 LYS 33 -1.263 4.540 -0.468 254 2HD LYS 33 HD3 LYS 33 -2.828 5.306 -0.703 255 1HE LYS 33 HE2 LYS 33 -3.120 4.302 -2.853 256 2HE LYS 33 HE3 LYS 33 -1.384 4.071 -3.067 257 1HZ LYS 33 HZ1 LYS 33 -2.410 1.963 -2.559 258 2HZ LYS 33 HZ2 LYS 33 -1.421 2.391 -1.355 259 3HZ LYS 33 HZ3 LYS 33 -3.054 2.542 -1.159 260 H VAL 34 H VAL 34 -5.112 7.020 -3.572 261 HA VAL 34 HA VAL 34 -5.282 9.344 -5.432 262 HB VAL 34 HB VAL 34 -7.236 7.024 -5.362 263 1HG1 VAL 34 HG11 VAL 34 -7.892 7.774 -7.500 264 2HG1 VAL 34 HG12 VAL 34 -7.709 9.258 -6.550 265 3HG1 VAL 34 HG13 VAL 34 -6.448 8.788 -7.703 266 1HG2 VAL 34 HG21 VAL 34 -6.087 6.013 -7.328 267 2HG2 VAL 34 HG22 VAL 34 -4.705 7.094 -7.058 268 3HG2 VAL 34 HG23 VAL 34 -5.138 5.864 -5.847 269 H TYR 35 H TYR 35 -6.178 11.012 -4.394 270 HA TYR 35 HA TYR 35 -8.496 10.491 -2.629 271 1HB TYR 35 HB2 TYR 35 -6.860 12.741 -1.680 272 2HB TYR 35 HB3 TYR 35 -7.773 11.557 -0.796 273 HD1 TYR 35 HD1 TYR 35 -6.658 9.199 -0.440 274 HD2 TYR 35 HD2 TYR 35 -4.540 12.729 -1.729 275 HE1 TYR 35 HE1 TYR 35 -4.541 8.254 0.447 276 HE2 TYR 35 HE2 TYR 35 -2.454 11.839 -0.800 277 HH TYR 35 HH TYR 35 -1.429 10.052 0.333 278 H SER 36 H SER 36 -9.630 12.578 -2.137 279 HA SER 36 HA SER 36 -9.662 14.445 -4.457 280 1HB SER 36 HB2 SER 36 -11.950 13.011 -3.032 281 2HB SER 36 HB3 SER 36 -12.150 14.272 -4.250 282 HG SER 36 HG SER 36 -11.163 11.659 -4.472 283 H ALA 37 H ALA 37 -10.145 16.532 -3.943 284 HA ALA 37 HA ALA 37 -11.510 17.176 -1.456 285 1HB ALA 37 HB1 ALA 37 -9.024 17.249 -0.924 286 2HB ALA 37 HB2 ALA 37 -8.879 18.540 -2.155 287 3HB ALA 37 HB3 ALA 37 -9.927 18.748 -0.722 288 H GLY 38 H GLY 38 -11.504 19.881 -1.653 289 1HA GLY 38 HA1 GLY 38 -11.695 20.912 -4.313 290 2HA GLY 38 HA2 GLY 38 -13.291 20.501 -3.665 291 H ILE 39 H ILE 39 -12.982 23.030 -4.211 292 HA ILE 39 HA ILE 39 -11.935 24.780 -2.214 293 HB ILE 39 HB ILE 39 -14.112 24.929 -4.308 294 1HG1 ILE 39 HG12 ILE 39 -12.710 26.720 -5.235 295 2HG1 ILE 39 HG13 ILE 39 -11.613 26.600 -3.860 296 1HG2 ILE 39 HG21 ILE 39 -13.566 27.169 -2.337 297 2HG2 ILE 39 HG22 ILE 39 -14.481 27.322 -3.854 298 3HG2 ILE 39 HG23 ILE 39 -15.099 26.290 -2.572 299 1HD1 ILE 39 HD11 ILE 39 -10.885 24.358 -4.632 300 2HD1 ILE 39 HD12 ILE 39 -12.055 24.457 -5.981 301 3HD1 ILE 39 HD13 ILE 39 -10.688 25.571 -5.885 302 H GLU 40 H GLU 40 -15.028 23.016 -2.503 303 HA GLU 40 HA GLU 40 -15.196 23.051 0.419 304 1HB GLU 40 HB2 GLU 40 -17.503 23.746 0.528 305 2HB GLU 40 HB3 GLU 40 -16.510 25.009 -0.179 306 1HG GLU 40 HG2 GLU 40 -17.295 24.385 -2.452 307 2HG GLU 40 HG3 GLU 40 -18.274 23.082 -1.772 308 H ALA 41 H ALA 41 -17.199 21.674 1.054 309 HA ALA 41 HA ALA 41 -17.751 19.316 -0.639 310 1HB ALA 41 HB1 ALA 41 -16.478 19.256 2.136 311 2HB ALA 41 HB2 ALA 41 -17.194 17.868 1.313 312 3HB ALA 41 HB3 ALA 41 -15.760 18.655 0.619 313 H HIS 42 H HIS 42 -19.668 18.284 0.172 314 HA HIS 42 HA HIS 42 -21.158 19.652 2.373 315 1HB HIS 42 HB2 HIS 42 -21.929 20.531 0.185 316 2HB HIS 42 HB3 HIS 42 -22.275 18.888 -0.358 317 HD1 HIS 42 HD1 HIS 42 -24.696 18.007 0.248 318 HD2 HIS 42 HD2 HIS 42 -23.439 21.399 2.409 319 HE1 HIS 42 HE1 HIS 42 -26.704 18.770 1.611 320 H GLY 43 H GLY 43 -20.704 16.746 0.308 321 1HA GLY 43 HA1 GLY 43 -20.656 14.937 2.438 322 2HA GLY 43 HA2 GLY 43 -22.300 14.924 1.753 323 H LEU 44 H LEU 44 -21.146 12.604 1.335 324 HA LEU 44 HA LEU 44 -19.726 12.553 -1.257 325 1HB LEU 44 HB2 LEU 44 -19.284 10.817 0.498 326 2HB LEU 44 HB3 LEU 44 -20.979 10.334 0.423 327 HG LEU 44 HG LEU 44 -20.607 9.854 -2.076 328 1HD1 LEU 44 HD11 LEU 44 -18.532 11.105 -2.453 329 2HD1 LEU 44 HD12 LEU 44 -17.687 10.114 -1.242 330 3HD1 LEU 44 HD13 LEU 44 -18.264 9.387 -2.755 331 1HD2 LEU 44 HD21 LEU 44 -20.777 8.059 -0.446 332 2HD2 LEU 44 HD22 LEU 44 -19.483 7.683 -1.598 333 3HD2 LEU 44 HD23 LEU 44 -19.082 8.271 0.027 334 H ASN 45 H ASN 45 -21.060 13.373 -2.879 335 HA ASN 45 HA ASN 45 -23.827 13.667 -2.565 336 1HB ASN 45 HB2 ASN 45 -22.341 14.978 -4.070 337 2HB ASN 45 HB3 ASN 45 -22.314 13.621 -5.203 338 1HD2 ASN 45 HD22 ASN 45 -23.485 16.513 -5.261 339 2HD2 ASN 45 HD21 ASN 45 -25.124 16.252 -5.803 340 HA PRO 46 HA PRO 46 -25.214 9.438 -3.437 341 1HB PRO 46 HB2 PRO 46 -27.751 10.917 -4.156 342 2HB PRO 46 HB3 PRO 46 -27.555 9.416 -3.199 343 1HG PRO 46 HG2 PRO 46 -27.965 11.787 -1.950 344 2HG PRO 46 HG3 PRO 46 -26.739 10.640 -1.314 345 1HD PRO 46 HD2 PRO 46 -26.300 13.097 -3.026 346 2HD PRO 46 HD3 PRO 46 -25.384 12.529 -1.595 347 H ASN 47 H ASN 47 -25.717 12.164 -5.748 348 HA ASN 47 HA ASN 47 -26.282 10.488 -8.001 349 1HB ASN 47 HB2 ASN 47 -26.434 12.357 -9.172 350 2HB ASN 47 HB3 ASN 47 -26.320 13.229 -7.661 351 1HD2 ASN 47 HD22 ASN 47 -25.051 12.948 -10.812 352 2HD2 ASN 47 HD21 ASN 47 -23.506 13.717 -10.547 353 H ALA 48 H ALA 48 -23.226 11.591 -6.517 354 HA ALA 48 HA ALA 48 -21.580 10.612 -8.670 355 1HB ALA 48 HB1 ALA 48 -19.735 10.961 -7.071 356 2HB ALA 48 HB2 ALA 48 -20.836 12.356 -7.106 357 3HB ALA 48 HB3 ALA 48 -20.883 11.206 -5.750 358 H VAL 49 H VAL 49 -22.735 9.307 -5.517 359 HA VAL 49 HA VAL 49 -21.254 6.885 -5.611 360 HB VAL 49 HB VAL 49 -23.970 7.318 -4.319 361 1HG1 VAL 49 HG11 VAL 49 -21.783 5.224 -3.928 362 2HG1 VAL 49 HG12 VAL 49 -23.220 5.415 -2.892 363 3HG1 VAL 49 HG13 VAL 49 -23.404 4.928 -4.580 364 1HG2 VAL 49 HG21 VAL 49 -22.349 8.928 -3.433 365 2HG2 VAL 49 HG22 VAL 49 -22.608 7.646 -2.252 366 3HG2 VAL 49 HG23 VAL 49 -21.138 7.644 -3.258 367 H LYS 50 H LYS 50 -24.656 7.594 -6.754 368 HA LYS 50 HA LYS 50 -24.928 4.937 -7.739 369 1HB LYS 50 HB2 LYS 50 -26.812 6.546 -7.163 370 2HB LYS 50 HB3 LYS 50 -26.522 7.335 -8.726 371 1HG LYS 50 HG2 LYS 50 -26.897 5.109 -9.856 372 2HG LYS 50 HG3 LYS 50 -27.204 4.383 -8.273 373 1HD LYS 50 HD2 LYS 50 -29.153 5.887 -7.967 374 2HD LYS 50 HD3 LYS 50 -28.837 6.607 -9.563 375 1HE LYS 50 HE2 LYS 50 -29.138 4.389 -10.630 376 2HE LYS 50 HE3 LYS 50 -29.447 3.663 -9.047 377 1HZ LYS 50 HZ1 LYS 50 -31.501 4.155 -10.208 378 2HZ LYS 50 HZ2 LYS 50 -31.419 5.066 -8.862 379 3HZ LYS 50 HZ3 LYS 50 -31.135 5.738 -10.326 380 H ALA 51 H ALA 51 -23.971 7.990 -9.420 381 HA ALA 51 HA ALA 51 -23.963 6.983 -12.027 382 1HB ALA 51 HB1 ALA 51 -22.312 8.787 -12.515 383 2HB ALA 51 HB2 ALA 51 -23.653 9.378 -11.516 384 3HB ALA 51 HB3 ALA 51 -22.069 9.032 -10.775 385 H MET 52 H MET 52 -21.312 6.849 -9.574 386 HA MET 52 HA MET 52 -19.519 5.428 -11.325 387 1HB MET 52 HB2 MET 52 -19.634 5.943 -8.326 388 2HB MET 52 HB3 MET 52 -18.274 5.190 -9.153 389 1HG MET 52 HG2 MET 52 -19.349 7.996 -9.653 390 2HG MET 52 HG3 MET 52 -17.874 7.590 -8.790 391 1HE MET 52 HE1 MET 52 -15.684 6.804 -9.870 392 2HE MET 52 HE2 MET 52 -16.582 5.363 -10.390 393 3HE MET 52 HE3 MET 52 -15.541 6.194 -11.532 394 H LYS 53 H LYS 53 -21.802 4.450 -8.713 395 HA LYS 53 HA LYS 53 -20.917 1.776 -8.545 396 1HB LYS 53 HB2 LYS 53 -22.307 2.975 -6.866 397 2HB LYS 53 HB3 LYS 53 -23.699 2.871 -7.961 398 1HG LYS 53 HG2 LYS 53 -23.629 0.407 -7.815 399 2HG LYS 53 HG3 LYS 53 -22.160 0.493 -6.815 400 1HD LYS 53 HD2 LYS 53 -23.419 1.775 -5.093 401 2HD LYS 53 HD3 LYS 53 -24.893 1.640 -6.056 402 1HE LYS 53 HE2 LYS 53 -23.285 -0.706 -4.929 403 2HE LYS 53 HE3 LYS 53 -24.708 -0.004 -4.159 404 1HZ LYS 53 HZ1 LYS 53 -25.303 -1.949 -5.419 405 2HZ LYS 53 HZ2 LYS 53 -26.013 -0.654 -6.100 406 3HZ LYS 53 HZ3 LYS 53 -24.702 -1.342 -6.803 407 H GLU 54 H GLU 54 -23.288 3.304 -10.708 408 HA GLU 54 HA GLU 54 -24.153 0.906 -11.968 409 1HB GLU 54 HB2 GLU 54 -24.143 3.843 -12.745 410 2HB GLU 54 HB3 GLU 54 -24.785 2.618 -13.840 411 1HG GLU 54 HG2 GLU 54 -25.747 3.011 -10.980 412 2HG GLU 54 HG3 GLU 54 -26.496 3.745 -12.393 413 H VAL 55 H VAL 55 -21.102 2.603 -12.292 414 HA VAL 55 HA VAL 55 -20.417 1.308 -14.856 415 HB VAL 55 HB VAL 55 -18.538 2.606 -12.833 416 1HG1 VAL 55 HG11 VAL 55 -17.353 1.289 -14.531 417 2HG1 VAL 55 HG12 VAL 55 -18.237 2.131 -15.825 418 3HG1 VAL 55 HG13 VAL 55 -17.089 3.008 -14.790 419 1HG2 VAL 55 HG21 VAL 55 -19.896 3.961 -15.197 420 2HG2 VAL 55 HG22 VAL 55 -20.220 4.279 -13.476 421 3HG2 VAL 55 HG23 VAL 55 -18.648 4.668 -14.143 422 H GLY 56 H GLY 56 -20.486 0.554 -11.448 423 1HA GLY 56 HA1 GLY 56 -20.074 -1.613 -10.562 424 2HA GLY 56 HA2 GLY 56 -18.837 -1.904 -11.796 425 H ILE 57 H ILE 57 -18.945 1.295 -10.265 426 HA ILE 57 HA ILE 57 -16.459 0.644 -8.756 427 HB ILE 57 HB ILE 57 -17.209 3.248 -10.118 428 1HG1 ILE 57 HG12 ILE 57 -15.135 1.196 -11.008 429 2HG1 ILE 57 HG13 ILE 57 -16.687 1.477 -11.797 430 1HG2 ILE 57 HG21 ILE 57 -15.766 3.435 -8.061 431 2HG2 ILE 57 HG22 ILE 57 -14.591 2.339 -8.812 432 3HG2 ILE 57 HG23 ILE 57 -14.915 3.933 -9.514 433 1HD1 ILE 57 HD11 ILE 57 -15.132 2.680 -13.078 434 2HD1 ILE 57 HD12 ILE 57 -16.002 3.890 -12.140 435 3HD1 ILE 57 HD13 ILE 57 -14.351 3.395 -11.656 436 H ASP 58 H ASP 58 -17.441 0.228 -6.846 437 HA ASP 58 HA ASP 58 -19.641 1.864 -5.830 438 1HB ASP 58 HB2 ASP 58 -19.661 -0.487 -5.329 439 2HB ASP 58 HB3 ASP 58 -18.053 -0.404 -4.590 440 H ILE 59 H ILE 59 -18.700 3.975 -5.786 441 HA ILE 59 HA ILE 59 -16.388 4.471 -4.109 442 HB ILE 59 HB ILE 59 -16.598 6.756 -4.658 443 1HG1 ILE 59 HG12 ILE 59 -19.217 6.341 -6.114 444 2HG1 ILE 59 HG13 ILE 59 -19.172 6.842 -4.425 445 1HG2 ILE 59 HG21 ILE 59 -17.299 5.193 -7.151 446 2HG2 ILE 59 HG22 ILE 59 -16.419 6.730 -7.063 447 3HG2 ILE 59 HG23 ILE 59 -15.692 5.265 -6.392 448 1HD1 ILE 59 HD11 ILE 59 -17.750 8.800 -5.042 449 2HD1 ILE 59 HD12 ILE 59 -18.008 8.406 -6.751 450 3HD1 ILE 59 HD13 ILE 59 -19.385 8.827 -5.713 451 H SER 60 H SER 60 -19.377 3.506 -3.033 452 HA SER 60 HA SER 60 -20.202 5.564 -1.348 453 1HB SER 60 HB2 SER 60 -20.347 2.611 -0.625 454 2HB SER 60 HB3 SER 60 -21.434 3.908 -0.106 455 HG SER 60 HG SER 60 -21.146 2.610 -2.576 456 H ASN 61 H ASN 61 -17.490 3.365 -0.992 457 HA ASN 61 HA ASN 61 -17.030 3.642 1.817 458 1HB ASN 61 HB2 ASN 61 -16.188 1.749 0.465 459 2HB ASN 61 HB3 ASN 61 -15.183 2.855 -0.481 460 1HD2 ASN 61 HD22 ASN 61 -15.728 1.734 2.925 461 2HD2 ASN 61 HD21 ASN 61 -14.062 1.913 3.405 462 H GLN 62 H GLN 62 -16.413 5.822 -0.856 463 HA GLN 62 HA GLN 62 -14.089 7.099 0.258 464 1HB GLN 62 HB2 GLN 62 -15.994 8.110 -1.887 465 2HB GLN 62 HB3 GLN 62 -14.380 8.730 -1.485 466 1HG GLN 62 HG2 GLN 62 -13.399 6.531 -2.103 467 2HG GLN 62 HG3 GLN 62 -14.995 5.985 -2.627 468 1HE2 GLN 62 HE22 GLN 62 -14.868 9.261 -3.561 469 2HE2 GLN 62 HE21 GLN 62 -14.383 8.937 -5.227 470 H THR 63 H THR 63 -14.327 9.596 0.673 471 HA THR 63 HA THR 63 -16.870 10.445 1.762 472 HB THR 63 HB THR 63 -15.590 11.257 3.895 473 HG1 THR 63 HG1 THR 63 -13.517 10.540 3.300 474 1HG2 THR 63 HG21 THR 63 -17.429 9.525 3.832 475 2HG2 THR 63 HG22 THR 63 -16.173 8.275 3.732 476 3HG2 THR 63 HG23 THR 63 -16.261 9.336 5.152 477 H SER 64 H SER 64 -16.933 12.789 2.114 478 HA SER 64 HA SER 64 -15.201 14.127 0.208 479 1HB SER 64 HB2 SER 64 -17.849 14.757 1.599 480 2HB SER 64 HB3 SER 64 -17.040 15.870 0.482 481 HG SER 64 HG SER 64 -18.608 14.429 -0.522 482 H ASP 65 H ASP 65 -14.139 16.062 0.624 483 HA ASP 65 HA ASP 65 -13.960 17.214 3.284 484 1HB ASP 65 HB2 ASP 65 -12.338 15.224 3.282 485 2HB ASP 65 HB3 ASP 65 -11.472 16.042 1.974 486 H ILE 66 H ILE 66 -12.590 19.216 3.157 487 HA ILE 66 HA ILE 66 -12.608 20.379 0.430 488 HB ILE 66 HB ILE 66 -12.755 22.477 1.394 489 1HG1 ILE 66 HG12 ILE 66 -12.066 21.257 4.090 490 2HG1 ILE 66 HG13 ILE 66 -11.104 22.409 3.139 491 1HG2 ILE 66 HG21 ILE 66 -14.490 20.831 3.280 492 2HG2 ILE 66 HG22 ILE 66 -14.856 22.397 2.538 493 3HG2 ILE 66 HG23 ILE 66 -14.782 20.931 1.541 494 1HD1 ILE 66 HD11 ILE 66 -13.727 22.924 4.563 495 2HD1 ILE 66 HD12 ILE 66 -12.145 23.655 4.887 496 3HD1 ILE 66 HD13 ILE 66 -13.020 24.056 3.383 497 H ILE 67 H ILE 67 -10.651 21.820 0.003 498 HA ILE 67 HA ILE 67 -8.497 20.077 -0.093 499 HB ILE 67 HB ILE 67 -8.941 21.662 -1.771 500 1HG1 ILE 67 HG12 ILE 67 -6.641 20.671 -1.384 501 2HG1 ILE 67 HG13 ILE 67 -6.813 22.012 -2.499 502 1HG2 ILE 67 HG21 ILE 67 -8.050 23.905 0.065 503 2HG2 ILE 67 HG22 ILE 67 -8.359 24.024 -1.677 504 3HG2 ILE 67 HG23 ILE 67 -9.688 23.626 -0.581 505 1HD1 ILE 67 HD11 ILE 67 -5.739 22.352 0.318 506 2HD1 ILE 67 HD12 ILE 67 -4.776 22.212 -1.157 507 3HD1 ILE 67 HD13 ILE 67 -5.870 23.588 -0.940 508 H ASP 68 H ASP 68 -7.165 19.338 1.253 509 HA ASP 68 HA ASP 68 -6.142 20.935 3.540 510 1HB ASP 68 HB2 ASP 68 -6.788 18.654 4.089 511 2HB ASP 68 HB3 ASP 68 -5.830 18.004 2.753 512 H SER 69 H SER 69 -4.342 22.096 3.168 513 HA SER 69 HA SER 69 -3.085 22.108 0.657 514 1HB SER 69 HB2 SER 69 -2.031 23.352 3.222 515 2HB SER 69 HB3 SER 69 -1.836 23.944 1.562 516 HG SER 69 HG SER 69 -3.469 25.062 2.790 517 H ASP 70 H ASP 70 -2.296 20.195 3.503 518 HA ASP 70 HA ASP 70 0.549 20.121 2.958 519 1HB ASP 70 HB2 ASP 70 -0.185 19.890 5.258 520 2HB ASP 70 HB3 ASP 70 -1.173 18.488 4.846 521 H ILE 71 H ILE 71 -2.299 18.020 2.406 522 HA ILE 71 HA ILE 71 -0.771 15.916 1.156 523 HB ILE 71 HB ILE 71 -3.701 16.681 0.852 524 1HG1 ILE 71 HG12 ILE 71 -2.252 14.423 2.323 525 2HG1 ILE 71 HG13 ILE 71 -2.951 15.850 3.092 526 1HG2 ILE 71 HG21 ILE 71 -2.941 15.506 -1.202 527 2HG2 ILE 71 HG22 ILE 71 -2.184 14.246 -0.205 528 3HG2 ILE 71 HG23 ILE 71 -3.960 14.453 -0.250 529 1HD1 ILE 71 HD11 ILE 71 -5.217 15.126 2.219 530 2HD1 ILE 71 HD12 ILE 71 -4.452 13.589 1.729 531 3HD1 ILE 71 HD13 ILE 71 -4.479 14.058 3.434 532 H LEU 72 H LEU 72 -2.382 18.867 -0.175 533 HA LEU 72 HA LEU 72 -1.722 18.450 -2.875 534 1HB LEU 72 HB2 LEU 72 -3.222 20.208 -2.072 535 2HB LEU 72 HB3 LEU 72 -1.923 20.999 -1.226 536 HG LEU 72 HG LEU 72 -1.203 20.694 -4.043 537 1HD1 LEU 72 HD11 LEU 72 -3.878 22.058 -3.507 538 2HD1 LEU 72 HD12 LEU 72 -2.954 22.138 -5.027 539 3HD1 LEU 72 HD13 LEU 72 -3.617 20.593 -4.464 540 1HD2 LEU 72 HD21 LEU 72 -1.053 23.190 -3.848 541 2HD2 LEU 72 HD22 LEU 72 -1.782 23.074 -2.238 542 3HD2 LEU 72 HD23 LEU 72 -0.215 22.325 -2.553 543 H ASN 73 H ASN 73 0.238 20.054 -0.305 544 HA ASN 73 HA ASN 73 2.442 20.532 -2.055 545 1HB ASN 73 HB2 ASN 73 2.016 20.748 0.928 546 2HB ASN 73 HB3 ASN 73 3.642 20.849 0.276 547 1HD2 ASN 73 HD22 ASN 73 0.429 22.415 0.136 548 2HD2 ASN 73 HD21 ASN 73 0.972 23.880 -0.668 549 H ASN 74 H ASN 74 1.432 17.520 -0.899 550 HA ASN 74 HA ASN 74 4.215 16.399 -0.953 551 1HB ASN 74 HB2 ASN 74 1.598 15.384 0.226 552 2HB ASN 74 HB3 ASN 74 2.912 14.291 -0.151 553 1HD2 ASN 74 HD22 ASN 74 1.773 16.621 2.111 554 2HD2 ASN 74 HD21 ASN 74 3.082 16.441 3.258 555 H ALA 75 H ALA 75 1.198 16.634 -2.732 556 HA ALA 75 HA ALA 75 1.163 14.059 -3.811 557 1HB ALA 75 HB1 ALA 75 -0.769 15.599 -3.738 558 2HB ALA 75 HB2 ALA 75 -0.001 16.610 -4.988 559 3HB ALA 75 HB3 ALA 75 -0.497 14.943 -5.361 560 H ASP 76 H ASP 76 1.735 13.240 -5.966 561 HA ASP 76 HA ASP 76 4.144 14.424 -7.179 562 1HB ASP 76 HB2 ASP 76 3.702 11.961 -7.357 563 2HB ASP 76 HB3 ASP 76 2.208 12.308 -8.243 564 H LEU 77 H LEU 77 0.649 14.371 -7.556 565 HA LEU 77 HA LEU 77 0.689 16.423 -9.672 566 1HB LEU 77 HB2 LEU 77 0.696 14.311 -10.807 567 2HB LEU 77 HB3 LEU 77 -0.508 13.647 -9.703 568 HG LEU 77 HG LEU 77 -2.211 15.196 -10.596 569 1HD1 LEU 77 HD11 LEU 77 -1.926 16.417 -12.641 570 2HD1 LEU 77 HD12 LEU 77 -0.644 16.963 -11.560 571 3HD1 LEU 77 HD13 LEU 77 -0.281 15.816 -12.868 572 1HD2 LEU 77 HD21 LEU 77 -0.802 13.458 -12.640 573 2HD2 LEU 77 HD22 LEU 77 -1.925 12.874 -11.406 574 3HD2 LEU 77 HD23 LEU 77 -2.517 13.937 -12.691 575 H VAL 78 H VAL 78 -1.021 17.707 -9.650 576 HA VAL 78 HA VAL 78 -3.339 17.137 -7.867 577 HB VAL 78 HB VAL 78 -2.089 19.827 -8.580 578 1HG1 VAL 78 HG11 VAL 78 -4.560 19.990 -8.348 579 2HG1 VAL 78 HG12 VAL 78 -4.471 19.168 -6.776 580 3HG1 VAL 78 HG13 VAL 78 -3.748 20.781 -6.998 581 1HG2 VAL 78 HG21 VAL 78 -0.766 18.604 -6.877 582 2HG2 VAL 78 HG22 VAL 78 -1.551 20.020 -6.204 583 3HG2 VAL 78 HG23 VAL 78 -2.224 18.396 -5.886 584 H VAL 79 H VAL 79 -5.335 17.268 -8.963 585 HA VAL 79 HA VAL 79 -5.188 17.989 -11.870 586 HB VAL 79 HB VAL 79 -6.859 15.779 -10.634 587 1HG1 VAL 79 HG11 VAL 79 -7.890 16.836 -12.616 588 2HG1 VAL 79 HG12 VAL 79 -6.372 16.646 -13.524 589 3HG1 VAL 79 HG13 VAL 79 -7.310 15.219 -13.028 590 1HG2 VAL 79 HG21 VAL 79 -4.311 15.627 -12.294 591 2HG2 VAL 79 HG22 VAL 79 -4.554 15.035 -10.630 592 3HG2 VAL 79 HG23 VAL 79 -5.390 14.252 -11.971 593 H THR 80 H THR 80 -6.145 19.856 -12.062 594 HA THR 80 HA THR 80 -8.277 20.686 -10.196 595 HB THR 80 HB THR 80 -7.949 22.911 -11.334 596 HG1 THR 80 HG1 THR 80 -5.776 21.522 -12.555 597 1HG2 THR 80 HG21 THR 80 -5.612 21.586 -9.890 598 2HG2 THR 80 HG22 THR 80 -5.774 23.325 -10.164 599 3HG2 THR 80 HG23 THR 80 -6.971 22.479 -9.169 600 H LEU 81 H LEU 81 -10.006 19.504 -10.776 601 HA LEU 81 HA LEU 81 -10.583 18.729 -13.465 602 1HB LEU 81 HB2 LEU 81 -12.237 18.711 -10.924 603 2HB LEU 81 HB3 LEU 81 -12.786 17.976 -12.428 604 HG LEU 81 HG LEU 81 -10.229 17.155 -10.977 605 1HD1 LEU 81 HD11 LEU 81 -11.517 15.225 -10.203 606 2HD1 LEU 81 HD12 LEU 81 -12.230 16.738 -9.620 607 3HD1 LEU 81 HD13 LEU 81 -12.982 15.863 -10.978 608 1HD2 LEU 81 HD21 LEU 81 -10.420 15.104 -12.393 609 2HD2 LEU 81 HD22 LEU 81 -11.790 15.836 -13.248 610 3HD2 LEU 81 HD23 LEU 81 -10.177 16.550 -13.372 611 H CYS 82 H CYS 82 -11.074 21.831 -12.098 612 HA CYS 82 HA CYS 82 -12.680 22.471 -14.400 613 1HB CYS 82 HB2 CYS 82 -14.464 23.607 -13.259 614 2HB CYS 82 HB3 CYS 82 -14.391 21.955 -12.611 615 HG CYS 82 HG CYS 82 -14.909 23.850 -10.711 616 H GLY 83 H GLY 83 -12.506 24.809 -14.856 617 1HA GLY 83 HA1 GLY 83 -9.808 25.551 -14.592 618 2HA GLY 83 HA2 GLY 83 -11.108 26.569 -15.239 619 H ASP 84 H ASP 84 -12.735 26.842 -12.921 620 HA ASP 84 HA ASP 84 -11.367 29.008 -11.680 621 1HB ASP 84 HB2 ASP 84 -13.815 28.904 -11.973 622 2HB ASP 84 HB3 ASP 84 -13.903 27.597 -10.791 623 H ALA 85 H ALA 85 -11.748 25.597 -10.682 624 HA ALA 85 HA ALA 85 -10.998 25.972 -7.962 625 1HB ALA 85 HB1 ALA 85 -11.999 23.876 -8.714 626 2HB ALA 85 HB2 ALA 85 -10.600 23.538 -9.764 627 3HB ALA 85 HB3 ALA 85 -10.416 23.551 -7.997 628 H ALA 86 H ALA 86 -9.088 25.920 -10.919 629 HA ALA 86 HA ALA 86 -6.591 25.256 -9.696 630 1HB ALA 86 HB1 ALA 86 -7.086 26.827 -12.249 631 2HB ALA 86 HB2 ALA 86 -5.644 25.884 -11.827 632 3HB ALA 86 HB3 ALA 86 -7.186 25.051 -12.136 633 H ASP 87 H ASP 87 -8.461 28.184 -9.518 634 HA ASP 87 HA ASP 87 -6.292 30.005 -9.037 635 1HB ASP 87 HB2 ASP 87 -8.639 30.696 -9.545 636 2HB ASP 87 HB3 ASP 87 -9.146 30.006 -7.992 637 H LYS 88 H LYS 88 -7.954 27.559 -7.110 638 HA LYS 88 HA LYS 88 -7.404 28.802 -4.560 639 1HB LYS 88 HB2 LYS 88 -9.379 27.392 -5.023 640 2HB LYS 88 HB3 LYS 88 -8.329 25.993 -5.288 641 1HG LYS 88 HG2 LYS 88 -9.389 25.845 -3.165 642 2HG LYS 88 HG3 LYS 88 -7.649 26.023 -2.941 643 1HD LYS 88 HD2 LYS 88 -7.933 28.380 -2.300 644 2HD LYS 88 HD3 LYS 88 -9.671 28.303 -2.693 645 1HE LYS 88 HE2 LYS 88 -9.981 26.541 -0.992 646 2HE LYS 88 HE3 LYS 88 -8.257 26.586 -0.604 647 1HZ LYS 88 HZ1 LYS 88 -8.553 28.881 0.151 648 2HZ LYS 88 HZ2 LYS 88 -10.148 28.842 -0.205 649 3HZ LYS 88 HZ3 LYS 88 -9.549 27.892 0.974 650 H CYS 89 H CYS 89 -5.773 26.270 -6.407 651 HA CYS 89 HA CYS 89 -4.520 24.729 -4.671 652 1HB CYS 89 HB2 CYS 89 -3.177 25.946 -7.098 653 2HB CYS 89 HB3 CYS 89 -2.687 24.454 -6.281 654 HG CYS 89 HG CYS 89 -4.974 23.191 -6.557 655 HA PRO 90 HA PRO 90 -2.015 27.742 -2.349 656 1HB PRO 90 HB2 PRO 90 -1.915 26.521 0.067 657 2HB PRO 90 HB3 PRO 90 -3.393 27.303 -0.572 658 1HG PRO 90 HG2 PRO 90 -2.676 24.368 -0.655 659 2HG PRO 90 HG3 PRO 90 -4.225 25.119 -0.139 660 1HD PRO 90 HD2 PRO 90 -3.820 24.119 -2.659 661 2HD PRO 90 HD3 PRO 90 -4.887 25.506 -2.328 662 H MET 91 H MET 91 -0.586 26.983 -4.079 663 HA MET 91 HA MET 91 1.561 26.935 -4.669 664 1HB MET 91 HB2 MET 91 2.319 25.957 -1.890 665 2HB MET 91 HB3 MET 91 3.410 26.484 -3.165 666 1HG MET 91 HG2 MET 91 2.364 28.731 -3.150 667 2HG MET 91 HG3 MET 91 1.301 28.221 -1.833 668 1HE MET 91 HE1 MET 91 2.006 30.312 -0.407 669 2HE MET 91 HE2 MET 91 3.693 30.758 -0.066 670 3HE MET 91 HE3 MET 91 3.071 30.844 -1.728 671 H THR 92 H THR 92 1.785 25.512 -6.261 672 HA THR 92 HA THR 92 2.242 22.646 -5.584 673 HB THR 92 HB THR 92 1.408 22.170 -7.898 674 HG1 THR 92 HG1 THR 92 1.485 24.307 -8.725 675 1HG2 THR 92 HG21 THR 92 -0.922 22.215 -7.304 676 2HG2 THR 92 HG22 THR 92 0.023 21.838 -5.856 677 3HG2 THR 92 HG23 THR 92 -0.637 23.470 -6.079 678 HA PRO 93 HA PRO 93 6.182 24.620 -7.050 679 1HB PRO 93 HB2 PRO 93 7.897 23.167 -5.449 680 2HB PRO 93 HB3 PRO 93 7.003 24.608 -4.884 681 1HG PRO 93 HG2 PRO 93 6.258 21.689 -4.548 682 2HG PRO 93 HG3 PRO 93 6.307 22.970 -3.293 683 1HD PRO 93 HD2 PRO 93 3.997 22.266 -4.515 684 2HD PRO 93 HD3 PRO 93 4.337 23.974 -4.109 685 HA PRO 94 HA PRO 94 7.422 21.761 -10.131 686 1HB PRO 94 HB2 PRO 94 10.132 21.419 -8.826 687 2HB PRO 94 HB3 PRO 94 9.747 21.623 -10.567 688 1HG PRO 94 HG2 PRO 94 10.554 23.762 -9.130 689 2HG PRO 94 HG3 PRO 94 9.147 23.926 -10.232 690 1HD PRO 94 HD2 PRO 94 9.167 23.569 -7.239 691 2HD PRO 94 HD3 PRO 94 8.133 24.628 -8.242 692 H HIS 95 H HIS 95 8.155 20.494 -6.876 693 HA HIS 95 HA HIS 95 8.327 17.723 -7.621 694 1HB HIS 95 HB2 HIS 95 7.546 18.970 -4.955 695 2HB HIS 95 HB3 HIS 95 8.108 17.322 -5.213 696 HD1 HIS 95 HD1 HIS 95 10.791 17.355 -6.452 697 HD2 HIS 95 HD2 HIS 95 9.405 20.577 -4.117 698 HE1 HIS 95 HE1 HIS 95 12.854 18.659 -5.733 699 H VAL 96 H VAL 96 5.683 19.805 -7.712 700 HA VAL 96 HA VAL 96 3.583 17.726 -7.387 701 HB VAL 96 HB VAL 96 3.507 20.635 -6.436 702 1HG1 VAL 96 HG11 VAL 96 1.441 20.009 -5.339 703 2HG1 VAL 96 HG12 VAL 96 1.336 19.638 -7.063 704 3HG1 VAL 96 HG13 VAL 96 1.609 18.331 -5.892 705 1HG2 VAL 96 HG21 VAL 96 3.983 18.205 -4.694 706 2HG2 VAL 96 HG22 VAL 96 5.071 19.581 -4.945 707 3HG2 VAL 96 HG23 VAL 96 3.534 19.816 -4.114 708 H LYS 97 H LYS 97 3.584 17.505 -9.684 709 HA LYS 97 HA LYS 97 3.430 19.862 -11.397 710 1HB LYS 97 HB2 LYS 97 3.470 18.409 -13.192 711 2HB LYS 97 HB3 LYS 97 4.395 17.531 -11.985 712 1HG LYS 97 HG2 LYS 97 2.007 16.424 -11.468 713 2HG LYS 97 HG3 LYS 97 1.663 16.986 -13.117 714 1HD LYS 97 HD2 LYS 97 3.751 15.740 -13.868 715 2HD LYS 97 HD3 LYS 97 3.901 15.143 -12.200 716 1HE LYS 97 HE2 LYS 97 1.386 14.378 -12.581 717 2HE LYS 97 HE3 LYS 97 1.788 14.492 -14.294 718 1HZ LYS 97 HZ1 LYS 97 3.685 12.947 -13.755 719 2HZ LYS 97 HZ2 LYS 97 3.128 12.831 -12.204 720 3HZ LYS 97 HZ3 LYS 97 2.231 12.268 -13.458 721 H ARG 98 H ARG 98 1.410 20.004 -12.877 722 HA ARG 98 HA ARG 98 -1.055 19.337 -11.414 723 1HB ARG 98 HB2 ARG 98 -0.231 21.597 -10.644 724 2HB ARG 98 HB3 ARG 98 -0.457 22.187 -12.298 725 1HG ARG 98 HG2 ARG 98 -2.876 21.725 -12.155 726 2HG ARG 98 HG3 ARG 98 -2.650 20.898 -10.609 727 1HD ARG 98 HD2 ARG 98 -3.514 23.036 -10.111 728 2HD ARG 98 HD3 ARG 98 -1.815 23.064 -9.625 729 HE ARG 98 HE ARG 98 -1.741 24.049 -12.185 730 1HH1 ARG 98 HH21 ARG 98 -3.587 24.935 -9.302 731 2HH1 ARG 98 HH22 ARG 98 -3.877 26.566 -9.791 732 1HH2 ARG 98 HH11 ARG 98 -2.007 26.268 -12.807 733 2HH2 ARG 98 HH12 ARG 98 -2.850 27.362 -11.780 734 H GLU 99 H GLU 99 -2.901 19.268 -12.720 735 HA GLU 99 HA GLU 99 -2.630 19.948 -15.562 736 1HB GLU 99 HB2 GLU 99 -2.095 17.515 -15.299 737 2HB GLU 99 HB3 GLU 99 -3.673 17.258 -14.561 738 1HG GLU 99 HG2 GLU 99 -3.497 16.589 -16.955 739 2HG GLU 99 HG3 GLU 99 -4.801 17.730 -16.626 740 H HIS 100 H HIS 100 -4.901 20.045 -16.540 741 HA HIS 100 HA HIS 100 -6.900 20.909 -14.558 742 1HB HIS 100 HB2 HIS 100 -7.040 23.116 -15.470 743 2HB HIS 100 HB3 HIS 100 -5.395 22.829 -14.935 744 HD1 HIS 100 HD1 HIS 100 -4.432 21.367 -17.822 745 HD2 HIS 100 HD2 HIS 100 -6.476 25.010 -17.181 746 HE1 HIS 100 HE1 HIS 100 -3.960 22.821 -19.838 747 H TRP 101 H TRP 101 -8.986 21.026 -15.299 748 HA TRP 101 HA TRP 101 -9.651 20.520 -18.123 749 1HB TRP 101 HB2 TRP 101 -10.843 18.884 -15.874 750 2HB TRP 101 HB3 TRP 101 -11.061 18.697 -17.614 751 HD1 TRP 101 HD1 TRP 101 -8.800 17.735 -14.771 752 HE1 TRP 101 HE1 TRP 101 -6.935 16.170 -15.531 753 HE3 TRP 101 HE3 TRP 101 -9.431 18.138 -19.839 754 HZ2 TRP 101 HZ2 TRP 101 -5.832 15.211 -18.022 755 HZ3 TRP 101 HZ3 TRP 101 -7.917 16.924 -21.383 756 HH2 TRP 101 HH2 TRP 101 -6.128 15.435 -20.480 757 H GLY 102 H GLY 102 -12.469 20.393 -17.738 758 1HA GLY 102 HA1 GLY 102 -13.095 23.013 -16.435 759 2HA GLY 102 HA2 GLY 102 -13.359 22.755 -18.152 760 H PHE 103 H PHE 103 -14.012 20.494 -15.374 761 HA PHE 103 HA PHE 103 -16.558 19.881 -16.603 762 1HB PHE 103 HB2 PHE 103 -15.162 18.810 -14.134 763 2HB PHE 103 HB3 PHE 103 -16.767 18.285 -14.653 764 HD1 PHE 103 HD1 PHE 103 -17.120 17.329 -16.956 765 HD2 PHE 103 HD2 PHE 103 -13.181 18.022 -15.343 766 HE1 PHE 103 HE1 PHE 103 -16.122 16.096 -18.854 767 HE2 PHE 103 HE2 PHE 103 -12.178 16.829 -17.244 768 HZ PHE 103 HZ PHE 103 -13.659 15.878 -19.041 769 H ASP 104 H ASP 104 -18.308 20.949 -16.385 770 HA ASP 104 HA ASP 104 -18.986 22.795 -14.275 771 1HB ASP 104 HB2 ASP 104 -19.923 22.889 -16.592 772 2HB ASP 104 HB3 ASP 104 -20.690 21.315 -16.315 773 H ASP 105 H ASP 105 -20.691 22.432 -12.678 774 HA ASP 105 HA ASP 105 -20.214 19.933 -11.340 775 1HB ASP 105 HB2 ASP 105 -20.484 22.181 -10.239 776 2HB ASP 105 HB3 ASP 105 -22.220 22.042 -10.528 777 HA PRO 106 HA PRO 106 -23.511 18.010 -13.568 778 1HB PRO 106 HB2 PRO 106 -23.498 15.474 -12.429 779 2HB PRO 106 HB3 PRO 106 -22.297 16.044 -13.625 780 1HG PRO 106 HG2 PRO 106 -22.068 15.991 -10.603 781 2HG PRO 106 HG3 PRO 106 -20.859 15.458 -11.816 782 1HD PRO 106 HD2 PRO 106 -20.720 17.908 -10.640 783 2HD PRO 106 HD3 PRO 106 -20.296 17.688 -12.364 784 H ALA 107 H ALA 107 -23.538 17.995 -10.003 785 HA ALA 107 HA ALA 107 -26.204 17.015 -9.773 786 1HB ALA 107 HB1 ALA 107 -26.034 17.739 -7.433 787 2HB ALA 107 HB2 ALA 107 -24.558 16.893 -7.956 788 3HB ALA 107 HB3 ALA 107 -24.567 18.665 -7.807 789 H ARG 108 H ARG 108 -25.013 20.124 -10.735 790 HA ARG 108 HA ARG 108 -27.630 21.428 -10.168 791 1HB ARG 108 HB2 ARG 108 -24.862 22.574 -10.785 792 2HB ARG 108 HB3 ARG 108 -26.338 23.529 -10.714 793 1HG ARG 108 HG2 ARG 108 -25.539 23.859 -8.616 794 2HG ARG 108 HG3 ARG 108 -26.694 22.541 -8.362 795 1HD ARG 108 HD2 ARG 108 -24.783 20.926 -8.376 796 2HD ARG 108 HD3 ARG 108 -23.667 22.287 -8.587 797 HE ARG 108 HE ARG 108 -25.188 22.877 -6.329 798 1HH1 ARG 108 HH21 ARG 108 -22.900 20.312 -7.302 799 2HH1 ARG 108 HH22 ARG 108 -22.390 19.987 -5.682 800 1HH2 ARG 108 HH11 ARG 108 -24.510 22.413 -4.185 801 2HH2 ARG 108 HH12 ARG 108 -23.343 21.187 -3.875 802 H ALA 109 H ALA 109 -26.505 19.571 -12.611 803 HA ALA 109 HA ALA 109 -26.605 21.136 -14.888 804 1HB ALA 109 HB1 ALA 109 -27.186 19.033 -16.091 805 2HB ALA 109 HB2 ALA 109 -25.916 18.777 -14.879 806 3HB ALA 109 HB3 ALA 109 -27.584 18.264 -14.540 807 H GLN 110 H GLN 110 -29.320 19.723 -13.150 808 HA GLN 110 HA GLN 110 -31.554 19.993 -13.160 809 1HB GLN 110 HB2 GLN 110 -30.677 22.797 -13.907 810 2HB GLN 110 HB3 GLN 110 -32.328 22.404 -13.440 811 1HG GLN 110 HG2 GLN 110 -31.719 21.749 -11.241 812 2HG GLN 110 HG3 GLN 110 -29.999 21.718 -11.619 813 1HE2 GLN 110 HE22 GLN 110 -28.896 23.749 -12.113 814 2HE2 GLN 110 HE21 GLN 110 -29.497 25.252 -11.426 815 H GLY 111 H GLY 111 -33.435 21.300 -14.585 816 1HA GLY 111 HA1 GLY 111 -34.199 21.721 -16.844 817 2HA GLY 111 HA2 GLY 111 -33.236 20.346 -17.411 818 H THR 112 H THR 112 -33.703 18.246 -16.134 819 HA THR 112 HA THR 112 -36.137 17.848 -14.759 820 HB THR 112 HB THR 112 -37.197 17.907 -16.946 821 HG1 THR 112 HG1 THR 112 -38.113 16.379 -15.756 822 1HG2 THR 112 HG21 THR 112 -36.638 16.262 -18.729 823 2HG2 THR 112 HG22 THR 112 -35.395 17.493 -18.488 824 3HG2 THR 112 HG23 THR 112 -35.151 15.854 -17.849 825 H GLU 113 H GLU 113 -36.133 15.455 -14.043 826 HA GLU 113 HA GLU 113 -33.591 14.906 -12.990 827 1HB GLU 113 HB2 GLU 113 -35.648 14.129 -11.960 828 2HB GLU 113 HB3 GLU 113 -36.022 13.105 -13.355 829 1HG GLU 113 HG2 GLU 113 -34.084 11.692 -12.914 830 2HG GLU 113 HG3 GLU 113 -33.544 12.768 -11.616 831 H GLU 114 H GLU 114 -35.156 13.558 -15.883 832 HA GLU 114 HA GLU 114 -33.063 11.677 -16.394 833 1HB GLU 114 HB2 GLU 114 -34.101 11.342 -18.574 834 2HB GLU 114 HB3 GLU 114 -35.282 11.294 -17.268 835 1HG GLU 114 HG2 GLU 114 -36.006 13.597 -17.814 836 2HG GLU 114 HG3 GLU 114 -34.806 13.677 -19.110 837 H GLU 115 H GLU 115 -33.375 15.114 -17.092 838 HA GLU 115 HA GLU 115 -31.290 15.145 -19.088 839 1HB GLU 115 HB2 GLU 115 -33.131 16.858 -18.946 840 2HB GLU 115 HB3 GLU 115 -32.406 17.448 -17.450 841 1HG GLU 115 HG2 GLU 115 -31.702 18.896 -19.191 842 2HG GLU 115 HG3 GLU 115 -30.295 17.950 -18.731 843 H LYS 116 H LYS 116 -31.614 15.696 -15.547 844 HA LYS 116 HA LYS 116 -28.895 16.399 -15.080 845 1HB LYS 116 HB2 LYS 116 -30.713 14.834 -13.190 846 2HB LYS 116 HB3 LYS 116 -29.219 15.675 -12.783 847 1HG LYS 116 HG2 LYS 116 -30.314 17.821 -13.573 848 2HG LYS 116 HG3 LYS 116 -31.818 16.911 -13.727 849 1HD LYS 116 HD2 LYS 116 -31.961 17.936 -11.622 850 2HD LYS 116 HD3 LYS 116 -31.570 16.229 -11.307 851 1HE LYS 116 HE2 LYS 116 -29.171 16.859 -10.993 852 2HE LYS 116 HE3 LYS 116 -29.560 18.539 -11.368 853 1HZ LYS 116 HZ1 LYS 116 -30.486 17.045 -8.989 854 2HZ LYS 116 HZ2 LYS 116 -29.406 18.281 -9.043 855 3HZ LYS 116 HZ3 LYS 116 -30.982 18.559 -9.368 856 H TRP 117 H TRP 117 -30.533 13.237 -14.881 857 HA TRP 117 HA TRP 117 -28.193 11.719 -14.438 858 1HB TRP 117 HB2 TRP 117 -30.481 10.808 -14.202 859 2HB TRP 117 HB3 TRP 117 -30.661 10.816 -15.959 860 HD1 TRP 117 HD1 TRP 117 -29.305 8.980 -17.334 861 HE1 TRP 117 HE1 TRP 117 -28.138 6.783 -16.700 862 HE3 TRP 117 HE3 TRP 117 -29.004 9.648 -12.269 863 HZ2 TRP 117 HZ2 TRP 117 -26.933 5.636 -14.370 864 HZ3 TRP 117 HZ3 TRP 117 -27.654 8.089 -10.895 865 HH2 TRP 117 HH2 TRP 117 -26.608 6.079 -11.931 866 H ALA 118 H ALA 118 -29.651 12.768 -17.552 867 HA ALA 118 HA ALA 118 -27.839 11.371 -19.215 868 1HB ALA 118 HB1 ALA 118 -29.246 14.029 -19.711 869 2HB ALA 118 HB2 ALA 118 -28.473 13.032 -20.950 870 3HB ALA 118 HB3 ALA 118 -29.884 12.410 -20.075 871 H PHE 119 H PHE 119 -27.492 14.528 -17.550 872 HA PHE 119 HA PHE 119 -24.942 15.095 -18.752 873 1HB PHE 119 HB2 PHE 119 -26.634 16.743 -17.771 874 2HB PHE 119 HB3 PHE 119 -26.058 16.257 -16.182 875 HD1 PHE 119 HD1 PHE 119 -25.157 17.907 -19.392 876 HD2 PHE 119 HD2 PHE 119 -23.867 16.982 -15.391 877 HE1 PHE 119 HE1 PHE 119 -23.308 19.550 -19.609 878 HE2 PHE 119 HE2 PHE 119 -22.053 18.689 -15.576 879 HZ PHE 119 HZ PHE 119 -21.759 19.939 -17.713 880 H PHE 120 H PHE 120 -25.984 13.489 -15.684 881 HA PHE 120 HA PHE 120 -23.448 13.144 -14.477 882 1HB PHE 120 HB2 PHE 120 -25.614 11.036 -14.534 883 2HB PHE 120 HB3 PHE 120 -24.293 11.184 -13.406 884 HD1 PHE 120 HD1 PHE 120 -25.261 14.525 -13.465 885 HD2 PHE 120 HD2 PHE 120 -26.759 10.647 -12.332 886 HE1 PHE 120 HE1 PHE 120 -26.837 15.584 -11.897 887 HE2 PHE 120 HE2 PHE 120 -28.406 11.729 -10.821 888 HZ PHE 120 HZ PHE 120 -28.437 14.204 -10.590 889 H GLN 121 H GLN 121 -25.145 11.179 -17.008 890 HA GLN 121 HA GLN 121 -23.125 9.262 -17.407 891 1HB GLN 121 HB2 GLN 121 -25.114 10.407 -19.403 892 2HB GLN 121 HB3 GLN 121 -24.066 9.047 -19.741 893 1HG GLN 121 HG2 GLN 121 -26.155 9.133 -17.524 894 2HG GLN 121 HG3 GLN 121 -26.347 8.344 -19.083 895 1HE2 GLN 121 HE22 GLN 121 -25.829 7.580 -15.953 896 2HE2 GLN 121 HE21 GLN 121 -24.802 6.178 -16.140 897 H ARG 122 H ARG 122 -23.486 12.437 -19.056 898 HA ARG 122 HA ARG 122 -21.182 12.095 -20.710 899 1HB ARG 122 HB2 ARG 122 -22.637 14.590 -19.748 900 2HB ARG 122 HB3 ARG 122 -21.080 14.723 -20.549 901 1HG ARG 122 HG2 ARG 122 -22.670 15.023 -22.250 902 2HG ARG 122 HG3 ARG 122 -21.970 13.414 -22.494 903 1HD ARG 122 HD2 ARG 122 -23.954 12.452 -21.279 904 2HD ARG 122 HD3 ARG 122 -24.648 14.091 -21.215 905 HE ARG 122 HE ARG 122 -24.137 13.640 -23.894 906 1HH1 ARG 122 HH21 ARG 122 -26.012 12.061 -21.347 907 2HH1 ARG 122 HH22 ARG 122 -27.124 11.278 -22.430 908 1HH2 ARG 122 HH11 ARG 122 -25.662 12.675 -25.357 909 2HH2 ARG 122 HH12 ARG 122 -26.947 11.695 -24.764 910 H VAL 123 H VAL 123 -21.478 13.668 -17.477 911 HA VAL 123 HA VAL 123 -18.704 14.311 -17.431 912 HB VAL 123 HB VAL 123 -20.751 14.117 -15.178 913 1HG1 VAL 123 HG11 VAL 123 -17.948 15.331 -15.116 914 2HG1 VAL 123 HG12 VAL 123 -19.186 15.537 -13.858 915 3HG1 VAL 123 HG13 VAL 123 -18.510 13.936 -14.169 916 1HG2 VAL 123 HG21 VAL 123 -21.241 15.877 -16.865 917 2HG2 VAL 123 HG22 VAL 123 -20.700 16.620 -15.358 918 3HG2 VAL 123 HG23 VAL 123 -19.588 16.498 -16.724 919 H ARG 124 H ARG 124 -20.399 11.359 -15.982 920 HA ARG 124 HA ARG 124 -17.927 10.430 -14.942 921 1HB ARG 124 HB2 ARG 124 -18.873 8.254 -14.668 922 2HB ARG 124 HB3 ARG 124 -20.114 9.438 -14.245 923 1HG ARG 124 HG2 ARG 124 -21.195 9.022 -16.446 924 2HG ARG 124 HG3 ARG 124 -19.939 7.834 -16.833 925 1HD ARG 124 HD2 ARG 124 -20.620 6.553 -14.770 926 2HD ARG 124 HD3 ARG 124 -22.019 7.638 -14.632 927 HE ARG 124 HE ARG 124 -22.133 6.776 -17.240 928 1HH1 ARG 124 HH22 ARG 124 -22.166 5.042 -14.118 929 2HH1 ARG 124 HH21 ARG 124 -22.834 3.605 -14.828 930 1HH2 ARG 124 HH11 ARG 124 -23.276 5.016 -18.021 931 2HH2 ARG 124 HH12 ARG 124 -23.441 3.561 -17.097 932 H ASP 125 H ASP 125 -19.401 9.946 -18.151 933 HA ASP 125 HA ASP 125 -17.519 8.054 -19.082 934 1HB ASP 125 HB2 ASP 125 -19.604 8.483 -20.270 935 2HB ASP 125 HB3 ASP 125 -19.103 10.141 -20.627 936 H GLU 126 H GLU 126 -17.496 11.672 -19.296 937 HA GLU 126 HA GLU 126 -14.999 11.652 -20.652 938 1HB GLU 126 HB2 GLU 126 -16.751 13.788 -19.492 939 2HB GLU 126 HB3 GLU 126 -15.081 14.190 -19.904 940 1HG GLU 126 HG2 GLU 126 -16.873 12.787 -21.895 941 2HG GLU 126 HG3 GLU 126 -16.874 14.538 -21.703 942 H ILE 127 H ILE 127 -15.810 11.799 -17.188 943 HA ILE 127 HA ILE 127 -13.129 12.555 -16.431 944 HB ILE 127 HB ILE 127 -15.580 12.243 -15.080 945 1HG1 ILE 127 HG12 ILE 127 -14.272 12.983 -13.058 946 2HG1 ILE 127 HG13 ILE 127 -12.812 12.891 -14.054 947 1HG2 ILE 127 HG21 ILE 127 -15.242 9.964 -14.639 948 2HG2 ILE 127 HG22 ILE 127 -13.663 10.282 -13.863 949 3HG2 ILE 127 HG23 ILE 127 -15.170 10.895 -13.140 950 1HD1 ILE 127 HD11 ILE 127 -13.795 14.562 -15.616 951 2HD1 ILE 127 HD12 ILE 127 -15.322 14.530 -14.708 952 3HD1 ILE 127 HD13 ILE 127 -13.862 15.193 -13.953 953 H GLY 128 H GLY 128 -14.788 9.416 -16.926 954 1HA GLY 128 HA1 GLY 128 -12.592 7.734 -16.270 955 2HA GLY 128 HA2 GLY 128 -13.943 7.340 -17.359 956 H ASN 129 H ASN 129 -13.684 9.101 -19.408 957 HA ASN 129 HA ASN 129 -11.616 8.123 -21.037 958 1HB ASN 129 HB2 ASN 129 -13.783 9.171 -21.752 959 2HB ASN 129 HB3 ASN 129 -13.124 10.737 -21.270 960 1HD2 ASN 129 HD22 ASN 129 -13.450 11.537 -23.364 961 2HD2 ASN 129 HD21 ASN 129 -12.463 11.021 -24.732 962 H ARG 130 H ARG 130 -11.728 11.064 -19.011 963 HA ARG 130 HA ARG 130 -9.231 12.174 -19.784 964 1HB ARG 130 HB2 ARG 130 -11.161 12.602 -17.595 965 2HB ARG 130 HB3 ARG 130 -9.539 12.565 -16.956 966 1HG ARG 130 HG2 ARG 130 -9.737 14.766 -17.388 967 2HG ARG 130 HG3 ARG 130 -8.941 14.239 -18.863 968 1HD ARG 130 HD2 ARG 130 -11.880 14.824 -18.396 969 2HD ARG 130 HD3 ARG 130 -10.782 15.822 -19.353 970 HE ARG 130 HE ARG 130 -12.338 13.564 -20.171 971 1HH1 ARG 130 HH21 ARG 130 -9.050 14.856 -20.836 972 2HH1 ARG 130 HH22 ARG 130 -8.979 13.980 -22.363 973 1HH2 ARG 130 HH11 ARG 130 -12.280 12.946 -22.398 974 2HH2 ARG 130 HH12 ARG 130 -10.676 12.861 -23.154 975 H LEU 131 H LEU 131 -10.010 9.877 -17.113 976 HA LEU 131 HA LEU 131 -7.252 9.674 -16.398 977 1HB LEU 131 HB2 LEU 131 -9.736 8.217 -15.600 978 2HB LEU 131 HB3 LEU 131 -8.190 7.426 -15.302 979 HG LEU 131 HG LEU 131 -8.961 8.694 -13.398 980 1HD1 LEU 131 HD11 LEU 131 -6.530 8.244 -13.801 981 2HD1 LEU 131 HD12 LEU 131 -6.369 9.870 -14.497 982 3HD1 LEU 131 HD13 LEU 131 -6.819 9.678 -12.810 983 1HD2 LEU 131 HD21 LEU 131 -10.048 10.606 -14.509 984 2HD2 LEU 131 HD22 LEU 131 -8.916 11.099 -13.250 985 3HD2 LEU 131 HD23 LEU 131 -8.450 11.249 -14.955 986 H LYS 132 H LYS 132 -9.250 7.751 -18.628 987 HA LYS 132 HA LYS 132 -7.279 5.821 -19.257 988 1HB LYS 132 HB2 LYS 132 -9.389 5.294 -19.962 989 2HB LYS 132 HB3 LYS 132 -9.774 6.892 -20.531 990 1HG LYS 132 HG2 LYS 132 -7.784 5.149 -22.030 991 2HG LYS 132 HG3 LYS 132 -9.530 4.953 -22.202 992 1HD LYS 132 HD2 LYS 132 -9.415 7.625 -22.589 993 2HD LYS 132 HD3 LYS 132 -7.795 7.203 -23.164 994 1HE LYS 132 HE2 LYS 132 -8.697 5.712 -24.834 995 2HE LYS 132 HE3 LYS 132 -10.312 5.790 -24.113 996 1HZ LYS 132 HZ1 LYS 132 -10.217 7.212 -26.023 997 2HZ LYS 132 HZ2 LYS 132 -10.396 8.145 -24.686 998 3HZ LYS 132 HZ3 LYS 132 -8.939 8.045 -25.445 999 H GLU 133 H GLU 133 -7.856 9.030 -20.830 1000 HA GLU 133 HA GLU 133 -5.600 8.796 -22.605 1001 1HB GLU 133 HB2 GLU 133 -6.978 11.212 -21.334 1002 2HB GLU 133 HB3 GLU 133 -5.560 11.352 -22.372 1003 1HG GLU 133 HG2 GLU 133 -6.792 10.297 -24.236 1004 2HG GLU 133 HG3 GLU 133 -8.248 10.221 -23.229 1005 H PHE 134 H PHE 134 -5.885 10.254 -19.337 1006 HA PHE 134 HA PHE 134 -3.241 11.125 -19.161 1007 1HB PHE 134 HB2 PHE 134 -4.950 11.896 -17.699 1008 2HB PHE 134 HB3 PHE 134 -5.312 10.264 -17.146 1009 HD1 PHE 134 HD1 PHE 134 -4.061 9.155 -15.482 1010 HD2 PHE 134 HD2 PHE 134 -2.918 13.074 -16.843 1011 HE1 PHE 134 HE1 PHE 134 -2.494 9.365 -13.553 1012 HE2 PHE 134 HE2 PHE 134 -1.308 13.260 -14.975 1013 HZ PHE 134 HZ PHE 134 -1.114 11.406 -13.322 1014 H ALA 135 H ALA 135 -4.586 7.921 -18.419 1015 HA ALA 135 HA ALA 135 -2.153 6.830 -17.389 1016 1HB ALA 135 HB1 ALA 135 -4.621 5.442 -18.511 1017 2HB ALA 135 HB2 ALA 135 -3.325 4.664 -17.578 1018 3HB ALA 135 HB3 ALA 135 -4.346 5.897 -16.814 1019 H GLU 136 H GLU 136 -3.755 6.640 -20.589 1020 HA GLU 136 HA GLU 136 -1.823 4.827 -21.687 1021 1HB GLU 136 HB2 GLU 136 -4.001 6.525 -22.949 1022 2HB GLU 136 HB3 GLU 136 -2.938 5.466 -23.885 1023 1HG GLU 136 HG2 GLU 136 -3.636 3.531 -22.468 1024 2HG GLU 136 HG3 GLU 136 -4.833 4.550 -21.682 1025 H THR 137 H THR 137 -2.256 8.339 -21.887 1026 HA THR 137 HA THR 137 -0.150 8.583 -23.821 1027 HB THR 137 HB THR 137 -0.804 10.877 -23.984 1028 HG1 THR 137 HG1 THR 137 -2.658 10.350 -21.918 1029 1HG2 THR 137 HG21 THR 137 -3.137 10.588 -24.718 1030 2HG2 THR 137 HG22 THR 137 -2.131 9.215 -25.220 1031 3HG2 THR 137 HG23 THR 137 -3.241 9.037 -23.854 1032 H GLY 138 H GLY 138 -0.481 8.881 -20.339 1033 1HA GLY 138 HA1 GLY 138 0.951 9.543 -18.692 1034 2HA GLY 138 HA2 GLY 138 2.302 9.507 -19.851 1035 H LYS 139 H LYS 139 -0.774 11.259 -19.914 1036 HA LYS 139 HA LYS 139 -0.115 13.544 -21.163 1037 1HB LYS 139 HB2 LYS 139 -2.388 12.720 -20.373 1038 2HB LYS 139 HB3 LYS 139 -2.010 13.402 -18.801 1039 1HG LYS 139 HG2 LYS 139 -3.314 15.050 -19.764 1040 2HG LYS 139 HG3 LYS 139 -1.682 15.649 -20.012 1041 1HD LYS 139 HD2 LYS 139 -2.977 16.000 -22.029 1042 2HD LYS 139 HD3 LYS 139 -1.768 14.757 -22.383 1043 1HE LYS 139 HE2 LYS 139 -3.448 12.984 -22.177 1044 2HE LYS 139 HE3 LYS 139 -4.647 14.136 -21.576 1045 1HZ LYS 139 HZ1 LYS 139 -3.553 14.032 -24.319 1046 2HZ LYS 139 HZ2 LYS 139 -5.099 13.710 -23.855 1047 3HZ LYS 139 HZ3 LYS 139 -4.524 15.233 -23.778 Start of MODEL 20 1 1H MET 1 H1 MET 1 3.086 -1.354 -4.883 2 2H MET 1 H2 MET 1 2.762 -2.545 -3.791 3 3H MET 1 H3 MET 1 1.610 -1.434 -4.171 4 HA MET 1 HA MET 1 2.465 -0.902 -2.059 5 1HB MET 1 HB2 MET 1 4.671 -2.026 -2.393 6 2HB MET 1 HB3 MET 1 5.177 -0.702 -3.448 7 1HG MET 1 HG2 MET 1 6.066 -0.487 -1.167 8 2HG MET 1 HG3 MET 1 5.045 0.877 -1.595 9 1HE MET 1 HE1 MET 1 4.528 0.608 2.264 10 2HE MET 1 HE2 MET 1 6.021 0.271 1.362 11 3HE MET 1 HE3 MET 1 4.996 1.649 0.900 12 H GLU 2 H GLU 2 2.237 1.270 -1.465 13 HA GLU 2 HA GLU 2 1.535 3.226 -3.391 14 1HB GLU 2 HB2 GLU 2 1.667 4.806 -1.497 15 2HB GLU 2 HB3 GLU 2 0.732 3.357 -1.125 16 1HG GLU 2 HG2 GLU 2 2.734 2.441 0.103 17 2HG GLU 2 HG3 GLU 2 3.579 3.961 -0.204 18 H ASN 3 H ASN 3 2.697 4.931 -4.355 19 HA ASN 3 HA ASN 3 5.609 5.126 -3.949 20 1HB ASN 3 HB2 ASN 3 5.638 3.183 -5.275 21 2HB ASN 3 HB3 ASN 3 4.275 3.698 -6.250 22 1HD2 ASN 3 HD22 ASN 3 4.591 4.918 -8.069 23 2HD2 ASN 3 HD21 ASN 3 6.184 5.358 -8.667 24 H LYS 4 H LYS 4 2.740 6.030 -5.838 25 HA LYS 4 HA LYS 4 3.785 8.819 -6.126 26 1HB LYS 4 HB2 LYS 4 2.408 6.967 -8.099 27 2HB LYS 4 HB3 LYS 4 2.129 8.703 -8.219 28 1HG LYS 4 HG2 LYS 4 4.304 9.213 -8.796 29 2HG LYS 4 HG3 LYS 4 4.987 7.812 -7.982 30 1HD LYS 4 HD2 LYS 4 5.225 7.631 -10.401 31 2HD LYS 4 HD3 LYS 4 4.254 6.318 -9.731 32 1HE LYS 4 HE2 LYS 4 2.188 7.420 -10.465 33 2HE LYS 4 HE3 LYS 4 3.136 8.738 -11.185 34 1HZ LYS 4 HZ1 LYS 4 3.299 5.861 -11.935 35 2HZ LYS 4 HZ2 LYS 4 2.546 7.032 -12.811 36 3HZ LYS 4 HZ3 LYS 4 4.169 7.070 -12.637 37 H ILE 5 H ILE 5 1.818 10.345 -6.446 38 HA ILE 5 HA ILE 5 -0.559 9.512 -4.907 39 HB ILE 5 HB ILE 5 1.246 11.853 -4.200 40 1HG1 ILE 5 HG12 ILE 5 0.611 9.392 -2.561 41 2HG1 ILE 5 HG13 ILE 5 2.162 9.854 -3.247 42 1HG2 ILE 5 HG21 ILE 5 -1.468 11.072 -3.046 43 2HG2 ILE 5 HG22 ILE 5 -0.456 12.403 -2.428 44 3HG2 ILE 5 HG23 ILE 5 -1.143 12.511 -4.025 45 1HD1 ILE 5 HD11 ILE 5 2.262 10.366 -0.932 46 2HD1 ILE 5 HD12 ILE 5 2.134 11.917 -1.784 47 3HD1 ILE 5 HD13 ILE 5 0.720 11.229 -0.953 48 H ILE 6 H ILE 6 -2.372 10.553 -5.759 49 HA ILE 6 HA ILE 6 -1.965 12.893 -7.533 50 HB ILE 6 HB ILE 6 -2.184 11.130 -9.082 51 1HG1 ILE 6 HG12 ILE 6 -4.932 12.415 -8.756 52 2HG1 ILE 6 HG13 ILE 6 -3.524 13.134 -9.541 53 1HG2 ILE 6 HG21 ILE 6 -4.014 9.440 -9.050 54 2HG2 ILE 6 HG22 ILE 6 -2.957 9.300 -7.667 55 3HG2 ILE 6 HG23 ILE 6 -4.542 10.078 -7.480 56 1HD1 ILE 6 HD11 ILE 6 -3.578 11.159 -11.177 57 2HD1 ILE 6 HD12 ILE 6 -5.160 10.750 -10.478 58 3HD1 ILE 6 HD13 ILE 6 -4.930 12.305 -11.279 59 H TYR 7 H TYR 7 -3.435 14.505 -7.148 60 HA TYR 7 HA TYR 7 -5.458 14.028 -5.013 61 1HB TYR 7 HB2 TYR 7 -3.270 14.900 -4.194 62 2HB TYR 7 HB3 TYR 7 -3.477 16.320 -5.209 63 HD1 TYR 7 HD1 TYR 7 -5.605 14.363 -2.786 64 HD2 TYR 7 HD2 TYR 7 -4.055 18.208 -3.929 65 HE1 TYR 7 HE1 TYR 7 -6.680 15.369 -0.795 66 HE2 TYR 7 HE2 TYR 7 -5.112 19.229 -1.924 67 HH TYR 7 HH TYR 7 -6.960 17.299 0.461 68 H PHE 8 H PHE 8 -7.384 14.337 -6.004 69 HA PHE 8 HA PHE 8 -7.684 16.238 -8.231 70 1HB PHE 8 HB2 PHE 8 -9.673 14.461 -6.744 71 2HB PHE 8 HB3 PHE 8 -10.089 15.493 -8.101 72 HD1 PHE 8 HD1 PHE 8 -8.724 12.267 -7.130 73 HD2 PHE 8 HD2 PHE 8 -8.949 15.137 -10.343 74 HE1 PHE 8 HE1 PHE 8 -7.966 10.539 -8.745 75 HE2 PHE 8 HE2 PHE 8 -8.172 13.406 -11.945 76 HZ PHE 8 HZ PHE 8 -7.667 11.116 -11.135 77 H LEU 9 H LEU 9 -8.942 18.110 -8.224 78 HA LEU 9 HA LEU 9 -9.911 19.191 -5.651 79 1HB LEU 9 HB2 LEU 9 -7.449 19.684 -6.074 80 2HB LEU 9 HB3 LEU 9 -7.896 20.514 -7.546 81 HG LEU 9 HG LEU 9 -7.337 21.989 -5.667 82 1HD1 LEU 9 HD11 LEU 9 -9.025 23.610 -5.914 83 2HD1 LEU 9 HD12 LEU 9 -9.007 22.711 -7.442 84 3HD1 LEU 9 HD13 LEU 9 -10.277 22.409 -6.226 85 1HD2 LEU 9 HD21 LEU 9 -8.847 22.280 -3.771 86 2HD2 LEU 9 HD22 LEU 9 -9.823 20.905 -4.297 87 3HD2 LEU 9 HD23 LEU 9 -8.142 20.641 -3.802 88 H CYS 10 H CYS 10 -11.867 20.294 -6.024 89 HA CYS 10 HA CYS 10 -12.424 21.484 -8.645 90 1HB CYS 10 HB2 CYS 10 -13.092 18.928 -8.554 91 2HB CYS 10 HB3 CYS 10 -14.417 19.471 -7.523 92 HG CYS 10 HG CYS 10 -13.541 20.634 -10.522 93 H THR 11 H THR 11 -14.824 22.582 -8.455 94 HA THR 11 HA THR 11 -14.683 24.236 -6.132 95 HB THR 11 HB THR 11 -17.017 24.982 -7.097 96 HG1 THR 11 HG1 THR 11 -17.139 24.577 -9.298 97 1HG2 THR 11 HG21 THR 11 -15.838 26.484 -8.582 98 2HG2 THR 11 HG22 THR 11 -14.835 26.215 -7.143 99 3HG2 THR 11 HG23 THR 11 -14.440 25.398 -8.658 100 H GLY 12 H GLY 12 -15.919 21.127 -6.356 101 1HA GLY 12 HA1 GLY 12 -16.739 21.269 -3.637 102 2HA GLY 12 HA2 GLY 12 -18.120 20.897 -4.701 103 H ASN 13 H ASN 13 -15.909 19.411 -2.855 104 HA ASN 13 HA ASN 13 -14.562 17.520 -4.504 105 1HB ASN 13 HB2 ASN 13 -14.074 18.025 -2.100 106 2HB ASN 13 HB3 ASN 13 -15.566 17.236 -1.627 107 1HD2 ASN 13 HD22 ASN 13 -13.029 16.526 -0.668 108 2HD2 ASN 13 HD21 ASN 13 -12.578 14.943 -1.269 109 H SER 14 H SER 14 -17.616 17.397 -2.783 110 HA SER 14 HA SER 14 -18.406 14.913 -2.648 111 1HB SER 14 HB2 SER 14 -20.147 17.312 -3.344 112 2HB SER 14 HB3 SER 14 -20.647 15.873 -2.425 113 HG SER 14 HG SER 14 -19.116 16.357 -0.889 114 H CYS 15 H CYS 15 -18.287 16.441 -5.780 115 HA CYS 15 HA CYS 15 -19.836 14.176 -6.936 116 1HB CYS 15 HB2 CYS 15 -20.494 15.812 -8.748 117 2HB CYS 15 HB3 CYS 15 -21.239 16.064 -7.169 118 HG CYS 15 HG CYS 15 -20.835 18.450 -7.981 119 H ARG 16 H ARG 16 -17.918 16.728 -8.453 120 HA ARG 16 HA ARG 16 -16.891 14.970 -10.397 121 1HB ARG 16 HB2 ARG 16 -16.081 17.774 -9.519 122 2HB ARG 16 HB3 ARG 16 -15.350 16.990 -10.916 123 1HG ARG 16 HG2 ARG 16 -17.309 16.965 -12.167 124 2HG ARG 16 HG3 ARG 16 -18.381 17.062 -10.776 125 1HD ARG 16 HD2 ARG 16 -16.588 19.337 -11.676 126 2HD ARG 16 HD3 ARG 16 -18.276 19.145 -12.159 127 HE ARG 16 HE ARG 16 -18.385 19.023 -9.406 128 1HH1 ARG 16 HH22 ARG 16 -17.228 21.441 -11.752 129 2HH1 ARG 16 HH21 ARG 16 -17.264 22.732 -10.585 130 1HH2 ARG 16 HH11 ARG 16 -18.501 20.799 -7.926 131 2HH2 ARG 16 HH12 ARG 16 -17.938 22.364 -8.441 132 H SER 17 H SER 17 -15.173 16.198 -7.419 133 HA SER 17 HA SER 17 -12.767 14.847 -8.170 134 1HB SER 17 HB2 SER 17 -13.545 15.646 -5.369 135 2HB SER 17 HB3 SER 17 -11.926 15.523 -6.085 136 HG SER 17 HG SER 17 -12.574 17.652 -5.893 137 H GLN 18 H GLN 18 -15.516 13.906 -6.028 138 HA GLN 18 HA GLN 18 -14.412 11.432 -5.157 139 1HB GLN 18 HB2 GLN 18 -17.302 12.328 -5.639 140 2HB GLN 18 HB3 GLN 18 -16.885 10.784 -4.913 141 1HG GLN 18 HG2 GLN 18 -16.115 13.487 -3.770 142 2HG GLN 18 HG3 GLN 18 -17.474 12.521 -3.241 143 1HE2 GLN 18 HE22 GLN 18 -14.420 13.318 -2.355 144 2HE2 GLN 18 HE21 GLN 18 -14.068 11.906 -1.358 145 H MET 19 H MET 19 -16.379 12.180 -8.084 146 HA MET 19 HA MET 19 -16.523 9.469 -9.018 147 1HB MET 19 HB2 MET 19 -16.750 12.151 -10.460 148 2HB MET 19 HB3 MET 19 -17.088 10.589 -11.220 149 1HG MET 19 HG2 MET 19 -18.952 10.164 -9.800 150 2HG MET 19 HG3 MET 19 -18.494 11.431 -8.679 151 1HE MET 19 HE1 MET 19 -18.835 11.553 -12.676 152 2HE MET 19 HE2 MET 19 -20.192 10.569 -12.072 153 3HE MET 19 HE3 MET 19 -20.499 12.166 -12.789 154 H ALA 20 H ALA 20 -14.264 12.188 -9.856 155 HA ALA 20 HA ALA 20 -12.711 10.785 -11.727 156 1HB ALA 20 HB1 ALA 20 -12.591 13.245 -11.294 157 2HB ALA 20 HB2 ALA 20 -11.770 12.909 -9.754 158 3HB ALA 20 HB3 ALA 20 -11.000 12.464 -11.290 159 H GLU 21 H GLU 21 -12.368 10.959 -8.169 160 HA GLU 21 HA GLU 21 -9.980 9.484 -7.924 161 1HB GLU 21 HB2 GLU 21 -10.831 10.721 -6.069 162 2HB GLU 21 HB3 GLU 21 -12.365 9.841 -6.062 163 1HG GLU 21 HG2 GLU 21 -11.250 7.786 -5.407 164 2HG GLU 21 HG3 GLU 21 -9.673 8.558 -5.477 165 H GLY 22 H GLY 22 -13.406 8.296 -7.918 166 1HA GLY 22 HA1 GLY 22 -12.823 5.582 -7.562 167 2HA GLY 22 HA2 GLY 22 -14.254 6.221 -8.364 168 H TRP 23 H TRP 23 -13.028 7.418 -10.741 169 HA TRP 23 HA TRP 23 -12.532 4.978 -12.255 170 1HB TRP 23 HB2 TRP 23 -12.151 7.898 -13.017 171 2HB TRP 23 HB3 TRP 23 -11.895 6.551 -14.105 172 HD1 TRP 23 HD1 TRP 23 -14.618 8.595 -12.512 173 HE1 TRP 23 HE1 TRP 23 -16.809 8.256 -13.724 174 HE3 TRP 23 HE3 TRP 23 -13.301 4.623 -15.477 175 HZ2 TRP 23 HZ2 TRP 23 -17.842 6.614 -15.824 176 HZ3 TRP 23 HZ3 TRP 23 -14.907 3.765 -17.160 177 HH2 TRP 23 HH2 TRP 23 -17.181 4.786 -17.360 178 H ALA 24 H ALA 24 -10.394 7.567 -10.934 179 HA ALA 24 HA ALA 24 -8.107 6.759 -12.350 180 1HB ALA 24 HB1 ALA 24 -6.842 8.082 -10.710 181 2HB ALA 24 HB2 ALA 24 -8.366 8.920 -11.058 182 3HB ALA 24 HB3 ALA 24 -8.191 8.003 -9.557 183 H LYS 25 H LYS 25 -9.384 5.559 -9.247 184 HA LYS 25 HA LYS 25 -7.167 3.958 -8.519 185 1HB LYS 25 HB2 LYS 25 -10.149 3.599 -8.066 186 2HB LYS 25 HB3 LYS 25 -8.943 2.522 -7.350 187 1HG LYS 25 HG2 LYS 25 -7.941 4.284 -6.060 188 2HG LYS 25 HG3 LYS 25 -8.832 5.537 -6.933 189 1HD LYS 25 HD2 LYS 25 -10.975 4.633 -6.081 190 2HD LYS 25 HD3 LYS 25 -10.088 3.407 -5.141 191 1HE LYS 25 HE2 LYS 25 -8.983 5.140 -3.823 192 2HE LYS 25 HE3 LYS 25 -9.607 6.400 -4.894 193 1HZ LYS 25 HZ1 LYS 25 -10.971 6.434 -3.042 194 2HZ LYS 25 HZ2 LYS 25 -11.875 5.713 -4.174 195 3HZ LYS 25 HZ3 LYS 25 -11.177 4.784 -2.989 196 H GLN 26 H GLN 26 -9.669 3.347 -10.971 197 HA GLN 26 HA GLN 26 -8.968 0.552 -11.345 198 1HB GLN 26 HB2 GLN 26 -10.216 2.431 -13.364 199 2HB GLN 26 HB3 GLN 26 -10.161 0.678 -13.425 200 1HG GLN 26 HG2 GLN 26 -11.618 0.613 -11.365 201 2HG GLN 26 HG3 GLN 26 -11.776 2.382 -11.485 202 1HE2 GLN 26 HE22 GLN 26 -12.028 2.963 -14.067 203 2HE2 GLN 26 HE21 GLN 26 -13.407 2.162 -14.802 204 H TYR 27 H TYR 27 -8.391 3.502 -13.259 205 HA TYR 27 HA TYR 27 -6.732 2.190 -15.153 206 1HB TYR 27 HB2 TYR 27 -7.090 5.147 -14.534 207 2HB TYR 27 HB3 TYR 27 -6.194 4.536 -15.913 208 HD1 TYR 27 HD1 TYR 27 -7.442 2.804 -17.472 209 HD2 TYR 27 HD2 TYR 27 -9.407 5.624 -14.865 210 HE1 TYR 27 HE1 TYR 27 -9.481 2.668 -18.868 211 HE2 TYR 27 HE2 TYR 27 -11.408 5.569 -16.306 212 HH TYR 27 HH TYR 27 -12.427 4.609 -18.181 213 H LEU 28 H LEU 28 -5.819 4.087 -12.267 214 HA LEU 28 HA LEU 28 -3.023 4.195 -13.147 215 1HB LEU 28 HB2 LEU 28 -4.364 5.253 -10.627 216 2HB LEU 28 HB3 LEU 28 -2.742 5.608 -11.169 217 HG LEU 28 HG LEU 28 -5.309 6.476 -12.517 218 1HD1 LEU 28 HD11 LEU 28 -4.540 7.739 -10.521 219 2HD1 LEU 28 HD12 LEU 28 -2.996 8.061 -11.331 220 3HD1 LEU 28 HD13 LEU 28 -4.504 8.717 -12.001 221 1HD2 LEU 28 HD21 LEU 28 -3.910 7.647 -14.166 222 2HD2 LEU 28 HD22 LEU 28 -2.458 6.852 -13.522 223 3HD2 LEU 28 HD23 LEU 28 -3.743 5.911 -14.317 224 H GLY 29 H GLY 29 -4.863 2.564 -10.596 225 1HA GLY 29 HA1 GLY 29 -4.383 0.553 -9.573 226 2HA GLY 29 HA2 GLY 29 -2.844 0.475 -10.432 227 H ASP 30 H ASP 30 -2.559 -0.407 -8.098 228 HA ASP 30 HA ASP 30 -2.593 1.226 -5.819 229 1HB ASP 30 HB2 ASP 30 -2.695 -1.240 -5.873 230 2HB ASP 30 HB3 ASP 30 -1.005 -1.289 -6.394 231 H GLU 31 H GLU 31 -0.172 1.089 -8.284 232 HA GLU 31 HA GLU 31 2.168 1.959 -6.943 233 1HB GLU 31 HB2 GLU 31 1.969 1.290 -9.355 234 2HB GLU 31 HB3 GLU 31 1.074 2.776 -9.678 235 1HG GLU 31 HG2 GLU 31 3.085 4.097 -8.956 236 2HG GLU 31 HG3 GLU 31 3.965 2.583 -8.746 237 H TRP 32 H TRP 32 -0.907 3.571 -7.417 238 HA TRP 32 HA TRP 32 0.324 6.148 -6.563 239 1HB TRP 32 HB2 TRP 32 -2.267 5.833 -8.105 240 2HB TRP 32 HB3 TRP 32 -1.428 7.315 -7.716 241 HD1 TRP 32 HD1 TRP 32 -0.707 4.133 -9.794 242 HE1 TRP 32 HE1 TRP 32 -0.049 4.835 -12.149 243 HE3 TRP 32 HE3 TRP 32 -0.604 9.210 -9.133 244 HZ2 TRP 32 HZ2 TRP 32 0.310 7.246 -13.621 245 HZ3 TRP 32 HZ3 TRP 32 -0.188 10.694 -11.060 246 HH2 TRP 32 HH2 TRP 32 0.264 9.705 -13.332 247 H LYS 33 H LYS 33 -0.639 7.154 -4.830 248 HA LYS 33 HA LYS 33 -2.995 5.903 -3.491 249 1HB LYS 33 HB2 LYS 33 -1.206 8.220 -2.683 250 2HB LYS 33 HB3 LYS 33 -2.629 7.640 -1.801 251 1HG LYS 33 HG2 LYS 33 -1.513 5.283 -1.926 252 2HG LYS 33 HG3 LYS 33 -0.025 6.153 -2.337 253 1HD LYS 33 HD2 LYS 33 -1.770 6.687 0.086 254 2HD LYS 33 HD3 LYS 33 -0.383 5.579 0.097 255 1HE LYS 33 HE2 LYS 33 1.024 7.569 -0.781 256 2HE LYS 33 HE3 LYS 33 -0.343 8.601 -0.333 257 1HZ LYS 33 HZ1 LYS 33 -0.071 7.743 1.961 258 2HZ LYS 33 HZ2 LYS 33 1.229 6.851 1.476 259 3HZ LYS 33 HZ3 LYS 33 1.287 8.488 1.440 260 H VAL 34 H VAL 34 -4.952 7.084 -3.438 261 HA VAL 34 HA VAL 34 -5.113 9.401 -5.319 262 HB VAL 34 HB VAL 34 -7.117 7.117 -5.268 263 1HG1 VAL 34 HG11 VAL 34 -7.971 8.071 -7.270 264 2HG1 VAL 34 HG12 VAL 34 -7.735 9.445 -6.177 265 3HG1 VAL 34 HG13 VAL 34 -6.570 9.139 -7.472 266 1HG2 VAL 34 HG21 VAL 34 -6.167 6.356 -7.451 267 2HG2 VAL 34 HG22 VAL 34 -4.766 7.414 -7.185 268 3HG2 VAL 34 HG23 VAL 34 -5.090 6.054 -6.090 269 H TYR 35 H TYR 35 -6.066 11.074 -4.340 270 HA TYR 35 HA TYR 35 -8.338 10.530 -2.550 271 1HB TYR 35 HB2 TYR 35 -6.711 12.837 -1.676 272 2HB TYR 35 HB3 TYR 35 -7.701 11.745 -0.761 273 HD1 TYR 35 HD1 TYR 35 -4.352 12.432 -2.105 274 HD2 TYR 35 HD2 TYR 35 -6.721 9.688 0.234 275 HE1 TYR 35 HE1 TYR 35 -2.305 11.597 -1.039 276 HE2 TYR 35 HE2 TYR 35 -4.660 8.780 1.261 277 HH TYR 35 HH TYR 35 -2.370 9.009 1.475 278 H SER 36 H SER 36 -9.558 12.624 -2.187 279 HA SER 36 HA SER 36 -9.387 14.505 -4.464 280 1HB SER 36 HB2 SER 36 -11.945 14.230 -4.487 281 2HB SER 36 HB3 SER 36 -10.993 12.929 -5.227 282 HG SER 36 HG SER 36 -11.350 11.668 -3.445 283 H ALA 37 H ALA 37 -9.939 16.572 -3.927 284 HA ALA 37 HA ALA 37 -11.284 17.134 -1.358 285 1HB ALA 37 HB1 ALA 37 -8.778 18.527 -2.317 286 2HB ALA 37 HB2 ALA 37 -9.755 18.831 -0.848 287 3HB ALA 37 HB3 ALA 37 -8.883 17.312 -1.007 288 H GLY 38 H GLY 38 -11.536 19.794 -1.535 289 1HA GLY 38 HA1 GLY 38 -12.007 20.798 -4.164 290 2HA GLY 38 HA2 GLY 38 -13.525 20.366 -3.363 291 H ILE 39 H ILE 39 -13.265 22.895 -3.987 292 HA ILE 39 HA ILE 39 -12.216 24.730 -2.075 293 HB ILE 39 HB ILE 39 -14.538 24.694 -4.009 294 1HG1 ILE 39 HG12 ILE 39 -13.395 26.531 -5.096 295 2HG1 ILE 39 HG13 ILE 39 -12.235 26.647 -3.786 296 1HG2 ILE 39 HG21 ILE 39 -15.506 25.998 -2.212 297 2HG2 ILE 39 HG22 ILE 39 -14.037 26.998 -2.099 298 3HG2 ILE 39 HG23 ILE 39 -15.070 27.054 -3.546 299 1HD1 ILE 39 HD11 ILE 39 -11.266 24.447 -4.456 300 2HD1 ILE 39 HD12 ILE 39 -12.469 24.373 -5.781 301 3HD1 ILE 39 HD13 ILE 39 -11.233 25.630 -5.755 302 H GLU 40 H GLU 40 -15.224 22.800 -2.166 303 HA GLU 40 HA GLU 40 -15.207 22.765 0.755 304 1HB GLU 40 HB2 GLU 40 -17.532 23.357 1.023 305 2HB GLU 40 HB3 GLU 40 -16.648 24.680 0.279 306 1HG GLU 40 HG2 GLU 40 -17.551 24.029 -1.959 307 2HG GLU 40 HG3 GLU 40 -18.443 22.704 -1.211 308 H ALA 41 H ALA 41 -17.148 21.214 1.432 309 HA ALA 41 HA ALA 41 -17.735 19.081 -0.517 310 1HB ALA 41 HB1 ALA 41 -16.329 18.633 2.165 311 2HB ALA 41 HB2 ALA 41 -17.046 17.367 1.155 312 3HB ALA 41 HB3 ALA 41 -15.655 18.303 0.554 313 H HIS 42 H HIS 42 -19.894 18.761 -0.315 314 HA HIS 42 HA HIS 42 -21.386 19.768 2.017 315 1HB HIS 42 HB2 HIS 42 -22.146 19.906 -0.403 316 2HB HIS 42 HB3 HIS 42 -22.361 18.158 -0.382 317 HD1 HIS 42 HD1 HIS 42 -23.776 18.306 2.693 318 HD2 HIS 42 HD2 HIS 42 -24.730 20.352 -0.862 319 HE1 HIS 42 HE1 HIS 42 -26.226 18.990 2.894 320 H GLY 43 H GLY 43 -20.197 16.732 0.677 321 1HA GLY 43 HA1 GLY 43 -20.080 15.021 2.807 322 2HA GLY 43 HA2 GLY 43 -21.775 14.937 2.263 323 H LEU 44 H LEU 44 -21.279 12.705 1.505 324 HA LEU 44 HA LEU 44 -19.759 12.610 -1.066 325 1HB LEU 44 HB2 LEU 44 -19.236 10.821 0.506 326 2HB LEU 44 HB3 LEU 44 -20.952 10.418 0.679 327 HG LEU 44 HG LEU 44 -21.100 9.676 -1.603 328 1HD1 LEU 44 HD11 LEU 44 -19.599 11.148 -2.825 329 2HD1 LEU 44 HD12 LEU 44 -18.206 10.550 -1.888 330 3HD1 LEU 44 HD13 LEU 44 -19.041 9.492 -3.043 331 1HD2 LEU 44 HD21 LEU 44 -18.631 8.592 -0.192 332 2HD2 LEU 44 HD22 LEU 44 -20.303 8.064 0.071 333 3HD2 LEU 44 HD23 LEU 44 -19.500 7.754 -1.481 334 H ASN 45 H ASN 45 -21.049 13.232 -2.794 335 HA ASN 45 HA ASN 45 -23.850 13.674 -2.415 336 1HB ASN 45 HB2 ASN 45 -22.326 14.947 -3.951 337 2HB ASN 45 HB3 ASN 45 -22.332 13.565 -5.052 338 1HD2 ASN 45 HD22 ASN 45 -23.457 16.471 -5.176 339 2HD2 ASN 45 HD21 ASN 45 -25.102 16.219 -5.707 340 HA PRO 46 HA PRO 46 -25.171 9.399 -3.269 341 1HB PRO 46 HB2 PRO 46 -27.723 10.838 -4.011 342 2HB PRO 46 HB3 PRO 46 -27.510 9.347 -3.039 343 1HG PRO 46 HG2 PRO 46 -27.973 11.721 -1.813 344 2HG PRO 46 HG3 PRO 46 -26.735 10.599 -1.157 345 1HD PRO 46 HD2 PRO 46 -26.320 13.049 -2.885 346 2HD PRO 46 HD3 PRO 46 -25.412 12.515 -1.437 347 H ASN 47 H ASN 47 -25.698 12.124 -5.568 348 HA ASN 47 HA ASN 47 -26.219 10.464 -7.840 349 1HB ASN 47 HB2 ASN 47 -26.464 12.353 -8.939 350 2HB ASN 47 HB3 ASN 47 -26.248 13.219 -7.439 351 1HD2 ASN 47 HD22 ASN 47 -25.157 12.891 -10.654 352 2HD2 ASN 47 HD21 ASN 47 -23.599 13.664 -10.480 353 H ALA 48 H ALA 48 -23.179 11.543 -6.298 354 HA ALA 48 HA ALA 48 -21.493 10.639 -8.451 355 1HB ALA 48 HB1 ALA 48 -20.781 12.297 -6.731 356 2HB ALA 48 HB2 ALA 48 -20.820 11.031 -5.490 357 3HB ALA 48 HB3 ALA 48 -19.675 10.914 -6.831 358 H VAL 49 H VAL 49 -22.691 9.214 -5.364 359 HA VAL 49 HA VAL 49 -21.230 6.788 -5.571 360 HB VAL 49 HB VAL 49 -23.928 7.158 -4.224 361 1HG1 VAL 49 HG11 VAL 49 -23.160 5.255 -2.839 362 2HG1 VAL 49 HG12 VAL 49 -23.256 4.784 -4.541 363 3HG1 VAL 49 HG13 VAL 49 -21.675 5.131 -3.820 364 1HG2 VAL 49 HG21 VAL 49 -22.365 8.806 -3.319 365 2HG2 VAL 49 HG22 VAL 49 -22.541 7.498 -2.155 366 3HG2 VAL 49 HG23 VAL 49 -21.093 7.582 -3.185 367 H LYS 50 H LYS 50 -24.625 7.560 -6.648 368 HA LYS 50 HA LYS 50 -24.927 4.935 -7.691 369 1HB LYS 50 HB2 LYS 50 -26.782 6.591 -7.073 370 2HB LYS 50 HB3 LYS 50 -26.523 7.331 -8.667 371 1HG LYS 50 HG2 LYS 50 -26.911 5.061 -9.713 372 2HG LYS 50 HG3 LYS 50 -27.198 4.394 -8.099 373 1HD LYS 50 HD2 LYS 50 -29.135 5.940 -7.831 374 2HD LYS 50 HD3 LYS 50 -28.844 6.548 -9.478 375 1HE LYS 50 HE2 LYS 50 -29.173 4.263 -10.386 376 2HE LYS 50 HE3 LYS 50 -29.460 3.650 -8.752 377 1HZ LYS 50 HZ1 LYS 50 -31.422 5.075 -8.633 378 2HZ LYS 50 HZ2 LYS 50 -31.160 5.640 -10.146 379 3HZ LYS 50 HZ3 LYS 50 -31.531 4.072 -9.910 380 H ALA 51 H ALA 51 -23.903 8.006 -9.320 381 HA ALA 51 HA ALA 51 -23.944 7.021 -11.947 382 1HB ALA 51 HB1 ALA 51 -21.989 9.013 -10.693 383 2HB ALA 51 HB2 ALA 51 -22.252 8.788 -12.432 384 3HB ALA 51 HB3 ALA 51 -23.570 9.410 -11.417 385 H MET 52 H MET 52 -21.276 6.842 -9.512 386 HA MET 52 HA MET 52 -19.514 5.410 -11.278 387 1HB MET 52 HB2 MET 52 -19.635 5.834 -8.268 388 2HB MET 52 HB3 MET 52 -18.274 5.107 -9.118 389 1HG MET 52 HG2 MET 52 -19.332 7.935 -9.510 390 2HG MET 52 HG3 MET 52 -17.858 7.485 -8.669 391 1HE MET 52 HE1 MET 52 -15.658 6.786 -9.785 392 2HE MET 52 HE2 MET 52 -16.551 5.351 -10.331 393 3HE MET 52 HE3 MET 52 -15.526 6.217 -11.462 394 H LYS 53 H LYS 53 -21.836 4.415 -8.700 395 HA LYS 53 HA LYS 53 -21.062 1.709 -8.654 396 1HB LYS 53 HB2 LYS 53 -22.333 2.859 -6.909 397 2HB LYS 53 HB3 LYS 53 -23.731 3.015 -7.975 398 1HG LYS 53 HG2 LYS 53 -24.210 0.706 -7.928 399 2HG LYS 53 HG3 LYS 53 -22.600 0.270 -7.330 400 1HD LYS 53 HD2 LYS 53 -24.540 1.968 -5.705 401 2HD LYS 53 HD3 LYS 53 -24.514 0.187 -5.626 402 1HE LYS 53 HE2 LYS 53 -22.071 0.268 -5.079 403 2HE LYS 53 HE3 LYS 53 -22.141 2.028 -5.048 404 1HZ LYS 53 HZ1 LYS 53 -23.557 0.215 -3.192 405 2HZ LYS 53 HZ2 LYS 53 -22.241 1.149 -2.883 406 3HZ LYS 53 HZ3 LYS 53 -23.698 1.850 -3.181 407 H GLU 54 H GLU 54 -23.357 3.399 -10.784 408 HA GLU 54 HA GLU 54 -24.383 1.073 -12.057 409 1HB GLU 54 HB2 GLU 54 -24.160 4.001 -12.826 410 2HB GLU 54 HB3 GLU 54 -24.829 2.823 -13.957 411 1HG GLU 54 HG2 GLU 54 -25.872 3.212 -11.126 412 2HG GLU 54 HG3 GLU 54 -26.507 4.056 -12.533 413 H VAL 55 H VAL 55 -21.227 2.551 -12.318 414 HA VAL 55 HA VAL 55 -20.578 1.063 -14.794 415 HB VAL 55 HB VAL 55 -18.845 2.857 -13.033 416 1HG1 VAL 55 HG11 VAL 55 -17.424 1.423 -14.422 417 2HG1 VAL 55 HG12 VAL 55 -18.371 1.844 -15.868 418 3HG1 VAL 55 HG13 VAL 55 -17.394 3.067 -15.022 419 1HG2 VAL 55 HG21 VAL 55 -20.702 4.164 -14.020 420 2HG2 VAL 55 HG22 VAL 55 -19.174 4.558 -14.798 421 3HG2 VAL 55 HG23 VAL 55 -20.340 3.487 -15.616 422 H GLY 56 H GLY 56 -20.855 0.388 -11.477 423 1HA GLY 56 HA1 GLY 56 -20.313 -1.583 -10.394 424 2HA GLY 56 HA2 GLY 56 -19.104 -1.980 -11.624 425 H ILE 57 H ILE 57 -19.018 1.304 -10.353 426 HA ILE 57 HA ILE 57 -16.567 0.633 -8.797 427 HB ILE 57 HB ILE 57 -17.327 3.257 -10.111 428 1HG1 ILE 57 HG12 ILE 57 -15.362 1.128 -11.057 429 2HG1 ILE 57 HG13 ILE 57 -16.872 1.589 -11.848 430 1HG2 ILE 57 HG21 ILE 57 -15.008 3.907 -9.505 431 2HG2 ILE 57 HG22 ILE 57 -15.861 3.383 -8.061 432 3HG2 ILE 57 HG23 ILE 57 -14.706 2.291 -8.845 433 1HD1 ILE 57 HD11 ILE 57 -15.177 2.668 -13.067 434 2HD1 ILE 57 HD12 ILE 57 -15.939 3.931 -12.105 435 3HD1 ILE 57 HD13 ILE 57 -14.354 3.261 -11.614 436 H ASP 58 H ASP 58 -17.530 0.165 -6.883 437 HA ASP 58 HA ASP 58 -19.695 1.785 -5.769 438 1HB ASP 58 HB2 ASP 58 -19.723 -0.564 -5.301 439 2HB ASP 58 HB3 ASP 58 -18.082 -0.518 -4.638 440 H ILE 59 H ILE 59 -18.679 3.880 -5.792 441 HA ILE 59 HA ILE 59 -16.388 4.340 -4.094 442 HB ILE 59 HB ILE 59 -16.599 6.641 -4.595 443 1HG1 ILE 59 HG12 ILE 59 -19.180 6.263 -6.117 444 2HG1 ILE 59 HG13 ILE 59 -19.177 6.707 -4.413 445 1HG2 ILE 59 HG21 ILE 59 -17.249 5.115 -7.128 446 2HG2 ILE 59 HG22 ILE 59 -16.364 6.646 -6.996 447 3HG2 ILE 59 HG23 ILE 59 -15.657 5.167 -6.335 448 1HD1 ILE 59 HD11 ILE 59 -17.742 8.673 -4.911 449 2HD1 ILE 59 HD12 ILE 59 -17.923 8.343 -6.644 450 3HD1 ILE 59 HD13 ILE 59 -19.344 8.734 -5.653 451 H SER 60 H SER 60 -19.397 3.418 -2.996 452 HA SER 60 HA SER 60 -20.090 5.576 -1.316 453 1HB SER 60 HB2 SER 60 -21.461 3.990 -0.068 454 2HB SER 60 HB3 SER 60 -21.648 3.771 -1.812 455 HG SER 60 HG SER 60 -20.433 1.950 -1.753 456 H ASN 61 H ASN 61 -17.575 3.181 -0.984 457 HA ASN 61 HA ASN 61 -17.066 3.409 1.818 458 1HB ASN 61 HB2 ASN 61 -16.315 1.505 0.433 459 2HB ASN 61 HB3 ASN 61 -15.280 2.581 -0.513 460 1HD2 ASN 61 HD22 ASN 61 -15.823 1.446 2.890 461 2HD2 ASN 61 HD21 ASN 61 -14.144 1.552 3.346 462 H GLN 62 H GLN 62 -16.390 5.598 -0.834 463 HA GLN 62 HA GLN 62 -14.031 6.816 0.284 464 1HB GLN 62 HB2 GLN 62 -15.976 7.888 -1.801 465 2HB GLN 62 HB3 GLN 62 -14.371 8.530 -1.410 466 1HG GLN 62 HG2 GLN 62 -13.362 6.362 -2.099 467 2HG GLN 62 HG3 GLN 62 -14.951 5.808 -2.626 468 1HE2 GLN 62 HE22 GLN 62 -14.998 9.074 -3.510 469 2HE2 GLN 62 HE21 GLN 62 -14.434 8.835 -5.161 470 H THR 63 H THR 63 -14.202 9.273 0.742 471 HA THR 63 HA THR 63 -16.721 10.267 1.714 472 HB THR 63 HB THR 63 -15.476 11.114 3.863 473 HG1 THR 63 HG1 THR 63 -13.436 10.233 3.412 474 1HG2 THR 63 HG21 THR 63 -16.256 8.176 3.838 475 2HG2 THR 63 HG22 THR 63 -16.334 9.324 5.190 476 3HG2 THR 63 HG23 THR 63 -17.428 9.509 3.806 477 H SER 64 H SER 64 -16.539 12.655 2.086 478 HA SER 64 HA SER 64 -14.557 13.797 0.210 479 1HB SER 64 HB2 SER 64 -17.186 14.900 1.253 480 2HB SER 64 HB3 SER 64 -16.182 15.585 -0.041 481 HG SER 64 HG SER 64 -18.099 14.131 -0.500 482 H ASP 65 H ASP 65 -13.612 15.799 0.712 483 HA ASP 65 HA ASP 65 -13.611 16.920 3.414 484 1HB ASP 65 HB2 ASP 65 -11.814 15.066 3.321 485 2HB ASP 65 HB3 ASP 65 -11.015 16.049 2.080 486 H ILE 66 H ILE 66 -12.373 19.038 3.346 487 HA ILE 66 HA ILE 66 -12.507 20.249 0.644 488 HB ILE 66 HB ILE 66 -12.716 22.314 1.665 489 1HG1 ILE 66 HG12 ILE 66 -11.927 21.053 4.317 490 2HG1 ILE 66 HG13 ILE 66 -11.016 22.254 3.377 491 1HG2 ILE 66 HG21 ILE 66 -14.676 20.660 1.819 492 2HG2 ILE 66 HG22 ILE 66 -14.331 20.541 3.546 493 3HG2 ILE 66 HG23 ILE 66 -14.787 22.102 2.849 494 1HD1 ILE 66 HD11 ILE 66 -12.985 23.832 3.680 495 2HD1 ILE 66 HD12 ILE 66 -13.634 22.655 4.848 496 3HD1 ILE 66 HD13 ILE 66 -12.072 23.434 5.162 497 H ILE 67 H ILE 67 -10.626 21.769 0.182 498 HA ILE 67 HA ILE 67 -8.422 20.165 -0.099 499 HB ILE 67 HB ILE 67 -9.050 21.937 -1.559 500 1HG1 ILE 67 HG12 ILE 67 -6.712 20.947 -1.480 501 2HG1 ILE 67 HG13 ILE 67 -6.976 22.395 -2.422 502 1HG2 ILE 67 HG21 ILE 67 -8.451 24.288 -1.233 503 2HG2 ILE 67 HG22 ILE 67 -9.742 23.726 -0.164 504 3HG2 ILE 67 HG23 ILE 67 -8.093 23.949 0.475 505 1HD1 ILE 67 HD11 ILE 67 -5.940 23.817 -0.771 506 2HD1 ILE 67 HD12 ILE 67 -5.719 22.476 0.347 507 3HD1 ILE 67 HD13 ILE 67 -4.848 22.480 -1.188 508 H ASP 68 H ASP 68 -6.576 19.718 0.770 509 HA ASP 68 HA ASP 68 -5.698 21.139 3.226 510 1HB ASP 68 HB2 ASP 68 -6.682 18.891 3.746 511 2HB ASP 68 HB3 ASP 68 -5.439 18.150 2.718 512 H SER 69 H SER 69 -3.880 22.234 2.620 513 HA SER 69 HA SER 69 -2.403 21.588 0.308 514 1HB SER 69 HB2 SER 69 -0.743 23.277 1.421 515 2HB SER 69 HB3 SER 69 -2.298 23.810 0.778 516 HG SER 69 HG SER 69 -1.899 24.621 2.893 517 H ASP 70 H ASP 70 -2.300 20.221 3.514 518 HA ASP 70 HA ASP 70 0.421 19.382 3.541 519 1HB ASP 70 HB2 ASP 70 -1.068 19.647 5.536 520 2HB ASP 70 HB3 ASP 70 -1.910 18.173 5.036 521 H ILE 71 H ILE 71 -2.031 18.324 1.476 522 HA ILE 71 HA ILE 71 -0.523 15.763 0.958 523 HB ILE 71 HB ILE 71 -3.457 16.455 0.461 524 1HG1 ILE 71 HG12 ILE 71 -2.148 14.199 2.050 525 2HG1 ILE 71 HG13 ILE 71 -2.828 15.669 2.764 526 1HG2 ILE 71 HG21 ILE 71 -2.552 15.267 -1.522 527 2HG2 ILE 71 HG22 ILE 71 -1.905 13.991 -0.467 528 3HG2 ILE 71 HG23 ILE 71 -3.657 14.248 -0.630 529 1HD1 ILE 71 HD11 ILE 71 -5.072 15.043 1.804 530 2HD1 ILE 71 HD12 ILE 71 -4.371 13.472 1.335 531 3HD1 ILE 71 HD13 ILE 71 -4.444 13.934 3.040 532 H LEU 72 H LEU 72 -2.302 18.539 -0.470 533 HA LEU 72 HA LEU 72 -1.656 18.370 -3.104 534 1HB LEU 72 HB2 LEU 72 -3.001 20.117 -1.889 535 2HB LEU 72 HB3 LEU 72 -1.488 20.773 -1.283 536 HG LEU 72 HG LEU 72 -1.072 20.826 -4.034 537 1HD1 LEU 72 HD11 LEU 72 -3.962 21.584 -3.424 538 2HD1 LEU 72 HD12 LEU 72 -3.076 22.014 -4.903 539 3HD1 LEU 72 HD13 LEU 72 -3.397 20.314 -4.522 540 1HD2 LEU 72 HD21 LEU 72 -1.385 23.289 -3.728 541 2HD2 LEU 72 HD22 LEU 72 -2.087 22.970 -2.125 542 3HD2 LEU 72 HD23 LEU 72 -0.395 22.555 -2.461 543 H ASN 73 H ASN 73 0.461 19.892 -0.600 544 HA ASN 73 HA ASN 73 2.454 20.650 -2.440 545 1HB ASN 73 HB2 ASN 73 3.635 21.508 -0.660 546 2HB ASN 73 HB3 ASN 73 1.996 21.531 -0.028 547 1HD2 ASN 73 HD22 ASN 73 1.404 19.800 1.527 548 2HD2 ASN 73 HD21 ASN 73 2.675 19.139 2.545 549 H ASN 74 H ASN 74 1.836 17.467 -1.560 550 HA ASN 74 HA ASN 74 4.606 16.626 -2.225 551 1HB ASN 74 HB2 ASN 74 4.470 14.850 -0.511 552 2HB ASN 74 HB3 ASN 74 4.475 16.464 0.182 553 1HD2 ASN 74 HD22 ASN 74 2.689 17.210 1.308 554 2HD2 ASN 74 HD21 ASN 74 1.384 16.168 1.806 555 H ALA 75 H ALA 75 1.512 16.583 -3.329 556 HA ALA 75 HA ALA 75 1.289 13.828 -4.053 557 1HB ALA 75 HB1 ALA 75 0.061 16.289 -5.338 558 2HB ALA 75 HB2 ALA 75 -0.441 14.602 -5.598 559 3HB ALA 75 HB3 ALA 75 -0.653 15.351 -4.005 560 H ASP 76 H ASP 76 1.673 12.986 -6.365 561 HA ASP 76 HA ASP 76 4.103 14.106 -7.609 562 1HB ASP 76 HB2 ASP 76 3.568 11.655 -7.816 563 2HB ASP 76 HB3 ASP 76 2.085 12.074 -8.685 564 H LEU 77 H LEU 77 0.606 14.217 -7.872 565 HA LEU 77 HA LEU 77 0.650 16.304 -9.957 566 1HB LEU 77 HB2 LEU 77 0.523 14.242 -11.158 567 2HB LEU 77 HB3 LEU 77 -0.608 13.552 -9.993 568 HG LEU 77 HG LEU 77 -2.371 15.104 -10.734 569 1HD1 LEU 77 HD11 LEU 77 -2.195 16.396 -12.776 570 2HD1 LEU 77 HD12 LEU 77 -0.893 16.939 -11.725 571 3HD1 LEU 77 HD13 LEU 77 -0.549 15.834 -13.069 572 1HD2 LEU 77 HD21 LEU 77 -2.015 12.791 -11.672 573 2HD2 LEU 77 HD22 LEU 77 -2.806 13.891 -12.820 574 3HD2 LEU 77 HD23 LEU 77 -1.072 13.531 -12.966 575 H VAL 78 H VAL 78 -1.017 17.636 -9.852 576 HA VAL 78 HA VAL 78 -3.242 17.173 -7.931 577 HB VAL 78 HB VAL 78 -1.573 19.663 -8.479 578 1HG1 VAL 78 HG11 VAL 78 -3.040 20.855 -6.928 579 2HG1 VAL 78 HG12 VAL 78 -3.945 20.338 -8.349 580 3HG1 VAL 78 HG13 VAL 78 -4.129 19.447 -6.819 581 1HG2 VAL 78 HG21 VAL 78 -1.093 19.615 -6.080 582 2HG2 VAL 78 HG22 VAL 78 -2.170 18.211 -5.853 583 3HG2 VAL 78 HG23 VAL 78 -0.669 18.059 -6.773 584 H VAL 79 H VAL 79 -5.243 17.475 -8.917 585 HA VAL 79 HA VAL 79 -5.187 18.318 -11.792 586 HB VAL 79 HB VAL 79 -6.921 16.154 -10.556 587 1HG1 VAL 79 HG11 VAL 79 -7.897 17.267 -12.536 588 2HG1 VAL 79 HG12 VAL 79 -6.399 16.976 -13.449 589 3HG1 VAL 79 HG13 VAL 79 -7.419 15.611 -12.928 590 1HG2 VAL 79 HG21 VAL 79 -5.552 14.544 -11.874 591 2HG2 VAL 79 HG22 VAL 79 -4.402 15.850 -12.226 592 3HG2 VAL 79 HG23 VAL 79 -4.659 15.291 -10.551 593 H THR 80 H THR 80 -6.345 20.075 -12.118 594 HA THR 80 HA THR 80 -8.387 20.899 -10.132 595 HB THR 80 HB THR 80 -8.158 23.124 -11.262 596 HG1 THR 80 HG1 THR 80 -5.970 21.818 -12.549 597 1HG2 THR 80 HG21 THR 80 -6.015 23.634 -10.130 598 2HG2 THR 80 HG22 THR 80 -7.055 22.586 -9.141 599 3HG2 THR 80 HG23 THR 80 -5.662 21.899 -10.002 600 H LEU 81 H LEU 81 -10.139 19.731 -10.622 601 HA LEU 81 HA LEU 81 -10.746 18.874 -13.296 602 1HB LEU 81 HB2 LEU 81 -12.331 18.813 -10.715 603 2HB LEU 81 HB3 LEU 81 -12.900 18.065 -12.203 604 HG LEU 81 HG LEU 81 -10.302 17.313 -10.787 605 1HD1 LEU 81 HD11 LEU 81 -12.291 16.786 -9.434 606 2HD1 LEU 81 HD12 LEU 81 -13.005 15.916 -10.814 607 3HD1 LEU 81 HD13 LEU 81 -11.519 15.317 -10.053 608 1HD2 LEU 81 HD21 LEU 81 -10.191 16.729 -13.165 609 2HD2 LEU 81 HD22 LEU 81 -10.459 15.259 -12.233 610 3HD2 LEU 81 HD23 LEU 81 -11.806 16.011 -13.104 611 H CYS 82 H CYS 82 -11.366 21.960 -11.879 612 HA CYS 82 HA CYS 82 -12.942 22.548 -14.217 613 1HB CYS 82 HB2 CYS 82 -14.791 23.625 -13.115 614 2HB CYS 82 HB3 CYS 82 -14.685 21.963 -12.503 615 HG CYS 82 HG CYS 82 -15.356 23.670 -10.552 616 H GLY 83 H GLY 83 -12.896 24.893 -14.653 617 1HA GLY 83 HA1 GLY 83 -10.236 25.776 -14.315 618 2HA GLY 83 HA2 GLY 83 -11.562 26.696 -15.047 619 H ASP 84 H ASP 84 -13.305 26.926 -12.799 620 HA ASP 84 HA ASP 84 -12.172 29.218 -11.561 621 1HB ASP 84 HB2 ASP 84 -14.598 28.865 -11.864 622 2HB ASP 84 HB3 ASP 84 -14.563 27.559 -10.675 623 H ALA 85 H ALA 85 -12.380 25.822 -10.475 624 HA ALA 85 HA ALA 85 -11.703 26.279 -7.762 625 1HB ALA 85 HB1 ALA 85 -11.186 23.832 -9.523 626 2HB ALA 85 HB2 ALA 85 -11.094 23.877 -7.755 627 3HB ALA 85 HB3 ALA 85 -12.636 24.151 -8.537 628 H ALA 86 H ALA 86 -9.691 26.150 -10.654 629 HA ALA 86 HA ALA 86 -7.236 25.462 -9.431 630 1HB ALA 86 HB1 ALA 86 -7.734 25.422 -11.879 631 2HB ALA 86 HB2 ALA 86 -7.694 27.207 -11.873 632 3HB ALA 86 HB3 ALA 86 -6.229 26.287 -11.480 633 H ASP 87 H ASP 87 -9.026 28.488 -9.371 634 HA ASP 87 HA ASP 87 -6.863 30.251 -8.756 635 1HB ASP 87 HB2 ASP 87 -9.095 31.019 -9.486 636 2HB ASP 87 HB3 ASP 87 -9.800 30.392 -7.988 637 H LYS 88 H LYS 88 -8.772 28.006 -6.817 638 HA LYS 88 HA LYS 88 -7.559 29.025 -4.266 639 1HB LYS 88 HB2 LYS 88 -9.995 28.909 -4.239 640 2HB LYS 88 HB3 LYS 88 -9.969 27.270 -4.889 641 1HG LYS 88 HG2 LYS 88 -10.560 27.272 -2.552 642 2HG LYS 88 HG3 LYS 88 -9.054 26.404 -2.807 643 1HD LYS 88 HD2 LYS 88 -7.807 28.438 -1.979 644 2HD LYS 88 HD3 LYS 88 -9.372 29.250 -1.732 645 1HE LYS 88 HE2 LYS 88 -10.087 27.417 -0.241 646 2HE LYS 88 HE3 LYS 88 -8.558 26.574 -0.506 647 1HZ LYS 88 HZ1 LYS 88 -8.840 29.222 0.816 648 2HZ LYS 88 HZ2 LYS 88 -8.536 27.818 1.580 649 3HZ LYS 88 HZ3 LYS 88 -7.421 28.446 0.572 650 H CYS 89 H CYS 89 -7.457 26.326 -6.500 651 HA CYS 89 HA CYS 89 -6.149 24.417 -4.890 652 1HB CYS 89 HB2 CYS 89 -6.951 24.114 -7.234 653 2HB CYS 89 HB3 CYS 89 -5.583 25.100 -7.791 654 HG CYS 89 HG CYS 89 -5.053 22.568 -8.182 655 HA PRO 90 HA PRO 90 -3.054 27.505 -3.776 656 1HB PRO 90 HB2 PRO 90 -1.734 25.476 -2.102 657 2HB PRO 90 HB3 PRO 90 -2.461 27.069 -1.681 658 1HG PRO 90 HG2 PRO 90 -3.674 24.702 -1.023 659 2HG PRO 90 HG3 PRO 90 -4.589 26.178 -1.446 660 1HD PRO 90 HD2 PRO 90 -3.943 23.823 -3.217 661 2HD PRO 90 HD3 PRO 90 -5.471 24.711 -3.012 662 H MET 91 H MET 91 -0.477 27.604 -3.565 663 HA MET 91 HA MET 91 0.596 26.994 -6.101 664 1HB MET 91 HB2 MET 91 1.975 27.693 -3.471 665 2HB MET 91 HB3 MET 91 2.785 27.617 -5.041 666 1HG MET 91 HG2 MET 91 1.267 29.361 -5.924 667 2HG MET 91 HG3 MET 91 0.479 29.477 -4.346 668 1HE MET 91 HE1 MET 91 2.402 32.876 -4.620 669 2HE MET 91 HE2 MET 91 1.625 31.973 -5.940 670 3HE MET 91 HE3 MET 91 0.831 32.088 -4.352 671 H THR 92 H THR 92 1.938 25.430 -6.829 672 HA THR 92 HA THR 92 2.522 23.055 -5.136 673 HB THR 92 HB THR 92 1.990 21.752 -7.299 674 HG1 THR 92 HG1 THR 92 1.760 23.570 -8.670 675 1HG2 THR 92 HG21 THR 92 0.599 21.688 -5.283 676 2HG2 THR 92 HG22 THR 92 -0.274 23.131 -5.826 677 3HG2 THR 92 HG23 THR 92 -0.373 21.634 -6.769 678 HA PRO 93 HA PRO 93 6.518 24.284 -6.921 679 1HB PRO 93 HB2 PRO 93 8.155 22.478 -5.649 680 2HB PRO 93 HB3 PRO 93 7.432 23.892 -4.829 681 1HG PRO 93 HG2 PRO 93 6.446 21.032 -4.842 682 2HG PRO 93 HG3 PRO 93 6.650 22.123 -3.437 683 1HD PRO 93 HD2 PRO 93 4.236 21.757 -4.666 684 2HD PRO 93 HD3 PRO 93 4.707 23.339 -3.976 685 HA PRO 94 HA PRO 94 7.209 21.674 -10.420 686 1HB PRO 94 HB2 PRO 94 10.051 21.198 -9.493 687 2HB PRO 94 HB3 PRO 94 9.462 21.610 -11.136 688 1HG PRO 94 HG2 PRO 94 10.506 23.545 -9.564 689 2HG PRO 94 HG3 PRO 94 8.993 23.868 -10.474 690 1HD PRO 94 HD2 PRO 94 9.320 23.150 -7.558 691 2HD PRO 94 HD3 PRO 94 8.240 24.361 -8.314 692 H HIS 95 H HIS 95 8.236 20.189 -7.355 693 HA HIS 95 HA HIS 95 8.356 17.479 -8.256 694 1HB HIS 95 HB2 HIS 95 7.608 18.535 -5.500 695 2HB HIS 95 HB3 HIS 95 8.233 16.934 -5.885 696 HD1 HIS 95 HD1 HIS 95 9.511 19.943 -4.403 697 HD2 HIS 95 HD2 HIS 95 10.830 17.297 -7.404 698 HE1 HIS 95 HE1 HIS 95 12.020 20.300 -4.617 699 H VAL 96 H VAL 96 5.689 19.562 -8.131 700 HA VAL 96 HA VAL 96 3.645 17.421 -7.867 701 HB VAL 96 HB VAL 96 3.535 20.284 -6.804 702 1HG1 VAL 96 HG11 VAL 96 1.512 19.583 -5.711 703 2HG1 VAL 96 HG12 VAL 96 1.373 19.211 -7.427 704 3HG1 VAL 96 HG13 VAL 96 1.720 17.911 -6.266 705 1HG2 VAL 96 HG21 VAL 96 5.166 19.213 -5.409 706 2HG2 VAL 96 HG22 VAL 96 3.647 19.400 -4.531 707 3HG2 VAL 96 HG23 VAL 96 4.118 17.813 -5.160 708 H LYS 97 H LYS 97 3.392 17.277 -10.157 709 HA LYS 97 HA LYS 97 3.321 19.714 -11.752 710 1HB LYS 97 HB2 LYS 97 3.139 18.348 -13.630 711 2HB LYS 97 HB3 LYS 97 4.174 17.462 -12.524 712 1HG LYS 97 HG2 LYS 97 1.803 16.330 -11.856 713 2HG LYS 97 HG3 LYS 97 1.408 16.861 -13.505 714 1HD LYS 97 HD2 LYS 97 3.522 15.657 -14.273 715 2HD LYS 97 HD3 LYS 97 3.694 15.072 -12.606 716 1HE LYS 97 HE2 LYS 97 1.203 14.229 -12.962 717 2HE LYS 97 HE3 LYS 97 1.575 14.370 -14.682 718 1HZ LYS 97 HZ1 LYS 97 3.531 12.884 -14.180 719 2HZ LYS 97 HZ2 LYS 97 2.984 12.720 -12.629 720 3HZ LYS 97 HZ3 LYS 97 2.100 12.155 -13.891 721 H ARG 98 H ARG 98 1.371 20.117 -13.153 722 HA ARG 98 HA ARG 98 -1.151 19.893 -11.572 723 1HB ARG 98 HB2 ARG 98 0.156 22.329 -12.846 724 2HB ARG 98 HB3 ARG 98 -1.577 22.283 -12.547 725 1HG ARG 98 HG2 ARG 98 0.376 21.687 -10.308 726 2HG ARG 98 HG3 ARG 98 0.001 23.351 -10.751 727 1HD ARG 98 HD2 ARG 98 -2.281 21.429 -10.242 728 2HD ARG 98 HD3 ARG 98 -1.384 22.068 -8.880 729 HE ARG 98 HE ARG 98 -3.084 23.590 -10.776 730 1HH1 ARG 98 HH11 ARG 98 -0.798 23.820 -8.071 731 2HH1 ARG 98 HH12 ARG 98 -1.710 25.002 -7.198 732 1HH2 ARG 98 HH21 ARG 98 -3.995 25.568 -9.861 733 2HH2 ARG 98 HH22 ARG 98 -3.460 26.111 -8.307 734 H GLU 99 H GLU 99 -3.036 19.755 -12.789 735 HA GLU 99 HA GLU 99 -2.896 20.098 -15.672 736 1HB GLU 99 HB2 GLU 99 -2.384 17.673 -15.268 737 2HB GLU 99 HB3 GLU 99 -3.930 17.502 -14.439 738 1HG GLU 99 HG2 GLU 99 -3.891 16.682 -16.794 739 2HG GLU 99 HG3 GLU 99 -5.146 17.879 -16.474 740 H HIS 100 H HIS 100 -5.184 20.207 -16.538 741 HA HIS 100 HA HIS 100 -7.110 21.186 -14.539 742 1HB HIS 100 HB2 HIS 100 -7.231 23.365 -15.553 743 2HB HIS 100 HB3 HIS 100 -5.601 23.070 -14.978 744 HD1 HIS 100 HD1 HIS 100 -4.724 21.448 -17.864 745 HD2 HIS 100 HD2 HIS 100 -6.484 25.242 -17.246 746 HE1 HIS 100 HE1 HIS 100 -4.144 22.849 -19.888 747 H TRP 101 H TRP 101 -9.205 21.232 -15.219 748 HA TRP 101 HA TRP 101 -9.937 20.718 -18.026 749 1HB TRP 101 HB2 TRP 101 -11.061 19.078 -15.747 750 2HB TRP 101 HB3 TRP 101 -11.291 18.867 -17.483 751 HD1 TRP 101 HD1 TRP 101 -9.014 17.965 -14.642 752 HE1 TRP 101 HE1 TRP 101 -7.155 16.386 -15.384 753 HE3 TRP 101 HE3 TRP 101 -9.647 18.316 -19.711 754 HZ2 TRP 101 HZ2 TRP 101 -6.053 15.399 -17.867 755 HZ3 TRP 101 HZ3 TRP 101 -8.136 17.086 -21.243 756 HH2 TRP 101 HH2 TRP 101 -6.357 15.592 -20.324 757 H GLY 102 H GLY 102 -12.711 20.543 -17.620 758 1HA GLY 102 HA1 GLY 102 -13.412 23.106 -16.251 759 2HA GLY 102 HA2 GLY 102 -13.680 22.879 -17.974 760 H PHE 103 H PHE 103 -14.207 20.508 -15.270 761 HA PHE 103 HA PHE 103 -16.757 19.823 -16.464 762 1HB PHE 103 HB2 PHE 103 -15.297 18.797 -14.008 763 2HB PHE 103 HB3 PHE 103 -16.884 18.213 -14.526 764 HD1 PHE 103 HD1 PHE 103 -13.292 18.058 -15.199 765 HD2 PHE 103 HD2 PHE 103 -17.199 17.297 -16.860 766 HE1 PHE 103 HE1 PHE 103 -12.246 16.901 -17.106 767 HE2 PHE 103 HE2 PHE 103 -16.159 16.123 -18.767 768 HZ PHE 103 HZ PHE 103 -13.689 15.956 -18.933 769 H ASP 104 H ASP 104 -18.520 20.900 -16.209 770 HA ASP 104 HA ASP 104 -19.133 22.718 -14.053 771 1HB ASP 104 HB2 ASP 104 -20.054 22.849 -16.387 772 2HB ASP 104 HB3 ASP 104 -20.911 21.327 -16.091 773 H ASP 105 H ASP 105 -20.849 22.362 -12.463 774 HA ASP 105 HA ASP 105 -20.573 19.824 -11.124 775 1HB ASP 105 HB2 ASP 105 -20.877 21.790 -9.797 776 2HB ASP 105 HB3 ASP 105 -22.379 22.187 -10.629 777 HA PRO 106 HA PRO 106 -23.884 18.006 -13.508 778 1HB PRO 106 HB2 PRO 106 -23.869 15.460 -12.504 779 2HB PRO 106 HB3 PRO 106 -22.511 16.101 -13.477 780 1HG PRO 106 HG2 PRO 106 -22.762 16.017 -10.445 781 2HG PRO 106 HG3 PRO 106 -21.402 15.409 -11.455 782 1HD PRO 106 HD2 PRO 106 -21.349 17.870 -10.309 783 2HD PRO 106 HD3 PRO 106 -20.693 17.609 -11.955 784 H ALA 107 H ALA 107 -24.056 18.061 -9.960 785 HA ALA 107 HA ALA 107 -26.491 16.625 -9.699 786 1HB ALA 107 HB1 ALA 107 -25.221 18.638 -7.799 787 2HB ALA 107 HB2 ALA 107 -26.469 17.443 -7.388 788 3HB ALA 107 HB3 ALA 107 -24.852 16.898 -7.884 789 H ARG 108 H ARG 108 -25.861 19.983 -10.420 790 HA ARG 108 HA ARG 108 -28.797 20.480 -10.510 791 1HB ARG 108 HB2 ARG 108 -28.213 22.937 -10.243 792 2HB ARG 108 HB3 ARG 108 -28.167 21.886 -8.846 793 1HG ARG 108 HG2 ARG 108 -26.318 23.568 -8.965 794 2HG ARG 108 HG3 ARG 108 -25.823 21.896 -8.736 795 1HD ARG 108 HD2 ARG 108 -24.334 22.875 -10.306 796 2HD ARG 108 HD3 ARG 108 -25.358 21.709 -11.161 797 HE ARG 108 HE ARG 108 -26.291 24.486 -11.242 798 1HH1 ARG 108 HH21 ARG 108 -24.269 22.030 -12.875 799 2HH1 ARG 108 HH22 ARG 108 -24.073 22.963 -14.310 800 1HH2 ARG 108 HH11 ARG 108 -26.189 25.616 -13.271 801 2HH2 ARG 108 HH12 ARG 108 -25.321 24.938 -14.597 802 H ALA 109 H ALA 109 -27.044 19.282 -12.642 803 HA ALA 109 HA ALA 109 -26.730 21.032 -14.796 804 1HB ALA 109 HB1 ALA 109 -27.077 19.002 -16.198 805 2HB ALA 109 HB2 ALA 109 -25.986 18.712 -14.826 806 3HB ALA 109 HB3 ALA 109 -27.664 18.131 -14.764 807 H GLN 110 H GLN 110 -29.703 19.490 -13.647 808 HA GLN 110 HA GLN 110 -31.906 19.856 -13.977 809 1HB GLN 110 HB2 GLN 110 -30.848 22.645 -14.503 810 2HB GLN 110 HB3 GLN 110 -32.565 22.294 -14.379 811 1HG GLN 110 HG2 GLN 110 -32.424 21.586 -12.122 812 2HG GLN 110 HG3 GLN 110 -30.666 21.519 -12.149 813 1HE2 GLN 110 HE22 GLN 110 -29.451 23.541 -12.374 814 2HE2 GLN 110 HE21 GLN 110 -30.156 25.050 -11.804 815 H GLY 111 H GLY 111 -33.445 21.312 -15.726 816 1HA GLY 111 HA1 GLY 111 -33.880 21.602 -18.086 817 2HA GLY 111 HA2 GLY 111 -32.888 20.171 -18.429 818 H THR 112 H THR 112 -33.580 18.219 -16.947 819 HA THR 112 HA THR 112 -36.159 17.961 -15.893 820 HB THR 112 HB THR 112 -37.039 17.850 -18.116 821 HG1 THR 112 HG1 THR 112 -38.004 15.927 -18.007 822 1HG2 THR 112 HG21 THR 112 -35.108 17.401 -19.495 823 2HG2 THR 112 HG22 THR 112 -34.904 15.793 -18.767 824 3HG2 THR 112 HG23 THR 112 -36.315 16.147 -19.785 825 H GLU 113 H GLU 113 -36.325 15.502 -15.191 826 HA GLU 113 HA GLU 113 -33.930 14.973 -13.745 827 1HB GLU 113 HB2 GLU 113 -36.108 14.270 -12.933 828 2HB GLU 113 HB3 GLU 113 -36.346 13.212 -14.334 829 1HG GLU 113 HG2 GLU 113 -34.498 11.782 -13.650 830 2HG GLU 113 HG3 GLU 113 -34.061 12.888 -12.340 831 H GLU 114 H GLU 114 -35.213 13.599 -16.767 832 HA GLU 114 HA GLU 114 -33.115 11.663 -16.993 833 1HB GLU 114 HB2 GLU 114 -33.922 11.239 -19.240 834 2HB GLU 114 HB3 GLU 114 -35.248 11.296 -18.081 835 1HG GLU 114 HG2 GLU 114 -35.821 13.585 -18.830 836 2HG GLU 114 HG3 GLU 114 -34.479 13.554 -19.983 837 H GLU 115 H GLU 115 -33.320 15.063 -17.908 838 HA GLU 115 HA GLU 115 -31.027 14.976 -19.662 839 1HB GLU 115 HB2 GLU 115 -32.844 16.688 -19.835 840 2HB GLU 115 HB3 GLU 115 -32.340 17.342 -18.276 841 1HG GLU 115 HG2 GLU 115 -31.415 18.741 -19.952 842 2HG GLU 115 HG3 GLU 115 -30.072 17.827 -19.285 843 H LYS 116 H LYS 116 -31.716 15.857 -16.251 844 HA LYS 116 HA LYS 116 -29.091 16.546 -15.479 845 1HB LYS 116 HB2 LYS 116 -31.004 17.111 -14.131 846 2HB LYS 116 HB3 LYS 116 -31.502 15.421 -14.003 847 1HG LYS 116 HG2 LYS 116 -29.561 14.865 -12.686 848 2HG LYS 116 HG3 LYS 116 -28.923 16.520 -12.818 849 1HD LYS 116 HD2 LYS 116 -31.573 15.741 -11.524 850 2HD LYS 116 HD3 LYS 116 -30.037 15.922 -10.652 851 1HE LYS 116 HE2 LYS 116 -29.985 18.322 -11.639 852 2HE LYS 116 HE3 LYS 116 -31.708 18.065 -12.003 853 1HZ LYS 116 HZ1 LYS 116 -31.524 19.089 -9.864 854 2HZ LYS 116 HZ2 LYS 116 -31.931 17.541 -9.559 855 3HZ LYS 116 HZ3 LYS 116 -30.372 18.046 -9.364 856 H TRP 117 H TRP 117 -30.774 13.377 -15.387 857 HA TRP 117 HA TRP 117 -28.531 11.917 -14.427 858 1HB TRP 117 HB2 TRP 117 -30.814 11.003 -14.437 859 2HB TRP 117 HB3 TRP 117 -30.822 10.980 -16.200 860 HD1 TRP 117 HD1 TRP 117 -29.422 9.081 -17.413 861 HE1 TRP 117 HE1 TRP 117 -28.383 6.869 -16.635 862 HE3 TRP 117 HE3 TRP 117 -29.469 9.898 -12.364 863 HZ2 TRP 117 HZ2 TRP 117 -27.447 5.726 -14.184 864 HZ3 TRP 117 HZ3 TRP 117 -28.341 8.308 -10.839 865 HH2 TRP 117 HH2 TRP 117 -27.326 6.212 -11.730 866 H ALA 118 H ALA 118 -29.591 12.624 -17.824 867 HA ALA 118 HA ALA 118 -27.554 11.164 -19.100 868 1HB ALA 118 HB1 ALA 118 -28.909 13.756 -19.975 869 2HB ALA 118 HB2 ALA 118 -27.975 12.678 -21.025 870 3HB ALA 118 HB3 ALA 118 -29.487 12.108 -20.289 871 H PHE 119 H PHE 119 -27.495 14.494 -17.755 872 HA PHE 119 HA PHE 119 -24.863 15.109 -18.598 873 1HB PHE 119 HB2 PHE 119 -26.743 16.621 -17.625 874 2HB PHE 119 HB3 PHE 119 -26.102 16.173 -16.052 875 HD1 PHE 119 HD1 PHE 119 -23.777 16.876 -15.413 876 HD2 PHE 119 HD2 PHE 119 -25.581 18.105 -19.127 877 HE1 PHE 119 HE1 PHE 119 -22.150 18.756 -15.578 878 HE2 PHE 119 HE2 PHE 119 -23.916 19.935 -19.329 879 HZ PHE 119 HZ PHE 119 -22.210 20.266 -17.562 880 H PHE 120 H PHE 120 -26.059 13.429 -15.597 881 HA PHE 120 HA PHE 120 -23.547 13.131 -14.315 882 1HB PHE 120 HB2 PHE 120 -25.653 10.947 -14.433 883 2HB PHE 120 HB3 PHE 120 -24.364 11.129 -13.285 884 HD1 PHE 120 HD1 PHE 120 -26.745 10.442 -12.204 885 HD2 PHE 120 HD2 PHE 120 -25.571 14.425 -13.372 886 HE1 PHE 120 HE1 PHE 120 -28.357 11.398 -10.583 887 HE2 PHE 120 HE2 PHE 120 -27.108 15.361 -11.694 888 HZ PHE 120 HZ PHE 120 -28.526 13.864 -10.306 889 H GLN 121 H GLN 121 -25.173 11.098 -16.832 890 HA GLN 121 HA GLN 121 -23.111 9.176 -17.024 891 1HB GLN 121 HB2 GLN 121 -25.043 9.988 -19.216 892 2HB GLN 121 HB3 GLN 121 -24.069 8.525 -19.166 893 1HG GLN 121 HG2 GLN 121 -26.363 9.240 -17.302 894 2HG GLN 121 HG3 GLN 121 -26.337 7.992 -18.527 895 1HE2 GLN 121 HE22 GLN 121 -25.681 8.681 -15.196 896 2HE2 GLN 121 HE21 GLN 121 -24.960 7.144 -14.797 897 H ARG 122 H ARG 122 -23.548 12.205 -18.880 898 HA ARG 122 HA ARG 122 -21.263 11.834 -20.557 899 1HB ARG 122 HB2 ARG 122 -22.886 14.258 -19.728 900 2HB ARG 122 HB3 ARG 122 -21.315 14.502 -20.475 901 1HG ARG 122 HG2 ARG 122 -22.895 14.612 -22.223 902 2HG ARG 122 HG3 ARG 122 -21.990 13.105 -22.416 903 1HD ARG 122 HD2 ARG 122 -23.903 11.891 -21.317 904 2HD ARG 122 HD3 ARG 122 -24.792 13.434 -21.275 905 HE ARG 122 HE ARG 122 -24.078 13.138 -23.916 906 1HH1 ARG 122 HH11 ARG 122 -25.874 11.163 -21.592 907 2HH1 ARG 122 HH12 ARG 122 -26.894 10.420 -22.775 908 1HH2 ARG 122 HH21 ARG 122 -25.439 12.164 -25.510 909 2HH2 ARG 122 HH22 ARG 122 -26.641 11.019 -25.056 910 H VAL 123 H VAL 123 -21.563 13.574 -17.402 911 HA VAL 123 HA VAL 123 -18.808 14.313 -17.418 912 HB VAL 123 HB VAL 123 -20.855 14.135 -15.164 913 1HG1 VAL 123 HG11 VAL 123 -18.062 15.370 -15.074 914 2HG1 VAL 123 HG12 VAL 123 -19.327 15.594 -13.846 915 3HG1 VAL 123 HG13 VAL 123 -18.636 13.991 -14.110 916 1HG2 VAL 123 HG21 VAL 123 -19.674 16.516 -16.695 917 2HG2 VAL 123 HG22 VAL 123 -21.302 15.861 -16.920 918 3HG2 VAL 123 HG23 VAL 123 -20.861 16.615 -15.386 919 H ARG 124 H ARG 124 -20.396 11.368 -15.861 920 HA ARG 124 HA ARG 124 -17.890 10.515 -14.834 921 1HB ARG 124 HB2 ARG 124 -18.776 8.276 -14.608 922 2HB ARG 124 HB3 ARG 124 -19.987 9.437 -14.071 923 1HG ARG 124 HG2 ARG 124 -21.260 9.120 -16.095 924 2HG ARG 124 HG3 ARG 124 -20.009 8.107 -16.810 925 1HD ARG 124 HD2 ARG 124 -20.358 6.469 -14.916 926 2HD ARG 124 HD3 ARG 124 -21.761 7.423 -14.447 927 HE ARG 124 HE ARG 124 -22.964 6.514 -16.165 928 1HH1 ARG 124 HH11 ARG 124 -19.551 5.859 -16.980 929 2HH1 ARG 124 HH12 ARG 124 -19.958 4.945 -18.386 930 1HH2 ARG 124 HH21 ARG 124 -23.454 5.381 -17.971 931 2HH2 ARG 124 HH22 ARG 124 -22.234 4.614 -18.948 932 H ASP 125 H ASP 125 -19.362 9.965 -18.035 933 HA ASP 125 HA ASP 125 -17.454 8.094 -18.941 934 1HB ASP 125 HB2 ASP 125 -19.544 8.462 -20.132 935 2HB ASP 125 HB3 ASP 125 -19.083 10.124 -20.514 936 H GLU 126 H GLU 126 -17.482 11.708 -19.199 937 HA GLU 126 HA GLU 126 -14.978 11.705 -20.544 938 1HB GLU 126 HB2 GLU 126 -16.778 13.816 -19.436 939 2HB GLU 126 HB3 GLU 126 -15.097 14.248 -19.772 940 1HG GLU 126 HG2 GLU 126 -16.771 12.821 -21.844 941 2HG GLU 126 HG3 GLU 126 -16.819 14.572 -21.646 942 H ILE 127 H ILE 127 -15.816 11.884 -17.085 943 HA ILE 127 HA ILE 127 -13.146 12.647 -16.311 944 HB ILE 127 HB ILE 127 -15.596 12.340 -14.974 945 1HG1 ILE 127 HG12 ILE 127 -14.298 13.050 -12.931 946 2HG1 ILE 127 HG13 ILE 127 -12.828 12.941 -13.909 947 1HG2 ILE 127 HG21 ILE 127 -15.262 10.047 -14.546 948 2HG2 ILE 127 HG22 ILE 127 -13.702 10.374 -13.733 949 3HG2 ILE 127 HG23 ILE 127 -15.228 10.977 -13.046 950 1HD1 ILE 127 HD11 ILE 127 -13.758 14.640 -15.469 951 2HD1 ILE 127 HD12 ILE 127 -15.301 14.626 -14.589 952 3HD1 ILE 127 HD13 ILE 127 -13.843 15.259 -13.804 953 H GLY 128 H GLY 128 -14.770 9.492 -16.819 954 1HA GLY 128 HA1 GLY 128 -12.557 7.841 -16.124 955 2HA GLY 128 HA2 GLY 128 -13.905 7.416 -17.205 956 H ASN 129 H ASN 129 -13.655 9.160 -19.279 957 HA ASN 129 HA ASN 129 -11.578 8.193 -20.922 958 1HB ASN 129 HB2 ASN 129 -13.783 9.227 -21.587 959 2HB ASN 129 HB3 ASN 129 -13.101 10.798 -21.151 960 1HD2 ASN 129 HD22 ASN 129 -13.384 11.600 -23.234 961 2HD2 ASN 129 HD21 ASN 129 -12.428 11.032 -24.606 962 H ARG 130 H ARG 130 -11.707 11.124 -18.879 963 HA ARG 130 HA ARG 130 -9.222 12.260 -19.664 964 1HB ARG 130 HB2 ARG 130 -11.148 12.644 -17.456 965 2HB ARG 130 HB3 ARG 130 -9.514 12.650 -16.845 966 1HG ARG 130 HG2 ARG 130 -9.824 14.847 -17.263 967 2HG ARG 130 HG3 ARG 130 -8.980 14.344 -18.719 968 1HD ARG 130 HD2 ARG 130 -11.951 14.821 -18.324 969 2HD ARG 130 HD3 ARG 130 -10.867 15.876 -19.231 970 HE ARG 130 HE ARG 130 -12.330 13.618 -20.152 971 1HH1 ARG 130 HH11 ARG 130 -9.052 14.943 -20.631 972 2HH1 ARG 130 HH12 ARG 130 -8.802 14.066 -22.119 973 1HH2 ARG 130 HH21 ARG 130 -12.187 13.004 -22.327 974 2HH2 ARG 130 HH22 ARG 130 -10.586 12.901 -23.070 975 H LEU 131 H LEU 131 -9.971 9.975 -16.979 976 HA LEU 131 HA LEU 131 -7.207 9.747 -16.294 977 1HB LEU 131 HB2 LEU 131 -9.696 8.286 -15.494 978 2HB LEU 131 HB3 LEU 131 -8.145 7.513 -15.187 979 HG LEU 131 HG LEU 131 -8.919 8.763 -13.284 980 1HD1 LEU 131 HD11 LEU 131 -6.812 9.779 -12.691 981 2HD1 LEU 131 HD12 LEU 131 -6.468 8.402 -13.741 982 3HD1 LEU 131 HD13 LEU 131 -6.388 10.062 -14.371 983 1HD2 LEU 131 HD21 LEU 131 -8.511 11.333 -14.849 984 2HD2 LEU 131 HD22 LEU 131 -10.080 10.637 -14.376 985 3HD2 LEU 131 HD23 LEU 131 -8.949 11.173 -13.138 986 H LYS 132 H LYS 132 -9.248 7.843 -18.499 987 HA LYS 132 HA LYS 132 -7.324 5.880 -19.153 988 1HB LYS 132 HB2 LYS 132 -9.502 5.458 -19.823 989 2HB LYS 132 HB3 LYS 132 -9.774 7.059 -20.450 990 1HG LYS 132 HG2 LYS 132 -7.929 5.106 -21.869 991 2HG LYS 132 HG3 LYS 132 -9.682 5.087 -22.067 992 1HD LYS 132 HD2 LYS 132 -9.266 7.734 -22.545 993 2HD LYS 132 HD3 LYS 132 -7.689 7.099 -23.032 994 1HE LYS 132 HE2 LYS 132 -8.926 7.144 -24.999 995 2HE LYS 132 HE3 LYS 132 -8.940 5.441 -24.519 996 1HZ LYS 132 HZ1 LYS 132 -11.128 7.398 -24.051 997 2HZ LYS 132 HZ2 LYS 132 -11.124 6.255 -25.222 998 3HZ LYS 132 HZ3 LYS 132 -11.193 5.799 -23.659 999 H GLU 133 H GLU 133 -7.854 9.084 -20.723 1000 HA GLU 133 HA GLU 133 -5.648 8.785 -22.553 1001 1HB GLU 133 HB2 GLU 133 -6.896 11.249 -21.252 1002 2HB GLU 133 HB3 GLU 133 -5.579 11.329 -22.432 1003 1HG GLU 133 HG2 GLU 133 -6.935 10.492 -24.192 1004 2HG GLU 133 HG3 GLU 133 -8.237 10.032 -23.089 1005 H PHE 134 H PHE 134 -5.854 10.311 -19.305 1006 HA PHE 134 HA PHE 134 -3.181 11.122 -19.223 1007 1HB PHE 134 HB2 PHE 134 -4.810 12.012 -17.747 1008 2HB PHE 134 HB3 PHE 134 -5.248 10.416 -17.138 1009 HD1 PHE 134 HD1 PHE 134 -2.453 12.907 -17.184 1010 HD2 PHE 134 HD2 PHE 134 -4.219 9.475 -15.275 1011 HE1 PHE 134 HE1 PHE 134 -0.772 13.053 -15.383 1012 HE2 PHE 134 HE2 PHE 134 -2.546 9.638 -13.435 1013 HZ PHE 134 HZ PHE 134 -0.837 11.440 -13.501 1014 H ALA 135 H ALA 135 -4.593 7.974 -18.339 1015 HA ALA 135 HA ALA 135 -2.178 6.856 -17.305 1016 1HB ALA 135 HB1 ALA 135 -3.389 4.712 -17.444 1017 2HB ALA 135 HB2 ALA 135 -4.387 5.980 -16.706 1018 3HB ALA 135 HB3 ALA 135 -4.671 5.491 -18.393 1019 H GLU 136 H GLU 136 -3.801 6.630 -20.487 1020 HA GLU 136 HA GLU 136 -1.914 4.743 -21.537 1021 1HB GLU 136 HB2 GLU 136 -4.111 6.419 -22.799 1022 2HB GLU 136 HB3 GLU 136 -3.124 5.303 -23.733 1023 1HG GLU 136 HG2 GLU 136 -4.783 4.441 -21.321 1024 2HG GLU 136 HG3 GLU 136 -5.346 4.383 -22.987 1025 H THR 137 H THR 137 -2.300 8.252 -21.839 1026 HA THR 137 HA THR 137 -0.219 8.398 -23.814 1027 HB THR 137 HB THR 137 -0.870 10.664 -24.109 1028 HG1 THR 137 HG1 THR 137 -2.711 10.253 -22.013 1029 1HG2 THR 137 HG21 THR 137 -3.186 10.341 -24.850 1030 2HG2 THR 137 HG22 THR 137 -2.200 8.917 -25.242 1031 3HG2 THR 137 HG23 THR 137 -3.325 8.862 -23.873 1032 H GLY 138 H GLY 138 -0.512 8.837 -20.339 1033 1HA GLY 138 HA1 GLY 138 0.984 9.493 -18.745 1034 2HA GLY 138 HA2 GLY 138 2.286 9.476 -19.955 1035 H LYS 139 H LYS 139 -0.779 11.253 -20.082 1036 HA LYS 139 HA LYS 139 0.149 13.569 -21.202 1037 1HB LYS 139 HB2 LYS 139 -2.209 12.779 -20.967 1038 2HB LYS 139 HB3 LYS 139 -2.213 13.337 -19.299 1039 1HG LYS 139 HG2 LYS 139 -2.089 15.593 -19.901 1040 2HG LYS 139 HG3 LYS 139 -1.508 15.252 -21.536 1041 1HD LYS 139 HD2 LYS 139 -4.303 14.507 -20.562 1042 2HD LYS 139 HD3 LYS 139 -3.907 16.014 -21.412 1043 1HE LYS 139 HE2 LYS 139 -2.961 14.619 -23.299 1044 2HE LYS 139 HE3 LYS 139 -3.593 13.174 -22.510 1045 1HZ LYS 139 HZ1 LYS 139 -5.279 15.457 -23.388 1046 2HZ LYS 139 HZ2 LYS 139 -5.034 14.113 -24.264 1047 3HZ LYS 139 HZ3 LYS 139 -5.844 13.999 -22.867
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